# AA SS3 SS8 ASA HSEa-u HSEa-d CN13 theta tau phi psi P(3-C) P(3-E) P(3-H) P(8-C) P(8-S) P(8-T) P(8-H) P(8-G) P(8-I) P(8-E) P(8-B) 0 I C C 43.56 16.78 17.07 33.64 117.91 -158.26 -105.11 127.79 96.82 3.18 0.00 96.96 0.08 0.01 0.00 0.00 0.00 2.91 0.03 1 V E E 65.06 9.53 19.73 30.00 119.73 -161.61 -110.48 130.01 27.75 72.22 0.03 27.59 0.33 0.05 0.01 0.01 0.00 71.48 0.53 2 M E E 41.20 17.50 14.73 32.29 121.50 -165.14 -111.17 133.21 7.49 92.49 0.02 6.94 0.40 0.04 0.01 0.01 0.00 92.23 0.37 3 T E E 62.88 8.52 20.83 30.08 125.60 -169.57 -121.46 140.95 7.27 92.70 0.03 6.65 0.46 0.05 0.01 0.01 0.00 92.01 0.80 4 Q E E 53.31 17.47 14.50 31.38 127.29 -167.18 -124.59 143.01 29.17 70.75 0.08 24.06 4.70 0.33 0.02 0.07 0.00 69.75 1.07 5 T C C 71.81 6.94 19.68 27.30 120.48 -140.96 -103.56 142.20 75.02 24.83 0.15 53.93 19.08 0.92 0.02 0.15 0.00 25.21 0.68 6 P C C 64.66 9.02 17.01 26.78 113.89 0.10 -70.39 148.49 86.19 13.19 0.62 66.63 15.97 2.29 0.06 0.67 0.00 13.82 0.57 7 L C C 73.79 12.94 15.38 28.49 99.08 -154.94 -87.70 -17.51 73.81 25.63 0.56 39.53 31.78 2.36 0.06 0.54 0.00 24.90 0.84 8 S E E 58.36 7.45 20.05 28.49 135.93 17.03 -143.88 150.49 22.87 76.83 0.30 18.56 4.05 0.67 0.05 0.28 0.00 75.71 0.68 9 L E E 39.31 18.09 14.85 32.54 128.15 -171.58 -133.35 138.62 5.77 94.20 0.02 5.00 0.63 0.05 0.00 0.02 0.00 94.02 0.27 10 S E E 68.54 5.32 23.16 29.28 116.39 -132.93 -94.36 136.55 4.50 95.49 0.01 4.10 0.27 0.02 0.00 0.01 0.00 95.43 0.17 11 V E E 15.93 21.73 12.68 33.92 132.53 -177.57 -135.80 151.07 20.98 78.99 0.03 19.67 1.16 0.05 0.01 0.02 0.00 76.85 2.24 12 T C C 65.00 5.07 23.36 28.37 120.48 -130.65 -98.24 146.06 87.96 12.00 0.04 86.40 2.01 0.13 0.01 0.03 0.00 10.05 1.38 13 P C T 56.54 15.05 13.91 28.75 109.45 -89.23 -60.80 136.61 99.52 0.27 0.21 0.32 3.53 95.78 0.01 0.15 0.00 0.16 0.04 14 G C T 48.58 4.20 18.80 23.95 96.28 20.91 87.22 -5.43 99.71 0.16 0.14 0.45 4.08 95.22 0.00 0.12 0.00 0.10 0.02 15 Q C S 90.83 5.85 18.62 25.69 124.21 106.35 -99.82 144.78 94.16 5.77 0.06 40.56 54.57 0.26 0.01 0.05 0.00 3.54 1.00 16 P C C 77.30 8.16 18.72 27.64 116.07 -104.56 -67.98 147.79 91.95 8.03 0.02 91.29 1.05 0.06 0.00 0.01 0.00 7.24 0.35 17 A E E 10.12 22.78 14.00 36.51 126.65 -158.28 -120.23 145.50 9.58 90.40 0.02 9.03 0.41 0.03 0.00 0.01 0.00 89.89 0.63 18 S E E 55.85 8.06 25.25 33.97 123.89 -154.14 -118.82 137.76 1.36 98.64 0.01 1.27 0.06 0.00 0.00 0.00 0.00 98.58 0.09 19 I E E 7.94 25.33 16.23 41.98 125.14 -170.13 -124.76 134.31 3.25 96.74 0.01 3.08 0.16 0.01 0.00 0.00 0.00 96.60 0.14 20 S E E 42.48 9.20 26.75 36.47 126.07 -164.98 -117.07 145.51 16.65 83.32 0.03 15.58 0.65 0.05 0.00 0.02 0.00 83.51 0.18 21 C E E 5.91 25.45 16.54 42.25 131.78 -174.77 -135.21 146.68 25.59 74.34 0.07 23.72 1.21 0.10 0.02 0.04 0.00 74.23 0.68 22 K E E 89.48 8.49 26.82 35.99 124.61 -160.55 -119.62 138.35 15.93 83.79 0.29 14.19 1.29 0.23 0.19 0.14 0.00 76.77 7.18 23 S E E 13.40 22.74 15.76 37.81 122.60 -147.69 -100.94 146.62 44.09 53.77 2.13 40.23 2.64 0.75 1.18 1.04 0.00 50.76 3.40 24 S C C 43.11 9.63 20.48 30.57 112.32 -134.33 -87.03 146.92 68.58 11.41 20.00 49.99 12.82 5.73 11.72 8.62 0.02 9.27 1.84 25 E H H 110.79 7.07 17.97 25.71 96.18 -106.27 -68.58 -29.49 41.85 2.99 55.16 14.72 11.10 16.29 28.37 26.54 0.15 1.88 0.94 26 S H G 59.80 6.10 18.89 25.60 95.48 60.74 -70.58 -27.11 39.32 3.23 57.45 17.35 7.33 14.30 28.34 29.60 0.07 2.12 0.88 27 L H G 36.19 17.86 14.20 31.34 95.88 56.76 -75.29 -25.24 37.30 5.63 57.07 18.53 7.99 11.11 28.39 28.69 0.13 3.75 1.41 28 R C H 98.72 12.26 16.42 28.44 98.75 64.17 -80.65 -18.14 46.06 13.02 40.92 22.80 10.77 13.90 25.04 14.67 0.59 8.39 3.83 29 Q C C 110.96 5.24 16.50 22.68 103.31 69.84 -85.88 31.02 64.73 11.24 24.04 35.66 14.20 15.56 15.10 8.59 0.17 7.13 3.58 30 S C C 57.31 8.75 12.73 22.43 108.10 107.48 -91.39 62.11 80.91 6.48 12.61 36.62 17.61 27.80 5.94 5.86 0.03 4.00 2.14 31 N C T 111.86 3.96 16.31 21.14 99.62 -110.42 -82.61 15.95 90.31 2.37 7.33 21.04 26.87 43.00 1.98 4.81 0.00 1.42 0.88 32 G C S 37.02 9.01 15.60 25.23 100.85 -87.69 82.60 3.34 92.23 4.37 3.40 18.05 42.62 31.86 0.42 2.89 0.00 3.29 0.87 33 K C C 94.49 9.70 19.44 29.32 108.66 104.55 -95.22 89.21 75.48 22.92 1.60 46.33 21.76 7.72 0.28 1.52 0.00 19.58 2.80 34 T C E 21.70 19.74 17.76 36.98 119.27 102.19 -109.28 135.70 51.49 48.10 0.40 42.28 7.33 1.17 0.09 0.36 0.00 47.22 1.56 35 S E E 15.16 15.44 25.40 41.08 132.68 -169.42 -130.12 153.62 18.36 81.57 0.06 16.43 1.61 0.13 0.01 0.04 0.00 81.10 0.68 36 L E E 3.45 26.13 21.06 47.76 122.43 -147.02 -113.60 134.69 3.99 96.00 0.01 3.58 0.26 0.02 0.00 0.00 0.00 96.04 0.09 37 Y E E 44.17 15.80 27.50 42.94 127.20 -168.89 -123.42 141.87 0.89 99.10 0.00 0.84 0.03 0.00 0.00 0.00 0.00 99.11 0.01 38 W E E 8.27 24.54 21.22 45.90 124.22 -158.61 -114.71 139.16 0.43 99.57 0.00 0.42 0.01 0.00 0.00 0.00 0.00 99.57 0.00 39 Y E E 27.54 16.04 24.69 40.86 131.74 -173.48 -129.71 149.53 0.23 99.77 0.00 0.21 0.00 0.00 0.00 0.00 0.00 99.77 0.01 40 R E E 42.67 16.63 21.18 37.73 120.51 -144.71 -110.24 133.91 0.90 99.10 0.00 0.74 0.05 0.00 0.00 0.00 0.00 99.18 0.02 41 Q E E 45.12 14.03 16.70 31.45 122.02 -162.83 -111.86 138.32 15.00 84.99 0.01 13.63 0.81 0.03 0.00 0.01 0.00 84.83 0.69 42 K C C 91.48 7.20 16.04 24.48 119.03 -134.75 -86.33 147.26 96.98 2.99 0.03 95.38 1.72 0.18 0.01 0.02 0.00 2.34 0.35 43 P C T 96.68 5.29 11.69 18.90 109.28 -86.88 -58.82 134.55 99.74 0.07 0.18 0.27 3.24 96.25 0.00 0.17 0.00 0.04 0.01 44 G C T 69.67 0.23 13.29 10.42 94.37 18.18 83.13 -3.00 99.76 0.05 0.19 0.36 3.11 96.29 0.00 0.20 0.00 0.03 0.01 45 Q C S 86.82 5.66 9.66 17.47 129.13 97.59 -113.33 158.52 95.50 4.28 0.22 37.37 57.65 0.75 0.04 0.18 0.00 1.47 2.55 46 S C C 82.64 1.55 17.68 18.56 116.91 -97.24 -68.48 150.76 98.07 1.90 0.02 89.90 8.16 0.16 0.00 0.02 0.00 1.49 0.26 47 P C C 47.72 17.73 11.18 28.08 114.91 -99.11 -65.05 144.22 93.65 6.33 0.02 91.26 2.21 0.12 0.00 0.02 0.00 6.21 0.18 48 Q E E 77.61 8.74 21.11 30.57 125.70 -160.83 -121.51 138.93 7.50 92.47 0.03 6.57 0.73 0.06 0.01 0.02 0.00 92.20 0.42 49 L E E 61.33 15.54 18.86 34.00 110.70 -115.18 -74.24 126.99 0.64 99.36 0.00 0.57 0.02 0.00 0.00 0.00 0.00 99.38 0.01 50 L E E 18.99 19.16 20.72 39.88 101.48 174.77 -96.43 -34.38 1.76 98.23 0.01 1.23 0.40 0.01 0.00 0.00 0.00 98.35 0.01 51 V E E 14.27 19.66 21.89 41.38 137.15 5.16 -149.28 143.05 0.28 99.72 0.00 0.23 0.02 0.00 0.00 0.00 0.00 99.74 0.00 52 F E E 42.73 18.47 21.58 39.14 125.23 -169.76 -127.15 131.87 0.92 99.06 0.01 0.80 0.03 0.00 0.00 0.00 0.00 99.14 0.02 53 E E E 53.14 14.15 22.75 36.60 119.05 -164.39 -113.55 124.43 10.24 89.55 0.22 7.96 1.61 0.27 0.07 0.09 0.00 89.75 0.24 54 V E E 36.12 16.48 18.41 34.64 113.97 -171.04 -106.94 122.53 41.45 56.20 2.35 27.94 10.92 4.05 0.71 1.50 0.00 53.94 0.93 55 S C C 44.31 10.42 19.49 30.20 118.65 79.53 -112.70 152.04 71.33 24.30 4.37 33.76 24.86 14.05 0.94 3.18 0.02 21.51 1.67 56 N C C 80.77 10.51 17.45 28.00 109.64 -89.70 -98.15 86.83 79.58 14.53 5.89 33.78 29.53 17.74 1.27 4.36 0.03 11.07 2.22 57 R C C 118.95 8.98 16.65 26.33 114.73 138.45 -102.21 129.92 75.64 18.76 5.61 48.59 16.77 10.85 1.56 4.19 0.01 13.76 4.25 58 F C C 79.53 13.84 12.52 26.34 116.06 -153.17 -99.47 131.43 78.10 17.08 4.82 55.32 13.20 9.08 1.47 3.59 0.01 12.20 5.14 59 S C T 77.59 4.61 15.56 21.62 114.22 -147.53 -93.34 129.83 84.39 12.02 3.59 26.94 18.95 39.57 0.85 2.55 0.01 8.58 2.55 60 G C T 53.24 3.72 16.81 21.27 102.31 20.51 84.96 -1.60 89.63 7.80 2.56 23.13 27.09 40.00 0.37 2.22 0.00 5.82 1.37 61 V C C 42.55 16.44 10.63 26.49 116.17 105.62 -98.99 126.97 83.51 14.36 2.13 56.35 22.02 4.88 0.67 1.65 0.00 8.70 5.73 62 S C C 58.16 7.61 16.02 24.63 107.16 -122.20 -71.53 144.22 82.16 9.83 8.00 49.04 15.64 17.47 1.39 7.17 0.00 7.32 1.97 63 D C C 99.32 6.21 17.59 24.65 97.62 -107.42 -78.01 -2.69 80.27 8.46 11.28 32.08 24.46 24.69 1.26 10.01 0.02 6.17 1.30 64 R C C 86.22 12.59 17.89 30.40 99.59 83.65 -93.04 -4.90 70.74 19.54 9.73 34.55 23.47 13.88 1.22 8.01 0.01 17.63 1.22 65 F E E 27.86 22.17 13.96 35.41 122.33 81.60 -110.99 136.01 22.92 75.97 1.11 18.72 3.84 1.11 0.43 0.63 0.00 73.89 1.38 66 V E E 73.74 7.33 23.39 31.79 130.49 -174.27 -131.80 147.06 6.10 93.75 0.14 5.41 0.55 0.11 0.07 0.05 0.00 93.30 0.50 67 G E E 21.57 18.76 15.51 33.03 139.67 168.64 -154.49 167.30 6.54 93.38 0.07 5.56 0.72 0.14 0.02 0.03 0.00 93.23 0.29 68 S E E 60.64 5.74 21.65 28.97 136.60 -164.55 -145.58 157.51 15.38 84.53 0.09 13.36 1.57 0.25 0.02 0.06 0.00 84.27 0.47 69 G E E 31.17 11.08 15.68 27.33 138.44 138.87 -154.22 165.76 38.66 61.16 0.18 27.75 10.16 1.40 0.03 0.18 0.00 59.58 0.91 70 S C C 77.10 3.30 20.62 24.50 117.71 -115.93 -119.02 112.63 61.39 37.91 0.70 40.29 17.81 4.97 0.13 0.75 0.00 32.40 3.65 71 G C S 34.83 9.63 18.81 28.68 108.55 -49.15 65.23 -127.91 98.02 1.07 0.90 2.83 55.66 39.72 0.03 0.89 0.00 0.71 0.17 72 T C S 54.08 14.54 16.41 30.85 97.56 -8.57 -99.74 -0.66 97.85 1.39 0.76 2.69 56.30 39.10 0.03 0.71 0.00 1.01 0.17 73 D E E 62.56 8.79 22.52 32.36 119.42 85.07 -106.11 129.19 43.73 55.93 0.34 28.59 14.62 2.00 0.04 0.40 0.00 51.89 2.46 74 F E E 7.82 24.57 16.01 40.99 129.20 -175.52 -128.12 144.46 21.21 78.79 0.01 20.03 0.63 0.04 0.00 0.01 0.00 78.89 0.41 75 T E E 31.54 10.59 27.21 39.00 122.97 -159.59 -119.74 135.47 4.82 95.18 0.00 4.37 0.13 0.00 0.00 0.00 0.00 95.44 0.05 76 L E E 2.61 26.48 19.17 46.64 118.81 -160.49 -109.48 127.90 0.34 99.66 0.00 0.35 0.00 0.00 0.00 0.00 0.00 99.64 0.01 77 R E E 82.84 10.00 27.69 38.21 119.07 -164.42 -114.04 126.90 0.14 99.86 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.82 0.01 78 I E E 6.34 24.79 16.88 42.30 116.58 -166.94 -112.38 122.35 3.27 96.73 0.00 3.41 0.02 0.00 0.00 0.00 0.00 96.12 0.45 79 S C S 41.04 8.18 23.26 31.72 128.10 -173.02 -108.60 156.34 89.06 10.91 0.02 40.03 44.96 2.15 0.00 0.04 0.00 12.65 0.17 80 R C S 143.77 3.70 24.11 27.92 95.13 11.12 57.90 55.29 98.00 1.99 0.01 6.51 89.04 2.38 0.00 0.01 0.00 1.96 0.09 81 V C C 12.78 24.44 10.56 34.70 115.45 -160.31 -77.14 135.18 97.67 2.32 0.01 97.05 1.06 0.01 0.00 0.00 0.00 1.38 0.48 82 E C C 83.70 4.57 24.73 28.98 131.88 -169.44 -123.27 162.23 95.62 4.34 0.04 96.84 0.19 0.01 0.01 0.01 0.00 1.01 1.93 83 A H G 52.80 13.77 15.17 28.91 91.07 -101.90 -58.65 -32.76 2.67 0.02 97.31 0.18 0.19 1.68 0.34 97.60 0.00 0.02 0.00 84 E H G 127.42 3.35 21.75 25.77 89.55 62.75 -70.41 -16.04 2.23 0.02 97.74 0.10 0.14 1.50 0.30 97.94 0.00 0.02 0.00 85 D H G 10.95 21.97 16.07 38.39 93.04 63.87 -84.32 -4.77 3.09 0.03 96.88 0.40 0.29 1.43 0.40 97.45 0.00 0.03 0.00 86 V C C 39.54 17.03 19.47 36.52 114.65 111.73 -69.68 136.32 98.13 1.71 0.16 94.21 3.98 0.19 0.03 0.11 0.00 1.29 0.19 87 G E E 13.94 9.70 24.35 36.03 140.07 70.30 142.80 -167.46 25.36 74.60 0.03 18.53 7.05 0.24 0.01 0.03 0.00 72.61 1.54 88 F E E 56.89 13.68 25.18 39.13 118.47 -33.60 -98.65 133.79 2.23 97.77 0.01 2.07 0.15 0.01 0.00 0.00 0.00 97.65 0.12 89 Y E E 6.03 25.57 20.58 46.39 124.59 -165.34 -116.03 139.16 0.97 99.03 0.01 0.87 0.06 0.01 0.00 0.00 0.00 99.02 0.03 90 Y E E 26.17 18.41 28.07 45.87 129.84 -170.96 -127.43 145.68 1.29 98.70 0.01 1.15 0.07 0.01 0.00 0.01 0.00 98.71 0.05 91 C E E 2.05 25.97 23.54 49.59 123.79 -156.08 -116.68 137.54 3.74 96.22 0.04 3.23 0.30 0.03 0.01 0.02 0.00 96.27 0.13 92 M E E 19.74 18.35 26.45 44.20 129.87 -172.65 -126.64 144.65 4.42 95.50 0.08 3.93 0.32 0.06 0.03 0.04 0.00 95.29 0.34 93 Q E E 27.87 19.21 21.35 39.85 124.39 -157.75 -115.69 138.04 13.81 85.99 0.20 11.39 2.11 0.39 0.05 0.13 0.00 85.24 0.67 94 S E E 25.18 13.74 18.42 32.84 122.35 -156.77 -110.05 143.05 44.04 55.64 0.32 36.43 5.78 1.21 0.06 0.29 0.00 54.79 1.44 95 K C S 105.77 9.06 16.05 25.74 103.31 -160.50 -90.89 -18.17 84.93 14.10 0.96 20.33 41.21 23.72 0.09 1.00 0.00 12.48 1.18 96 D C S 106.25 2.76 17.01 20.07 102.61 30.39 -95.13 -9.82 95.62 3.52 0.85 14.08 54.35 27.30 0.07 0.91 0.00 2.76 0.54 97 F C S 105.62 6.46 13.40 21.50 121.82 30.89 -120.73 133.54 92.44 6.80 0.75 20.55 64.77 7.25 0.10 0.71 0.00 5.40 1.21 98 P C C 80.23 5.77 17.28 23.90 114.10 -87.41 -68.02 147.03 86.62 12.57 0.80 53.96 24.18 7.78 0.10 0.83 0.00 12.35 0.79 99 L C C 56.76 16.83 13.78 30.11 115.23 -113.41 -79.09 134.38 60.06 39.30 0.64 50.13 6.47 2.07 0.11 0.56 0.00 39.52 1.14 100 T E E 53.19 10.72 21.09 32.24 126.89 -169.79 -122.36 141.29 19.31 80.30 0.39 16.34 2.19 0.63 0.16 0.25 0.00 76.06 4.36 101 F E E 56.83 19.19 16.61 34.72 120.06 -153.32 -107.01 133.95 22.83 76.74 0.43 17.28 4.83 1.46 0.15 0.32 0.00 72.25 3.71 102 G C E 24.60 12.81 19.42 31.86 121.38 -156.18 10.05 -168.53 60.37 39.19 0.44 37.12 18.30 5.37 0.06 0.43 0.00 37.69 1.03 103 G C C 44.55 6.99 21.43 28.61 104.48 -67.78 -60.07 7.18 74.62 25.06 0.31 50.34 19.08 3.88 0.04 0.34 0.00 25.63 0.68 104 G C C 21.64 17.00 14.44 30.37 127.25 -135.75 89.18 172.76 66.95 32.86 0.20 54.21 9.53 1.36 0.02 0.21 0.00 33.92 0.76 105 T E E 60.70 9.90 19.69 30.19 126.64 -101.49 -121.45 145.40 16.86 83.02 0.12 14.91 1.58 0.24 0.04 0.08 0.00 81.62 1.54 106 K E E 115.68 8.27 17.40 26.87 118.23 -129.88 -96.47 132.75 7.78 92.10 0.12 7.10 0.63 0.11 0.08 0.06 0.00 89.77 2.26 107 V E E 48.66 15.09 10.66 25.69 113.44 -155.41 -96.94 127.87 48.20 51.58 0.23 47.85 0.52 0.18 0.10 0.09 0.00 50.14 1.12 108 D C C 109.62 2.66 17.56 20.98 111.34 -148.72 -93.25 116.54 99.29 0.70 0.01 99.31 0.06 0.02 0.00 0.00 0.00 0.59 0.01