#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vkd s VAL 3 N 0.00 1.68 -1.09 -0.18 1.01 -1.26 -0.77 120.40 119.78 1vkd s VAL 3 Ca 0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 61.98 61.16 1vkd s VAL 3 Cb 0.00 -1.49 0.30 0.00 0.00 0.00 0.00 36.38 35.19 1vkd s VAL 3 CO 0.00 0.48 1.43 0.49 0.00 0.00 0.00 175.10 177.49 1vkd n PHE 4 N 3.88 2.76 -4.15 5.22 3.01 -0.08 -4.88 117.46 123.21 1vkd n PHE 4 Ca -0.20 -2.80 -0.08 0.00 1.01 0.00 0.00 57.45 55.38 1vkd n PHE 4 Cb 0.52 -1.34 -0.02 0.00 -0.01 0.00 0.00 39.48 38.63 1vkd n PHE 4 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1vkd n THR 5 N 1.56 0.00 -1.98 4.37 -2.24 -1.26 -4.63 114.28 110.10 1vkd n THR 5 Ca 0.26 -0.69 -0.32 0.00 -2.27 0.00 0.00 64.05 61.02 1vkd n THR 5 Cb 0.34 0.24 0.02 0.00 -2.10 0.00 0.00 70.33 68.83 1vkd n THR 5 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1vkd s GLU 6 N -2.46 3.28 0.08 -0.78 2.02 -1.26 -4.62 118.70 114.96 1vkd s GLU 6 Ca 0.06 1.16 -0.31 0.00 0.02 0.00 0.00 54.97 55.89 1vkd s GLU 6 Cb 0.00 -2.03 -0.07 0.00 0.10 0.00 0.00 34.13 32.14 1vkd s GLU 6 CO 0.04 -0.84 1.32 0.15 0.02 0.00 0.00 175.26 175.95 1vkd s LYS 7 N -4.23 4.35 -0.49 1.61 1.02 -1.26 -1.35 119.74 119.39 1vkd s LYS 7 Ca 0.63 1.96 0.06 0.00 0.02 0.00 0.00 55.97 58.64 1vkd s LYS 7 Cb -0.15 -3.31 0.22 0.00 -0.52 0.00 0.00 37.83 34.06 1vkd s LYS 7 CO 0.40 -0.39 0.53 -0.89 -0.92 0.00 0.00 175.35 174.07 1vkd n ILE 8 N 4.02 0.20 -0.31 2.17 5.41 -1.26 -4.89 119.36 124.69 1vkd n ILE 8 Ca 0.11 -4.27 0.15 0.00 1.00 0.00 0.00 62.75 59.74 1vkd n ILE 8 Cb 0.44 -1.95 0.39 0.00 -0.71 0.00 0.00 39.64 37.81 1vkd n ILE 8 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 176.55 175.90 1vkd h PRO 9 N 4.60 0.63 -0.72 0.38 0.11 -1.98 -1.59 132.00 133.42 1vkd h PRO 9 Ca 0.16 -0.04 -0.17 0.00 0.11 0.00 0.00 66.00 66.06 1vkd h PRO 9 Cb 0.82 -0.14 -0.10 0.00 0.11 0.00 0.00 31.00 31.69 1vkd h PRO 9 CO 0.56 0.42 0.22 0.27 -0.21 0.00 0.00 178.00 179.25 1vkd n ASN 10 N -4.64 5.05 -4.56 -2.05 6.94 -1.26 -4.98 115.26 109.75 1vkd n ASN 10 Ca 0.21 -3.14 -0.49 0.00 -0.02 0.00 0.00 54.58 51.14 1vkd n ASN 10 Cb 0.60 -0.74 -0.04 0.00 -2.36 0.00 0.00 39.78 37.24 1vkd n ASN 10 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1vkd n ILE 11 N 0.04 0.97 -1.66 1.53 3.06 -0.60 -4.84 119.36 117.87 1vkd n ILE 11 Ca 0.38 -0.24 -0.46 0.00 -2.50 0.00 0.00 62.75 59.93 1vkd n ILE 11 Cb 1.35 -0.75 -0.04 0.00 0.54 0.00 0.00 39.64 40.74 1vkd n ILE 11 CO 0.00 0.00 0.00 -0.81 -2.50 0.00 0.00 176.55 173.24 1vkd n PRO 12 N 1.63 1.95 -3.64 9.51 -0.04 -1.25 -4.96 135.00 138.21 1vkd n PRO 12 Ca 0.15 0.70 -0.15 0.00 -0.04 0.00 0.00 63.50 64.16 1vkd n PRO 12 Cb 0.24 -2.39 -0.07 0.00 -0.04 0.00 0.00 33.50 31.24 1vkd n PRO 12 CO 0.00 0.00 0.00 -0.46 -0.04 0.00 0.00 175.50 175.00 1vkd s TRP 13 N 0.35 -0.52 -0.12 0.54 -0.11 -1.26 -4.66 118.94 113.16 1vkd s TRP 13 Ca 0.74 1.02 -0.09 0.00 1.22 0.00 0.00 56.10 58.99 1vkd s TRP 13 Cb -0.70 0.26 0.04 0.00 -1.50 0.00 0.00 33.47 31.57 1vkd s TRP 13 CO 0.45 -0.45 0.31 -2.00 -4.62 0.00 0.00 176.95 170.63 1vkd s GLU 14 N -0.76 0.32 0.66 5.86 2.12 -1.26 -5.15 118.70 120.49 1vkd s GLU 14 Ca -0.08 0.52 -0.18 0.00 0.36 0.00 0.00 54.97 55.59 1vkd s GLU 14 Cb -0.03 0.05 -0.01 0.00 0.26 0.00 0.00 34.13 34.41 1vkd s GLU 14 CO 0.06 -0.10 1.23 0.39 -0.54 0.00 0.00 175.26 176.30 1vkd n GLU 15 N 3.54 0.98 -2.20 4.30 -0.58 -1.26 -4.91 120.64 120.51 1vkd n GLU 15 Ca -0.18 0.39 -0.35 0.00 -0.42 0.00 0.00 57.16 56.59 1vkd n GLU 15 Cb 0.56 -2.47 0.01 0.00 -0.57 0.00 0.00 31.44 28.97 1vkd n GLU 15 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 1vkd s ARG 16 N -3.36 3.29 0.50 3.49 1.70 -1.26 -4.95 118.95 118.36 1vkd s ARG 16 Ca 0.81 1.68 -0.23 0.00 -0.47 0.00 0.00 55.73 57.52 1vkd s ARG 16 Cb -0.38 -2.02 -0.07 0.00 -0.57 0.00 0.00 34.95 31.92 1vkd s ARG 16 CO 0.42 -0.91 1.28 -2.30 -1.08 0.00 0.00 175.30 172.71 1vkd n PRO 17 N -1.31 1.71 -1.63 3.89 -0.02 -1.26 -4.86 135.00 131.53 1vkd n PRO 17 Ca 0.12 0.62 -0.58 0.00 -2.02 0.00 0.00 63.50 61.64 1vkd n PRO 17 Cb 0.50 -2.45 -0.08 0.00 -0.02 0.00 0.00 33.50 31.46 1vkd n PRO 17 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 1vkd n GLU 18 N -0.54 0.63 -1.06 -0.52 4.07 -1.26 -1.30 120.64 120.67 1vkd n GLU 18 Ca 0.09 0.23 -0.02 0.00 -0.06 0.00 0.00 57.16 57.40 1vkd n GLU 18 Cb 0.43 -1.82 -0.01 0.00 -0.06 0.00 0.00 31.44 29.98 1vkd n GLU 18 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1vkd n GLY 19 N 2.99 0.36 3.70 8.31 0.00 -1.26 -4.97 105.19 114.32 1vkd n GLY 19 Ca 0.23 -0.06 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 1vkd n GLY 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1vkd s TYR 20 N -1.52 3.37 -0.12 1.61 5.04 -0.42 -4.95 117.35 120.35 1vkd s TYR 20 Ca 0.00 1.32 0.17 0.00 -2.44 0.00 0.00 57.07 56.13 1vkd s TYR 20 Cb 0.00 -3.38 -0.20 0.00 0.35 0.00 0.00 41.96 38.73 1vkd s TYR 20 CO 0.00 -1.11 0.56 0.25 -1.34 0.00 0.00 175.55 173.91 1vkd n THR 21 N 4.20 1.12 -1.12 4.34 -2.24 -1.26 -4.92 114.28 114.40 1vkd n THR 21 Ca 0.09 -0.72 -0.32 0.00 -2.27 0.00 0.00 64.05 60.84 1vkd n THR 21 Cb 0.47 -0.60 0.12 0.00 -2.10 0.00 0.00 70.33 68.22 1vkd n THR 21 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1vkd s GLY 22 N -4.97 1.84 0.34 3.38 0.00 -1.26 -4.95 107.32 101.69 1vkd s GLY 22 Ca -0.06 0.52 0.26 0.00 0.00 0.00 0.00 44.72 45.45 1vkd s GLY 22 CO 0.83 0.91 1.76 -0.56 0.00 0.00 0.00 173.10 176.04 1vkd h PRO 23 N -1.17 0.00 -3.62 2.90 0.13 -1.92 -3.44 132.00 124.88 1vkd h PRO 23 Ca -0.44 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.43 1vkd h PRO 23 Cb 1.26 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 32.08 1vkd h PRO 23 CO 0.47 0.00 -0.72 0.08 -0.23 0.00 0.00 178.00 177.60 1vkd s VAL 24 N -3.28 -0.03 0.06 1.56 1.01 -1.26 -4.24 120.40 114.22 1vkd s VAL 24 Ca 0.07 0.10 0.05 0.00 0.00 0.00 0.00 61.98 62.20 1vkd s VAL 24 Cb 0.09 -0.05 -0.03 0.00 0.00 0.00 0.00 36.38 36.40 1vkd s VAL 24 CO 0.56 0.04 -0.14 -1.66 0.00 0.00 0.00 175.10 173.90 1vkd s TRP 25 N 0.50 1.21 0.47 5.22 -2.14 -0.04 -4.93 118.94 119.24 1vkd s TRP 25 Ca -0.04 -0.42 -0.22 0.00 2.66 0.00 0.00 56.10 58.08 1vkd s TRP 25 Cb -0.06 -0.70 -0.07 0.00 -3.10 0.00 0.00 33.47 29.54 1vkd s TRP 25 CO -0.01 0.05 1.16 1.03 -2.66 0.00 0.00 176.95 176.51 1vkd s ARG 26 N -1.49 3.69 0.09 3.25 0.52 -1.26 -0.27 118.95 123.48 1vkd s ARG 26 Ca -0.01 1.74 -0.31 0.00 -0.52 0.00 0.00 55.73 56.64 1vkd s ARG 26 Cb -0.09 -2.34 -0.08 0.00 0.52 0.00 0.00 34.95 32.96 1vkd s ARG 26 CO 0.02 -0.60 1.52 -0.47 0.02 0.00 0.00 175.30 175.79 1vkd s TYR 27 N -1.59 2.88 -0.11 -0.53 5.04 -0.13 -4.86 117.35 118.05 1vkd s TYR 27 Ca 0.65 0.65 0.28 0.00 -2.44 0.00 0.00 57.07 56.21 1vkd s TYR 27 Cb -0.28 -3.83 1.34 0.00 0.35 0.00 0.00 41.96 39.54 1vkd s TYR 27 CO 0.33 -3.13 1.85 0.66 -1.34 0.00 0.00 175.55 173.92 1vkd h SER 28 N 7.45 0.00 -0.58 4.32 4.64 -1.94 -1.74 113.55 125.70 1vkd h SER 28 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1vkd h SER 28 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 1vkd h SER 28 CO 0.90 0.00 0.00 0.29 -0.87 0.00 0.00 176.83 177.15 1vkd n LYS 29 N -2.52 3.34 -1.69 4.77 5.02 -1.26 -4.99 118.16 120.82 1vkd n LYS 29 Ca -0.00 -2.71 -0.38 0.00 -2.02 0.00 0.00 58.31 53.20 1vkd n LYS 29 Cb 0.15 -1.72 0.06 0.00 -0.02 0.00 0.00 35.03 33.49 1vkd n LYS 29 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1vkd n ASN 30 N 0.96 1.83 -4.89 4.39 3.02 -0.66 -4.38 115.26 115.53 1vkd n ASN 30 Ca 0.23 0.87 -0.29 0.00 -0.03 0.00 0.00 54.58 55.36 1vkd n ASN 30 Cb 0.76 -1.51 0.01 0.00 -0.61 0.00 0.00 39.78 38.44 1vkd n ASN 30 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1vkd s PRO 31 N -3.00 3.41 0.06 3.52 0.04 -1.26 -5.04 135.00 132.73 1vkd s PRO 31 Ca 0.77 0.39 0.15 0.00 0.04 0.00 0.00 61.00 62.36 1vkd s PRO 31 Cb -0.41 -2.22 -0.14 0.00 0.04 0.00 0.00 34.50 31.77 1vkd s PRO 31 CO 0.45 -0.48 0.86 -0.84 0.04 0.00 0.00 177.00 177.03 1vkd h ILE 32 N -0.11 0.64 -3.00 0.56 3.07 -1.31 -3.48 117.51 113.88 1vkd h ILE 32 Ca -0.45 -2.20 -0.02 0.00 1.55 0.00 0.00 64.86 63.73 1vkd h ILE 32 Cb 1.21 2.17 -0.12 0.00 -0.27 0.00 0.00 36.82 39.81 1vkd h ILE 32 CO 0.62 0.36 0.21 -0.51 -1.05 0.00 0.00 178.15 177.78 1vkd s ILE 33 N -2.85 0.00 0.00 0.16 2.07 -1.19 -4.92 121.20 114.46 1vkd s ILE 33 Ca -0.03 -0.01 0.00 0.00 -1.41 0.00 0.00 60.65 59.21 1vkd s ILE 33 Cb 0.08 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.67 1vkd s ILE 33 CO 0.81 -0.00 0.00 0.61 -1.91 0.00 0.00 174.94 174.45 1vkd n GLY 34 N -0.37 -1.40 3.77 1.50 0.00 -1.26 -0.10 105.19 107.31 1vkd n GLY 34 Ca -0.17 0.70 -0.39 0.00 0.00 0.00 0.00 46.02 46.16 1vkd n GLY 34 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkd s ARG 35 N 0.76 4.42 -1.26 1.61 0.52 -1.24 -1.16 118.95 122.59 1vkd s ARG 35 Ca 0.00 1.82 -0.19 0.00 -0.52 0.00 0.00 55.73 56.84 1vkd s ARG 35 Cb 0.00 -2.98 0.01 0.00 0.52 0.00 0.00 34.95 32.50 1vkd s ARG 35 CO 0.00 0.01 0.59 0.09 0.02 0.00 0.00 175.30 176.01 1vkd n ASN 36 N 0.74 -3.23 0.09 0.23 3.02 0.31 -4.88 115.26 111.55 1vkd n ASN 36 Ca 0.01 -1.14 -0.03 0.00 -0.03 0.00 0.00 54.58 53.39 1vkd n ASN 36 Cb 0.45 -2.52 0.19 0.00 -0.61 0.00 0.00 39.78 37.29 1vkd n ASN 36 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1vkd h PRO 37 N -2.14 0.23 -4.06 3.52 0.13 -1.70 -3.46 132.00 124.53 1vkd h PRO 37 Ca -0.68 -0.13 -0.11 0.00 -0.87 0.00 0.00 66.00 64.22 1vkd h PRO 37 Cb 1.38 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 32.38 1vkd h PRO 37 CO 0.55 0.66 -0.53 0.14 -0.23 0.00 0.00 178.00 178.59 1vkd s VAL 38 N -4.02 0.17 0.32 1.56 -7.23 -1.26 -4.94 120.40 105.00 1vkd s VAL 38 Ca -0.04 -1.54 0.05 0.00 -1.81 0.00 0.00 61.98 58.64 1vkd s VAL 38 Cb 0.13 -1.52 0.30 0.00 0.56 0.00 0.00 36.38 35.85 1vkd s VAL 38 CO 0.78 -0.76 1.84 -0.65 -0.31 0.00 0.00 175.10 176.00 1vkd h PRO 39 N 2.92 0.81 -0.00 4.82 0.11 -1.88 0.25 132.00 139.02 1vkd h PRO 39 Ca -0.34 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.72 1vkd h PRO 39 Cb 1.18 -0.18 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1vkd h PRO 39 CO 0.60 0.54 -0.12 1.63 -0.21 0.00 0.00 178.00 180.44 1vkd n LYS 40 N -4.61 0.71 -3.68 1.05 5.02 -1.26 -4.94 118.16 110.44 1vkd n LYS 40 Ca 0.19 -0.26 -0.37 0.00 -2.02 0.00 0.00 58.31 55.85 1vkd n LYS 40 Cb 0.43 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 33.88 1vkd n LYS 40 CO 0.00 0.00 0.00 0.20 -0.52 0.00 0.00 177.40 177.08 1vkd s GLY 41 N -2.47 2.26 -0.21 0.72 0.00 0.07 -1.42 107.32 106.27 1vkd s GLY 41 Ca 0.28 -0.48 -0.15 0.00 0.00 0.00 0.00 44.72 44.38 1vkd s GLY 41 CO 0.48 -0.02 0.08 0.00 0.00 0.00 0.00 173.10 173.65 1vkd n ALA 42 N 2.38 0.95 -3.52 3.20 0.00 0.16 -3.81 120.51 119.87 1vkd n ALA 42 Ca -0.16 -0.70 -0.12 0.00 0.00 0.00 0.00 53.44 52.47 1vkd n ALA 42 Cb 0.53 -0.40 -0.10 0.00 0.00 0.00 0.00 19.45 19.49 1vkd n ALA 42 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1vkd s ARG 43 N -2.45 0.51 -0.15 0.00 0.52 -1.10 -0.53 118.95 115.76 1vkd s ARG 43 Ca -0.30 0.77 -0.03 0.00 -0.52 0.00 0.00 55.73 55.65 1vkd s ARG 43 Cb 0.08 0.15 -0.02 0.00 0.52 0.00 0.00 34.95 35.68 1vkd s ARG 43 CO 0.61 -0.11 -0.06 0.54 0.02 0.00 0.00 175.30 176.30 1vkd s VAL 44 N 0.82 3.68 0.00 3.52 0.11 -0.31 -1.06 120.40 127.15 1vkd s VAL 44 Ca -0.05 -0.43 0.00 0.00 -2.93 0.00 0.00 61.98 58.57 1vkd s VAL 44 Cb -0.05 -2.60 0.00 0.00 -1.53 0.00 0.00 36.38 32.20 1vkd s VAL 44 CO -0.06 0.50 0.09 2.22 -3.33 0.00 0.00 175.10 174.52 1vkd n PHE 45 N 3.58 0.00 -4.83 1.54 -1.74 -0.94 -3.09 117.46 111.98 1vkd n PHE 45 Ca -0.18 0.00 -0.30 0.00 -0.56 0.00 0.00 57.45 56.42 1vkd n PHE 45 Cb 0.52 0.07 -0.14 0.00 1.52 0.00 0.00 39.48 41.45 1vkd n PHE 45 CO 0.00 0.00 0.00 -0.80 -0.56 0.00 0.00 176.76 175.40 1vkd s ASN 46 N 0.00 3.19 -0.28 5.98 0.02 -1.24 -3.49 114.94 119.12 1vkd s ASN 46 Ca 0.00 -0.62 -0.00 0.00 -1.02 0.00 0.00 52.86 51.22 1vkd s ASN 46 Cb 0.00 -0.28 0.14 0.00 0.02 0.00 0.00 41.25 41.14 1vkd s ASN 46 CO 0.00 0.25 0.35 -0.94 0.02 0.00 0.00 177.10 176.78 1vkd s SER 47 N -1.37 0.88 -0.62 -1.22 1.04 -1.26 -1.64 113.70 109.51 1vkd s SER 47 Ca 0.12 -0.39 -0.21 0.00 0.48 0.00 0.00 55.95 55.95 1vkd s SER 47 Cb -0.10 0.85 0.08 0.00 0.10 0.00 0.00 66.02 66.95 1vkd s SER 47 CO 0.03 -0.36 0.84 0.00 0.98 0.00 0.00 173.24 174.74 1vkd s ALA 48 N 2.47 3.25 -0.13 5.32 0.00 0.13 -4.08 121.76 128.72 1vkd s ALA 48 Ca 0.10 -1.96 -0.05 0.00 0.00 0.00 0.00 51.96 50.04 1vkd s ALA 48 Cb -0.14 -3.70 -0.04 0.00 0.00 0.00 0.00 23.12 19.25 1vkd s ALA 48 CO -0.27 -2.55 0.06 0.08 0.00 0.00 0.00 175.76 173.07 1vkd s VAL 49 N 3.45 4.77 0.09 0.00 1.01 -1.26 -0.89 120.40 127.57 1vkd s VAL 49 Ca 0.18 -0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1vkd s VAL 49 Cb -0.20 -3.08 -0.04 0.00 0.00 0.00 0.00 36.38 33.07 1vkd s VAL 49 CO 0.09 0.56 -0.09 0.68 0.00 0.00 0.00 175.10 176.34 1vkd s VAL 50 N -0.44 0.81 0.33 2.92 -7.23 -0.49 -4.72 120.40 111.58 1vkd s VAL 50 Ca 0.10 -1.67 -0.28 0.00 -1.81 0.00 0.00 61.98 58.31 1vkd s VAL 50 Cb -0.12 -1.38 -0.09 0.00 0.56 0.00 0.00 36.38 35.35 1vkd s VAL 50 CO 0.02 -0.64 1.14 -2.84 -0.31 0.00 0.00 175.10 172.46 1vkd s PRO 51 N -2.99 4.42 -0.20 4.82 0.02 -1.26 -1.53 135.00 138.28 1vkd s PRO 51 Ca 0.06 1.84 -0.07 0.00 0.02 0.00 0.00 61.00 62.84 1vkd s PRO 51 Cb -0.01 -2.99 0.09 0.00 0.02 0.00 0.00 34.50 31.61 1vkd s PRO 51 CO -0.01 0.00 0.43 -0.47 -0.33 0.00 0.00 177.00 176.62 1vkd s TYR 52 N -1.27 -0.81 -1.15 6.54 5.04 0.60 -4.84 117.35 121.46 1vkd s TYR 52 Ca 0.49 1.55 -0.07 0.00 -2.44 0.00 0.00 57.07 56.61 1vkd s TYR 52 Cb -0.32 0.33 0.01 0.00 0.35 0.00 0.00 41.96 42.33 1vkd s TYR 52 CO 0.41 -0.48 0.88 -1.71 -1.34 0.00 0.00 175.55 173.30 1vkd n ASN 53 N 5.35 -5.55 0.00 4.32 2.85 -1.26 -0.81 115.26 120.15 1vkd n ASN 53 Ca -0.09 -0.40 0.00 0.00 -0.11 0.00 0.00 54.58 53.98 1vkd n ASN 53 Cb 0.50 -4.21 0.00 0.00 1.24 0.00 0.00 39.78 37.31 1vkd n ASN 53 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1vkd n GLY 54 N -1.67 0.78 0.00 8.20 0.00 -1.26 -4.95 105.19 106.29 1vkd n GLY 54 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 1vkd n GLY 54 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1vkd n GLU 55 N -2.04 1.56 -4.21 1.61 1.02 0.01 -5.00 120.64 113.58 1vkd n GLU 55 Ca 0.00 0.00 -0.17 0.00 -0.02 0.00 0.00 57.16 56.97 1vkd n GLU 55 Cb 0.01 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.30 1vkd n GLU 55 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 1vkd s PHE 56 N 0.76 0.87 0.14 -0.32 0.40 -0.01 -0.29 117.98 119.53 1vkd s PHE 56 Ca 0.00 -0.35 0.03 0.00 -0.60 0.00 0.00 56.93 56.01 1vkd s PHE 56 Cb 0.00 -0.52 -0.04 0.00 0.51 0.00 0.00 43.02 42.96 1vkd s PHE 56 CO 0.00 -0.01 -0.06 0.14 0.70 0.00 0.00 175.22 175.98 1vkd s VAL 57 N -0.88 0.89 0.06 -0.44 -7.23 -0.58 -1.25 120.40 110.96 1vkd s VAL 57 Ca -0.02 -2.00 -0.14 0.00 -1.81 0.00 0.00 61.98 58.01 1vkd s VAL 57 Cb -0.07 -1.87 0.02 0.00 0.56 0.00 0.00 36.38 35.02 1vkd s VAL 57 CO 0.01 -0.72 0.32 -0.83 -0.31 0.00 0.00 175.10 173.57 1vkd s GLY 58 N -3.13 -0.15 -0.23 2.32 0.00 -0.17 -1.40 107.32 104.57 1vkd s GLY 58 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 44.72 44.83 1vkd s GLY 58 CO -0.00 -0.22 0.05 0.14 0.00 0.00 0.00 173.10 173.06 1vkd s VAL 59 N -2.79 4.24 -0.04 1.40 1.01 -0.07 -1.20 120.40 122.95 1vkd s VAL 59 Ca -0.03 -0.20 0.04 0.00 0.00 0.00 0.00 61.98 61.78 1vkd s VAL 59 Cb -0.00 -2.95 -0.03 0.00 0.00 0.00 0.00 36.38 33.40 1vkd s VAL 59 CO -0.05 0.38 -0.14 -0.36 0.00 0.00 0.00 175.10 174.93 1vkd s PHE 60 N 1.28 2.71 -0.26 5.22 0.40 0.14 -0.69 117.98 126.78 1vkd s PHE 60 Ca 0.04 -0.15 -0.20 0.00 -0.60 0.00 0.00 56.93 56.02 1vkd s PHE 60 Cb -0.15 -1.61 -0.02 0.00 0.51 0.00 0.00 43.02 41.75 1vkd s PHE 60 CO 0.03 0.21 0.62 0.50 0.70 0.00 0.00 175.22 177.28 1vkd s ARG 61 N -0.85 4.09 -0.20 0.44 3.52 -0.65 -0.43 118.95 124.87 1vkd s ARG 61 Ca 0.12 0.52 0.01 0.00 -0.13 0.00 0.00 55.73 56.25 1vkd s ARG 61 Cb -0.11 -3.66 0.03 0.00 -1.56 0.00 0.00 34.95 29.66 1vkd s ARG 61 CO 0.01 -0.42 -0.16 0.42 -0.81 0.00 0.00 175.30 174.34 1vkd s ILE 62 N 2.50 2.01 0.01 4.11 1.01 -0.03 -2.22 121.20 128.60 1vkd s ILE 62 Ca 0.26 -1.09 -0.30 0.00 0.00 0.00 0.00 60.65 59.51 1vkd s ILE 62 Cb -0.15 -1.92 -0.05 0.00 0.01 0.00 0.00 42.46 40.34 1vkd s ILE 62 CO 0.09 0.36 1.33 -1.81 0.00 0.00 0.00 174.94 174.91 1vkd s ASP 63 N 1.27 6.92 1.03 3.58 1.11 -0.22 -1.23 116.67 129.13 1vkd s ASP 63 Ca 0.01 2.07 -0.15 0.00 0.18 0.00 0.00 52.55 54.66 1vkd s ASP 63 Cb -0.15 -2.57 0.21 0.00 1.07 0.00 0.00 42.92 41.48 1vkd s ASP 63 CO -0.10 -0.65 1.14 1.41 1.18 0.00 0.00 175.17 178.15 1vkd n HIS 64 N 4.94 -3.97 1.18 4.23 8.25 0.62 0.39 115.22 130.86 1vkd n HIS 64 Ca 0.12 -1.01 0.00 0.00 -0.26 0.00 0.00 57.72 56.57 1vkd n HIS 64 Cb 0.44 -0.92 0.00 0.00 1.12 0.00 0.00 29.99 30.64 1vkd n HIS 64 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1vkd n LYS 65 N -3.61 0.89 -0.11 -0.41 5.02 -0.51 -0.44 118.16 118.99 1vkd n LYS 65 Ca 0.14 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.47 1vkd n LYS 65 Cb 0.51 -1.30 0.09 0.00 -0.02 0.00 0.00 35.03 34.31 1vkd n LYS 65 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1vkd n ASN 66 N -0.12 2.55 0.00 4.39 6.94 -1.26 -4.98 115.26 122.77 1vkd n ASN 66 Ca 0.00 -2.10 0.00 0.00 -0.02 0.00 0.00 54.58 52.46 1vkd n ASN 66 Cb 0.15 -0.15 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1vkd n ASN 66 CO 0.00 0.00 0.00 0.41 -1.03 0.00 0.00 177.26 176.64 1vkd n THR 67 N -0.06 0.00 -2.73 5.53 -1.04 0.41 -5.00 114.28 111.39 1vkd n THR 67 Ca 0.07 0.00 -0.41 0.00 -2.04 0.00 0.00 64.05 61.68 1vkd n THR 67 Cb 0.38 -0.51 -0.05 0.00 -1.82 0.00 0.00 70.33 68.33 1vkd n THR 67 CO 0.00 0.00 0.00 -0.60 -0.64 0.00 0.00 175.07 173.83 1vkd s ARG 68 N -1.02 4.75 0.15 -2.82 3.52 -1.26 -4.66 118.95 117.62 1vkd s ARG 68 Ca 0.00 1.47 -0.21 0.00 -0.13 0.00 0.00 55.73 56.86 1vkd s ARG 68 Cb 0.00 -3.34 -0.08 0.00 -1.56 0.00 0.00 34.95 29.97 1vkd s ARG 68 CO 0.00 0.32 0.67 -1.25 -0.81 0.00 0.00 175.30 174.23 1vkd s PRO 69 N -0.41 4.30 0.06 5.12 0.04 -1.26 -0.27 135.00 142.57 1vkd s PRO 69 Ca 0.45 0.87 0.01 0.00 0.04 0.00 0.00 61.00 62.37 1vkd s PRO 69 Cb -0.24 -3.10 -0.03 0.00 0.04 0.00 0.00 34.50 31.16 1vkd s PRO 69 CO 0.31 0.53 -0.06 -0.06 0.04 0.00 0.00 177.00 177.75 1vkd s PHE 70 N -1.28 0.71 -0.18 0.56 0.40 -0.36 -3.40 117.98 114.42 1vkd s PHE 70 Ca 0.36 -0.75 -0.13 0.00 -0.60 0.00 0.00 56.93 55.81 1vkd s PHE 70 Cb -0.19 -0.43 -0.05 0.00 0.51 0.00 0.00 43.02 42.86 1vkd s PHE 70 CO 0.22 -0.16 0.28 -0.51 0.70 0.00 0.00 175.22 175.75 1vkd s LEU 71 N -2.35 4.20 0.07 -0.37 1.43 -1.26 -0.85 118.68 119.56 1vkd s LEU 71 Ca 0.01 0.42 0.10 0.00 -1.03 0.00 0.00 54.13 53.63 1vkd s LEU 71 Cb -0.01 -2.34 -0.03 0.00 0.03 0.00 0.00 46.19 43.84 1vkd s LEU 71 CO -0.03 0.07 -0.27 -1.00 0.23 0.00 0.00 176.35 175.35 1vkd s HIS 72 N 0.71 2.31 0.17 0.29 3.76 0.43 -0.45 115.29 122.51 1vkd s HIS 72 Ca 0.15 -0.40 -0.18 0.00 -0.15 0.00 0.00 55.06 54.48 1vkd s HIS 72 Cb -0.13 -1.34 -0.07 0.00 1.11 0.00 0.00 32.58 32.14 1vkd s HIS 72 CO 0.04 0.19 0.63 0.12 -0.85 0.00 0.00 174.74 174.88 1vkd s PHE 73 N -0.89 3.67 0.05 1.40 5.36 -1.26 0.26 117.98 126.57 1vkd s PHE 73 Ca 0.12 1.25 -0.03 0.00 -0.96 0.00 0.00 56.93 57.32 1vkd s PHE 73 Cb -0.10 -2.51 -0.03 0.00 -0.34 0.00 0.00 43.02 40.04 1vkd s PHE 73 CO 0.03 0.42 0.02 0.20 -1.46 0.00 0.00 175.22 174.44 1vkd s GLY 74 N -1.57 0.33 0.05 13.12 0.00 -0.34 -0.77 107.32 118.13 1vkd s GLY 74 Ca 0.38 -0.91 0.04 0.00 0.00 0.00 0.00 44.72 44.24 1vkd s GLY 74 CO 0.20 -1.03 -0.12 0.50 0.00 0.00 0.00 173.10 172.65 1vkd s ARG 75 N -3.29 0.77 -0.17 2.90 0.52 0.04 -1.00 118.95 118.71 1vkd s ARG 75 Ca 0.01 -0.78 -0.13 0.00 -0.52 0.00 0.00 55.73 54.30 1vkd s ARG 75 Cb 0.03 -0.73 0.05 0.00 0.52 0.00 0.00 34.95 34.82 1vkd s ARG 75 CO -0.08 0.17 0.43 0.45 0.02 0.00 0.00 175.30 176.29 1vkd s SER 76 N -1.37 -0.49 0.20 0.23 0.15 -0.38 -0.12 113.70 111.92 1vkd s SER 76 Ca -0.02 0.90 0.02 0.00 0.70 0.00 0.00 55.95 57.54 1vkd s SER 76 Cb -0.09 0.86 0.12 0.00 -1.71 0.00 0.00 66.02 65.20 1vkd s SER 76 CO 0.01 -0.17 1.47 0.11 1.20 0.00 0.00 173.24 175.87 1vkd h LYS 77 N 6.04 0.30 -0.00 5.44 1.57 -1.84 0.01 116.57 128.10 1vkd h LYS 77 Ca -0.30 -0.24 0.00 0.00 -1.87 0.00 0.00 60.65 58.24 1vkd h LYS 77 Cb 1.18 0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.54 1vkd h LYS 77 CO 0.25 0.89 -0.14 -0.40 -0.57 0.00 0.00 179.45 179.48 1vkd n ASP 78 N -3.81 0.27 0.00 0.86 5.68 -1.26 -4.56 116.55 113.73 1vkd n ASP 78 Ca -0.03 -0.64 0.00 0.00 -0.50 0.00 0.00 54.79 53.62 1vkd n ASP 78 Cb 0.69 0.90 0.00 0.00 -1.14 0.00 0.00 41.12 41.57 1vkd n ASP 78 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1vkd n GLY 79 N 0.99 0.84 0.48 6.12 0.00 -1.26 -3.79 105.19 108.58 1vkd n GLY 79 Ca 0.01 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1vkd n GLY 79 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1vkd n ILE 80 N -2.12 0.21 -3.39 -0.61 5.41 -1.26 -4.93 119.36 112.67 1vkd n ILE 80 Ca 0.00 -0.07 -0.41 0.00 1.00 0.00 0.00 62.75 63.27 1vkd n ILE 80 Cb 0.00 -1.13 -0.09 0.00 -0.71 0.00 0.00 39.64 37.71 1vkd n ILE 80 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 176.55 176.75 1vkd s ASN 81 N -4.90 6.17 -0.11 4.38 0.01 -1.26 -4.85 114.94 114.37 1vkd s ASN 81 Ca -0.05 -0.40 -0.03 0.00 -0.71 0.00 0.00 52.86 51.66 1vkd s ASN 81 Cb 0.02 -2.20 -0.03 0.00 0.41 0.00 0.00 41.25 39.45 1vkd s ASN 81 CO 0.08 -0.40 0.02 0.26 -1.51 0.00 0.00 177.10 175.54 1vkd s TRP 82 N 2.00 3.19 -0.34 2.20 0.52 -1.26 -4.32 118.94 120.93 1vkd s TRP 82 Ca 0.11 0.13 -0.09 0.00 0.02 0.00 0.00 56.10 56.27 1vkd s TRP 82 Cb -0.17 -1.87 0.02 0.00 -1.15 0.00 0.00 33.47 30.30 1vkd s TRP 82 CO 0.12 0.37 0.15 -1.21 0.02 0.00 0.00 176.95 176.40 1vkd s GLU 83 N -0.52 2.97 -0.13 4.98 2.02 0.82 -4.96 118.70 123.88 1vkd s GLU 83 Ca 0.09 -0.96 -0.04 0.00 0.02 0.00 0.00 54.97 54.08 1vkd s GLU 83 Cb -0.12 -3.57 -0.03 0.00 0.10 0.00 0.00 34.13 30.50 1vkd s GLU 83 CO 0.02 -0.57 -0.00 0.42 0.02 0.00 0.00 175.26 175.14 1vkd s ILE 84 N 1.53 4.23 0.28 -1.63 1.01 -1.26 -0.78 121.20 124.58 1vkd s ILE 84 Ca 0.02 -0.25 -0.30 0.00 0.00 0.00 0.00 60.65 60.12 1vkd s ILE 84 Cb -0.18 -2.84 -0.12 0.00 0.01 0.00 0.00 42.46 39.33 1vkd s ILE 84 CO 0.05 0.53 1.58 -0.62 0.00 0.00 0.00 174.94 176.48 1vkd n GLU 85 N 2.99 2.62 0.24 2.79 -0.58 0.05 -4.90 120.64 123.85 1vkd n GLU 85 Ca -0.18 0.93 0.11 0.00 -0.42 0.00 0.00 57.16 57.61 1vkd n GLU 85 Cb 0.53 -2.70 0.59 0.00 -0.57 0.00 0.00 31.44 29.29 1vkd n GLU 85 CO 0.00 0.00 0.00 -1.35 -0.48 0.00 0.00 177.13 175.30 1vkd h PRO 86 N 4.81 0.00 -6.29 3.49 0.11 -1.98 -3.44 132.00 128.70 1vkd h PRO 86 Ca -0.46 0.00 -0.58 0.00 0.11 0.00 0.00 66.00 65.06 1vkd h PRO 86 Cb 1.23 0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.24 1vkd h PRO 86 CO 0.80 0.17 -0.65 -1.21 -0.21 0.00 0.00 178.00 176.91 1vkd s GLU 87 N -3.89 2.40 0.66 1.05 0.41 -1.26 -4.70 118.70 113.37 1vkd s GLU 87 Ca -0.01 -1.20 -0.12 0.00 -0.41 0.00 0.00 54.97 53.23 1vkd s GLU 87 Cb 0.11 -2.31 -0.01 0.00 -1.78 0.00 0.00 34.13 30.15 1vkd s GLU 87 CO 0.61 0.42 1.05 -1.83 -0.49 0.00 0.00 175.26 175.02 1vkd s GLU 88 N -3.23 3.12 0.31 1.61 1.03 -1.26 -4.58 118.70 115.70 1vkd s GLU 88 Ca 0.29 0.98 -0.29 0.00 0.03 0.00 0.00 54.97 55.98 1vkd s GLU 88 Cb -0.08 -2.01 -0.11 0.00 -0.80 0.00 0.00 34.13 31.13 1vkd s GLU 88 CO 0.19 -0.96 1.50 0.42 -1.33 0.00 0.00 175.26 175.09 1vkd s ILE 89 N -2.94 2.25 -0.20 1.83 1.01 0.41 -4.96 121.20 118.59 1vkd s ILE 89 Ca 0.59 0.22 -0.11 0.00 0.00 0.00 0.00 60.65 61.35 1vkd s ILE 89 Cb -0.14 -3.14 -0.05 0.00 0.01 0.00 0.00 42.46 39.14 1vkd s ILE 89 CO 0.51 0.04 0.16 -1.10 0.00 0.00 0.00 174.94 174.55 1vkd s GLN 90 N -1.10 4.18 -0.08 2.79 -1.52 -1.26 -4.93 119.66 117.74 1vkd s GLN 90 Ca 0.58 -0.18 0.00 0.00 -1.95 0.00 0.00 55.36 53.81 1vkd s GLN 90 Cb -0.45 -3.44 -0.03 0.00 -0.22 0.00 0.00 33.01 28.86 1vkd s GLN 90 CO 0.52 0.25 -0.05 -1.58 -0.25 0.00 0.00 175.29 174.18 1vkd s TRP 91 N 0.50 2.99 0.24 0.91 0.52 -1.26 -4.36 118.94 118.48 1vkd s TRP 91 Ca 0.09 0.05 0.12 0.00 0.02 0.00 0.00 56.10 56.38 1vkd s TRP 91 Cb -0.12 -1.74 -0.05 0.00 -1.15 0.00 0.00 33.47 30.42 1vkd s TRP 91 CO -0.00 0.35 -0.21 0.14 0.02 0.00 0.00 176.95 177.25 1vkd s VAL 92 N -0.79 2.47 0.91 4.03 -7.23 -0.70 -0.81 120.40 118.29 1vkd s VAL 92 Ca 0.12 -2.23 -0.12 0.00 -1.81 0.00 0.00 61.98 57.94 1vkd s VAL 92 Cb -0.11 -2.25 0.19 0.00 0.56 0.00 0.00 36.38 34.77 1vkd s VAL 92 CO 0.02 -0.28 1.24 1.51 -0.31 0.00 0.00 175.10 177.28 1vkd s ASP 93 N -3.15 3.37 0.64 4.85 1.47 0.15 0.06 116.67 124.05 1vkd s ASP 93 Ca 0.26 0.05 0.43 0.00 1.18 0.00 0.00 52.55 54.47 1vkd s ASP 93 Cb -0.06 -0.15 2.30 0.00 -0.34 0.00 0.00 42.92 44.66 1vkd s ASP 93 CO 0.13 -2.55 2.31 -0.37 0.68 0.00 0.00 175.17 175.37 1vkd h VAL 94 N -1.37 0.00 -0.01 2.11 -1.51 -1.90 0.37 116.25 113.94 1vkd h VAL 94 Ca -0.42 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.02 1vkd h VAL 94 Cb 1.24 1.00 0.00 0.00 -2.13 0.00 0.00 31.29 31.40 1vkd h VAL 94 CO 0.37 0.00 -0.11 0.59 -1.23 0.00 0.00 177.57 177.19 1vkd n ASN 95 N -3.03 1.35 0.00 4.19 3.02 -1.26 -4.94 115.26 114.59 1vkd n ASN 95 Ca -0.03 -1.26 0.00 0.00 -0.03 0.00 0.00 54.58 53.26 1vkd n ASN 95 Cb 0.08 0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.32 1vkd n ASN 95 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkd n GLY 96 N 1.25 0.75 3.83 7.41 0.00 0.13 -5.06 105.19 113.51 1vkd n GLY 96 Ca 0.16 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.85 1vkd n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1vkd s GLU 97 N -0.45 4.15 0.33 1.61 0.41 -1.26 -4.70 118.70 118.79 1vkd s GLU 97 Ca 0.00 0.91 -0.29 0.00 -0.41 0.00 0.00 54.97 55.18 1vkd s GLU 97 Cb 0.00 -2.38 -0.12 0.00 -1.78 0.00 0.00 34.13 29.85 1vkd s GLU 97 CO 0.00 0.10 1.42 -2.30 -0.49 0.00 0.00 175.26 173.99 1vkd n PRO 98 N -0.34 2.38 -2.99 0.39 -0.02 -1.26 0.29 135.00 133.44 1vkd n PRO 98 Ca 0.04 0.84 -0.14 0.00 -2.02 0.00 0.00 63.50 62.22 1vkd n PRO 98 Cb 0.53 -2.51 0.01 0.00 -0.02 0.00 0.00 33.50 31.51 1vkd n PRO 98 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1vkd n PHE 99 N 0.91 -0.51 -2.61 6.00 7.35 0.01 -4.66 117.46 123.95 1vkd n PHE 99 Ca 0.05 -3.21 -0.42 0.00 -0.76 0.00 0.00 57.45 53.11 1vkd n PHE 99 Cb 0.36 0.15 -0.03 0.00 0.35 0.00 0.00 39.48 40.31 1vkd n PHE 99 CO 0.00 0.00 0.00 -1.14 -0.76 0.00 0.00 176.76 174.86 1vkd s GLN 100 N -1.79 4.51 0.41 -4.13 2.00 -1.25 -4.68 119.66 114.73 1vkd s GLN 100 Ca 0.33 1.54 -0.26 0.00 -2.00 0.00 0.00 55.36 54.98 1vkd s GLN 100 Cb 0.35 -3.43 -0.08 0.00 0.80 0.00 0.00 33.01 30.65 1vkd s GLN 100 CO -0.06 -0.14 1.29 -2.14 -0.50 0.00 0.00 175.29 173.75 1vkd s PRO 101 N 1.09 3.92 0.16 1.67 0.02 -1.26 -4.94 135.00 135.67 1vkd s PRO 101 Ca 0.54 2.12 -0.14 0.00 0.02 0.00 0.00 61.00 63.55 1vkd s PRO 101 Cb -0.24 -2.71 0.06 0.00 0.02 0.00 0.00 34.50 31.63 1vkd s PRO 101 CO 0.28 -0.52 1.76 1.03 -0.33 0.00 0.00 177.00 179.22 1vkd h SER 102 N 2.59 0.68 -5.20 2.53 0.87 -1.95 -3.44 113.55 109.62 1vkd h SER 102 Ca -0.50 -0.11 -0.10 0.00 -1.23 0.00 0.00 61.79 59.86 1vkd h SER 102 Cb 1.25 -0.17 -0.14 0.00 -0.44 0.00 0.00 62.40 62.90 1vkd h SER 102 CO 0.62 0.59 -0.40 -0.72 -0.53 0.00 0.00 176.83 176.39 1vkd s TYR 103 N -5.79 0.27 -0.19 2.24 -0.85 -1.26 -5.06 117.35 106.71 1vkd s TYR 103 Ca -0.13 -0.70 -0.16 0.00 -0.52 0.00 0.00 57.07 55.56 1vkd s TYR 103 Cb 0.12 -0.11 0.05 0.00 0.38 0.00 0.00 41.96 42.40 1vkd s TYR 103 CO 0.76 -0.57 0.49 0.00 -1.52 0.00 0.00 175.55 174.72 1vkd s ALA 104 N -3.90 -1.22 0.29 9.51 0.00 -1.22 -4.12 121.76 121.09 1vkd s ALA 104 Ca 0.09 1.45 -0.04 0.00 0.00 0.00 0.00 51.96 53.45 1vkd s ALA 104 Cb 0.05 -0.85 0.02 0.00 0.00 0.00 0.00 23.12 22.34 1vkd s ALA 104 CO -0.08 -0.24 0.45 2.48 0.00 0.00 0.00 175.76 178.37 1vkd n TYR 105 N 3.05 -1.49 -3.13 0.00 4.11 -0.49 -3.37 117.16 115.84 1vkd n TYR 105 Ca -0.15 -1.74 -0.14 0.00 -0.00 0.00 0.00 57.90 55.87 1vkd n TYR 105 Cb 0.57 0.52 0.06 0.00 -0.00 0.00 0.00 39.34 40.49 1vkd n TYR 105 CO 0.00 0.00 0.00 -3.47 -0.00 0.00 0.00 176.86 173.39 1vkd n ASP 106 N -1.63 -3.54 -4.78 9.48 2.03 -1.26 0.38 116.55 117.22 1vkd n ASP 106 Ca -0.02 -0.40 -0.35 0.00 0.52 0.00 0.00 54.79 54.54 1vkd n ASP 106 Cb 0.46 -3.69 -0.01 0.00 -0.72 0.00 0.00 41.12 37.16 1vkd n ASP 106 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 1vkd s PRO 107 N -5.43 3.52 0.00 -0.67 0.04 -1.26 -4.23 135.00 126.97 1vkd s PRO 107 Ca 0.20 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.75 1vkd s PRO 107 Cb -0.09 -2.04 -0.00 0.00 0.04 0.00 0.00 34.50 32.41 1vkd s PRO 107 CO 0.51 -0.69 -0.04 1.03 0.04 0.00 0.00 177.00 177.85 1vkd s ARG 108 N -3.30 0.31 -0.07 4.56 1.81 0.06 -4.47 118.95 117.85 1vkd s ARG 108 Ca 0.70 -0.18 0.03 0.00 -1.72 0.00 0.00 55.73 54.57 1vkd s ARG 108 Cb -0.21 -0.27 0.01 0.00 -0.45 0.00 0.00 34.95 34.03 1vkd s ARG 108 CO 0.25 0.07 -0.16 0.08 -0.68 0.00 0.00 175.30 174.85 1vkd s VAL 109 N -0.20 1.43 -0.12 3.52 1.01 -1.26 -1.25 120.40 123.53 1vkd s VAL 109 Ca 0.00 -0.67 -0.07 0.00 0.00 0.00 0.00 61.98 61.24 1vkd s VAL 109 Cb -0.02 -1.26 0.05 0.00 0.00 0.00 0.00 36.38 35.14 1vkd s VAL 109 CO -0.00 0.42 0.30 0.54 0.00 0.00 0.00 175.10 176.36 1vkd s VAL 110 N 0.39 -0.03 -0.17 2.92 0.11 -0.25 -4.87 120.40 118.50 1vkd s VAL 110 Ca -0.12 0.10 -0.26 0.00 -2.93 0.00 0.00 61.98 58.78 1vkd s VAL 110 Cb -0.15 -0.45 -0.01 0.00 -1.53 0.00 0.00 36.38 34.24 1vkd s VAL 110 CO 0.04 0.04 0.85 -0.75 -3.33 0.00 0.00 175.10 171.95 1vkd s LYS 111 N 1.09 4.29 -0.18 1.54 2.20 -1.26 -0.45 119.74 126.97 1vkd s LYS 111 Ca -0.08 1.04 0.01 0.00 -0.36 0.00 0.00 55.97 56.58 1vkd s LYS 111 Cb -0.08 -3.58 0.02 0.00 -1.51 0.00 0.00 37.83 32.68 1vkd s LYS 111 CO -0.08 -0.35 -0.19 0.42 -0.36 0.00 0.00 175.35 174.79 1vkd s ILE 112 N 2.22 2.04 0.00 5.43 1.01 0.27 -4.69 121.20 127.48 1vkd s ILE 112 Ca 0.39 -0.95 0.00 0.00 0.00 0.00 0.00 60.65 60.08 1vkd s ILE 112 Cb -0.16 -1.86 0.00 0.00 0.01 0.00 0.00 42.46 40.45 1vkd s ILE 112 CO 0.12 0.51 0.00 -0.62 0.00 0.00 0.00 174.94 174.95 1vkd n GLU 113 N 4.62 0.00 -0.04 2.79 1.02 -1.26 -1.55 120.64 126.21 1vkd n GLU 113 Ca -0.20 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.06 1vkd n GLU 113 Cb 0.50 0.00 0.25 0.00 -0.02 0.00 0.00 31.44 32.17 1vkd n GLU 113 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1vkd n ASP 114 N 7.31 2.60 -4.06 1.62 8.00 -1.26 -4.93 116.55 125.82 1vkd n ASP 114 Ca 0.00 -1.85 -0.24 0.00 0.71 0.00 0.00 54.79 53.41 1vkd n ASP 114 Cb 0.00 -0.05 -0.16 0.00 -0.02 0.00 0.00 41.12 40.89 1vkd n ASP 114 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1vkd s THR 115 N -1.89 1.13 -0.30 -3.53 2.01 -0.60 -4.79 115.64 107.68 1vkd s THR 115 Ca 0.33 -0.53 -0.22 0.00 0.31 0.00 0.00 61.69 61.58 1vkd s THR 115 Cb 0.20 -1.00 -0.01 0.00 0.01 0.00 0.00 72.50 71.71 1vkd s THR 115 CO 0.31 0.34 0.70 -0.31 -0.69 0.00 0.00 174.62 174.97 1vkd s TYR 116 N 0.25 3.22 -0.03 4.92 1.51 -0.35 -0.57 117.35 126.30 1vkd s TYR 116 Ca -0.06 0.72 -0.10 0.00 -1.01 0.00 0.00 57.07 56.62 1vkd s TYR 116 Cb -0.12 -3.07 -0.05 0.00 -0.11 0.00 0.00 41.96 38.62 1vkd s TYR 116 CO 0.02 -0.49 0.30 0.71 -1.11 0.00 0.00 175.55 174.97 1vkd s TYR 117 N 2.74 3.65 -0.12 2.71 2.02 0.40 -0.95 117.35 127.80 1vkd s TYR 117 Ca 0.29 0.76 0.01 0.00 -0.37 0.00 0.00 57.07 57.75 1vkd s TYR 117 Cb -0.15 -2.11 0.02 0.00 -0.40 0.00 0.00 41.96 39.32 1vkd s TYR 117 CO 0.11 0.66 -0.14 0.42 -1.57 0.00 0.00 175.55 175.04 1vkd s ILE 118 N -1.12 1.48 0.21 2.71 1.01 0.10 -1.10 121.20 124.48 1vkd s ILE 118 Ca 0.22 -0.61 0.08 0.00 0.00 0.00 0.00 60.65 60.34 1vkd s ILE 118 Cb -0.14 -1.37 -0.04 0.00 0.01 0.00 0.00 42.46 40.91 1vkd s ILE 118 CO 0.11 0.44 0.05 0.42 0.00 0.00 0.00 174.94 175.96 1vkd s THR 119 N 1.22 3.88 0.16 2.92 -4.23 -0.38 -0.21 115.64 119.00 1vkd s THR 119 Ca -0.02 -1.50 -0.24 0.00 -1.18 0.00 0.00 61.69 58.75 1vkd s THR 119 Cb -0.14 -3.01 0.06 0.00 1.34 0.00 0.00 72.50 70.75 1vkd s THR 119 CO -0.05 -0.22 0.86 0.72 -0.54 0.00 0.00 174.62 175.39 1vkd s PHE 120 N -1.95 -0.21 -0.16 3.99 -0.71 -0.73 -0.76 117.98 117.45 1vkd s PHE 120 Ca 0.30 -0.11 -0.12 0.00 -1.04 0.00 0.00 56.93 55.96 1vkd s PHE 120 Cb -0.08 0.64 -0.05 0.00 -1.21 0.00 0.00 43.02 42.32 1vkd s PHE 120 CO 0.21 -0.90 0.24 0.00 -1.34 0.00 0.00 175.22 173.44 1vkd s THR 122 N 0.24 0.00 0.04 0.00 -1.32 -0.36 -1.40 115.64 112.84 1vkd s THR 122 Ca 0.15 -1.92 -0.21 0.00 -1.21 0.00 0.00 61.69 58.50 1vkd s THR 122 Cb -0.13 -2.46 -0.06 0.00 -1.51 0.00 0.00 72.50 68.34 1vkd s THR 122 CO 0.03 0.00 0.63 -0.62 -2.21 0.00 0.00 174.62 172.44 1vkd s ASP 123 N -3.15 7.07 -0.43 8.08 2.15 -1.26 -0.54 116.67 128.59 1vkd s ASP 123 Ca 0.37 1.27 0.06 0.00 0.43 0.00 0.00 52.55 54.68 1vkd s ASP 123 Cb 0.06 -2.39 0.21 0.00 -0.30 0.00 0.00 42.92 40.50 1vkd s ASP 123 CO 0.12 0.15 0.54 -0.67 -0.17 0.00 0.00 175.17 175.14 1vkd n ASP 124 N 2.35 -1.12 -3.82 -0.34 2.03 -1.26 -4.84 116.55 109.54 1vkd n ASP 124 Ca -0.07 -2.70 -0.25 0.00 0.52 0.00 0.00 54.79 52.29 1vkd n ASP 124 Cb 0.51 0.15 0.02 0.00 -0.72 0.00 0.00 41.12 41.08 1vkd n ASP 124 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 1vkd n HIS 125 N 2.21 -1.95 0.00 -0.67 8.25 -1.26 -4.57 115.22 117.23 1vkd n HIS 125 Ca 0.22 0.84 0.00 0.00 -0.26 0.00 0.00 57.72 58.52 1vkd n HIS 125 Cb 0.53 -4.11 0.00 0.00 1.12 0.00 0.00 29.99 27.53 1vkd n HIS 125 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1vkd n GLY 126 N -1.68 3.55 3.75 -1.41 0.00 -1.26 -4.87 105.19 103.27 1vkd n GLY 126 Ca -0.21 -1.82 -0.41 0.00 0.00 0.00 0.00 46.02 43.58 1vkd n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1vkd s PRO 127 N -2.81 4.29 0.27 1.61 0.04 -1.26 -4.37 135.00 132.76 1vkd s PRO 127 Ca 0.00 2.29 -0.04 0.00 0.04 0.00 0.00 61.00 63.29 1vkd s PRO 127 Cb 0.00 -3.09 0.02 0.00 0.04 0.00 0.00 34.50 31.47 1vkd s PRO 127 CO 0.00 -0.35 0.42 -2.37 0.04 0.00 0.00 177.00 174.74 1vkd n THR 128 N 1.73 0.00 -3.40 1.26 5.66 0.30 -1.53 114.28 118.30 1vkd n THR 128 Ca 0.04 -1.18 -0.41 0.00 -3.05 0.00 0.00 64.05 59.45 1vkd n THR 128 Cb 0.41 0.80 -0.09 0.00 -1.55 0.00 0.00 70.33 69.89 1vkd n THR 128 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 175.07 171.39 1vkd s ILE 129 N -2.62 5.17 0.35 1.09 1.01 -1.26 -1.22 121.20 123.71 1vkd s ILE 129 Ca 0.19 -0.04 -0.12 0.00 0.00 0.00 0.00 60.65 60.68 1vkd s ILE 129 Cb -0.01 -3.85 -0.07 0.00 0.01 0.00 0.00 42.46 38.53 1vkd s ILE 129 CO 0.14 -0.14 0.72 -0.83 0.00 0.00 0.00 174.94 174.84 1vkd s GLY 130 N 1.74 2.13 -0.05 6.18 0.00 0.64 -1.60 107.32 116.36 1vkd s GLY 130 Ca 0.11 -0.13 0.01 0.00 0.00 0.00 0.00 44.72 44.72 1vkd s GLY 130 CO 0.12 0.06 -0.06 0.14 0.00 0.00 0.00 173.10 173.36 1vkd s VAL 131 N -2.15 0.65 0.00 1.40 1.01 -1.26 -1.78 120.40 118.27 1vkd s VAL 131 Ca 0.52 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.32 1vkd s VAL 131 Cb -0.10 -0.66 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1vkd s VAL 131 CO 0.24 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.21 1vkd n GLY 132 N 4.10 5.12 3.63 4.51 0.00 0.71 -0.09 105.19 123.17 1vkd n GLY 132 Ca -0.23 -1.50 -0.03 0.00 0.00 0.00 0.00 46.02 44.26 1vkd n GLY 132 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1vkd s THR 134 N -1.06 0.00 -0.33 2.61 -1.32 -0.12 -0.73 115.64 114.69 1vkd s THR 134 Ca 0.00 0.00 0.21 0.00 -1.21 0.00 0.00 61.69 60.69 1vkd s THR 134 Cb 0.00 -1.00 -0.30 0.00 -1.51 0.00 0.00 72.50 69.69 1vkd s THR 134 CO 0.00 0.00 0.60 0.29 -2.21 0.00 0.00 174.62 173.30 1vkd n LYS 135 N 0.74 0.49 0.00 7.08 5.02 -1.26 -1.21 118.16 129.02 1vkd n LYS 135 Ca -0.03 -0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.12 1vkd n LYS 135 Cb 0.58 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 1vkd n LYS 135 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 1vkd n ASP 136 N -2.00 0.06 -2.08 4.39 5.75 -1.26 -4.89 116.55 116.51 1vkd n ASP 136 Ca -0.01 -0.88 -0.17 0.00 -0.01 0.00 0.00 54.79 53.71 1vkd n ASP 136 Cb 0.48 0.01 -0.03 0.00 -1.03 0.00 0.00 41.12 40.55 1vkd n ASP 136 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 1vkd n PHE 137 N -0.01 -0.82 -0.03 2.11 3.72 -1.26 -4.80 117.46 116.38 1vkd n PHE 137 Ca 0.00 0.00 -0.06 0.00 -0.05 0.00 0.00 57.45 57.34 1vkd n PHE 137 Cb 0.21 -3.29 -0.03 0.00 -0.94 0.00 0.00 39.48 35.43 1vkd n PHE 137 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1vkd n LYS 138 N -2.63 0.14 -4.14 -1.08 5.02 -1.26 -4.99 118.16 109.22 1vkd n LYS 138 Ca -0.19 0.05 -0.35 0.00 -2.02 0.00 0.00 58.31 55.80 1vkd n LYS 138 Cb 0.62 -0.88 -0.12 0.00 -0.02 0.00 0.00 35.03 34.63 1vkd n LYS 138 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 1vkd s THR 139 N -2.12 3.94 -0.26 -0.18 2.01 -1.26 -5.04 115.64 112.73 1vkd s THR 139 Ca -0.09 -0.32 -0.03 0.00 0.31 0.00 0.00 61.69 61.56 1vkd s THR 139 Cb 0.03 -2.77 0.02 0.00 0.01 0.00 0.00 72.50 69.79 1vkd s THR 139 CO 0.12 0.44 -0.03 -0.36 -0.69 0.00 0.00 174.62 174.11 1vkd s PHE 140 N 0.85 3.07 -0.19 4.92 0.40 -1.26 -4.50 117.98 121.28 1vkd s PHE 140 Ca 0.00 -1.39 -0.05 0.00 -0.60 0.00 0.00 56.93 54.89 1vkd s PHE 140 Cb -0.14 -2.10 -0.03 0.00 0.51 0.00 0.00 43.02 41.26 1vkd s PHE 140 CO 0.02 -0.68 0.01 0.08 0.70 0.00 0.00 175.22 175.35 1vkd s VAL 141 N 1.37 4.15 -0.18 -0.44 1.01 -1.26 -1.71 120.40 123.33 1vkd s VAL 141 Ca 0.01 -0.25 -0.08 0.00 0.00 0.00 0.00 61.98 61.65 1vkd s VAL 141 Cb -0.17 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.30 1vkd s VAL 141 CO -0.03 0.44 0.10 -0.60 0.00 0.00 0.00 175.10 175.01 1vkd s ARG 142 N 0.79 3.99 0.61 2.72 3.52 0.11 -4.32 118.95 126.36 1vkd s ARG 142 Ca 0.01 -0.26 0.00 0.00 -0.13 0.00 0.00 55.73 55.35 1vkd s ARG 142 Cb -0.14 -3.30 0.06 0.00 -1.56 0.00 0.00 34.95 30.01 1vkd s ARG 142 CO 0.02 0.36 0.85 -0.51 -0.81 0.00 0.00 175.30 175.22 1vkd s LEU 143 N 0.15 3.16 0.58 -0.88 1.43 0.87 -4.16 118.68 119.83 1vkd s LEU 143 Ca 0.07 -0.07 -0.21 0.00 -1.03 0.00 0.00 54.13 52.90 1vkd s LEU 143 Cb -0.12 -2.65 -0.04 0.00 0.03 0.00 0.00 46.19 43.41 1vkd s LEU 143 CO -0.00 -1.36 1.35 -2.65 0.23 0.00 0.00 176.35 173.91 1vkd n PRO 144 N -2.51 1.53 -1.61 1.29 -0.02 -1.26 -4.41 135.00 128.00 1vkd n PRO 144 Ca 0.10 0.57 -0.39 0.00 -2.02 0.00 0.00 63.50 61.76 1vkd n PRO 144 Cb 0.60 -2.57 0.03 0.00 -0.02 0.00 0.00 33.50 31.54 1vkd n PRO 144 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1vkd n ASN 145 N -1.29 0.98 0.16 2.55 3.02 -1.26 -4.53 115.26 114.89 1vkd n ASN 145 Ca 0.12 0.91 0.01 0.00 -0.03 0.00 0.00 54.58 55.59 1vkd n ASN 145 Cb 0.46 -1.37 0.26 0.00 -0.61 0.00 0.00 39.78 38.51 1vkd n ASN 145 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1vkd h ALA 146 N 1.00 1.14 -2.42 5.41 0.00 -1.63 -3.47 119.26 119.29 1vkd h ALA 146 Ca -0.47 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 53.84 1vkd h ALA 146 Cb 1.35 -0.08 -0.16 0.00 0.00 0.00 0.00 17.79 18.90 1vkd h ALA 146 CO 0.53 0.63 -0.69 0.71 0.00 0.00 0.00 179.25 180.44 1vkd s TYR 147 N -3.84 0.51 0.69 0.00 2.02 -1.26 -4.77 117.35 110.70 1vkd s TYR 147 Ca -0.02 -0.93 -0.14 0.00 -0.37 0.00 0.00 57.07 55.61 1vkd s TYR 147 Cb 0.13 -0.36 0.02 0.00 -0.40 0.00 0.00 41.96 41.35 1vkd s TYR 147 CO 0.74 -0.31 1.13 0.14 -1.57 0.00 0.00 175.55 175.69 1vkd s VAL 148 N -3.32 2.98 1.01 0.71 -7.23 -1.26 -4.62 120.40 108.67 1vkd s VAL 148 Ca 0.02 0.44 -0.12 0.00 -1.81 0.00 0.00 61.98 60.52 1vkd s VAL 148 Cb 0.04 -2.95 0.18 0.00 0.56 0.00 0.00 36.38 34.20 1vkd s VAL 148 CO -0.07 -0.29 0.98 -0.81 -0.31 0.00 0.00 175.10 174.59 1vkd n PRO 149 N -2.65 -1.11 -4.18 4.82 -0.04 -1.26 -4.52 135.00 126.07 1vkd n PRO 149 Ca 0.11 -0.27 -0.34 0.00 -0.04 0.00 0.00 63.50 62.96 1vkd n PRO 149 Cb 0.52 -2.23 -0.14 0.00 -0.04 0.00 0.00 33.50 31.60 1vkd n PRO 149 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1vkd s PHE 150 N -2.52 2.90 -0.03 0.54 0.40 -1.26 -5.06 117.98 112.93 1vkd s PHE 150 Ca 0.66 -0.95 -0.19 0.00 -0.60 0.00 0.00 56.93 55.85 1vkd s PHE 150 Cb -0.23 -2.01 0.04 0.00 0.51 0.00 0.00 43.02 41.33 1vkd s PHE 150 CO 0.62 -0.48 0.41 1.21 0.70 0.00 0.00 175.22 177.68 1vkd s ASN 151 N 1.13 -0.33 0.28 1.36 3.84 -0.58 -0.65 114.94 119.98 1vkd s ASN 151 Ca 0.01 0.31 -0.09 0.00 0.21 0.00 0.00 52.86 53.30 1vkd s ASN 151 Cb -0.14 0.42 0.04 0.00 -0.55 0.00 0.00 41.25 41.01 1vkd s ASN 151 CO -0.02 -0.47 0.53 -2.11 -2.79 0.00 0.00 177.10 172.24 1vkd n ARG 152 N 1.30 0.77 -3.83 0.43 1.85 -1.07 -3.03 116.66 113.08 1vkd n ARG 152 Ca -0.20 -1.66 -0.28 0.00 -1.00 0.00 0.00 57.85 54.71 1vkd n ARG 152 Cb 0.56 1.98 0.04 0.00 -1.05 0.00 0.00 32.46 33.99 1vkd n ARG 152 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1vkd n ASN 153 N -1.44 -4.68 -4.69 2.89 5.03 -1.26 -1.70 115.26 109.41 1vkd n ASN 153 Ca -0.05 -0.74 -0.42 0.00 0.87 0.00 0.00 54.58 54.24 1vkd n ASN 153 Cb 0.42 -4.14 -0.03 0.00 -1.02 0.00 0.00 39.78 35.01 1vkd n ASN 153 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 1vkd s GLY 154 N -3.44 2.14 -0.10 7.41 0.00 -1.26 -4.23 107.32 107.85 1vkd s GLY 154 Ca 0.57 0.58 -0.07 0.00 0.00 0.00 0.00 44.72 45.80 1vkd s GLY 154 CO 0.81 2.16 0.24 0.54 0.00 0.00 0.00 173.10 176.85 1vkd s VAL 155 N 2.18 -0.02 0.28 1.40 0.11 -0.52 -4.65 120.40 119.18 1vkd s VAL 155 Ca 0.55 0.06 -0.20 0.00 -2.93 0.00 0.00 61.98 59.46 1vkd s VAL 155 Cb -0.24 -0.36 -0.09 0.00 -1.53 0.00 0.00 36.38 34.17 1vkd s VAL 155 CO 0.21 0.03 0.79 -0.76 -3.33 0.00 0.00 175.10 172.04 1vkd s LEU 156 N 0.62 4.25 0.41 2.54 1.43 -1.26 -0.18 118.68 126.50 1vkd s LEU 156 Ca -0.04 1.50 -0.24 0.00 -1.03 0.00 0.00 54.13 54.32 1vkd s LEU 156 Cb -0.05 -3.85 -0.08 0.00 0.03 0.00 0.00 46.19 42.23 1vkd s LEU 156 CO -0.04 -0.07 1.13 -0.36 0.23 0.00 0.00 176.35 177.24 1vkd s PHE 157 N -1.69 3.11 -2.00 0.29 0.40 -0.23 -4.47 117.98 113.39 1vkd s PHE 157 Ca 0.48 1.58 0.13 0.00 -0.60 0.00 0.00 56.93 58.53 1vkd s PHE 157 Cb -0.15 -3.30 0.80 0.00 0.51 0.00 0.00 43.02 40.88 1vkd s PHE 157 CO 0.20 -1.11 1.23 -0.35 0.70 0.00 0.00 175.22 175.89 1vkd n PRO 158 N -0.06 0.48 -3.79 0.24 -0.04 -1.26 -4.74 135.00 125.83 1vkd n PRO 158 Ca 0.05 0.00 -0.09 0.00 -0.04 0.00 0.00 63.50 63.42 1vkd n PRO 158 Cb 0.48 -1.44 -0.03 0.00 -0.04 0.00 0.00 33.50 32.46 1vkd n PRO 158 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1vkd s ARG 159 N -2.00 1.51 0.52 0.54 1.70 -1.26 -4.35 118.95 115.61 1vkd s ARG 159 Ca 0.20 -0.93 -0.22 0.00 -0.47 0.00 0.00 55.73 54.31 1vkd s ARG 159 Cb 0.09 0.54 -0.06 0.00 -0.57 0.00 0.00 34.95 34.96 1vkd s ARG 159 CO 0.16 -0.66 1.28 0.15 -1.08 0.00 0.00 175.30 175.14 1vkd s LYS 160 N -3.90 3.33 -0.16 3.89 1.02 -1.26 -4.66 119.74 118.00 1vkd s LYS 160 Ca 0.11 2.03 0.01 0.00 0.02 0.00 0.00 55.97 58.15 1vkd s LYS 160 Cb -0.02 -2.27 0.02 0.00 -0.52 0.00 0.00 37.83 35.03 1vkd s LYS 160 CO 0.01 -0.98 -0.18 0.42 -0.92 0.00 0.00 175.35 173.70 1vkd s ILE 161 N -1.42 1.86 -1.51 2.17 1.01 0.26 -4.71 121.20 118.87 1vkd s ILE 161 Ca 0.70 -0.82 -0.12 0.00 0.00 0.00 0.00 60.65 60.40 1vkd s ILE 161 Cb -0.35 -1.69 0.07 0.00 0.01 0.00 0.00 42.46 40.51 1vkd s ILE 161 CO 0.42 0.51 0.96 0.59 0.00 0.00 0.00 174.94 177.41 1vkd n ASN 162 N 4.52 -4.42 0.00 3.58 3.02 -1.26 -1.38 115.26 119.32 1vkd n ASN 162 Ca -0.19 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.58 1vkd n ASN 162 Cb 0.50 -3.92 0.00 0.00 -0.61 0.00 0.00 39.78 35.75 1vkd n ASN 162 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkd n GLY 163 N -1.69 0.49 3.32 7.41 0.00 -1.26 -5.02 105.19 108.44 1vkd n GLY 163 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1vkd n GLY 163 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1vkd s LYS 164 N -0.34 1.93 0.42 1.61 -0.14 -0.48 -4.79 119.74 117.96 1vkd s LYS 164 Ca 0.00 -1.02 -0.24 0.00 -1.36 0.00 0.00 55.97 53.36 1vkd s LYS 164 Cb 0.00 -1.99 -0.08 0.00 -1.68 0.00 0.00 37.83 34.08 1vkd s LYS 164 CO 0.00 0.53 1.11 0.71 -0.76 0.00 0.00 175.35 176.94 1vkd s TYR 165 N -0.71 3.10 0.46 3.18 2.02 0.02 -0.57 117.35 124.86 1vkd s TYR 165 Ca 0.11 1.59 0.03 0.00 -0.37 0.00 0.00 57.07 58.43 1vkd s TYR 165 Cb -0.10 -3.26 -0.01 0.00 -0.40 0.00 0.00 41.96 38.19 1vkd s TYR 165 CO 0.01 -1.05 0.10 0.08 -1.57 0.00 0.00 175.55 173.12 1vkd s VAL 166 N -1.57 0.67 -0.03 0.71 1.01 -1.26 -0.87 120.40 119.06 1vkd s VAL 166 Ca 0.59 -2.00 -0.04 0.00 0.00 0.00 0.00 61.98 60.53 1vkd s VAL 166 Cb -0.26 -2.18 0.01 0.00 0.00 0.00 0.00 36.38 33.95 1vkd s VAL 166 CO 0.32 0.00 0.10 -0.76 0.00 0.00 0.00 175.10 174.76 1vkd s LEU 168 N -3.73 1.63 0.35 3.92 1.43 0.75 -1.06 118.68 121.96 1vkd s LEU 168 Ca 0.14 0.12 0.00 0.00 -1.03 0.00 0.00 54.13 53.37 1vkd s LEU 168 Cb 0.01 0.39 -0.00 0.00 0.03 0.00 0.00 46.19 46.61 1vkd s LEU 168 CO 0.10 -0.09 0.44 0.54 0.23 0.00 0.00 176.35 177.56 1vkd s ASN 169 N -0.20 1.15 -0.37 2.29 2.20 0.01 -1.44 114.94 118.58 1vkd s ASN 169 Ca -0.03 -1.57 0.02 0.00 -0.94 0.00 0.00 52.86 50.35 1vkd s ASN 169 Cb -0.02 0.65 0.15 0.00 -2.00 0.00 0.00 41.25 40.03 1vkd s ASN 169 CO 0.00 -1.26 0.34 -0.60 -2.94 0.00 0.00 177.10 172.64 1vkd s ARG 170 N -3.09 0.62 0.16 3.55 3.00 -0.69 -1.49 118.95 121.01 1vkd s ARG 170 Ca 0.33 -0.98 -0.34 0.00 -1.00 0.00 0.00 55.73 53.74 1vkd s ARG 170 Cb 0.00 -0.86 -0.15 0.00 0.00 0.00 0.00 34.95 33.94 1vkd s ARG 170 CO 0.23 -1.20 1.31 -2.30 0.00 0.00 0.00 175.30 173.34 1vkd n PRO 171 N 4.18 1.46 -1.81 5.12 -0.02 -1.25 -2.61 135.00 140.06 1vkd n PRO 171 Ca 0.12 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1vkd n PRO 171 Cb 0.43 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.79 1vkd n PRO 171 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 1vkd n SER 172 N 2.36 0.18 -4.97 2.55 7.64 0.18 -4.50 113.62 117.06 1vkd n SER 172 Ca 0.15 -0.91 -0.20 0.00 1.01 0.00 0.00 58.87 58.93 1vkd n SER 172 Cb 0.25 0.00 0.06 0.00 -1.01 0.00 0.00 64.21 63.51 1vkd n SER 172 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1vkd s ASP 173 N -0.81 5.06 0.33 6.43 1.11 -1.26 -4.47 116.67 123.05 1vkd s ASP 173 Ca 0.00 -0.68 0.17 0.00 0.18 0.00 0.00 52.55 52.22 1vkd s ASP 173 Cb 0.00 0.08 0.22 0.00 1.07 0.00 0.00 42.92 44.29 1vkd s ASP 173 CO 0.00 -1.34 1.52 -1.13 1.18 0.00 0.00 175.17 175.40 1vkd h ASN 174 N 0.12 0.00 0.00 0.27 -1.24 -1.98 -3.45 115.58 109.30 1vkd h ASN 174 Ca -0.33 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.68 1vkd h ASN 174 Cb 1.28 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.33 1vkd h ASN 174 CO 0.42 0.39 0.00 0.61 -1.29 0.00 0.00 177.43 177.55 1vkd n GLY 175 N 1.07 3.47 3.55 1.57 0.00 -1.26 -4.89 105.19 108.69 1vkd n GLY 175 Ca 0.02 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 1vkd n GLY 175 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1vkd s HIS 176 N 3.94 2.94 -0.34 1.61 3.76 -1.26 -4.94 115.29 121.00 1vkd s HIS 176 Ca 0.00 -1.67 -0.41 0.00 -0.15 0.00 0.00 55.06 52.83 1vkd s HIS 176 Cb 0.00 -4.64 -0.16 0.00 1.11 0.00 0.00 32.58 28.89 1vkd s HIS 176 CO 0.00 -1.72 1.78 2.41 -0.85 0.00 0.00 174.74 176.36 1vkd n THR 177 N 6.00 0.23 -0.44 1.30 -1.04 -1.26 -4.89 114.28 114.18 1vkd n THR 177 Ca 0.44 -0.06 -0.14 0.00 -2.04 0.00 0.00 64.05 62.25 1vkd n THR 177 Cb 0.46 -1.09 0.07 0.00 -1.82 0.00 0.00 70.33 67.94 1vkd n THR 177 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 1vkd n PRO 178 N 5.48 1.70 -3.84 -2.82 -0.04 -1.26 -4.90 135.00 129.32 1vkd n PRO 178 Ca 0.30 -1.53 -0.02 0.00 -0.04 0.00 0.00 63.50 62.21 1vkd n PRO 178 Cb 0.09 -1.60 0.01 0.00 -0.04 0.00 0.00 33.50 31.96 1vkd n PRO 178 CO 0.00 0.00 0.00 -0.59 -0.04 0.00 0.00 175.50 174.87 1vkd s PHE 179 N -1.72 0.02 0.00 0.54 -0.12 -1.25 -4.89 117.98 110.55 1vkd s PHE 179 Ca 0.30 -0.35 0.00 0.00 -0.05 0.00 0.00 56.93 56.82 1vkd s PHE 179 Cb 0.24 0.66 0.00 0.00 -0.63 0.00 0.00 43.02 43.30 1vkd s PHE 179 CO 0.03 -0.80 0.00 0.41 -0.05 0.00 0.00 175.22 174.81 1vkd n GLY 180 N -0.65 2.75 3.62 1.99 0.00 -1.25 -4.75 105.19 106.89 1vkd n GLY 180 Ca -0.04 0.10 -0.27 0.00 0.00 0.00 0.00 46.02 45.81 1vkd n GLY 180 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1vkd s ASP 181 N 0.00 4.53 -0.18 1.61 1.01 -1.26 -1.65 116.67 120.74 1vkd s ASP 181 Ca 0.00 -0.46 -0.21 0.00 0.71 0.00 0.00 52.55 52.59 1vkd s ASP 181 Cb 0.00 -0.88 -0.03 0.00 1.01 0.00 0.00 42.92 43.02 1vkd s ASP 181 CO 0.00 0.10 0.63 -0.63 0.21 0.00 0.00 175.17 175.49 1vkd s ILE 182 N -1.67 5.03 0.38 0.77 1.01 0.57 -3.96 121.20 123.32 1vkd s ILE 182 Ca 0.26 1.22 0.08 0.00 0.00 0.00 0.00 60.65 62.20 1vkd s ILE 182 Cb -0.09 -3.95 -0.05 0.00 0.01 0.00 0.00 42.46 38.37 1vkd s ILE 182 CO 0.17 0.14 0.11 -0.36 0.00 0.00 0.00 174.94 175.00 1vkd s PHE 183 N 1.71 2.60 0.18 3.97 0.40 -0.56 -0.51 117.98 125.78 1vkd s PHE 183 Ca 0.30 -0.51 0.06 0.00 -0.60 0.00 0.00 56.93 56.18 1vkd s PHE 183 Cb -0.16 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.58 1vkd s PHE 183 CO 0.11 0.32 -0.11 -0.48 0.70 0.00 0.00 175.22 175.76 1vkd s LEU 184 N -3.83 2.52 0.04 -0.37 0.05 0.49 -0.81 118.68 116.77 1vkd s LEU 184 Ca 0.38 -1.03 -0.01 0.00 0.05 0.00 0.00 54.13 53.52 1vkd s LEU 184 Cb 0.02 -0.46 -0.03 0.00 -2.05 0.00 0.00 46.19 43.67 1vkd s LEU 184 CO 0.21 -0.29 -0.02 -0.44 -0.55 0.00 0.00 176.35 175.26 1vkd s SER 185 N -3.23 0.36 0.17 1.48 0.01 -1.26 -1.31 113.70 109.92 1vkd s SER 185 Ca 0.20 -0.75 0.11 0.00 1.31 0.00 0.00 55.95 56.81 1vkd s SER 185 Cb 0.02 0.16 -0.04 0.00 0.21 0.00 0.00 66.02 66.36 1vkd s SER 185 CO 0.03 -0.46 -0.23 -1.83 0.41 0.00 0.00 173.24 171.16 1vkd s GLU 186 N -2.76 1.43 -0.07 12.44 -1.05 -0.14 -4.30 118.70 124.25 1vkd s GLU 186 Ca -0.04 -1.45 -0.05 0.00 -0.15 0.00 0.00 54.97 53.28 1vkd s GLU 186 Cb -0.00 -1.74 0.02 0.00 -0.44 0.00 0.00 34.13 31.97 1vkd s GLU 186 CO -0.06 0.38 0.17 0.45 0.95 0.00 0.00 175.26 177.15 1vkd s SER 187 N -2.52 -0.17 0.49 0.83 0.15 -0.05 -1.19 113.70 111.24 1vkd s SER 187 Ca 0.18 0.35 0.28 0.00 0.70 0.00 0.00 55.95 57.45 1vkd s SER 187 Cb -0.08 0.32 0.89 0.00 -1.71 0.00 0.00 66.02 65.44 1vkd s SER 187 CO 0.08 -0.09 1.81 1.55 1.20 0.00 0.00 173.24 177.80 1vkd h PRO 188 N 6.28 0.00 0.00 5.44 0.13 -1.87 0.09 132.00 142.07 1vkd h PRO 188 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 1vkd h PRO 188 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1vkd h PRO 188 CO 0.41 0.05 0.00 -0.40 -0.23 0.00 0.00 178.00 177.82 1vkd n ASP 189 N -3.14 -0.36 0.00 1.44 5.68 -1.26 -4.83 116.55 114.08 1vkd n ASP 189 Ca 0.02 0.29 0.00 0.00 -0.50 0.00 0.00 54.79 54.60 1vkd n ASP 189 Cb 0.42 0.48 0.00 0.00 -1.14 0.00 0.00 41.12 40.88 1vkd n ASP 189 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.20 175.49 1vkd n ILE 191 N -3.02 0.00 -3.76 2.12 5.41 -1.26 -5.15 119.36 113.70 1vkd n ILE 191 Ca 0.00 0.00 -0.36 0.00 1.00 0.00 0.00 62.75 63.39 1vkd n ILE 191 Cb 0.00 0.00 -0.10 0.00 -0.71 0.00 0.00 39.64 38.83 1vkd n ILE 191 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 1vkd s HIS 192 N -0.04 3.29 -0.02 1.39 3.76 -1.26 -4.85 115.29 117.56 1vkd s HIS 192 Ca 0.00 0.15 0.08 0.00 -0.15 0.00 0.00 55.06 55.14 1vkd s HIS 192 Cb 0.00 -2.21 -0.02 0.00 1.11 0.00 0.00 32.58 31.46 1vkd s HIS 192 CO 0.00 0.08 -0.26 -1.58 -0.85 0.00 0.00 174.74 172.14 1vkd s TRP 193 N 0.84 2.35 0.01 1.40 0.52 -1.26 -4.16 118.94 118.64 1vkd s TRP 193 Ca 0.06 -0.45 -0.01 0.00 0.02 0.00 0.00 56.10 55.73 1vkd s TRP 193 Cb -0.13 -1.51 0.00 0.00 -1.15 0.00 0.00 33.47 30.68 1vkd s TRP 193 CO 0.03 -0.04 0.03 0.41 0.02 0.00 0.00 176.95 177.39 1vkd n GLY 194 N 2.47 1.62 3.92 0.98 0.00 -0.33 -4.94 105.19 108.90 1vkd n GLY 194 Ca -0.16 -0.97 -0.27 0.00 0.00 0.00 0.00 46.02 44.62 1vkd n GLY 194 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1vkd n ASN 195 N -0.81 -1.16 -4.78 1.61 3.02 -1.26 -0.97 115.26 110.91 1vkd n ASN 195 Ca -0.00 -1.02 -0.35 0.00 -0.03 0.00 0.00 54.58 53.18 1vkd n ASN 195 Cb 0.02 -3.04 -0.01 0.00 -0.61 0.00 0.00 39.78 36.14 1vkd n ASN 195 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1vkd s HIS 196 N -3.88 2.80 -0.13 3.10 3.76 -1.26 -4.37 115.29 115.31 1vkd s HIS 196 Ca 0.09 1.55 -0.09 0.00 -0.15 0.00 0.00 55.06 56.46 1vkd s HIS 196 Cb -0.03 -3.19 0.04 0.00 1.11 0.00 0.00 32.58 30.50 1vkd s HIS 196 CO 0.89 -1.29 0.32 1.03 -0.85 0.00 0.00 174.74 174.83 1vkd s ARG 197 N -3.32 0.33 0.28 1.40 0.52 -0.43 -4.98 118.95 112.75 1vkd s ARG 197 Ca 0.70 0.55 -0.30 0.00 -0.52 0.00 0.00 55.73 56.16 1vkd s ARG 197 Cb -0.21 0.04 -0.12 0.00 0.52 0.00 0.00 34.95 35.18 1vkd s ARG 197 CO 0.25 -0.11 1.53 0.34 0.02 0.00 0.00 175.30 177.34 1vkd n PHE 198 N 3.63 2.63 -0.02 -0.53 7.35 -1.26 -0.38 117.46 128.88 1vkd n PHE 198 Ca -0.19 0.32 -0.06 0.00 -0.76 0.00 0.00 57.45 56.76 1vkd n PHE 198 Cb 0.56 -2.55 -0.02 0.00 0.35 0.00 0.00 39.48 37.82 1vkd n PHE 198 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1vkd n VAL 199 N 2.00 1.11 -3.76 -2.13 0.31 0.34 -4.85 118.33 111.35 1vkd n VAL 199 Ca 0.09 0.17 -0.13 0.00 -0.01 0.00 0.00 64.34 64.47 1vkd n VAL 199 Cb 0.35 -1.81 -0.11 0.00 -0.91 0.00 0.00 33.84 31.36 1vkd n VAL 199 CO 0.00 0.00 0.00 -0.22 -1.32 0.00 0.00 176.83 175.29 1vkd s LEU 200 N -7.11 0.76 0.33 7.52 2.96 -0.81 -4.70 118.68 117.63 1vkd s LEU 200 Ca -0.12 0.62 0.04 0.00 -0.22 0.00 0.00 54.13 54.45 1vkd s LEU 200 Cb 0.03 1.05 -0.06 0.00 0.50 0.00 0.00 46.19 47.70 1vkd s LEU 200 CO 0.17 -0.11 0.06 -0.83 -1.32 0.00 0.00 176.35 174.31 1vkd s GLY 201 N 0.28 2.11 0.58 7.98 0.00 -1.26 -0.32 107.32 116.69 1vkd s GLY 201 Ca -0.01 -2.08 -0.19 0.00 0.00 0.00 0.00 44.72 42.44 1vkd s GLY 201 CO -0.01 -1.84 0.94 -0.96 0.00 0.00 0.00 173.10 171.23 1vkd n ARG 202 N -0.71 0.93 -3.62 2.90 1.85 -1.26 -4.97 116.66 111.78 1vkd n ARG 202 Ca -0.02 0.36 -0.34 0.00 -1.00 0.00 0.00 57.85 56.84 1vkd n ARG 202 Cb 0.67 -2.12 -0.05 0.00 -1.05 0.00 0.00 32.46 29.90 1vkd n ARG 202 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 1vkd s SER 203 N -1.18 6.60 -0.08 2.89 0.15 -0.01 -4.97 113.70 117.11 1vkd s SER 203 Ca 0.74 0.73 -0.10 0.00 0.70 0.00 0.00 55.95 58.01 1vkd s SER 203 Cb -0.43 -2.15 -0.29 0.00 -1.71 0.00 0.00 66.02 61.44 1vkd s SER 203 CO 0.49 0.17 0.55 -1.28 1.20 0.00 0.00 173.24 174.37 1vkd h SER 204 N 3.64 0.53 0.12 5.45 0.87 -1.90 -3.29 113.55 118.97 1vkd h SER 204 Ca -0.49 -0.94 -0.28 0.00 -1.23 0.00 0.00 61.79 58.86 1vkd h SER 204 Cb 1.19 -0.17 0.02 0.00 -0.44 0.00 0.00 62.40 63.00 1vkd h SER 204 CO 0.67 1.80 -1.12 0.22 -0.53 0.00 0.00 176.83 177.87 1vkd h TYR 205 N 0.05 0.96 -3.32 2.24 3.20 -1.97 -3.41 116.97 114.72 1vkd h TYR 205 Ca -0.37 -0.56 -0.67 0.00 3.14 0.00 0.00 58.73 60.27 1vkd h TYR 205 Cb 2.05 -0.09 -0.17 0.00 1.54 0.00 0.00 36.73 40.05 1vkd h TYR 205 CO 0.10 1.40 0.10 -0.80 -1.64 0.00 0.00 178.16 177.32 1vkd s ASN 206 N -7.32 6.25 0.40 -2.11 0.01 -1.26 -4.92 114.94 106.00 1vkd s ASN 206 Ca -0.09 -0.74 0.08 0.00 -0.71 0.00 0.00 52.86 51.40 1vkd s ASN 206 Cb 0.07 -2.31 0.84 0.00 0.41 0.00 0.00 41.25 40.26 1vkd s ASN 206 CO 0.92 -0.89 2.01 -0.50 -1.51 0.00 0.00 177.10 177.13 1vkd h TRP 207 N 8.99 0.41 -0.02 2.20 4.06 -1.87 -2.15 115.95 127.57 1vkd h TRP 207 Ca -0.27 -0.01 0.01 0.00 2.06 0.00 0.00 58.89 60.68 1vkd h TRP 207 Cb 1.09 -0.13 -0.00 0.00 -1.00 0.00 0.00 29.16 29.12 1vkd h TRP 207 CO 0.76 0.34 0.03 0.11 -3.56 0.00 0.00 178.44 176.11 1vkd h TRP 208 N 0.42 0.00 -0.28 0.49 5.08 -1.91 -2.58 115.95 117.18 1vkd h TRP 208 Ca 0.11 0.00 -0.23 0.00 1.08 0.00 0.00 58.89 59.84 1vkd h TRP 208 Cb 0.10 0.00 -0.29 0.00 -3.00 0.00 0.00 29.16 25.97 1vkd h TRP 208 CO 0.00 0.00 -0.84 -0.85 -1.28 0.00 0.00 178.44 175.47 1vkd n GLU 209 N -3.71 1.75 0.00 0.12 0.28 -0.83 -2.43 120.64 115.82 1vkd n GLU 209 Ca -0.02 -3.25 0.13 0.00 -0.16 0.00 0.00 57.16 53.85 1vkd n GLU 209 Cb 0.11 -1.39 0.31 0.00 1.43 0.00 0.00 31.44 31.90 1vkd n GLU 209 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1vkd n ASN 210 N -0.52 1.23 -0.12 -1.84 6.94 -0.97 -0.83 115.26 119.16 1vkd n ASN 210 Ca 0.20 -1.03 -0.23 0.00 -0.02 0.00 0.00 54.58 53.50 1vkd n ASN 210 Cb 0.90 0.20 -0.08 0.00 -2.36 0.00 0.00 39.78 38.43 1vkd n ASN 210 CO 0.00 0.00 0.00 -0.11 -1.03 0.00 0.00 177.26 176.12 1vkd n LEU 211 N -0.51 1.94 -3.68 -4.53 7.94 0.23 -4.71 117.00 113.69 1vkd n LEU 211 Ca 0.12 0.36 -0.05 0.00 -1.11 0.00 0.00 56.01 55.32 1vkd n LEU 211 Cb 0.37 -0.81 -0.02 0.00 0.53 0.00 0.00 43.42 43.49 1vkd n LEU 211 CO 0.26 0.31 0.67 -1.59 -1.11 0.00 0.00 177.39 175.93 1vkd s LYS 212 N -2.59 1.16 0.15 1.96 -2.85 -1.20 -3.84 119.74 112.54 1vkd s LYS 212 Ca -0.35 -0.59 -0.01 0.00 -1.00 0.00 0.00 55.97 54.03 1vkd s LYS 212 Cb 0.11 0.43 -0.04 0.00 -2.06 0.00 0.00 37.83 36.27 1vkd s LYS 212 CO 0.47 -0.53 0.06 0.96 0.10 0.00 0.00 175.35 176.42 1vkd s ILE 213 N -3.33 0.18 -0.10 3.79 -4.36 -0.66 -0.69 121.20 116.02 1vkd s ILE 213 Ca 0.10 -1.93 -0.30 0.00 -0.26 0.00 0.00 60.65 58.26 1vkd s ILE 213 Cb -0.02 -2.12 0.07 0.00 1.25 0.00 0.00 42.46 41.64 1vkd s ILE 213 CO -0.01 -0.40 0.69 -0.83 0.24 0.00 0.00 174.94 174.63 1vkd s GLY 214 N -3.08 -0.57 0.58 6.27 0.00 -0.82 -4.43 107.32 105.27 1vkd s GLY 214 Ca 0.26 1.50 -0.18 0.00 0.00 0.00 0.00 44.72 46.30 1vkd s GLY 214 CO 0.04 1.15 1.14 0.00 0.00 0.00 0.00 173.10 175.42 1vkd s ALA 215 N -0.81 2.61 0.00 3.20 0.00 -1.26 -0.56 121.76 124.94 1vkd s ALA 215 Ca -0.08 0.78 0.00 0.00 0.00 0.00 0.00 51.96 52.66 1vkd s ALA 215 Cb -0.01 -3.36 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1vkd s ALA 215 CO 0.08 -0.96 0.00 0.41 0.00 0.00 0.00 175.76 175.29 1vkd n GLY 216 N 0.05 1.15 3.64 0.00 0.00 -0.66 -4.73 105.19 104.64 1vkd n GLY 216 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1vkd n GLY 216 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1vkd n PRO 217 N 0.00 -0.11 -2.02 1.61 -0.02 -1.25 -4.82 135.00 128.39 1vkd n PRO 217 Ca 0.00 0.04 -0.37 0.00 -2.02 0.00 0.00 63.50 61.15 1vkd n PRO 217 Cb 0.00 -2.33 0.03 0.00 -0.02 0.00 0.00 33.50 31.18 1vkd n PRO 217 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 1vkd s TYR 218 N -2.34 2.46 0.25 6.00 -0.85 -1.26 -4.60 117.35 117.02 1vkd s TYR 218 Ca 0.69 1.49 -0.30 0.00 -0.52 0.00 0.00 57.07 58.43 1vkd s TYR 218 Cb -0.26 -3.52 -0.11 0.00 0.38 0.00 0.00 41.96 38.45 1vkd s TYR 218 CO 0.56 -2.20 1.55 -2.14 -1.52 0.00 0.00 175.55 171.79 1vkd s PRO 219 N -3.13 4.19 -0.25 -3.49 0.02 -1.26 -4.86 135.00 126.22 1vkd s PRO 219 Ca 0.74 2.45 -0.12 0.00 0.02 0.00 0.00 61.00 64.09 1vkd s PRO 219 Cb -0.32 -3.07 -0.05 0.00 0.02 0.00 0.00 34.50 31.08 1vkd s PRO 219 CO 0.36 -0.56 0.25 0.42 -0.33 0.00 0.00 177.00 177.14 1vkd s ILE 220 N 0.23 5.28 -0.21 2.83 1.01 -0.20 -4.50 121.20 125.64 1vkd s ILE 220 Ca 0.64 0.35 -0.29 0.00 0.00 0.00 0.00 60.65 61.34 1vkd s ILE 220 Cb -0.45 -3.59 -0.00 0.00 0.01 0.00 0.00 42.46 38.43 1vkd s ILE 220 CO 0.43 0.27 1.19 -0.70 0.00 0.00 0.00 174.94 176.12 1vkd s GLU 221 N 1.49 4.19 0.35 2.79 2.12 -1.26 0.11 118.70 128.49 1vkd s GLU 221 Ca 0.11 1.48 0.05 0.00 0.36 0.00 0.00 54.97 56.97 1vkd s GLU 221 Cb -0.15 -3.74 -0.07 0.00 0.26 0.00 0.00 34.13 30.43 1vkd s GLU 221 CO 0.08 -0.75 0.03 0.95 -0.54 0.00 0.00 175.26 175.03 1vkd s THR 222 N 3.53 1.51 -0.14 -1.70 -4.23 -0.35 -0.90 115.64 113.36 1vkd s THR 222 Ca 0.51 -2.01 0.28 0.00 -1.18 0.00 0.00 61.69 59.29 1vkd s THR 222 Cb -0.18 -2.85 0.29 0.00 1.34 0.00 0.00 72.50 71.10 1vkd s THR 222 CO 0.13 -0.02 1.83 0.77 -0.54 0.00 0.00 174.62 176.80 1vkd h SER 223 N 2.00 0.00 -0.18 3.99 4.64 -1.35 -2.04 113.55 120.62 1vkd h SER 223 Ca -0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.90 1vkd h SER 223 Cb 1.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.33 1vkd h SER 223 CO 0.73 0.00 0.00 -0.62 -0.87 0.00 0.00 176.83 176.07 1vkd n GLU 224 N -2.51 2.02 0.00 4.77 -0.58 -1.26 -5.01 120.64 118.07 1vkd n GLU 224 Ca 0.00 -1.52 0.00 0.00 -0.42 0.00 0.00 57.16 55.22 1vkd n GLU 224 Cb 0.17 -1.45 0.00 0.00 -0.57 0.00 0.00 31.44 29.59 1vkd n GLU 224 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1vkd n GLY 225 N 1.27 0.56 3.65 0.62 0.00 -0.77 -4.78 105.19 105.74 1vkd n GLY 225 Ca 0.17 -2.32 -0.43 0.00 0.00 0.00 0.00 46.02 43.44 1vkd n GLY 225 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1vkd s TRP 226 N -0.91 3.15 -0.47 1.61 0.52 0.21 -1.20 118.94 121.85 1vkd s TRP 226 Ca 0.00 1.24 -0.24 0.00 0.02 0.00 0.00 56.10 57.12 1vkd s TRP 226 Cb 0.00 -3.57 0.03 0.00 -1.15 0.00 0.00 33.47 28.78 1vkd s TRP 226 CO 0.00 -0.82 0.88 -1.17 0.02 0.00 0.00 176.95 175.86 1vkd s LEU 227 N 3.56 4.11 -0.38 2.99 2.96 0.12 -0.98 118.68 131.05 1vkd s LEU 227 Ca 0.46 -0.04 -0.12 0.00 -0.22 0.00 0.00 54.13 54.22 1vkd s LEU 227 Cb -0.14 -3.06 0.03 0.00 0.50 0.00 0.00 46.19 43.52 1vkd s LEU 227 CO 0.13 -1.04 0.22 -0.22 -1.32 0.00 0.00 176.35 174.12 1vkd s LEU 228 N 3.64 4.81 -0.16 -0.68 2.96 -0.19 -1.03 118.68 128.03 1vkd s LEU 228 Ca 0.34 -1.01 -0.24 0.00 -0.22 0.00 0.00 54.13 52.99 1vkd s LEU 228 Cb -0.11 -2.04 -0.02 0.00 0.50 0.00 0.00 46.19 44.52 1vkd s LEU 228 CO 0.24 -0.41 0.77 -0.63 -1.32 0.00 0.00 176.35 175.01 1vkd s ILE 229 N 1.57 4.94 0.08 6.68 1.01 -1.26 -0.67 121.20 133.54 1vkd s ILE 229 Ca 0.02 1.52 0.02 0.00 0.00 0.00 0.00 60.65 62.22 1vkd s ILE 229 Cb -0.19 -4.09 -0.03 0.00 0.01 0.00 0.00 42.46 38.16 1vkd s ILE 229 CO 0.07 0.08 -0.08 -0.72 0.00 0.00 0.00 174.94 174.29 1vkd s TYR 230 N 1.86 0.88 0.28 3.97 -0.85 -0.79 -1.65 117.35 121.05 1vkd s TYR 230 Ca 0.36 -0.71 -0.09 0.00 -0.52 0.00 0.00 57.07 56.12 1vkd s TYR 230 Cb -0.17 -0.50 -0.07 0.00 0.38 0.00 0.00 41.96 41.61 1vkd s TYR 230 CO 0.13 -0.08 0.59 -3.38 -1.52 0.00 0.00 175.55 171.29 1vkd s HIS 231 N -2.58 3.44 0.03 -3.49 -3.43 0.27 -0.88 115.29 108.65 1vkd s HIS 231 Ca 0.03 0.84 0.03 0.00 -0.80 0.00 0.00 55.06 55.16 1vkd s HIS 231 Cb -0.02 -2.25 -0.02 0.00 -1.43 0.00 0.00 32.58 28.87 1vkd s HIS 231 CO -0.02 0.18 -0.09 0.20 -2.00 0.00 0.00 174.74 173.02 1vkd s GLY 232 N -2.71 0.50 -0.00 -1.38 0.00 -0.02 -1.95 107.32 101.77 1vkd s GLY 232 Ca 0.47 -0.60 0.06 0.00 0.00 0.00 0.00 44.72 44.64 1vkd s GLY 232 CO 0.25 -0.61 -0.17 0.14 0.00 0.00 0.00 173.10 172.71 1vkd s VAL 233 N -0.82 1.38 0.14 1.40 1.01 0.13 -0.98 120.40 122.64 1vkd s VAL 233 Ca -0.03 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.20 1vkd s VAL 233 Cb -0.07 -1.16 -0.04 0.00 0.00 0.00 0.00 36.38 35.11 1vkd s VAL 233 CO 0.00 0.32 -0.17 0.28 0.00 0.00 0.00 175.10 175.53 1vkd s THR 234 N -0.50 1.63 -0.28 3.92 -1.32 -0.89 -0.60 115.64 117.59 1vkd s THR 234 Ca 0.06 -1.77 -0.07 0.00 -1.21 0.00 0.00 61.69 58.70 1vkd s THR 234 Cb -0.07 -1.67 -0.00 0.00 -1.51 0.00 0.00 72.50 69.24 1vkd s THR 234 CO -0.00 -0.30 0.09 -0.22 -2.21 0.00 0.00 174.62 171.98 1vkd s LEU 235 N -2.44 3.76 0.69 9.08 2.96 -1.26 -1.06 118.68 130.40 1vkd s LEU 235 Ca 0.11 -0.53 0.03 0.00 -0.22 0.00 0.00 54.13 53.53 1vkd s LEU 235 Cb -0.06 -1.91 0.12 0.00 0.50 0.00 0.00 46.19 44.84 1vkd s LEU 235 CO 0.05 -0.15 0.94 0.42 -1.32 0.00 0.00 176.35 176.30 1vkd s THR 236 N 1.55 2.06 0.11 3.68 -4.23 0.08 -4.97 115.64 113.93 1vkd s THR 236 Ca 0.04 -0.75 0.34 0.00 -1.18 0.00 0.00 61.69 60.14 1vkd s THR 236 Cb -0.16 -2.31 0.38 0.00 1.34 0.00 0.00 72.50 71.74 1vkd s THR 236 CO 0.03 0.00 2.00 0.00 -0.54 0.00 0.00 174.62 176.12 1vkd n ASN 238 N -2.98 3.19 0.00 0.00 3.02 -1.26 -5.07 115.26 112.16 1vkd n ASN 238 Ca 0.00 -2.00 0.00 0.00 -0.03 0.00 0.00 54.58 52.55 1vkd n ASN 238 Cb 0.26 -0.30 0.00 0.00 -0.61 0.00 0.00 39.78 39.13 1vkd n ASN 238 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1vkd n GLY 239 N 0.80 0.89 3.82 7.41 0.00 -1.10 -5.09 105.19 111.91 1vkd n GLY 239 Ca 0.15 -1.99 -0.34 0.00 0.00 0.00 0.00 46.02 43.84 1vkd n GLY 239 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1vkd s TYR 240 N -1.47 3.40 -0.16 1.61 2.02 -1.26 -0.74 117.35 120.75 1vkd s TYR 240 Ca 0.00 1.57 0.01 0.00 -0.37 0.00 0.00 57.07 58.28 1vkd s TYR 240 Cb 0.00 -2.80 0.02 0.00 -0.40 0.00 0.00 41.96 38.78 1vkd s TYR 240 CO 0.00 -0.00 -0.17 0.08 -1.57 0.00 0.00 175.55 173.88 1vkd s VAL 241 N -2.03 1.79 -0.23 0.71 1.01 -0.23 -4.79 120.40 116.64 1vkd s VAL 241 Ca 0.58 -0.78 -0.10 0.00 0.00 0.00 0.00 61.98 61.68 1vkd s VAL 241 Cb -0.11 -1.64 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1vkd s VAL 241 CO 0.16 0.50 0.15 -0.31 0.00 0.00 0.00 175.10 175.59 1vkd s TYR 242 N 1.32 3.31 0.48 5.22 1.51 -0.43 -2.10 117.35 126.67 1vkd s TYR 242 Ca 0.03 0.20 0.02 0.00 -1.01 0.00 0.00 57.07 56.32 1vkd s TYR 242 Cb -0.13 -2.24 -0.03 0.00 -0.11 0.00 0.00 41.96 39.45 1vkd s TYR 242 CO -0.10 0.08 0.01 -1.12 -1.11 0.00 0.00 175.55 173.31 1vkd s SER 243 N 0.94 3.97 0.02 2.29 0.01 -0.16 -2.02 113.70 118.76 1vkd s SER 243 Ca 0.07 -1.60 0.00 0.00 1.31 0.00 0.00 55.95 55.73 1vkd s SER 243 Cb -0.13 0.36 -0.02 0.00 0.21 0.00 0.00 66.02 66.44 1vkd s SER 243 CO 0.03 -0.79 -0.03 0.72 0.41 0.00 0.00 173.24 173.59 1vkd s PHE 244 N -2.88 0.26 0.00 2.43 -0.12 -0.10 -0.84 117.98 116.74 1vkd s PHE 244 Ca 0.12 -0.43 0.00 0.00 -0.05 0.00 0.00 56.93 56.57 1vkd s PHE 244 Cb 0.03 -0.18 0.00 0.00 -0.63 0.00 0.00 43.02 42.24 1vkd s PHE 244 CO 0.06 -0.15 0.00 0.41 -0.05 0.00 0.00 175.22 175.50 1vkd n GLY 245 N 1.86 5.43 3.40 1.99 0.00 -0.06 0.64 105.19 118.46 1vkd n GLY 245 Ca -0.22 -1.32 -0.13 0.00 0.00 0.00 0.00 46.02 44.35 1vkd n GLY 245 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1vkd s ALA 246 N -2.00 -1.40 0.12 4.61 0.00 -1.26 -1.88 121.76 119.96 1vkd s ALA 246 Ca 0.00 0.54 0.04 0.00 0.00 0.00 0.00 51.96 52.54 1vkd s ALA 246 Cb 0.00 0.54 -0.04 0.00 0.00 0.00 0.00 23.12 23.62 1vkd s ALA 246 CO 0.00 -0.59 -0.09 0.00 0.00 0.00 0.00 175.76 175.07 1vkd s ALA 247 N -2.91 1.26 -0.13 0.00 0.00 0.15 -1.88 121.76 118.25 1vkd s ALA 247 Ca -0.03 -1.38 -0.02 0.00 0.00 0.00 0.00 51.96 50.54 1vkd s ALA 247 Cb -0.00 0.07 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 1vkd s ALA 247 CO -0.05 -0.11 -0.09 -0.51 0.00 0.00 0.00 175.76 175.00 1vkd s LEU 248 N -2.95 2.99 0.03 0.00 1.43 0.13 -1.02 118.68 119.28 1vkd s LEU 248 Ca 0.13 -0.21 0.04 0.00 -1.03 0.00 0.00 54.13 53.05 1vkd s LEU 248 Cb 0.02 -1.69 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1vkd s LEU 248 CO -0.01 0.19 -0.06 -0.76 0.23 0.00 0.00 176.35 175.94 1vkd s LEU 249 N 0.24 3.21 0.32 1.79 1.43 -0.15 0.00 118.68 125.53 1vkd s LEU 249 Ca -0.06 -0.17 -0.29 0.00 -1.03 0.00 0.00 54.13 52.58 1vkd s LEU 249 Cb -0.15 -1.88 -0.12 0.00 0.03 0.00 0.00 46.19 44.08 1vkd s LEU 249 CO 0.04 0.25 1.50 -0.67 0.23 0.00 0.00 176.35 177.71 1vkd n ASP 250 N 1.31 3.61 -0.22 2.29 2.03 0.39 -0.62 116.55 125.34 1vkd n ASP 250 Ca -0.14 1.18 -0.07 0.00 0.52 0.00 0.00 54.79 56.28 1vkd n ASP 250 Cb 0.52 -1.58 0.03 0.00 -0.72 0.00 0.00 41.12 39.38 1vkd n ASP 250 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 1vkd h LEU 251 N 3.80 0.77 0.11 -2.67 3.38 -1.93 -2.06 115.31 116.71 1vkd h LEU 251 Ca -0.48 -0.10 -0.31 0.00 0.09 0.00 0.00 57.88 57.08 1vkd h LEU 251 Cb 1.24 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 1vkd h LEU 251 CO 0.71 0.65 -1.59 0.44 0.09 0.00 0.00 178.44 178.75 1vkd h ASP 252 N 0.83 0.36 -3.19 -0.43 3.32 -1.99 -3.40 116.42 111.92 1vkd h ASP 252 Ca 0.21 -0.53 -0.61 0.00 0.02 0.00 0.00 57.03 56.12 1vkd h ASP 252 Cb 0.06 -0.12 -0.40 0.00 0.22 0.00 0.00 39.33 39.10 1vkd h ASP 252 CO -0.03 1.45 -0.76 -0.62 -1.72 0.00 0.00 179.24 177.56 1vkd s ASP 253 N -6.91 3.41 0.00 6.45 2.15 -1.22 -4.93 116.67 115.63 1vkd s ASP 253 Ca -0.10 -2.89 0.03 0.00 0.43 0.00 0.00 52.55 50.02 1vkd s ASP 253 Cb 0.07 -1.00 0.16 0.00 -0.30 0.00 0.00 42.92 41.85 1vkd s ASP 253 CO 0.84 -0.22 0.87 -0.81 -0.17 0.00 0.00 175.17 175.68 1vkd n PRO 254 N 3.18 0.05 0.01 4.34 -0.04 -0.78 -0.63 135.00 141.14 1vkd n PRO 254 Ca 0.14 0.21 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 1vkd n PRO 254 Cb 0.37 -1.50 0.50 0.00 -0.04 0.00 0.00 33.50 32.83 1vkd n PRO 254 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1vkd n SER 255 N -1.24 0.22 -4.59 3.54 3.41 -1.26 -4.63 113.62 109.07 1vkd n SER 255 Ca 0.02 0.34 -0.42 0.00 -0.26 0.00 0.00 58.87 58.55 1vkd n SER 255 Cb 0.02 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.56 1vkd n SER 255 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1vkd s LYS 256 N -3.02 3.82 -0.24 4.33 2.20 0.19 -4.64 119.74 122.39 1vkd s LYS 256 Ca 0.13 0.34 -0.23 0.00 -0.36 0.00 0.00 55.97 55.85 1vkd s LYS 256 Cb 0.18 -3.77 -0.01 0.00 -1.51 0.00 0.00 37.83 32.71 1vkd s LYS 256 CO 0.58 -0.74 0.75 0.08 -0.36 0.00 0.00 175.35 175.66 1vkd s VAL 257 N 2.92 4.90 -0.08 4.02 1.01 -1.26 -0.46 120.40 131.45 1vkd s VAL 257 Ca 0.30 1.41 -0.13 0.00 0.00 0.00 0.00 61.98 63.56 1vkd s VAL 257 Cb -0.14 -4.05 -0.29 0.00 0.00 0.00 0.00 36.38 31.90 1vkd s VAL 257 CO 0.15 -0.02 0.60 -0.07 0.00 0.00 0.00 175.10 175.75 1vkd h LEU 258 N 8.94 0.49 -7.38 3.92 3.38 -0.75 -3.47 115.31 120.44 1vkd h LEU 258 Ca -0.25 -0.90 -0.08 0.00 0.09 0.00 0.00 57.88 56.74 1vkd h LEU 258 Cb 1.11 -0.16 -0.17 0.00 0.09 0.00 0.00 40.66 41.53 1vkd h LEU 258 CO 0.83 1.70 -0.12 -0.31 0.09 0.00 0.00 178.44 180.64 1vkd s TYR 259 N -2.52 -0.28 -0.27 1.13 2.02 -1.09 -4.98 117.35 111.36 1vkd s TYR 259 Ca -0.18 0.30 -0.09 0.00 -0.37 0.00 0.00 57.07 56.73 1vkd s TYR 259 Cb 0.05 0.21 0.12 0.00 -0.40 0.00 0.00 41.96 41.94 1vkd s TYR 259 CO 0.80 -0.54 0.59 0.50 -1.57 0.00 0.00 175.55 175.33 1vkd s ARG 260 N -2.15 0.51 0.13 -0.62 3.52 -1.26 0.21 118.95 119.29 1vkd s ARG 260 Ca -0.07 1.33 -0.31 0.00 -0.13 0.00 0.00 55.73 56.55 1vkd s ARG 260 Cb -0.02 0.72 -0.08 0.00 -1.56 0.00 0.00 34.95 34.01 1vkd s ARG 260 CO -0.00 -0.23 1.37 0.45 -0.81 0.00 0.00 175.30 176.08 1vkd s SER 261 N 2.82 6.85 0.43 -2.12 0.15 -0.79 -3.85 113.70 117.19 1vkd s SER 261 Ca -0.04 2.33 0.22 0.00 0.70 0.00 0.00 55.95 59.16 1vkd s SER 261 Cb -0.12 -2.59 0.93 0.00 -1.71 0.00 0.00 66.02 62.53 1vkd s SER 261 CO -0.17 -0.62 1.84 0.08 1.20 0.00 0.00 173.24 175.57 1vkd h ARG 262 N 6.52 0.00 -5.77 5.44 0.11 -1.13 -3.44 114.38 116.12 1vkd h ARG 262 Ca -0.43 0.00 -0.65 0.00 0.10 0.00 0.00 59.98 59.01 1vkd h ARG 262 Cb 1.21 0.00 -0.06 0.00 1.11 0.00 0.00 29.97 32.23 1vkd h ARG 262 CO 0.84 0.27 -0.44 0.71 0.10 0.00 0.00 179.97 181.45 1vkd s TYR 263 N -3.79 3.59 0.71 4.08 2.02 -1.26 -4.93 117.35 117.78 1vkd s TYR 263 Ca -0.01 0.52 -0.15 0.00 -0.37 0.00 0.00 57.07 57.07 1vkd s TYR 263 Cb 0.11 -1.94 0.03 0.00 -0.40 0.00 0.00 41.96 39.76 1vkd s TYR 263 CO 0.65 0.68 1.17 1.52 -1.57 0.00 0.00 175.55 178.00 1vkd s TYR 264 N -1.17 2.24 0.10 2.71 -0.85 -1.26 -4.74 117.35 114.37 1vkd s TYR 264 Ca 0.22 1.59 0.00 0.00 -0.52 0.00 0.00 57.07 58.36 1vkd s TYR 264 Cb -0.13 -3.36 -0.22 0.00 0.38 0.00 0.00 41.96 38.64 1vkd s TYR 264 CO 0.11 -2.28 1.22 -0.07 -1.52 0.00 0.00 175.55 173.01 1vkd h LEU 265 N -0.26 0.26 -7.34 -3.49 3.38 -0.11 -3.47 115.31 104.27 1vkd h LEU 265 Ca -0.47 -0.26 -0.12 0.00 0.09 0.00 0.00 57.88 57.12 1vkd h LEU 265 Cb 1.28 -0.08 -0.23 0.00 0.09 0.00 0.00 40.66 41.72 1vkd h LEU 265 CO 0.51 1.19 -0.22 -0.22 0.09 0.00 0.00 178.44 179.78 1vkd s LEU 266 N -7.04 0.47 0.06 1.67 2.96 -0.88 -4.71 118.68 111.21 1vkd s LEU 266 Ca -0.02 0.65 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 1vkd s LEU 266 Cb 0.08 1.44 -0.03 0.00 0.50 0.00 0.00 46.19 48.18 1vkd s LEU 266 CO 0.85 -0.24 -0.05 0.28 -1.32 0.00 0.00 176.35 175.88 1vkd s THR 267 N -0.21 0.43 0.15 3.68 -1.32 -1.26 -0.92 115.64 116.19 1vkd s THR 267 Ca -0.04 -1.56 -0.31 0.00 -1.21 0.00 0.00 61.69 58.57 1vkd s THR 267 Cb -0.03 -1.19 -0.11 0.00 -1.51 0.00 0.00 72.50 69.66 1vkd s THR 267 CO 0.02 -0.75 1.73 -2.84 -2.21 0.00 0.00 174.62 170.57 1vkd s PRO 268 N -3.02 4.15 0.00 7.08 0.02 -1.26 -4.77 135.00 137.21 1vkd s PRO 268 Ca 0.02 2.53 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1vkd s PRO 268 Cb 0.01 -3.36 0.00 0.00 0.02 0.00 0.00 34.50 31.17 1vkd s PRO 268 CO -0.05 -0.76 0.00 0.39 -0.33 0.00 0.00 177.00 176.25 1vkd n GLU 269 N 4.86 0.00 -2.50 5.54 1.02 -1.26 -4.93 120.64 123.37 1vkd n GLU 269 Ca 0.16 0.00 -0.31 0.00 -0.02 0.00 0.00 57.16 57.00 1vkd n GLU 269 Cb 0.38 -0.30 -0.02 0.00 -0.02 0.00 0.00 31.44 31.47 1vkd n GLU 269 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1vkd s GLU 270 N -1.14 3.77 0.34 3.49 0.41 -1.26 -4.82 118.70 119.49 1vkd s GLU 270 Ca 0.00 0.64 0.07 0.00 -0.41 0.00 0.00 54.97 55.27 1vkd s GLU 270 Cb 0.00 -2.25 0.76 0.00 -1.78 0.00 0.00 34.13 30.86 1vkd s GLU 270 CO 0.00 -0.23 1.87 1.49 -0.49 0.00 0.00 175.26 177.90 1vkd h GLU 271 N 0.73 0.74 0.00 1.61 4.81 -1.96 0.28 114.58 120.78 1vkd h GLU 271 Ca -0.46 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1vkd h GLU 271 Cb 1.19 -0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.40 1vkd h GLU 271 CO 0.62 0.49 0.00 2.48 -0.73 0.00 0.00 179.01 181.87 1vkd n TYR 272 N -4.56 0.00 -0.04 0.92 0.18 -1.26 -1.89 117.16 110.50 1vkd n TYR 272 Ca 0.17 0.00 -0.02 0.00 1.88 0.00 0.00 57.90 59.93 1vkd n TYR 272 Cb 0.42 -0.32 -0.09 0.00 -0.38 0.00 0.00 39.34 38.97 1vkd n TYR 272 CO 0.00 0.00 0.00 0.39 -2.08 0.00 0.00 176.86 175.17 1vkd n GLU 273 N -1.32 1.61 0.00 -3.48 1.02 0.83 -3.73 120.64 115.57 1vkd n GLU 273 Ca 0.07 -0.04 0.09 0.00 -0.02 0.00 0.00 57.16 57.27 1vkd n GLU 273 Cb 0.15 -1.29 -0.03 0.00 -0.02 0.00 0.00 31.44 30.24 1vkd n GLU 273 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 1vkd n THR 274 N -2.27 0.00 -4.28 2.62 -2.24 -0.19 -0.82 114.28 107.09 1vkd n THR 274 Ca -0.14 -0.24 -0.20 0.00 -2.27 0.00 0.00 64.05 61.21 1vkd n THR 274 Cb 0.71 1.16 -0.16 0.00 -2.10 0.00 0.00 70.33 69.94 1vkd n THR 274 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1vkd s VAL 275 N -2.32 0.66 -5.00 2.28 1.01 -0.79 -4.11 120.40 112.12 1vkd s VAL 275 Ca 0.13 -0.25 0.00 0.00 0.00 0.00 0.00 61.98 61.86 1vkd s VAL 275 Cb 0.15 -0.62 0.00 0.00 0.00 0.00 0.00 36.38 35.90 1vkd s VAL 275 CO 0.56 0.23 0.00 0.61 0.00 0.00 0.00 175.10 176.50 1vkd n GLY 276 N 3.63 0.20 0.10 4.51 0.00 -1.26 -4.65 105.19 107.72 1vkd n GLY 276 Ca -0.21 -1.46 -0.09 0.00 0.00 0.00 0.00 46.02 44.26 1vkd n GLY 276 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1vkd h PHE 277 N 0.00 0.09 -3.35 1.61 3.57 -1.73 -3.32 116.94 113.81 1vkd h PHE 277 Ca 0.00 0.01 -0.62 0.00 3.53 0.00 0.00 57.97 60.89 1vkd h PHE 277 Cb 0.00 -0.01 -0.40 0.00 2.79 0.00 0.00 35.95 38.33 1vkd h PHE 277 CO 0.00 0.04 -0.72 0.08 -2.23 0.00 0.00 178.31 175.48 1vkd s VAL 278 N -6.18 1.72 0.57 1.41 1.01 -0.58 -5.01 120.40 113.34 1vkd s VAL 278 Ca -0.13 -2.22 -0.20 0.00 0.00 0.00 0.00 61.98 59.43 1vkd s VAL 278 Cb 0.09 -2.26 -0.04 0.00 0.00 0.00 0.00 36.38 34.18 1vkd s VAL 278 CO 0.69 -0.70 1.27 -2.84 0.00 0.00 0.00 175.10 173.51 1vkd s PRO 279 N 0.87 3.04 -0.48 2.72 0.02 -1.25 -3.92 135.00 136.00 1vkd s PRO 279 Ca 0.13 2.00 -0.00 0.00 0.02 0.00 0.00 61.00 63.15 1vkd s PRO 279 Cb -0.20 -2.08 -0.00 0.00 0.02 0.00 0.00 34.50 32.23 1vkd s PRO 279 CO -0.11 -1.20 0.40 0.09 -0.33 0.00 0.00 177.00 175.85 1vkd n ASN 280 N -1.33 -2.28 -3.83 2.53 3.02 -0.00 -4.89 115.26 108.47 1vkd n ASN 280 Ca 0.12 -0.26 -0.22 0.00 -0.03 0.00 0.00 54.58 54.20 1vkd n ASN 280 Cb 0.48 -2.39 -0.17 0.00 -0.61 0.00 0.00 39.78 37.09 1vkd n ASN 280 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1vkd s VAL 281 N -3.15 0.48 -0.18 2.41 1.01 -1.07 -1.31 120.40 118.59 1vkd s VAL 281 Ca 0.03 -0.01 0.01 0.00 0.00 0.00 0.00 61.98 62.00 1vkd s VAL 281 Cb -0.00 -0.57 0.03 0.00 0.00 0.00 0.00 36.38 35.84 1vkd s VAL 281 CO 0.30 0.25 -0.16 0.68 0.00 0.00 0.00 175.10 176.17 1vkd s VAL 282 N 1.46 1.87 -0.30 2.92 -7.23 -0.86 -1.08 120.40 117.17 1vkd s VAL 282 Ca -0.03 -0.94 0.01 0.00 -1.81 0.00 0.00 61.98 59.21 1vkd s VAL 282 Cb -0.13 -1.77 0.09 0.00 0.56 0.00 0.00 36.38 35.13 1vkd s VAL 282 CO -0.03 0.40 0.06 0.12 -0.31 0.00 0.00 175.10 175.34 1vkd s PHE 283 N 1.34 2.35 0.09 2.82 2.19 -0.17 -4.21 117.98 122.39 1vkd s PHE 283 Ca 0.03 -2.06 -0.30 0.00 0.33 0.00 0.00 56.93 54.92 1vkd s PHE 283 Cb -0.14 -2.01 -0.06 0.00 -1.31 0.00 0.00 43.02 39.49 1vkd s PHE 283 CO -0.11 -0.87 1.19 -1.25 1.83 0.00 0.00 175.22 176.00 1vkd s PRO 284 N 1.40 4.46 -0.07 10.12 0.04 -1.26 -0.53 135.00 149.15 1vkd s PRO 284 Ca 0.08 1.77 0.05 0.00 0.04 0.00 0.00 61.00 62.94 1vkd s PRO 284 Cb -0.18 -3.33 -0.08 0.00 0.04 0.00 0.00 34.50 30.95 1vkd s PRO 284 CO -0.17 -0.20 0.01 0.00 0.04 0.00 0.00 177.00 176.67 1vkd s ALA 286 N -2.17 -1.48 -0.02 0.00 0.00 -1.14 -3.97 121.76 112.97 1vkd s ALA 286 Ca -0.05 0.95 0.02 0.00 0.00 0.00 0.00 51.96 52.88 1vkd s ALA 286 Cb 0.02 0.12 0.00 0.00 0.00 0.00 0.00 23.12 23.27 1vkd s ALA 286 CO 0.28 -0.39 -0.07 0.00 0.00 0.00 0.00 175.76 175.58 1vkd s ALA 287 N -1.55 0.69 -0.04 0.00 0.00 -1.26 -0.20 121.76 119.41 1vkd s ALA 287 Ca -0.10 -0.24 0.00 0.00 0.00 0.00 0.00 51.96 51.62 1vkd s ALA 287 Cb -0.01 -0.27 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 1vkd s ALA 287 CO 0.06 0.10 0.00 -0.51 0.00 0.00 0.00 175.76 175.41 1vkd s LEU 288 N 0.22 3.54 -0.09 0.00 1.43 0.85 -4.96 118.68 119.67 1vkd s LEU 288 Ca -0.03 0.06 -0.02 0.00 -1.03 0.00 0.00 54.13 53.10 1vkd s LEU 288 Cb -0.08 -1.94 0.04 0.00 0.03 0.00 0.00 46.19 44.24 1vkd s LEU 288 CO 0.00 0.32 0.04 0.00 0.23 0.00 0.00 176.35 176.94 1vkd s ASP 290 N 2.05 6.27 0.42 0.00 2.15 -0.33 -4.32 116.67 122.91 1vkd s ASP 290 Ca 0.04 -0.16 0.23 0.00 0.43 0.00 0.00 52.55 53.09 1vkd s ASP 290 Cb -0.13 -2.56 1.22 0.00 -0.30 0.00 0.00 42.92 41.15 1vkd s ASP 290 CO -0.05 -1.68 1.74 0.00 -0.17 0.00 0.00 175.17 175.00 1vkd h ALA 291 N 9.93 2.42 -0.19 3.66 0.00 -1.47 0.46 119.26 134.07 1vkd h ALA 291 Ca -0.27 0.07 -0.09 0.00 0.00 0.00 0.00 54.91 54.62 1vkd h ALA 291 Cb 1.06 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 1vkd h ALA 291 CO 1.23 -0.88 -0.27 -0.44 0.00 0.00 0.00 179.25 178.90 1vkd h ASP 292 N 0.29 0.35 0.00 0.00 5.19 -1.90 -3.35 116.42 117.00 1vkd h ASP 292 Ca 0.65 -0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.94 1vkd h ASP 292 Cb 1.83 -0.09 0.00 0.00 0.18 0.00 0.00 39.33 41.24 1vkd h ASP 292 CO -0.31 0.62 -0.58 0.35 -3.12 0.00 0.00 179.24 176.21 1vkd n THR 293 N -4.13 0.00 -0.88 0.35 -2.24 -0.67 -5.01 114.28 101.71 1vkd n THR 293 Ca -0.01 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 1vkd n THR 293 Cb 0.39 0.60 0.00 0.00 -2.10 0.00 0.00 70.33 69.22 1vkd n THR 293 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1vkd n GLY 294 N 1.70 0.85 3.75 3.38 0.00 0.15 -4.94 105.19 110.08 1vkd n GLY 294 Ca 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 1vkd n GLY 294 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1vkd s ARG 295 N -0.12 4.20 -0.04 1.61 0.52 -1.24 -0.38 118.95 123.49 1vkd s ARG 295 Ca 0.00 2.44 0.06 0.00 -0.52 0.00 0.00 55.73 57.71 1vkd s ARG 295 Cb 0.00 -3.06 -0.01 0.00 0.52 0.00 0.00 34.95 32.40 1vkd s ARG 295 CO 0.00 -0.51 -0.22 0.08 0.02 0.00 0.00 175.30 174.67 1vkd s VAL 296 N -0.17 1.77 -0.15 3.52 1.01 0.15 -1.18 120.40 125.36 1vkd s VAL 296 Ca 0.60 -0.92 0.02 0.00 0.00 0.00 0.00 61.98 61.68 1vkd s VAL 296 Cb -0.45 -1.50 0.01 0.00 0.00 0.00 0.00 36.38 34.45 1vkd s VAL 296 CO 0.48 0.50 -0.20 0.00 0.00 0.00 0.00 175.10 175.87 1vkd s ALA 297 N -0.18 2.21 -0.18 5.51 0.00 -0.16 -1.90 121.76 127.06 1vkd s ALA 297 Ca -0.01 -1.10 -0.05 0.00 0.00 0.00 0.00 51.96 50.80 1vkd s ALA 297 Cb -0.12 -1.04 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 1vkd s ALA 297 CO 0.02 -0.15 0.01 0.42 0.00 0.00 0.00 175.76 176.06 1vkd s ILE 298 N 1.01 4.14 -0.16 0.00 1.01 0.84 -0.11 121.20 127.93 1vkd s ILE 298 Ca -0.03 -0.26 -0.18 0.00 0.00 0.00 0.00 60.65 60.18 1vkd s ILE 298 Cb -0.15 -2.86 -0.04 0.00 0.01 0.00 0.00 42.46 39.43 1vkd s ILE 298 CO -0.06 0.45 0.49 -0.31 0.00 0.00 0.00 174.94 175.52 1vkd s TYR 299 N 0.68 3.44 0.06 3.97 2.02 0.73 -1.01 117.35 127.24 1vkd s TYR 299 Ca 0.00 0.82 0.03 0.00 -0.37 0.00 0.00 57.07 57.55 1vkd s TYR 299 Cb -0.14 -2.61 -0.03 0.00 -0.40 0.00 0.00 41.96 38.78 1vkd s TYR 299 CO 0.02 0.03 -0.09 1.52 -1.57 0.00 0.00 175.55 175.46 1vkd s TYR 300 N 1.14 0.86 0.15 2.71 1.13 0.11 -0.47 117.35 122.99 1vkd s TYR 300 Ca 0.25 -0.55 -0.25 0.00 -1.41 0.00 0.00 57.07 55.10 1vkd s TYR 300 Cb -0.15 -0.50 -0.08 0.00 -1.10 0.00 0.00 41.96 40.13 1vkd s TYR 300 CO 0.10 -0.05 0.77 0.20 -2.51 0.00 0.00 175.55 174.06 1vkd s GLY 301 N -1.87 2.90 -0.20 5.49 0.00 0.32 -0.43 107.32 113.53 1vkd s GLY 301 Ca -0.04 0.35 0.00 0.00 0.00 0.00 0.00 44.72 45.03 1vkd s GLY 301 CO 0.00 0.89 -0.15 0.00 0.00 0.00 0.00 173.10 173.84 1vkd s ALA 302 N -1.01 2.46 -1.44 3.20 0.00 0.51 -1.00 121.76 124.49 1vkd s ALA 302 Ca 0.36 -1.26 0.00 0.00 0.00 0.00 0.00 51.96 51.06 1vkd s ALA 302 Cb -0.23 -1.34 0.00 0.00 0.00 0.00 0.00 23.12 21.55 1vkd s ALA 302 CO 0.26 -0.45 0.00 0.00 0.00 0.00 0.00 175.76 175.56 1vkd n ALA 303 N 4.65 -0.64 -4.19 0.00 0.00 -0.24 -0.94 120.51 119.14 1vkd n ALA 303 Ca -0.20 0.15 -0.36 0.00 0.00 0.00 0.00 53.44 53.04 1vkd n ALA 303 Cb 0.49 -1.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.12 1vkd n ALA 303 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1vkd n ASP 304 N -1.75 -3.45 0.00 0.00 9.92 -1.25 -1.53 116.55 118.49 1vkd n ASP 304 Ca -0.19 -0.99 0.00 0.00 -0.53 0.00 0.00 54.79 53.08 1vkd n ASP 304 Cb 0.63 -2.88 0.00 0.00 -0.64 0.00 0.00 41.12 38.23 1vkd n ASP 304 CO 0.00 0.00 0.00 0.41 0.13 0.00 0.00 177.20 177.74 1vkd n THR 305 N -4.42 0.00 -4.20 -3.53 -1.04 -0.12 -4.51 114.28 96.47 1vkd n THR 305 Ca 0.07 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.95 1vkd n THR 305 Cb 0.50 -0.08 -0.10 0.00 -1.82 0.00 0.00 70.33 68.82 1vkd n THR 305 CO 0.00 0.00 0.00 -1.00 -0.64 0.00 0.00 175.07 173.43 1vkd s HIS 306 N -1.11 1.07 -0.15 -1.42 3.76 -0.71 -3.67 115.29 113.06 1vkd s HIS 306 Ca 0.00 -0.76 -0.10 0.00 -0.15 0.00 0.00 55.06 54.05 1vkd s HIS 306 Cb 0.00 -0.58 -0.05 0.00 1.11 0.00 0.00 32.58 33.07 1vkd s HIS 306 CO 0.00 -0.02 0.18 0.08 -0.85 0.00 0.00 174.74 174.13 1vkd s VAL 307 N -3.04 5.40 0.11 -0.90 1.01 0.85 -0.36 120.40 123.48 1vkd s VAL 307 Ca 0.11 0.31 0.01 0.00 0.00 0.00 0.00 61.98 62.40 1vkd s VAL 307 Cb 0.01 -3.49 -0.04 0.00 0.00 0.00 0.00 36.38 32.86 1vkd s VAL 307 CO -0.01 0.51 -0.03 0.00 0.00 0.00 0.00 175.10 175.57 1vkd s ALA 308 N -0.29 0.97 0.06 5.51 0.00 0.43 -1.09 121.76 127.35 1vkd s ALA 308 Ca 0.13 -1.39 0.08 0.00 0.00 0.00 0.00 51.96 50.78 1vkd s ALA 308 Cb -0.12 0.34 -0.03 0.00 0.00 0.00 0.00 23.12 23.31 1vkd s ALA 308 CO 0.03 -0.30 -0.21 -0.51 0.00 0.00 0.00 175.76 174.76 1vkd s LEU 309 N -3.05 2.50 0.06 0.00 1.43 -1.26 -0.71 118.68 117.64 1vkd s LEU 309 Ca 0.15 -0.50 0.03 0.00 -1.03 0.00 0.00 54.13 52.78 1vkd s LEU 309 Cb 0.06 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.81 1vkd s LEU 309 CO -0.03 0.24 -0.11 0.00 0.23 0.00 0.00 176.35 176.69 1vkd s ALA 310 N -0.93 0.85 0.15 4.21 0.00 -0.18 -0.95 121.76 124.90 1vkd s ALA 310 Ca 0.14 -0.88 0.08 0.00 0.00 0.00 0.00 51.96 51.30 1vkd s ALA 310 Cb -0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1vkd s ALA 310 CO 0.05 0.06 -0.17 -0.06 0.00 0.00 0.00 175.76 175.64 1vkd s PHE 311 N -1.37 1.72 0.09 0.00 0.08 0.63 -0.11 117.98 119.01 1vkd s PHE 311 Ca -0.06 -0.49 -0.25 0.00 0.12 0.00 0.00 56.93 56.25 1vkd s PHE 311 Cb -0.10 -0.87 0.09 0.00 -0.57 0.00 0.00 43.02 41.57 1vkd s PHE 311 CO 0.01 0.28 1.16 0.20 -0.10 0.00 0.00 175.22 176.77 1vkd s GLY 312 N -2.55 0.02 -0.12 4.36 0.00 -0.80 -0.86 107.32 107.38 1vkd s GLY 312 Ca 0.13 -0.20 -0.04 0.00 0.00 0.00 0.00 44.72 44.62 1vkd s GLY 312 CO 0.06 4.35 0.03 -0.19 0.00 0.00 0.00 173.10 177.34 1vkd s TYR 313 N -2.04 3.24 0.26 1.90 2.02 -1.26 0.34 117.35 121.82 1vkd s TYR 313 Ca 0.27 0.18 -0.03 0.00 -0.37 0.00 0.00 57.07 57.12 1vkd s TYR 313 Cb -0.02 -1.88 0.40 0.00 -0.40 0.00 0.00 41.96 40.06 1vkd s TYR 313 CO 0.03 0.41 1.88 0.97 -1.57 0.00 0.00 175.55 177.26 1vkd h ILE 314 N 4.35 1.08 -0.10 2.71 6.09 -1.04 -1.08 117.51 129.52 1vkd h ILE 314 Ca -0.47 -0.39 -0.13 0.00 -1.37 0.00 0.00 64.86 62.49 1vkd h ILE 314 Cb 1.19 -0.17 -0.01 0.00 0.47 0.00 0.00 36.82 38.30 1vkd h ILE 314 CO 0.59 0.21 -0.52 -2.24 -3.07 0.00 0.00 178.15 173.12 1vkd h ASP 315 N 1.15 0.31 0.16 2.19 2.03 -1.95 0.02 116.42 120.32 1vkd h ASP 315 Ca 0.43 -0.15 -0.21 0.00 -0.73 0.00 0.00 57.03 56.37 1vkd h ASP 315 Cb 0.17 -0.09 0.00 0.00 -0.83 0.00 0.00 39.33 38.59 1vkd h ASP 315 CO -0.17 0.77 -0.79 -0.33 -1.03 0.00 0.00 179.24 177.68 1vkd h GLU 316 N 0.22 0.52 -0.06 4.15 5.08 -1.80 -0.13 114.58 122.56 1vkd h GLU 316 Ca 0.01 -0.45 -0.01 0.00 -1.00 0.00 0.00 59.36 57.91 1vkd h GLU 316 Cb 0.98 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.34 1vkd h GLU 316 CO 0.08 1.08 0.01 0.82 -1.00 0.00 0.00 179.01 180.00 1vkd h ILE 317 N 0.34 1.22 -0.51 3.13 2.04 -1.04 0.15 117.51 122.84 1vkd h ILE 317 Ca -0.05 -0.69 0.08 0.00 1.00 0.00 0.00 64.86 65.20 1vkd h ILE 317 Cb 1.40 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 38.98 1vkd h ILE 317 CO 0.14 0.19 0.16 0.58 0.00 0.00 0.00 178.15 179.22 1vkd h VAL 318 N -0.15 0.79 -0.67 1.67 2.07 -1.01 -0.55 116.25 118.41 1vkd h VAL 318 Ca 0.02 -0.11 0.07 0.00 0.82 0.00 0.00 66.70 67.50 1vkd h VAL 318 Cb 0.29 0.44 -0.06 0.00 -1.52 0.00 0.00 31.29 30.44 1vkd h VAL 318 CO 0.00 0.06 0.35 0.44 0.02 0.00 0.00 177.57 178.44 1vkd h ASP 319 N 0.32 0.49 -0.45 0.57 3.32 -0.72 -1.36 116.42 118.59 1vkd h ASP 319 Ca 0.25 0.04 -0.03 0.00 0.02 0.00 0.00 57.03 57.32 1vkd h ASP 319 Cb 0.30 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1vkd h ASP 319 CO -0.28 0.31 0.17 0.15 -1.72 0.00 0.00 179.24 177.87 1vkd h PHE 320 N 0.63 0.70 -0.12 4.55 3.57 0.13 0.22 116.94 126.63 1vkd h PHE 320 Ca 0.31 -0.06 0.02 0.00 3.53 0.00 0.00 57.97 61.77 1vkd h PHE 320 Cb 0.26 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1vkd h PHE 320 CO -0.09 0.60 -0.00 0.28 -2.23 0.00 0.00 178.31 176.87 1vkd h VAL 321 N 0.59 0.92 0.20 1.41 2.07 -0.79 -1.15 116.25 119.49 1vkd h VAL 321 Ca 0.15 -0.01 -0.01 0.00 0.82 0.00 0.00 66.70 67.65 1vkd h VAL 321 Cb 0.21 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 30.86 1vkd h VAL 321 CO -0.01 0.01 -0.09 0.11 0.02 0.00 0.00 177.57 177.60 1vkd h LYS 322 N 0.04 -0.25 -0.07 1.57 1.57 -1.07 -2.73 116.57 115.62 1vkd h LYS 322 Ca 0.05 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1vkd h LYS 322 Cb 0.06 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1vkd h LYS 322 CO -0.09 -0.05 -0.04 -0.09 -0.57 0.00 0.00 179.45 178.60 1vkd h ARG 323 N -0.42 0.10 -0.62 3.15 2.43 -0.88 -2.40 114.38 115.75 1vkd h ARG 323 Ca -0.03 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 1vkd h ARG 323 Cb 0.32 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.85 1vkd h ARG 323 CO 0.04 0.16 0.00 0.09 -1.51 0.00 0.00 179.97 178.75 1vkd n ASN 324 N -4.42 4.78 0.00 -3.80 3.02 -0.44 -5.06 115.26 109.33 1vkd n ASN 324 Ca -0.02 -2.51 0.09 0.00 -0.03 0.00 0.00 54.58 52.12 1vkd n ASN 324 Cb 0.16 -0.58 0.54 0.00 -0.61 0.00 0.00 39.78 39.29 1vkd n ASN 324 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44