#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k3t s ALA -2 N 0.00 -1.08 -1.76 4.61 0.00 -1.26 -5.05 121.76 117.22 2k3t s ALA -2 Ca 0.00 -0.17 0.06 0.00 0.00 0.00 0.00 51.96 51.85 2k3t s ALA -2 Cb 0.00 0.87 0.21 0.00 0.00 0.00 0.00 23.12 24.20 2k3t s ALA -2 CO 0.00 -0.87 1.11 -1.33 0.00 0.00 0.00 175.76 174.67 2k3t n MET -1 N -0.38 1.66 -3.86 0.00 0.00 -1.25 -4.90 117.12 108.39 2k3t n MET -1 Ca -0.09 -0.84 -0.05 0.00 0.00 0.00 0.00 57.70 56.72 2k3t n MET -1 Cb 0.62 -1.29 0.02 0.00 0.00 0.00 0.00 33.22 32.57 2k3t n MET -1 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 175.97 176.17 2k3t s GLY 2427N -0.85 0.21 -0.14 3.03 0.00 -1.00 -1.79 107.32 106.79 2k3t s GLY 2427Ca 0.15 -0.50 -0.10 0.00 0.00 0.00 0.00 44.72 44.27 2k3t s GLY 2427CO 0.09 1.44 0.35 -0.35 0.00 0.00 0.00 173.10 174.63 2k3t s ASP 2428N -3.29 -0.39 0.59 1.64 -1.08 -1.26 -4.91 116.67 107.98 2k3t s ASP 2428Ca 0.20 0.72 0.37 0.00 -0.52 0.00 0.00 52.55 53.32 2k3t s ASP 2428Cb -0.04 0.68 1.76 0.00 -1.46 0.00 0.00 42.92 43.87 2k3t s ASP 2428CO 0.08 -0.15 2.14 1.55 0.52 0.00 0.00 175.17 179.31 2k3t h PRO 2429N 6.19 0.00 0.00 4.34 0.13 -1.91 -0.49 132.00 140.27 2k3t h PRO 2429Ca -0.31 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.68 2k3t h PRO 2429Cb 1.18 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.29 2k3t h PRO 2429CO 0.30 0.02 -0.76 0.78 -0.23 0.00 0.00 178.00 178.11 2k3t h GLY 2430N 1.14 0.00 1.55 1.56 0.00 -1.94 -2.19 103.07 103.19 2k3t h GLY 2430Ca -0.00 0.00 -0.27 0.00 0.00 0.00 0.00 47.33 47.06 2k3t h GLY 2430CO 0.00 0.00 -1.31 1.41 0.00 0.00 0.00 176.54 176.64 2k3t h LEU 2431N 0.00 0.33 -9.86 3.11 -0.00 -1.74 -3.44 115.31 103.71 2k3t h LEU 2431Ca -0.03 -0.39 -0.53 0.00 -0.00 0.00 0.00 57.88 56.93 2k3t h LEU 2431Cb 1.51 -0.11 0.08 0.00 -0.00 0.00 0.00 40.66 42.14 2k3t h LEU 2431CO 0.08 1.31 0.73 -0.69 -0.00 0.00 0.00 178.44 179.87 2k3t s VAL 2432N -2.65 2.46 0.00 1.22 1.01 -0.26 -4.39 120.40 117.80 2k3t s VAL 2432Ca -0.05 0.44 0.00 0.00 0.00 0.00 0.00 61.98 62.37 2k3t s VAL 2432Cb 0.07 -3.28 0.00 0.00 0.00 0.00 0.00 36.38 33.18 2k3t s VAL 2432CO 0.86 0.09 0.00 -0.24 0.00 0.00 0.00 175.10 175.82 2k3t n SER 2433N 1.22 0.88 -3.72 3.32 2.88 -1.02 -3.75 113.62 113.43 2k3t n SER 2433Ca 0.03 -0.72 -0.14 0.00 -1.33 0.00 0.00 58.87 56.70 2k3t n SER 2433Cb 0.40 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 63.77 2k3t n SER 2433CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k3t s ALA 2434N -2.00 -1.00 0.01 -1.46 0.00 -1.26 -0.58 121.76 115.47 2k3t s ALA 2434Ca 0.00 0.81 -0.05 0.00 0.00 0.00 0.00 51.96 52.72 2k3t s ALA 2434Cb 0.00 -0.27 -0.01 0.00 0.00 0.00 0.00 23.12 22.85 2k3t s ALA 2434CO 0.00 -0.24 0.08 0.71 0.00 0.00 0.00 175.76 176.31 2k3t s TYR 2435N -0.62 0.10 0.00 0.00 2.02 -0.56 -4.95 117.35 113.35 2k3t s TYR 2435Ca -0.07 -0.25 0.00 0.00 -0.37 0.00 0.00 57.07 56.38 2k3t s TYR 2435Cb -0.04 -0.09 0.00 0.00 -0.40 0.00 0.00 41.96 41.43 2k3t s TYR 2435CO 0.03 -0.25 0.00 0.41 -1.57 0.00 0.00 175.55 174.17 2k3t n GLY 2436N 1.54 3.23 0.27 0.71 0.00 -1.26 -0.48 105.19 109.20 2k3t n GLY 2436Ca -0.23 -1.98 0.06 0.00 0.00 0.00 0.00 46.02 43.87 2k3t n GLY 2436CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t h ALA 2437N 0.00 1.82 0.00 4.61 0.00 -1.83 -2.93 119.26 120.93 2k3t h ALA 2437Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2k3t h ALA 2437Cb 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.72 2k3t h ALA 2437CO 0.00 0.15 0.00 0.41 0.00 0.00 0.00 179.25 179.81 2k3t n GLY 2438N -1.41 -0.93 0.13 0.00 0.00 -0.11 -1.16 105.19 101.71 2k3t n GLY 2438Ca -0.00 -0.03 -0.00 0.00 0.00 0.00 0.00 46.02 45.99 2k3t n GLY 2438CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2k3t h LEU 2439N 0.00 0.00 0.04 0.99 3.38 -1.77 -3.34 115.31 114.62 2k3t h LEU 2439Ca 0.00 0.00 -0.34 0.00 0.09 0.00 0.00 57.88 57.63 2k3t h LEU 2439Cb 0.21 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.91 2k3t h LEU 2439CO 0.00 0.63 -2.03 -0.62 0.09 0.00 0.00 178.44 176.52 2k3t n GLU 2440N -3.37 0.69 0.00 1.13 1.02 -0.31 -3.48 120.64 116.32 2k3t n GLU 2440Ca 0.01 0.22 0.00 0.00 -0.02 0.00 0.00 57.16 57.36 2k3t n GLU 2440Cb 0.74 -1.68 0.00 0.00 -0.02 0.00 0.00 31.44 30.48 2k3t n GLU 2440CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2k3t n GLY 2441N 1.84 0.48 0.00 0.62 0.00 -0.39 -1.56 105.19 106.18 2k3t n GLY 2441Ca -0.29 -1.23 0.00 0.00 0.00 0.00 0.00 46.02 44.50 2k3t n GLY 2441CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2442N 0.00 -0.56 3.04 -0.02 0.00 -1.25 -4.03 105.19 102.37 2k3t n GLY 2442Ca 0.00 -0.53 -0.09 0.00 0.00 0.00 0.00 46.02 45.40 2k3t n GLY 2442CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k3t s VAL 2443N -4.00 0.12 0.15 1.61 0.11 -1.26 -3.87 120.40 113.26 2k3t s VAL 2443Ca 0.00 -1.00 -0.34 0.00 -2.93 0.00 0.00 61.98 57.70 2k3t s VAL 2443Cb 0.00 -0.55 -0.15 0.00 -1.53 0.00 0.00 36.38 34.16 2k3t s VAL 2443CO 0.00 -0.55 1.51 0.35 -3.33 0.00 0.00 175.10 173.07 2k3t n THR 2444N 1.25 0.05 -0.11 5.04 -2.24 -0.68 -2.19 114.28 115.40 2k3t n THR 2444Ca -0.22 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.55 2k3t n THR 2444Cb 0.56 -1.35 0.00 0.00 -2.10 0.00 0.00 70.33 67.44 2k3t n THR 2444CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2445N 3.12 1.83 3.86 3.38 0.00 -0.31 -4.86 105.19 112.21 2k3t n GLY 2445Ca 0.17 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.86 2k3t n GLY 2445CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2k3t s ASN 2446N -3.29 6.11 -0.07 1.61 4.22 -0.93 -4.98 114.94 117.60 2k3t s ASN 2446Ca 0.00 0.26 -0.30 0.00 -2.14 0.00 0.00 52.86 50.68 2k3t s ASN 2446Cb 0.00 -1.85 -0.03 0.00 1.28 0.00 0.00 41.25 40.65 2k3t s ASN 2446CO 0.00 0.26 1.20 -2.16 -2.04 0.00 0.00 177.10 174.36 2k3t s PRO 2447N -1.93 4.34 0.07 3.55 0.04 -1.26 -4.25 135.00 135.55 2k3t s PRO 2447Ca 0.26 1.66 0.03 0.00 0.04 0.00 0.00 61.00 63.00 2k3t s PRO 2447Cb -0.12 -3.58 -0.04 0.00 0.04 0.00 0.00 34.50 30.79 2k3t s PRO 2447CO 0.18 -0.48 0.03 0.00 0.04 0.00 0.00 177.00 176.77 2k3t s ALA 2448N 2.38 3.41 0.10 8.56 0.00 -0.05 -4.97 121.76 131.19 2k3t s ALA 2448Ca 0.55 -1.04 -0.17 0.00 0.00 0.00 0.00 51.96 51.30 2k3t s ALA 2448Cb -0.24 -1.33 0.04 0.00 0.00 0.00 0.00 23.12 21.59 2k3t s ALA 2448CO 0.21 0.71 0.42 -1.83 0.00 0.00 0.00 175.76 175.27 2k3t s GLU 2449N -2.21 1.03 0.17 0.00 -1.05 -1.26 -0.98 118.70 114.40 2k3t s GLU 2449Ca 0.26 -0.58 -0.23 0.00 -0.15 0.00 0.00 54.97 54.27 2k3t s GLU 2449Cb -0.12 0.46 0.07 0.00 -0.44 0.00 0.00 34.13 34.10 2k3t s GLU 2449CO 0.18 -0.39 0.63 -0.59 0.95 0.00 0.00 175.26 176.04 2k3t s PHE 2450N -3.37 -0.49 -0.15 4.83 -0.71 -0.56 -0.94 117.98 116.59 2k3t s PHE 2450Ca 0.00 0.26 -0.00 0.00 -1.04 0.00 0.00 56.93 56.15 2k3t s PHE 2450Cb 0.01 0.58 -0.01 0.00 -1.21 0.00 0.00 43.02 42.38 2k3t s PHE 2450CO -0.09 -0.88 -0.13 0.08 -1.34 0.00 0.00 175.22 172.87 2k3t s VAL 2451N -3.74 2.97 -0.57 -2.49 1.01 0.37 -0.47 120.40 117.48 2k3t s VAL 2451Ca 0.02 -0.67 -0.28 0.00 0.00 0.00 0.00 61.98 61.05 2k3t s VAL 2451Cb -0.02 -2.26 0.03 0.00 0.00 0.00 0.00 36.38 34.13 2k3t s VAL 2451CO -0.11 0.51 1.21 -0.69 0.00 0.00 0.00 175.10 176.03 2k3t s VAL 2452N 0.61 4.00 -0.31 2.92 1.01 0.46 -1.49 120.40 127.60 2k3t s VAL 2452Ca -0.07 0.90 -0.21 0.00 0.00 0.00 0.00 61.98 62.60 2k3t s VAL 2452Cb -0.16 -4.69 -0.01 0.00 0.00 0.00 0.00 36.38 31.52 2k3t s VAL 2452CO 0.03 -1.31 0.65 0.21 0.00 0.00 0.00 175.10 174.68 2k3t s ASN 2453N 3.07 6.52 0.00 3.32 3.84 0.25 -1.74 114.94 130.20 2k3t s ASN 2453Ca 0.44 0.46 0.21 0.00 0.21 0.00 0.00 52.86 54.18 2k3t s ASN 2453Cb -0.08 -2.34 0.11 0.00 -0.55 0.00 0.00 41.25 38.39 2k3t s ASN 2453CO 0.26 -0.50 1.12 0.35 -2.79 0.00 0.00 177.10 175.54 2k3t n THR 2454N 5.41 0.00 0.04 -5.21 -2.24 -1.18 -2.45 114.28 108.65 2k3t n THR 2454Ca -0.00 -0.43 0.04 0.00 -2.27 0.00 0.00 64.05 61.38 2k3t n THR 2454Cb 0.49 1.38 0.43 0.00 -2.10 0.00 0.00 70.33 70.52 2k3t n THR 2454CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2k3t h SER 2455N 3.54 0.40 1.25 3.42 0.87 -1.85 -0.58 113.55 120.60 2k3t h SER 2455Ca 0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 2k3t h SER 2455Cb 0.82 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 62.68 2k3t h SER 2455CO 0.00 0.34 -0.14 0.59 -0.53 0.00 0.00 176.83 177.09 2k3t n ASN 2456N -4.44 0.65 -0.12 6.23 3.02 -1.26 -4.38 115.26 114.96 2k3t n ASN 2456Ca 0.02 0.45 -0.21 0.00 -0.03 0.00 0.00 54.58 54.81 2k3t n ASN 2456Cb 0.11 -0.53 -0.09 0.00 -0.61 0.00 0.00 39.78 38.65 2k3t n ASN 2456CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2k3t n ALA 2457N -1.73 1.48 0.00 5.41 0.00 -0.35 -4.87 120.51 120.45 2k3t n ALA 2457Ca 0.05 -0.96 0.00 0.00 0.00 0.00 0.00 53.44 52.54 2k3t n ALA 2457Cb 0.41 0.09 0.00 0.00 0.00 0.00 0.00 19.45 19.95 2k3t n ALA 2457CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k3t n GLY 2458N 1.96 0.95 3.21 0.00 0.00 -0.46 -4.22 105.19 106.63 2k3t n GLY 2458Ca -0.44 -1.11 -0.11 0.00 0.00 0.00 0.00 46.02 44.37 2k3t n GLY 2458CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2459N -2.00 -0.47 0.00 4.61 0.00 -0.74 -4.72 121.76 118.44 2k3t s ALA 2459Ca 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 51.96 51.75 2k3t s ALA 2459Cb 0.00 0.32 0.00 0.00 0.00 0.00 0.00 23.12 23.44 2k3t s ALA 2459CO 0.00 -0.40 0.00 0.41 0.00 0.00 0.00 175.76 175.77 2k3t n GLY 2460N 0.56 0.79 3.78 0.00 0.00 -1.26 -2.39 105.19 106.67 2k3t n GLY 2460Ca -0.18 -1.11 -0.37 0.00 0.00 0.00 0.00 46.02 44.36 2k3t n GLY 2460CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2k3t s ALA 2461N -2.00 3.05 0.06 4.61 0.00 -1.26 -4.88 121.76 121.33 2k3t s ALA 2461Ca 0.00 0.78 0.06 0.00 0.00 0.00 0.00 51.96 52.80 2k3t s ALA 2461Cb 0.00 -3.31 -0.03 0.00 0.00 0.00 0.00 23.12 19.78 2k3t s ALA 2461CO 0.00 -0.37 -0.17 -1.17 0.00 0.00 0.00 175.76 174.06 2k3t s LEU 2462N -2.79 2.23 0.16 0.00 0.20 -1.26 -1.42 118.68 115.80 2k3t s LEU 2462Ca 0.60 -0.56 0.04 0.00 0.69 0.00 0.00 54.13 54.90 2k3t s LEU 2462Cb -0.24 -0.69 -0.05 0.00 -0.43 0.00 0.00 46.19 44.78 2k3t s LEU 2462CO 0.30 0.03 -0.08 -0.55 -0.29 0.00 0.00 176.35 175.76 2k3t s SER 2463N -1.47 1.71 -0.28 3.68 0.15 -0.14 -5.00 113.70 112.36 2k3t s SER 2463Ca 0.02 -1.06 -0.22 0.00 0.70 0.00 0.00 55.95 55.40 2k3t s SER 2463Cb -0.09 0.01 0.08 0.00 -1.71 0.00 0.00 66.02 64.31 2k3t s SER 2463CO 0.02 -0.39 0.77 0.54 1.20 0.00 0.00 173.24 175.39 2k3t s VAL 2464N -3.39 0.00 -0.02 4.45 0.11 -1.26 -1.23 120.40 119.06 2k3t s VAL 2464Ca 0.19 0.00 -0.02 0.00 -2.93 0.00 0.00 61.98 59.22 2k3t s VAL 2464Cb 0.03 -1.00 0.01 0.00 -1.53 0.00 0.00 36.38 33.89 2k3t s VAL 2464CO 0.02 0.00 0.06 -0.89 -3.33 0.00 0.00 175.10 170.96 2k3t s THR 2465N 0.72 -0.01 -0.20 5.04 2.01 -0.39 -5.03 115.64 117.80 2k3t s THR 2465Ca -0.03 0.03 -0.00 0.00 0.31 0.00 0.00 61.69 62.00 2k3t s THR 2465Cb -0.05 -0.10 0.01 0.00 0.01 0.00 0.00 72.50 72.38 2k3t s THR 2465CO -0.06 0.01 -0.14 -0.63 -0.69 0.00 0.00 174.62 173.11 2k3t s ILE 2466N 0.20 2.49 0.28 1.82 1.01 -1.26 -0.88 121.20 124.85 2k3t s ILE 2466Ca -0.01 -0.84 0.07 0.00 0.00 0.00 0.00 60.65 59.86 2k3t s ILE 2466Cb -0.02 -2.10 -0.03 0.00 0.01 0.00 0.00 42.46 40.32 2k3t s ILE 2466CO -0.01 0.47 0.28 -0.62 0.00 0.00 0.00 174.94 175.07 2k3t s ASP 2467N 1.34 5.68 0.00 3.58 2.15 -0.42 -4.92 116.67 124.09 2k3t s ASP 2467Ca 0.05 -0.23 0.00 0.00 0.43 0.00 0.00 52.55 52.79 2k3t s ASP 2467Cb -0.14 -1.38 0.00 0.00 -0.30 0.00 0.00 42.92 41.10 2k3t s ASP 2467CO -0.09 -0.16 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 2k3t n GLY 2468N -1.32 -1.00 0.13 2.66 0.00 -1.26 -0.55 105.19 103.85 2k3t n GLY 2468Ca -0.06 -0.90 0.12 0.00 0.00 0.00 0.00 46.02 45.18 2k3t n GLY 2468CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2469N 0.00 0.20 -3.29 1.61 -0.04 -1.26 -4.84 135.00 127.38 2k3t n PRO 2469Ca 0.00 0.42 -0.09 0.00 -0.04 0.00 0.00 63.50 63.79 2k3t n PRO 2469Cb 0.00 -1.87 0.01 0.00 -0.04 0.00 0.00 33.50 31.60 2k3t n PRO 2469CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2k3t n SER 2470N -2.24 -1.54 -3.97 3.54 7.64 -1.26 -4.93 113.62 110.86 2k3t n SER 2470Ca 0.02 -2.34 -0.30 0.00 1.01 0.00 0.00 58.87 57.26 2k3t n SER 2470Cb 0.23 2.64 0.24 0.00 -1.01 0.00 0.00 64.21 66.32 2k3t n SER 2470CO 0.00 0.00 0.00 -1.59 -3.01 0.00 0.00 175.04 170.44 2k3t s LYS 2471N -2.28 -1.38 0.05 1.43 -2.85 -1.26 -4.97 119.74 108.48 2k3t s LYS 2471Ca 0.16 0.21 0.04 0.00 -1.00 0.00 0.00 55.97 55.39 2k3t s LYS 2471Cb -0.03 -1.55 -0.02 0.00 -2.06 0.00 0.00 37.83 34.17 2k3t s LYS 2471CO 0.12 -3.88 -0.11 0.14 0.10 0.00 0.00 175.35 171.72 2k3t s VAL 2472N -2.72 0.86 0.07 1.79 -7.23 -1.26 -4.31 120.40 107.60 2k3t s VAL 2472Ca 0.69 -1.09 -0.30 0.00 -1.81 0.00 0.00 61.98 59.47 2k3t s VAL 2472Cb -0.15 -0.85 -0.05 0.00 0.56 0.00 0.00 36.38 35.90 2k3t s VAL 2472CO 0.58 -0.21 1.12 -0.75 -0.31 0.00 0.00 175.10 175.53 2k3t s LYS 2473N -1.44 4.50 -0.00 4.82 2.20 -1.10 -4.95 119.74 123.77 2k3t s LYS 2473Ca -0.04 1.66 0.00 0.00 -0.36 0.00 0.00 55.97 57.23 2k3t s LYS 2473Cb -0.09 -3.36 -0.00 0.00 -1.51 0.00 0.00 37.83 32.87 2k3t s LYS 2473CO 0.01 -0.13 -0.01 1.41 -0.36 0.00 0.00 175.35 176.28 2k3t s MET 2474N 0.75 0.08 0.05 4.03 1.75 -1.26 -1.06 119.30 123.64 2k3t s MET 2474Ca 0.55 -0.03 -0.03 0.00 -1.25 0.00 0.00 55.69 54.93 2k3t s MET 2474Cb -0.27 -0.08 -0.03 0.00 2.84 0.00 0.00 34.83 37.29 2k3t s MET 2474CO 0.30 0.02 0.03 -0.51 -0.65 0.00 0.00 175.02 174.20 2k3t s ASP 2475N -0.00 0.34 -0.02 1.11 1.01 -0.06 -5.01 116.67 114.03 2k3t s ASP 2475Ca 0.00 -0.78 -0.19 0.00 0.71 0.00 0.00 52.55 52.29 2k3t s ASP 2475Cb -0.01 0.21 0.04 0.00 1.01 0.00 0.00 42.92 44.17 2k3t s ASP 2475CO -0.00 -0.55 0.41 0.00 0.21 0.00 0.00 175.17 175.24 2k3t s GLN 2477N -1.30 0.54 0.20 0.00 0.74 -0.34 -5.01 119.66 114.49 2k3t s GLN 2477Ca -0.13 0.85 -0.22 0.00 0.05 0.00 0.00 55.36 55.92 2k3t s GLN 2477Cb -0.04 0.13 -0.08 0.00 1.10 0.00 0.00 33.01 34.12 2k3t s GLN 2477CO 0.06 -0.12 0.74 -1.83 -0.55 0.00 0.00 175.29 173.59 2k3t s GLU 2478N 1.01 4.36 0.29 1.67 -1.05 -1.26 -0.46 118.70 123.26 2k3t s GLU 2478Ca -0.06 0.97 -0.10 0.00 -0.15 0.00 0.00 54.97 55.63 2k3t s GLU 2478Cb -0.06 -3.01 0.01 0.00 -0.44 0.00 0.00 34.13 30.63 2k3t s GLU 2478CO -0.09 0.46 0.52 0.00 0.95 0.00 0.00 175.26 177.10 2k3t h PRO 2480N 2.17 0.00 0.00 0.00 0.11 -2.03 -1.85 132.00 130.40 2k3t h PRO 2480Ca -0.27 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2k3t h PRO 2480Cb 1.25 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.36 2k3t h PRO 2480CO 0.37 0.00 -0.04 1.49 -0.21 0.00 0.00 178.00 179.61 2k3t h GLU 2481N 0.00 0.00 0.00 1.05 4.57 -1.97 -3.46 114.58 114.77 2k3t h GLU 2481Ca 0.06 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2k3t h GLU 2481Cb 0.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.86 2k3t h GLU 2481CO -0.00 0.00 0.00 0.41 -1.18 0.00 0.00 179.01 178.24 2k3t n GLY 2482N 1.12 0.63 3.52 1.92 0.00 -0.70 -3.13 105.19 108.55 2k3t n GLY 2482Ca 0.04 -1.73 -0.43 0.00 0.00 0.00 0.00 46.02 43.90 2k3t n GLY 2482CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2k3t s TYR 2483N -2.94 3.03 0.11 1.61 1.51 -0.71 -1.08 117.35 118.88 2k3t s TYR 2483Ca 0.00 -0.04 -0.30 0.00 -1.01 0.00 0.00 57.07 55.72 2k3t s TYR 2483Cb 0.00 -3.49 -0.06 0.00 -0.11 0.00 0.00 41.96 38.31 2k3t s TYR 2483CO 0.00 -0.94 0.98 0.50 -1.11 0.00 0.00 175.55 174.98 2k3t s ARG 2484N 2.99 4.68 -0.04 -0.62 3.52 0.39 -0.41 118.95 129.46 2k3t s ARG 2484Ca 0.24 1.48 0.05 0.00 -0.13 0.00 0.00 55.73 57.37 2k3t s ARG 2484Cb -0.14 -3.37 -0.01 0.00 -1.56 0.00 0.00 34.95 29.88 2k3t s ARG 2484CO 0.19 0.18 -0.18 0.08 -0.81 0.00 0.00 175.30 174.77 2k3t s VAL 2485N 0.03 1.48 -0.00 7.11 1.01 0.38 -1.19 120.40 129.21 2k3t s VAL 2485Ca 0.48 -0.75 0.04 0.00 0.00 0.00 0.00 61.98 61.75 2k3t s VAL 2485Cb -0.24 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 2k3t s VAL 2485CO 0.30 0.42 -0.14 -0.89 0.00 0.00 0.00 175.10 174.80 2k3t s THR 2486N -0.03 1.08 0.02 3.92 2.01 -0.33 -1.49 115.64 120.81 2k3t s THR 2486Ca -0.03 -0.63 -0.15 0.00 0.31 0.00 0.00 61.69 61.19 2k3t s THR 2486Cb -0.11 -0.91 0.03 0.00 0.01 0.00 0.00 72.50 71.52 2k3t s THR 2486CO 0.02 0.27 0.34 -0.72 -0.69 0.00 0.00 174.62 173.84 2k3t s TYR 2487N -0.38 -0.18 -0.22 4.92 1.13 -0.16 -0.88 117.35 121.58 2k3t s TYR 2487Ca 0.05 0.14 0.01 0.00 -1.41 0.00 0.00 57.07 55.86 2k3t s TYR 2487Cb -0.06 0.13 0.03 0.00 -1.10 0.00 0.00 41.96 40.97 2k3t s TYR 2487CO -0.00 -0.49 -0.13 0.99 -2.51 0.00 0.00 175.55 173.41 2k3t s THR 2488N -2.13 2.33 0.67 -3.49 2.01 -0.22 -0.87 115.64 113.94 2k3t s THR 2488Ca -0.08 -1.18 -0.09 0.00 0.31 0.00 0.00 61.69 60.65 2k3t s THR 2488Cb -0.02 -2.16 0.02 0.00 0.01 0.00 0.00 72.50 70.34 2k3t s THR 2488CO -0.00 0.26 1.03 -2.16 -0.69 0.00 0.00 174.62 173.06 2k3t s PRO 2489N 1.24 2.80 0.00 4.92 0.04 -1.26 -2.71 135.00 140.03 2k3t s PRO 2489Ca -0.01 0.25 0.00 0.00 0.04 0.00 0.00 61.00 61.28 2k3t s PRO 2489Cb -0.16 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.27 2k3t s PRO 2489CO -0.08 -0.96 0.21 0.00 0.04 0.00 0.00 177.00 176.21 2k3t n MET 2490N -2.87 0.00 -3.87 4.56 0.00 -1.26 -1.16 117.12 112.51 2k3t n MET 2490Ca 0.06 -0.21 -0.11 0.00 0.00 0.00 0.00 57.70 57.44 2k3t n MET 2490Cb 0.58 -0.41 -0.11 0.00 0.00 0.00 0.00 33.22 33.27 2k3t n MET 2490CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2k3t s ALA 2491N 0.00 -0.25 0.50 3.17 0.00 -1.26 -1.27 121.76 122.66 2k3t s ALA 2491Ca 0.00 -0.01 -0.21 0.00 0.00 0.00 0.00 51.96 51.74 2k3t s ALA 2491Cb 0.00 -0.01 -0.07 0.00 0.00 0.00 0.00 23.12 23.04 2k3t s ALA 2491CO 0.00 -0.14 1.10 -1.25 0.00 0.00 0.00 175.76 175.47 2k3t s PRO 2492N -0.82 3.60 0.00 0.00 0.04 -1.26 -4.84 135.00 131.73 2k3t s PRO 2492Ca -0.09 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.51 2k3t s PRO 2492Cb -0.05 -2.13 0.00 0.00 0.04 0.00 0.00 34.50 32.36 2k3t s PRO 2492CO 0.01 -0.63 0.00 0.41 0.04 0.00 0.00 177.00 176.82 2k3t n GLY 2493N 0.09 0.80 3.58 0.56 0.00 -0.38 -4.84 105.19 105.01 2k3t n GLY 2493Ca 0.10 -2.04 -0.39 0.00 0.00 0.00 0.00 46.02 43.68 2k3t n GLY 2493CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2k3t s SER 2494N -4.00 6.13 -0.26 1.61 0.01 -1.26 -0.74 113.70 115.19 2k3t s SER 2494Ca 0.00 0.01 -0.18 0.00 1.31 0.00 0.00 55.95 57.09 2k3t s SER 2494Cb 0.00 -2.17 -0.03 0.00 0.21 0.00 0.00 66.02 64.04 2k3t s SER 2494CO 0.00 -0.17 0.50 -0.31 0.41 0.00 0.00 173.24 173.67 2k3t s TYR 2495N 1.91 3.27 -0.41 2.43 1.51 -0.31 -4.25 117.35 121.50 2k3t s TYR 2495Ca 0.10 0.62 -0.20 0.00 -1.01 0.00 0.00 57.07 56.59 2k3t s TYR 2495Cb -0.16 -2.70 0.02 0.00 -0.11 0.00 0.00 41.96 39.00 2k3t s TYR 2495CO 0.11 -0.27 0.58 -1.17 -1.11 0.00 0.00 175.55 173.69 2k3t s LEU 2496N 2.25 4.52 -0.48 -1.29 2.96 0.29 -2.19 118.68 124.74 2k3t s LEU 2496Ca 0.21 -0.30 -0.14 0.00 -0.22 0.00 0.00 54.13 53.68 2k3t s LEU 2496Cb -0.16 -2.65 0.09 0.00 0.50 0.00 0.00 46.19 43.98 2k3t s LEU 2496CO 0.09 -0.67 0.39 -0.63 -1.32 0.00 0.00 176.35 174.21 2k3t s ILE 2497N 2.61 4.95 -0.18 6.68 1.01 0.25 -1.30 121.20 135.23 2k3t s ILE 2497Ca 0.20 -1.28 -0.18 0.00 0.00 0.00 0.00 60.65 59.39 2k3t s ILE 2497Cb -0.15 -4.04 -0.04 0.00 0.01 0.00 0.00 42.46 38.25 2k3t s ILE 2497CO 0.17 -0.64 0.50 -0.44 0.00 0.00 0.00 174.94 174.52 2k3t s SER 2498N 2.73 6.58 -0.10 3.58 0.01 -0.06 -1.39 113.70 125.05 2k3t s SER 2498Ca 0.04 0.69 0.01 0.00 1.31 0.00 0.00 55.95 58.00 2k3t s SER 2498Cb -0.25 -2.28 0.02 0.00 0.21 0.00 0.00 66.02 63.71 2k3t s SER 2498CO 0.04 -0.13 -0.11 -0.63 0.41 0.00 0.00 173.24 172.83 2k3t s ILE 2499N 1.37 1.17 0.02 1.44 1.01 -1.26 -1.26 121.20 123.70 2k3t s ILE 2499Ca 0.24 -0.43 0.05 0.00 0.00 0.00 0.00 60.65 60.52 2k3t s ILE 2499Cb -0.15 -1.12 -0.02 0.00 0.01 0.00 0.00 42.46 41.17 2k3t s ILE 2499CO 0.10 0.38 -0.16 -0.54 0.00 0.00 0.00 174.94 174.71 2k3t s LYS 2500N 1.25 1.17 -0.14 2.79 1.02 -0.36 -1.22 119.74 124.25 2k3t s LYS 2500Ca -0.03 -0.74 -0.12 0.00 0.02 0.00 0.00 55.97 55.10 2k3t s LYS 2500Cb -0.14 -1.19 0.04 0.00 -0.52 0.00 0.00 37.83 36.01 2k3t s LYS 2500CO -0.04 0.31 0.36 -0.47 -0.92 0.00 0.00 175.35 174.59 2k3t s TYR 2501N -0.67 -0.40 -0.49 3.18 6.14 -1.14 -0.97 117.35 123.01 2k3t s TYR 2501Ca 0.05 0.97 0.00 0.00 0.64 0.00 0.00 57.07 58.73 2k3t s TYR 2501Cb -0.07 0.14 0.00 0.00 0.42 0.00 0.00 41.96 42.44 2k3t s TYR 2501CO 0.01 -0.19 0.00 0.41 0.64 0.00 0.00 175.55 176.41 2k3t n GLY 2502N 2.93 0.63 0.00 8.97 0.00 -0.50 -4.22 105.19 112.99 2k3t n GLY 2502Ca -0.13 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.72 2k3t n GLY 2502CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2503N -0.95 0.11 0.75 -0.02 0.00 -1.26 -4.98 105.19 98.84 2k3t n GLY 2503Ca -0.05 -1.71 -0.00 0.00 0.00 0.00 0.00 46.02 44.27 2k3t n GLY 2503CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2k3t n PRO 2504N -0.43 1.31 -4.71 1.61 -0.04 -1.26 -4.89 135.00 126.60 2k3t n PRO 2504Ca 0.00 -0.29 -0.34 0.00 -0.04 0.00 0.00 63.50 62.83 2k3t n PRO 2504Cb 0.00 -1.46 -0.12 0.00 -0.04 0.00 0.00 33.50 31.88 2k3t n PRO 2504CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2k3t s TYR 2505N -0.96 2.86 0.47 0.54 2.02 -1.26 -5.01 117.35 116.02 2k3t s TYR 2505Ca 0.05 -0.04 -0.24 0.00 -0.37 0.00 0.00 57.07 56.47 2k3t s TYR 2505Cb 0.04 -1.69 -0.07 0.00 -0.40 0.00 0.00 41.96 39.84 2k3t s TYR 2505CO 0.01 0.28 1.37 -1.01 -1.57 0.00 0.00 175.55 174.63 2k3t s HIS 2506N -0.77 2.50 0.89 2.71 3.76 -1.26 -2.87 115.29 120.25 2k3t s HIS 2506Ca 0.12 1.34 -0.12 0.00 -0.15 0.00 0.00 55.06 56.25 2k3t s HIS 2506Cb -0.11 -3.80 0.13 0.00 1.11 0.00 0.00 32.58 29.91 2k3t s HIS 2506CO 0.01 -2.68 1.11 0.96 -0.85 0.00 0.00 174.74 173.30 2k3t s ILE 2507N -1.27 2.37 -0.01 0.60 -4.36 -0.36 -4.79 121.20 113.38 2k3t s ILE 2507Ca 0.64 0.12 -0.32 0.00 -0.26 0.00 0.00 60.65 60.83 2k3t s ILE 2507Cb -0.41 -2.80 -0.11 0.00 1.25 0.00 0.00 42.46 40.40 2k3t s ILE 2507CO 0.51 -0.16 1.91 0.61 0.24 0.00 0.00 174.94 178.05 2k3t n GLY 2508N -1.88 1.64 1.71 6.27 0.00 -0.82 -1.52 105.19 110.59 2k3t n GLY 2508Ca 0.06 0.83 0.00 0.00 0.00 0.00 0.00 46.02 46.91 2k3t n GLY 2508CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2k3t n GLY 2509N 4.43 1.56 3.85 -0.02 0.00 -1.26 -4.68 105.19 109.06 2k3t n GLY 2509Ca 0.21 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.89 2k3t n GLY 2509CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2k3t s SER 2510N -3.12 6.81 0.47 1.61 0.15 -0.58 -4.20 113.70 114.85 2k3t s SER 2510Ca 0.00 1.11 -0.21 0.00 0.70 0.00 0.00 55.95 57.56 2k3t s SER 2510Cb 0.00 -2.30 -0.09 0.00 -1.71 0.00 0.00 66.02 61.92 2k3t s SER 2510CO 0.00 0.03 1.03 -2.16 1.20 0.00 0.00 173.24 173.34 2k3t s PRO 2511N -2.22 3.89 -0.18 5.44 0.04 -1.26 -4.72 135.00 135.98 2k3t s PRO 2511Ca 0.42 1.33 -0.09 0.00 0.04 0.00 0.00 61.00 62.70 2k3t s PRO 2511Cb -0.14 -2.13 -0.05 0.00 0.04 0.00 0.00 34.50 32.22 2k3t s PRO 2511CO 0.20 -0.35 0.12 -0.06 0.04 0.00 0.00 177.00 176.94 2k3t s PHE 2512N -1.99 3.41 -2.05 0.56 0.40 -0.49 -4.90 117.98 112.92 2k3t s PHE 2512Ca 0.66 0.31 0.11 0.00 -0.60 0.00 0.00 56.93 57.42 2k3t s PHE 2512Cb -0.16 -2.10 0.37 0.00 0.51 0.00 0.00 43.02 41.65 2k3t s PHE 2512CO 0.19 0.34 1.29 0.36 0.70 0.00 0.00 175.22 178.10 2k3t n LYS 2513N 3.24 1.63 0.00 0.44 2.85 -1.26 -0.58 118.16 124.48 2k3t n LYS 2513Ca -0.17 -0.97 0.00 0.00 -1.05 0.00 0.00 58.31 56.12 2k3t n LYS 2513Cb 0.53 -1.25 0.00 0.00 -0.65 0.00 0.00 35.03 33.65 2k3t n LYS 2513CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2k3t n ALA 2514N 0.26 0.00 -2.65 0.58 0.00 -0.93 -3.48 120.51 114.29 2k3t n ALA 2514Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.17 2k3t n ALA 2514Cb 0.24 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.63 2k3t n ALA 2514CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2k3t s LYS 2515N 0.00 4.04 0.09 0.00 1.02 -0.60 -1.17 119.74 123.13 2k3t s LYS 2515Ca 0.00 0.25 0.04 0.00 0.02 0.00 0.00 55.97 56.28 2k3t s LYS 2515Cb 0.00 -3.32 -0.03 0.00 -0.52 0.00 0.00 37.83 33.96 2k3t s LYS 2515CO 0.00 0.47 -0.12 0.14 -0.92 0.00 0.00 175.35 174.92 2k3t s VAL 2516N -0.30 1.05 0.07 3.17 -7.23 0.08 -3.81 120.40 113.43 2k3t s VAL 2516Ca 0.21 -1.56 0.00 0.00 -1.81 0.00 0.00 61.98 58.82 2k3t s VAL 2516Cb -0.15 -1.30 -0.00 0.00 0.56 0.00 0.00 36.38 35.49 2k3t s VAL 2516CO 0.09 -0.45 0.00 0.35 -0.31 0.00 0.00 175.10 174.78 2k3t n THR 2517N 0.75 0.00 0.00 5.32 -2.24 -1.25 -1.25 114.28 115.60 2k3t n THR 2517Ca -0.17 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 2k3t n THR 2517Cb 0.57 0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 2k3t n THR 2517CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2k3t n GLY 2518N 4.06 0.55 3.75 3.38 0.00 -1.26 -1.69 105.19 113.98 2k3t n GLY 2518Ca -0.03 -2.07 -0.41 0.00 0.00 0.00 0.00 46.02 43.52 2k3t n GLY 2518CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2k3t s PRO 2519N -1.24 4.45 0.08 1.61 0.04 -1.26 -4.34 135.00 134.33 2k3t s PRO 2519Ca 0.00 2.02 -0.30 0.00 0.04 0.00 0.00 61.00 62.75 2k3t s PRO 2519Cb 0.00 -3.16 -0.06 0.00 0.04 0.00 0.00 34.50 31.32 2k3t s PRO 2519CO 0.00 -0.10 1.16 0.50 0.04 0.00 0.00 177.00 178.60 2k3t s ARG 2520N -0.92 4.47 0.03 4.56 3.52 -1.26 -4.72 118.95 124.62 2k3t s ARG 2520Ca 0.51 1.73 -0.01 0.00 -0.13 0.00 0.00 55.73 57.84 2k3t s ARG 2520Cb -0.36 -3.34 -0.26 0.00 -1.56 0.00 0.00 34.95 29.42 2k3t s ARG 2520CO 0.43 -0.18 0.95 -0.07 -0.81 0.00 0.00 175.30 175.62 2k3t h LEU 2521N 6.50 0.31 0.00 -0.88 -0.00 -1.58 -3.50 115.31 116.17 2k3t h LEU 2521Ca -0.42 -0.40 0.00 0.00 -0.00 0.00 0.00 57.88 57.06 2k3t h LEU 2521Cb 1.21 -0.10 0.00 0.00 -0.00 0.00 0.00 40.66 41.77 2k3t h LEU 2521CO 0.79 1.33 0.00 1.33 -0.00 0.00 0.00 178.44 181.89