# 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 Q C C 107.13 5.37 20.79 26.76 114.44 -149.27 -94.82 121.64 99.17 0.82 0.00 99.19 0.08 0.01 0.00 0.00 0.00 0.69 0.01 1 V C C 35.50 20.57 11.27 30.64 121.42 -159.21 -109.45 133.52 50.46 49.47 0.07 49.87 0.42 0.09 0.02 0.03 0.00 49.06 0.51 2 Q E E 93.66 5.14 22.09 27.93 123.34 -168.26 -119.91 137.22 12.79 87.11 0.10 11.70 0.84 0.14 0.04 0.05 0.00 86.81 0.43 3 L E E 53.44 19.02 13.88 32.07 117.59 -142.80 -99.12 129.61 9.03 90.87 0.10 8.52 0.44 0.08 0.03 0.04 0.00 90.53 0.35 4 V E E 60.07 9.14 20.08 30.03 122.42 -169.70 -116.23 135.63 13.43 86.33 0.24 11.57 1.45 0.34 0.08 0.13 0.00 85.92 0.51 5 Q E E 84.50 13.15 15.77 28.73 119.79 -141.24 -101.83 132.23 27.48 71.93 0.59 22.58 3.96 1.08 0.15 0.40 0.00 71.09 0.73 6 S C E 54.29 10.70 16.09 27.31 114.12 -170.80 -102.23 133.66 57.41 41.85 0.73 38.21 13.61 5.01 0.10 0.69 0.00 41.62 0.75 7 G C C 40.60 7.23 19.04 26.66 113.37 -93.61 103.06 24.32 71.13 28.30 0.57 37.70 26.13 6.93 0.06 0.62 0.00 27.78 0.78 8 A C C 37.06 17.32 13.60 30.07 121.32 -84.39 -98.29 142.34 61.34 38.04 0.62 49.44 9.56 1.55 0.10 0.53 0.00 37.78 1.02 9 E E E 96.01 8.36 21.40 30.27 120.64 -158.41 -113.90 137.11 34.96 64.58 0.46 27.35 7.08 1.01 0.13 0.33 0.00 62.19 1.91 10 V E E 55.64 16.30 16.90 32.58 118.14 -147.23 -107.09 127.39 28.11 71.66 0.24 25.49 2.22 0.31 0.10 0.14 0.00 69.11 2.62 11 K E E 74.22 12.61 17.65 30.43 125.38 -174.87 -118.85 145.97 43.36 56.48 0.16 39.88 3.08 0.25 0.07 0.10 0.00 52.46 4.16 12 K C C 114.20 5.42 21.10 27.14 122.09 -112.90 -97.54 148.30 93.53 6.38 0.09 81.93 11.12 0.51 0.02 0.07 0.00 5.25 1.09 13 P C T 67.78 12.22 14.01 26.64 110.47 -82.95 -59.72 138.10 98.90 0.80 0.29 0.64 3.38 95.12 0.02 0.21 0.00 0.50 0.12 14 G C T 49.04 3.83 19.06 23.60 95.85 22.07 87.55 -5.24 99.35 0.48 0.17 0.95 3.70 94.77 0.01 0.15 0.00 0.39 0.03 15 A C C 33.03 10.95 14.84 27.31 120.56 128.54 -80.37 154.98 90.65 9.25 0.10 79.69 10.51 0.35 0.01 0.10 0.00 8.55 0.78 16 S E E 60.93 8.22 19.84 29.07 124.57 -136.90 -107.91 145.26 41.78 58.19 0.03 40.37 1.05 0.07 0.00 0.02 0.00 57.58 0.91 17 L E E 16.53 22.20 14.95 36.94 129.10 -168.95 -130.62 142.80 3.18 96.82 0.00 3.06 0.09 0.00 0.00 0.00 0.00 96.73 0.11 18 K E E 107.42 6.89 24.60 32.31 118.20 -148.87 -106.62 129.70 1.03 98.97 0.00 1.00 0.03 0.00 0.00 0.00 0.00 98.95 0.03 19 V E E 5.51 25.34 15.91 41.84 122.40 -169.41 -119.19 133.11 2.30 97.70 0.00 2.21 0.07 0.00 0.00 0.00 0.00 97.64 0.07 20 S E E 39.15 9.20 26.48 36.19 126.70 -166.36 -118.25 143.21 11.23 88.75 0.02 10.21 0.55 0.03 0.00 0.01 0.00 89.07 0.12 21 C E E 6.77 24.97 16.04 41.13 129.97 -176.15 -133.05 145.78 16.21 83.74 0.05 14.84 0.91 0.07 0.01 0.02 0.00 83.90 0.25 22 R E E 115.22 6.68 26.44 33.88 122.36 -161.95 -116.74 134.64 9.28 90.63 0.10 8.52 0.75 0.12 0.04 0.05 0.00 88.85 1.67 23 A E E 9.90 23.71 13.69 36.95 120.19 -166.75 -112.81 129.67 28.32 71.42 0.26 26.48 1.49 0.28 0.09 0.17 0.00 68.84 2.65 24 S C C 62.70 6.11 20.54 27.29 118.36 -155.77 -106.96 143.07 61.04 38.39 0.57 36.25 19.85 6.64 0.07 0.61 0.00 35.32 1.26 25 G C S 52.45 3.02 20.07 23.12 98.91 13.43 83.85 -2.32 80.59 18.82 0.59 16.22 52.37 11.42 0.05 0.63 0.00 18.30 1.02 26 Y C C 64.01 16.98 12.67 29.06 122.97 112.07 -104.98 145.99 76.60 22.54 0.85 53.56 18.73 4.39 0.15 0.94 0.00 19.29 2.94 27 T C C 76.88 6.37 21.70 28.77 121.34 -158.50 -114.46 133.64 77.69 21.58 0.72 61.58 11.67 3.74 0.15 0.77 0.00 17.48 4.61 28 F C C 37.92 20.95 13.74 33.59 120.31 -166.82 -112.24 128.88 76.42 22.50 1.08 60.50 11.62 3.51 0.28 1.00 0.00 16.35 6.74 29 T C S 78.81 5.85 21.36 27.63 113.00 -162.19 -105.27 105.59 81.90 17.06 1.04 23.31 33.90 25.57 0.13 1.05 0.00 14.09 1.94 30 S C S 55.18 8.06 21.38 29.65 102.02 14.96 -108.41 29.45 83.25 16.03 0.72 16.94 40.05 25.76 0.05 0.78 0.00 15.63 0.78 31 H C C 23.66 21.06 16.85 37.33 127.24 116.32 -115.46 147.24 62.35 37.45 0.20 51.05 9.00 0.85 0.03 0.20 0.00 38.09 0.78 32 F E E 37.79 14.61 26.80 41.53 128.22 -162.18 -124.67 144.35 12.34 87.64 0.02 11.55 0.60 0.05 0.00 0.01 0.00 87.37 0.42 33 I E E 2.25 26.89 22.22 49.74 121.08 -153.86 -115.69 131.17 1.52 98.48 0.00 1.43 0.05 0.00 0.00 0.00 0.00 98.48 0.04 34 H E E 23.98 18.04 28.18 45.63 129.20 -173.50 -126.38 144.93 0.52 99.48 0.00 0.47 0.02 0.00 0.00 0.00 0.00 99.50 0.00 35 W E E 5.61 25.15 23.50 48.60 123.04 -153.71 -112.05 136.32 0.48 99.52 0.00 0.43 0.01 0.00 0.00 0.00 0.00 99.54 0.00 36 V E E 10.62 19.66 25.31 44.56 127.76 -169.99 -124.04 141.71 0.32 99.68 0.00 0.29 0.00 0.00 0.00 0.00 0.00 99.70 0.00 37 R E E 39.67 18.11 22.86 40.17 124.25 -159.28 -113.95 136.02 0.37 99.63 0.00 0.33 0.01 0.00 0.00 0.00 0.00 99.65 0.01 38 Q E E 52.38 13.45 20.05 33.82 118.59 -152.94 -107.78 129.78 3.97 96.02 0.00 3.64 0.18 0.01 0.00 0.00 0.00 95.91 0.26 39 A C C 23.28 12.47 14.71 28.62 117.99 -131.58 -77.80 150.91 84.45 15.41 0.14 82.08 1.55 0.29 0.02 0.10 0.00 15.26 0.70 40 P C T 89.93 6.24 13.38 21.32 109.14 -84.92 -58.66 135.81 96.27 0.26 3.46 0.45 3.87 91.55 0.06 3.85 0.00 0.15 0.07 41 G C T 69.31 0.31 13.68 11.36 95.47 15.21 82.27 -3.33 96.05 0.13 3.82 0.52 3.64 91.37 0.07 4.29 0.00 0.07 0.04 42 Q C S 107.57 4.79 11.93 18.31 106.95 79.25 -107.14 -4.39 88.79 4.94 6.26 20.58 46.85 20.93 0.43 6.84 0.01 3.01 1.36 43 G C C 34.49 4.06 17.14 22.19 126.94 -120.15 89.65 -168.05 81.92 17.84 0.23 62.94 17.26 1.63 0.04 0.26 0.00 16.38 1.50 44 L E E 59.66 16.00 13.59 29.41 115.58 -32.06 -75.00 137.51 41.45 58.51 0.03 38.08 1.63 0.09 0.00 0.03 0.00 59.86 0.31 45 E E E 76.18 10.35 21.73 32.42 127.49 -171.41 -126.05 141.59 2.69 97.30 0.01 2.27 0.20 0.01 0.00 0.00 0.00 97.46 0.06 46 W E E 88.67 16.19 20.58 36.20 110.80 -112.91 -72.36 128.74 0.57 99.43 0.00 0.53 0.02 0.00 0.00 0.00 0.00 99.43 0.01 47 M E E 11.17 21.61 21.68 43.57 100.34 176.66 -101.41 -24.43 4.49 95.51 0.01 3.43 0.86 0.05 0.00 0.00 0.00 95.64 0.02 48 G E E 2.12 19.30 24.23 44.12 145.02 -48.82 166.12 173.13 1.87 98.12 0.00 1.47 0.23 0.02 0.00 0.00 0.00 98.25 0.02 49 I E E 24.92 17.95 25.55 43.19 130.94 -100.23 -130.52 144.89 1.02 98.98 0.00 0.92 0.04 0.00 0.00 0.00 0.00 98.96 0.08 50 I E E 14.12 20.96 19.78 40.90 117.63 -146.24 -107.80 125.90 2.75 97.25 0.00 2.50 0.15 0.01 0.00 0.00 0.00 96.11 1.23 51 N C C 37.58 11.39 20.27 32.47 123.77 -161.10 -101.56 162.46 85.53 14.44 0.04 84.00 1.36 0.11 0.01 0.02 0.00 13.84 0.67 52 P C T 74.33 12.22 14.38 27.04 91.02 -110.55 -63.98 -21.64 98.47 0.47 1.06 1.26 7.29 89.87 0.05 1.10 0.00 0.35 0.08 53 S C T 91.09 1.25 16.94 17.11 94.48 55.58 -85.84 -4.39 98.47 0.30 1.23 0.82 7.16 90.44 0.05 1.27 0.00 0.19 0.07 54 G C S 40.74 7.83 14.82 23.41 105.32 -89.04 96.77 3.30 95.56 2.22 2.22 20.59 65.68 9.30 0.24 2.07 0.00 1.31 0.81 55 G C C 33.10 6.16 17.90 25.00 125.04 121.10 10.83 -173.49 93.67 5.44 0.89 77.87 12.66 3.06 0.29 0.64 0.00 3.94 1.54 56 A E E 50.69 15.25 14.53 29.04 123.57 -77.62 -108.62 142.54 44.50 52.60 2.91 34.10 6.90 2.11 1.76 1.52 0.05 40.95 12.62 57 S E E 46.78 9.15 21.09 30.64 133.05 172.16 -134.50 155.24 33.15 62.42 4.43 26.07 5.54 2.60 2.62 2.29 0.02 55.31 5.54 58 Y C E 82.44 15.18 19.56 33.84 113.95 -120.45 -86.83 139.26 37.83 35.74 26.44 21.67 8.98 10.36 10.28 15.40 0.30 29.43 3.58 59 A H G 10.18 22.35 13.21 34.79 99.17 -90.11 -71.00 5.31 42.10 4.79 53.11 25.17 7.25 11.14 11.41 40.48 0.01 3.87 0.67 60 Q H G 115.23 4.83 18.50 24.81 92.82 105.60 -62.82 -31.01 17.14 0.73 82.13 4.21 2.84 10.45 11.86 69.97 0.00 0.52 0.14 61 N H G 103.56 3.88 19.50 24.14 91.18 60.09 -71.58 -17.30 19.08 0.32 80.59 2.10 2.36 14.22 11.04 69.97 0.01 0.21 0.10 62 F H G 16.59 21.53 11.26 32.80 97.76 49.81 -104.50 7.44 36.77 1.14 62.09 8.75 6.27 22.42 7.27 54.12 0.02 0.65 0.51 63 R C T 130.72 9.27 15.12 25.94 109.25 123.91 -62.82 128.73 86.92 2.20 10.89 3.93 3.87 80.09 1.84 7.75 0.01 1.12 1.40 64 D C T 127.40 1.09 19.33 19.23 94.22 14.96 72.77 0.93 88.78 0.31 10.91 0.63 3.01 86.53 0.79 8.77 0.00 0.17 0.11 65 R C T 80.27 13.39 16.62 30.02 99.99 57.61 -100.09 -16.11 91.50 1.11 7.38 3.79 11.41 76.16 0.62 6.92 0.00 0.91 0.19 66 V E E 5.24 25.09 12.30 37.80 130.10 45.86 -129.31 143.63 10.85 89.11 0.04 8.98 1.89 0.09 0.01 0.02 0.00 87.55 1.46 67 T E E 63.91 6.11 26.66 33.28 125.56 -165.26 -121.90 140.05 1.84 98.16 0.01 1.70 0.06 0.00 0.00 0.00 0.00 98.15 0.08 68 M E E 26.40 23.97 14.07 37.49 125.30 -164.60 -121.94 135.53 3.90 96.09 0.01 3.65 0.15 0.02 0.00 0.00 0.00 96.09 0.09 69 T E E 64.15 6.13 25.93 32.46 125.68 -172.68 -126.81 139.00 7.95 92.03 0.02 7.10 0.57 0.05 0.00 0.01 0.00 92.00 0.27 70 T E E 43.50 19.97 13.44 32.25 124.01 -161.09 -117.87 136.07 24.64 75.28 0.08 21.24 3.37 0.22 0.03 0.06 0.00 72.75 2.33 71 D C C 59.65 7.38 18.71 27.19 110.42 -151.84 -107.92 112.54 88.38 11.54 0.09 86.38 2.01 0.24 0.02 0.06 0.00 10.26 1.03 72 P C T 79.16 10.06 13.19 24.67 92.53 -157.01 -66.85 -19.83 97.59 0.61 1.80 3.53 15.73 78.09 0.09 1.96 0.00 0.46 0.15 73 S C T 88.93 1.42 18.03 18.70 93.74 57.84 -81.95 -15.52 97.10 0.70 2.20 2.53 16.25 78.09 0.12 2.31 0.00 0.48 0.21 74 T C S 49.67 10.16 15.16 26.21 121.86 53.12 -116.16 147.53 95.68 2.39 1.93 20.17 55.47 19.89 0.19 1.94 0.00 1.40 0.93 75 S C S 45.88 13.72 17.46 31.32 98.30 -148.30 -88.44 11.05 97.22 2.46 0.32 20.26 60.85 15.97 0.03 0.37 0.00 2.23 0.30 76 T C E 36.02 12.04 22.37 35.28 127.76 98.90 -114.04 145.39 50.09 49.82 0.10 38.00 11.78 0.63 0.02 0.11 0.00 47.16 2.31 77 V E E 5.09 24.34 18.59 43.39 125.20 -162.99 -122.87 137.07 11.25 88.74 0.01 10.72 0.40 0.03 0.00 0.01 0.00 88.37 0.48 78 Y E E 51.80 13.44 26.61 40.32 123.15 -160.19 -116.59 135.62 1.84 98.16 0.00 1.64 0.08 0.00 0.00 0.00 0.00 98.24 0.03 79 M E E 4.00 25.76 19.82 46.14 120.91 -162.02 -114.10 131.59 0.30 99.70 0.00 0.29 0.01 0.00 0.00 0.00 0.00 99.70 0.00 80 E E E 68.74 10.81 27.55 38.78 117.51 -156.45 -105.86 125.42 0.24 99.76 0.00 0.23 0.00 0.00 0.00 0.00 0.00 99.75 0.01 81 L E E 6.31 25.19 17.14 42.85 117.89 -166.31 -109.83 125.78 12.26 87.73 0.01 12.33 0.14 0.01 0.00 0.01 0.00 86.79 0.72 82 G C S 25.52 8.92 23.33 32.53 120.19 -166.37 -95.32 169.73 92.70 7.16 0.14 39.88 44.28 7.55 0.01 0.22 0.00 7.75 0.31 83 S C S 66.30 5.26 24.82 30.22 100.55 6.35 34.67 78.56 97.88 2.05 0.07 15.55 75.16 7.11 0.00 0.10 0.00 1.84 0.24 84 L C C 12.93 24.87 11.01 35.90 114.03 -143.84 -74.02 133.39 98.01 1.97 0.02 97.11 1.20 0.03 0.00 0.01 0.00 0.80 0.85 85 R C C 97.63 5.06 24.59 29.65 133.99 -170.51 -128.55 164.49 99.00 0.96 0.04 98.19 0.80 0.02 0.01 0.01 0.00 0.20 0.77 86 S H G 59.44 12.40 16.17 28.67 90.85 -98.46 -59.87 -31.83 7.16 0.06 92.78 0.39 0.55 4.83 0.41 93.78 0.00 0.04 0.00 87 E H G 122.76 4.32 22.02 27.07 90.44 62.10 -73.39 -15.12 6.54 0.07 93.38 0.27 0.43 4.65 0.39 94.20 0.00 0.05 0.00 88 D H G 11.77 21.75 16.74 38.70 95.27 62.27 -89.94 1.36 7.97 0.17 91.86 2.03 1.14 2.90 0.57 93.24 0.00 0.11 0.02 89 T C C 29.69 17.68 21.95 39.45 116.47 109.13 -82.89 134.90 83.76 15.54 0.70 78.65 4.81 0.43 0.14 0.50 0.00 14.55 0.93 90 A E E 8.72 20.54 24.24 43.81 142.88 160.95 -153.57 169.14 8.71 91.19 0.10 7.96 0.80 0.11 0.04 0.05 0.00 90.29 0.75 91 V E E 21.87 18.78 26.56 44.67 118.61 -109.43 -101.97 132.49 1.66 98.32 0.02 1.57 0.08 0.01 0.00 0.00 0.00 98.26 0.08 92 Y E E 6.64 25.18 23.85 48.66 122.75 -161.86 -110.05 136.76 1.58 98.37 0.04 1.45 0.11 0.02 0.01 0.02 0.00 98.32 0.07 93 Y E E 17.64 21.26 27.87 47.98 131.84 -173.02 -128.80 148.61 5.07 94.46 0.47 4.31 0.61 0.22 0.18 0.18 0.00 94.28 0.23 94 C E E 3.76 24.76 24.98 49.19 128.00 -163.88 -123.88 144.03 19.82 78.29 1.90 15.83 3.03 1.21 0.66 0.85 0.00 77.67 0.75 95 A E E 8.37 20.67 24.93 44.91 124.77 -154.91 -115.53 142.18 29.49 67.20 3.32 23.35 5.24 2.07 1.49 1.57 0.01 64.54 1.73 96 R E E 55.54 16.93 21.90 38.08 121.17 -157.51 -110.57 138.57 41.53 54.99 3.49 32.09 7.80 3.13 1.60 1.95 0.03 49.82 3.57 97 A C C 35.08 13.08 17.42 30.86 115.40 -125.11 -88.24 141.93 63.94 33.02 3.04 46.82 12.03 5.30 0.98 2.17 0.01 29.85 2.85 98 E C T 123.15 6.00 15.91 23.21 109.76 -109.79 -77.14 129.38 80.57 15.08 4.35 28.45 23.53 30.04 0.81 3.39 0.01 11.81 1.96 99 G C T 56.01 2.43 15.20 18.36 107.53 20.51 89.54 -6.09 90.94 4.89 4.17 24.73 30.11 36.57 0.64 3.54 0.00 3.27 1.14 100 S C C 61.37 8.06 11.94 21.06 113.96 107.71 -93.03 140.58 87.97 5.46 6.58 35.75 30.77 21.94 1.30 5.26 0.00 3.14 1.83 101 S C C 69.04 6.00 15.15 22.15 108.79 -146.67 -89.84 101.30 81.78 8.02 10.20 30.31 26.49 26.40 2.24 7.32 0.02 4.94 2.26 102 W C C 119.23 11.53 14.38 25.99 107.06 -125.38 -86.50 86.31 68.03 17.34 14.63 32.35 18.49 19.53 3.86 10.04 0.13 11.02 4.58 103 L C C 78.34 11.05 16.48 27.68 107.83 136.81 -90.77 74.37 64.84 17.69 17.48 28.96 15.45 23.18 4.14 12.19 0.13 12.14 3.81 104 G C C 32.15 11.05 19.11 29.87 108.88 51.09 -15.58 -22.42 69.03 15.31 15.67 28.88 17.16 25.55 3.00 11.67 0.07 10.73 2.95 105 W C C 88.47 14.85 18.93 32.98 109.65 60.26 -94.14 60.83 65.26 21.22 13.53 35.58 16.73 15.05 3.28 9.88 0.09 14.65 4.75 106 F C C 45.56 18.39 18.17 35.80 118.30 89.48 -103.24 135.13 65.83 29.01 5.16 39.68 19.69 6.03 2.41 3.06 0.14 14.40 14.58 107 D C C 44.16 14.74 20.61 34.92 111.31 -127.66 -90.67 117.72 87.07 10.42 2.50 69.76 12.85 3.93 0.88 1.77 0.00 6.56 4.25 108 P C T 49.14 16.00 19.56 34.76 95.85 -147.05 -67.71 -21.16 87.76 2.75 9.49 13.74 14.20 59.50 1.82 7.79 0.01 1.77 1.18 109 W C T 91.71 14.45 20.48 34.12 97.85 51.28 -90.21 1.17 87.27 3.10 9.63 8.12 15.06 63.51 1.87 7.94 0.02 1.92 1.56 110 G C C 21.01 15.71 19.74 34.20 110.19 -104.79 87.81 -3.07 84.61 7.39 8.00 31.61 31.29 22.11 1.26 6.60 0.01 3.69 3.43 111 Q C C 82.10 12.08 23.15 34.33 102.33 105.93 -87.83 2.11 85.99 10.12 3.89 48.04 21.48 16.79 0.84 3.24 0.00 6.05 3.56 112 G C C 14.22 18.01 20.50 37.09 122.46 -104.38 94.61 -175.33 79.23 18.96 1.81 47.76 20.39 11.28 0.26 1.84 0.00 16.14 2.34 113 T E E 20.81 20.71 21.76 41.40 115.75 -91.83 -103.77 128.49 42.65 56.93 0.42 35.51 5.98 0.87 0.08 0.36 0.00 55.90 1.30 114 L E E 55.09 14.34 25.36 39.12 117.52 -142.49 -100.71 129.36 6.67 93.31 0.02 5.97 0.59 0.05 0.00 0.01 0.00 92.95 0.42 115 V E E 7.35 24.67 18.56 43.42 121.89 -165.67 -113.40 131.95 1.73 98.27 0.00 1.67 0.05 0.00 0.00 0.00 0.00 98.20 0.07 116 T E E 50.61 9.78 25.98 36.16 120.15 -158.39 -108.31 133.56 1.95 98.04 0.01 1.85 0.07 0.00 0.00 0.00 0.00 97.94 0.13 117 V E E 16.72 22.62 14.37 36.58 119.43 -159.37 -107.76 131.48 15.32 84.61 0.06 14.06 0.96 0.11 0.02 0.04 0.00 83.84 0.95 118 S C C 50.65 7.56 18.83 26.99 126.76 -168.79 -113.11 158.93 61.13 38.76 0.12 58.35 1.48 0.33 0.03 0.08 0.00 38.70 1.03 119 S C C 74.82 6.09 16.72 23.90 108.60 -96.58 -77.80 136.60 99.67 0.32 0.01 99.53 0.19 0.04 0.00 0.00 0.00 0.22 0.01