# 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 A C C 49.82 9.46 20.57 30.13 117.79 -149.82 -100.70 136.04 99.59 0.40 0.00 99.60 0.07 0.01 0.00 0.00 0.00 0.30 0.01 1 I C C 33.65 20.41 13.05 32.59 119.14 -149.98 -101.33 131.00 53.35 46.57 0.08 52.91 0.42 0.09 0.02 0.03 0.00 45.91 0.63 2 R E E 127.70 5.17 22.16 28.25 121.01 -163.06 -113.92 132.12 15.72 84.14 0.14 14.80 0.83 0.15 0.06 0.07 0.00 82.93 1.17 3 M E E 39.88 20.93 12.48 32.40 119.47 -155.11 -103.45 132.14 15.98 83.86 0.15 15.18 0.76 0.14 0.07 0.08 0.00 82.09 1.69 4 T E E 69.52 6.84 20.84 28.20 110.46 -171.89 -109.52 3.22 37.00 62.78 0.23 30.04 6.02 0.66 0.06 0.17 0.00 61.78 1.27 5 Q C C 80.93 11.14 17.37 28.81 127.12 21.24 -124.28 142.99 65.24 34.52 0.24 38.21 26.50 1.57 0.04 0.22 0.00 32.15 1.31 6 S C C 53.67 11.72 16.53 28.54 120.69 -137.32 -100.93 143.19 88.23 11.64 0.13 61.66 25.52 1.02 0.02 0.13 0.00 10.98 0.67 7 P C C 50.27 11.48 16.12 28.16 115.28 8.25 -71.51 151.58 90.96 7.40 1.65 65.38 18.60 6.11 0.15 2.01 0.00 7.18 0.58 8 S C S 69.27 7.83 17.51 26.17 98.06 -146.46 -82.07 -20.89 82.25 16.63 1.12 27.38 47.67 6.20 0.07 1.21 0.00 16.76 0.71 9 S E E 56.36 7.09 20.12 28.33 137.09 13.14 -148.05 151.01 24.93 73.23 1.84 18.08 5.88 2.13 0.19 1.62 0.00 71.48 0.61 10 L E E 34.71 19.62 14.91 33.80 132.01 -175.33 -139.29 144.10 6.79 93.08 0.12 5.91 0.78 0.12 0.03 0.07 0.00 92.74 0.35 11 S E E 63.28 7.10 22.97 31.27 126.25 -159.18 -119.55 141.73 4.53 95.41 0.06 4.00 0.43 0.07 0.02 0.03 0.00 95.14 0.31 12 A E E 13.64 19.40 14.68 34.10 137.84 169.23 -146.26 159.64 16.27 83.58 0.15 14.02 1.64 0.23 0.04 0.10 0.00 83.53 0.44 13 S E E 54.12 5.27 23.53 28.72 123.00 -112.85 -90.96 156.58 32.16 67.39 0.46 26.86 4.28 0.98 0.16 0.37 0.00 63.55 3.79 14 V C T 61.34 15.14 14.22 29.23 109.21 -83.67 -60.94 134.73 91.55 6.66 1.79 2.60 9.49 80.45 0.16 1.48 0.00 4.96 0.86 15 G C T 45.68 4.66 19.85 25.18 96.24 22.64 88.97 -6.39 97.06 1.71 1.22 3.61 13.07 80.40 0.08 1.20 0.00 1.41 0.24 16 D C S 61.28 9.08 17.34 27.35 123.02 114.56 -84.95 155.86 92.31 6.79 0.90 36.92 51.03 4.66 0.11 0.84 0.00 5.62 0.81 17 R C C 127.22 8.13 19.47 28.68 121.16 -123.44 -100.01 137.71 67.09 32.86 0.05 64.27 1.64 0.15 0.01 0.04 0.00 33.47 0.42 18 V E E 12.66 22.24 14.53 36.78 127.66 -168.67 -126.37 141.58 1.95 98.05 0.00 1.87 0.05 0.00 0.00 0.00 0.00 97.95 0.12 19 T E E 63.73 7.82 25.07 33.42 117.88 -147.42 -106.73 129.07 0.60 99.40 0.00 0.57 0.01 0.00 0.00 0.00 0.00 99.40 0.01 20 I E E 5.20 25.60 16.30 42.69 120.24 -166.36 -114.98 129.50 2.56 97.44 0.00 2.37 0.06 0.00 0.00 0.00 0.00 97.54 0.02 21 T E E 45.33 9.28 27.01 37.01 121.35 -164.79 -112.75 134.45 11.70 88.29 0.00 10.77 0.24 0.01 0.00 0.00 0.00 88.91 0.06 22 C E E 4.29 25.74 16.76 42.97 127.39 -172.16 -126.97 139.99 9.84 90.15 0.01 8.99 0.40 0.01 0.00 0.00 0.00 90.45 0.14 23 Q E E 77.57 7.76 27.63 36.26 122.38 -161.99 -117.39 133.90 4.77 95.20 0.03 4.47 0.25 0.03 0.01 0.01 0.00 94.30 0.92 24 A E E 9.00 23.94 14.00 37.60 123.72 -161.78 -108.22 145.44 33.43 66.35 0.22 31.95 1.37 0.20 0.09 0.13 0.00 64.13 2.12 25 S C C 48.38 8.05 20.15 28.73 111.43 -144.59 -87.64 160.04 74.61 24.40 0.99 52.30 19.06 3.04 0.20 0.90 0.00 22.85 1.65 26 Q C S 111.82 4.83 18.45 23.73 104.70 -50.09 -85.02 -10.31 89.65 5.16 5.19 11.67 47.61 31.14 0.99 3.73 0.01 3.95 0.91 27 D C C 98.32 4.15 19.42 24.01 104.72 19.30 -87.42 83.91 92.72 3.14 4.14 38.30 25.63 28.96 0.62 3.64 0.00 2.12 0.72 28 I C C 36.21 20.19 12.16 31.03 111.72 -162.08 -91.99 118.68 86.12 6.95 6.93 58.18 15.42 11.88 1.28 6.37 0.00 4.41 2.46 29 S C C 53.52 8.44 21.04 29.66 109.45 161.49 -98.22 -7.39 89.34 5.75 4.91 51.01 22.97 15.32 0.59 4.81 0.00 4.23 1.08 30 N C S 73.74 11.03 20.44 31.08 102.76 19.86 -97.79 -3.98 86.03 11.29 2.67 23.06 52.85 9.97 0.23 2.40 0.00 10.59 0.91 31 Y E E 67.25 12.61 23.01 35.78 128.69 44.33 -126.93 144.02 36.51 62.52 0.97 30.77 4.47 1.07 0.14 0.82 0.00 61.98 0.75 32 L E E 4.35 25.69 18.46 44.63 125.28 -163.11 -119.25 137.84 6.30 93.68 0.03 5.82 0.36 0.03 0.01 0.01 0.00 93.55 0.21 33 N E E 29.23 14.78 27.75 42.69 126.86 -166.50 -118.68 144.12 1.42 98.58 0.00 1.29 0.06 0.00 0.00 0.00 0.00 98.63 0.02 34 W E E 8.24 24.74 21.23 46.04 125.01 -156.72 -114.54 141.45 0.83 99.17 0.00 0.76 0.03 0.00 0.00 0.00 0.00 99.20 0.01 35 Y E E 27.21 15.93 24.12 40.28 132.52 -174.43 -132.99 151.71 0.54 99.46 0.00 0.48 0.02 0.00 0.00 0.00 0.00 99.48 0.02 36 Q E E 38.82 15.28 20.97 36.46 122.74 -141.88 -113.12 136.22 2.36 97.64 0.00 1.95 0.17 0.01 0.00 0.00 0.00 97.80 0.06 37 Q E E 50.46 13.78 15.89 30.35 120.60 -155.46 -109.38 135.03 28.49 71.49 0.02 25.94 1.59 0.06 0.00 0.01 0.00 71.37 1.02 38 K C C 98.31 6.17 15.73 23.18 119.02 -133.95 -88.51 146.32 97.01 2.96 0.04 95.16 1.96 0.20 0.01 0.03 0.00 2.21 0.44 39 P C T 100.69 4.45 11.49 17.99 109.35 -83.62 -58.53 133.82 99.66 0.10 0.25 0.28 3.10 96.32 0.00 0.23 0.00 0.06 0.02 40 G C T 68.59 0.34 13.21 11.10 95.48 18.06 83.32 -3.56 99.67 0.08 0.26 0.36 3.08 96.23 0.01 0.27 0.00 0.05 0.01 41 K C S 109.38 4.26 11.09 17.49 129.07 93.27 -115.81 158.51 92.43 7.27 0.30 35.56 55.91 1.06 0.07 0.23 0.00 2.42 4.75 42 A C C 72.83 2.86 16.72 20.09 116.53 -96.73 -68.53 149.81 97.14 2.84 0.02 89.29 7.97 0.12 0.00 0.02 0.00 2.25 0.34 43 P C C 42.13 18.41 10.85 28.44 115.05 -101.97 -65.65 144.66 91.32 8.67 0.01 90.20 1.44 0.07 0.00 0.01 0.00 7.96 0.31 44 K E E 104.15 6.25 21.23 28.39 123.81 -158.62 -120.34 138.10 9.84 90.14 0.02 8.69 0.90 0.05 0.01 0.01 0.00 89.75 0.60 45 L E E 67.89 15.22 17.00 31.90 110.53 -116.76 -75.54 126.36 0.87 99.13 0.00 0.79 0.03 0.00 0.00 0.00 0.00 99.14 0.04 46 L E E 31.23 16.54 19.75 36.45 101.24 175.58 -96.65 -33.72 2.37 97.62 0.00 1.60 0.64 0.01 0.00 0.00 0.00 97.73 0.01 47 I E E 27.75 17.16 20.86 38.06 135.47 7.96 -146.46 142.50 0.62 99.38 0.00 0.50 0.05 0.00 0.00 0.00 0.00 99.44 0.01 48 Y E E 58.43 18.51 19.26 36.75 127.23 -172.78 -132.34 134.04 3.42 96.56 0.01 3.01 0.19 0.01 0.00 0.00 0.00 96.69 0.09 49 D E E 42.93 10.51 22.75 33.80 112.76 -161.03 -115.72 107.10 27.29 72.44 0.28 24.30 2.48 0.31 0.07 0.18 0.00 71.87 0.79 50 A H G 24.09 19.88 14.15 33.55 94.28 -172.43 -69.45 -19.71 34.42 3.91 61.67 13.88 6.39 15.57 4.85 55.54 0.00 3.29 0.48 51 S H G 75.59 4.17 19.19 24.28 91.89 68.49 -71.38 -18.15 37.59 1.25 61.16 4.86 6.28 26.25 5.03 56.37 0.01 0.84 0.37 52 N H G 95.47 5.36 18.10 24.25 99.32 46.98 -102.04 4.55 37.11 1.48 61.40 9.03 7.96 21.58 5.30 54.74 0.01 0.92 0.46 53 L C C 38.51 19.81 9.55 27.83 117.35 106.35 -84.24 140.10 82.16 5.70 12.14 55.93 19.85 6.11 6.16 5.81 0.01 2.39 3.74 54 E C C 116.59 4.67 17.47 23.26 116.40 -139.61 -93.60 134.99 86.75 7.52 5.74 67.82 10.76 7.31 2.91 2.78 0.00 3.70 4.70 55 T C T 95.63 5.92 14.32 21.82 111.60 -104.16 -70.74 133.37 91.83 4.61 3.56 18.78 19.67 53.55 1.39 1.95 0.00 2.77 1.88 56 G C T 53.58 3.43 17.41 21.53 98.39 20.63 86.12 -3.10 97.00 1.76 1.24 16.58 27.67 52.85 0.21 1.02 0.00 1.21 0.46 57 V C C 40.48 15.28 11.57 27.18 118.48 105.81 -102.24 130.64 90.66 8.77 0.57 51.34 38.29 1.57 0.21 0.35 0.00 3.62 4.62 58 P C C 62.51 8.49 16.89 26.47 110.23 -111.35 -66.42 146.54 87.09 5.27 7.64 58.41 13.80 13.94 1.12 7.61 0.00 3.58 1.54 59 S C C 61.87 10.91 16.47 27.49 100.03 -112.38 -75.32 -3.14 82.59 6.28 11.13 43.42 19.36 19.53 1.11 11.04 0.00 4.34 1.20 60 R C C 102.82 10.40 19.91 30.37 102.64 74.95 -96.97 10.43 71.33 18.31 10.36 39.84 21.08 11.29 1.27 9.05 0.01 15.97 1.50 61 F E E 27.63 22.38 13.85 35.52 124.24 101.25 -112.32 138.80 28.38 70.66 0.96 23.80 4.38 0.99 0.37 0.61 0.00 68.25 1.61 62 S E E 54.26 6.78 24.07 32.02 133.08 -177.06 -137.63 155.38 8.77 91.09 0.13 7.89 0.77 0.13 0.06 0.06 0.00 90.52 0.56 63 G E E 21.81 19.16 15.09 32.91 141.04 168.72 -154.90 166.26 6.59 93.36 0.05 5.74 0.61 0.09 0.01 0.02 0.00 93.22 0.30 64 S E E 64.18 4.76 22.24 28.61 136.04 -168.63 -148.18 156.90 9.97 89.98 0.05 8.83 0.88 0.12 0.01 0.03 0.00 89.74 0.39 65 G E E 30.05 10.94 15.97 27.67 140.06 122.90 152.13 162.13 25.85 74.04 0.11 19.02 6.64 0.83 0.02 0.11 0.00 72.57 0.82 66 S C C 74.90 3.54 21.08 25.13 118.96 -95.06 -119.80 128.63 58.26 41.45 0.30 45.65 10.41 2.01 0.06 0.32 0.00 39.23 2.32 67 G C S 32.46 10.90 19.19 29.93 107.84 -50.07 65.72 -121.51 98.54 0.90 0.56 1.81 56.55 40.37 0.01 0.53 0.00 0.63 0.10 68 T C S 52.46 14.94 16.84 31.61 97.85 -7.65 -98.60 -3.22 98.58 0.96 0.47 1.68 56.41 40.68 0.01 0.42 0.00 0.71 0.09 69 D E E 59.43 9.17 22.65 32.94 120.74 82.42 -109.09 130.85 35.13 64.67 0.20 23.87 10.91 1.41 0.02 0.26 0.00 62.08 1.46 70 F E E 6.96 24.87 16.12 41.53 128.19 -174.39 -125.68 142.45 10.10 89.90 0.00 9.78 0.20 0.01 0.00 0.00 0.00 89.80 0.21 71 T E E 34.63 10.46 27.26 38.80 123.02 -163.06 -118.81 133.67 1.58 98.42 0.00 1.38 0.04 0.00 0.00 0.00 0.00 98.56 0.02 72 F E E 4.09 26.04 18.94 45.78 121.55 -165.12 -115.82 130.79 0.16 99.84 0.00 0.17 0.00 0.00 0.00 0.00 0.00 99.83 0.00 73 T E E 39.66 10.16 27.23 38.23 120.44 -163.39 -115.56 129.08 0.12 99.88 0.00 0.13 0.00 0.00 0.00 0.00 0.00 99.87 0.00 74 I E E 7.48 24.13 16.14 40.86 116.89 -163.51 -110.23 123.59 3.13 96.87 0.00 3.22 0.04 0.00 0.00 0.00 0.00 96.40 0.34 75 S C C 51.87 6.75 22.98 29.93 110.19 -166.65 -94.46 -23.35 95.42 4.53 0.04 47.63 43.97 3.03 0.00 0.08 0.00 5.12 0.17 76 S C S 62.88 4.60 24.36 28.83 111.02 8.46 -110.35 104.67 99.25 0.72 0.03 11.15 84.87 3.30 0.00 0.03 0.00 0.56 0.08 77 L C C 21.34 23.53 10.95 33.94 112.20 -135.80 -78.22 127.96 99.49 0.49 0.01 97.80 1.72 0.03 0.00 0.00 0.00 0.17 0.27 78 Q C C 79.07 4.72 23.53 28.23 130.90 177.15 -126.71 157.29 99.88 0.10 0.01 99.19 0.69 0.01 0.00 0.00 0.00 0.02 0.08 79 P H G 74.61 11.49 15.52 27.47 91.03 -104.98 -58.45 -31.68 3.26 0.01 96.72 0.16 0.19 2.13 0.25 97.26 0.00 0.01 0.00 80 E H G 123.10 4.12 21.01 25.97 89.81 63.32 -70.36 -15.59 2.68 0.02 97.29 0.09 0.14 1.85 0.18 97.73 0.00 0.02 0.00 81 D H G 11.50 21.44 15.55 37.52 93.34 61.94 -85.93 -4.18 3.58 0.04 96.37 0.44 0.35 1.64 0.25 97.29 0.00 0.04 0.00 82 I C C 45.15 16.28 20.21 36.65 114.37 104.38 -77.16 131.86 87.33 12.44 0.23 84.07 3.62 0.11 0.04 0.17 0.00 11.48 0.51 83 A E E 16.91 15.23 22.70 37.95 144.89 142.01 -165.37 175.61 8.36 91.64 0.01 7.68 0.50 0.02 0.00 0.00 0.00 91.42 0.37 84 T E E 39.67 12.39 25.22 38.05 119.40 -80.97 -103.20 135.23 0.87 99.13 0.00 0.78 0.04 0.00 0.00 0.00 0.00 99.16 0.02 85 Y E E 7.39 25.22 19.10 44.59 124.92 -165.58 -117.09 139.21 0.36 99.64 0.00 0.31 0.02 0.00 0.00 0.00 0.00 99.66 0.01 86 Y E E 34.78 15.31 27.31 42.72 130.13 -170.42 -126.01 146.16 0.99 99.01 0.00 0.85 0.05 0.00 0.00 0.00 0.00 99.08 0.02 87 C E E 2.94 25.39 21.03 46.77 123.10 -156.56 -114.93 137.47 5.03 94.89 0.08 4.31 0.42 0.06 0.03 0.04 0.00 95.01 0.12 88 Q E E 32.15 14.64 25.88 40.52 127.84 -171.32 -122.25 143.58 4.53 95.26 0.21 3.93 0.33 0.09 0.08 0.10 0.00 95.27 0.20 89 Q E E 29.16 18.74 18.83 37.27 123.22 -155.16 -112.30 139.33 12.23 87.41 0.37 10.47 1.39 0.33 0.12 0.23 0.00 86.83 0.64 90 Y E E 69.81 11.71 17.79 30.42 120.77 -163.83 -114.55 133.41 43.27 56.17 0.57 35.19 6.44 1.54 0.12 0.48 0.00 54.63 1.60 91 D C S 76.62 8.52 14.81 24.09 114.11 -155.57 -109.22 118.31 87.48 11.46 1.06 19.26 35.96 32.24 0.08 1.16 0.00 10.40 0.91 92 N C S 130.37 1.80 15.80 17.92 97.92 -37.18 -57.37 12.23 97.04 2.05 0.91 14.30 47.59 35.18 0.06 1.04 0.00 1.49 0.36 93 L C S 71.62 8.72 11.37 21.72 122.98 89.22 -109.81 142.27 90.23 9.25 0.52 20.84 64.28 5.30 0.08 0.48 0.00 7.45 1.58 94 P C C 82.69 4.84 17.52 23.11 113.52 -97.53 -67.87 147.43 84.24 15.42 0.34 60.82 19.30 3.09 0.05 0.35 0.00 15.68 0.72 95 V C C 51.06 17.26 12.97 29.51 116.19 -120.58 -86.70 134.21 57.99 41.76 0.24 51.38 4.19 0.75 0.04 0.19 0.00 42.55 0.89 96 T E E 57.49 9.64 20.93 31.10 124.48 -165.83 -120.30 138.03 16.75 83.09 0.15 14.79 1.25 0.24 0.06 0.09 0.00 79.32 4.25 97 F E E 64.90 18.25 16.02 33.24 117.28 -153.07 -104.89 130.40 21.13 78.65 0.22 17.13 3.29 0.65 0.08 0.16 0.00 75.12 3.57 98 G C C 25.21 12.52 18.59 30.88 120.05 -147.25 -79.02 -167.52 62.37 37.40 0.23 43.38 15.70 2.63 0.03 0.23 0.00 37.14 0.90 99 G C C 45.00 6.39 21.99 28.36 102.39 -66.08 -74.51 6.14 75.65 24.17 0.18 56.10 15.82 2.10 0.02 0.19 0.00 25.22 0.56 100 G C C 20.00 17.02 15.40 31.39 127.55 -135.46 95.95 175.46 65.83 34.07 0.09 57.15 5.76 0.54 0.01 0.09 0.00 35.94 0.51 101 T E E 39.20 14.19 19.21 33.68 126.98 -106.12 -120.86 143.28 9.49 90.49 0.02 8.74 0.41 0.02 0.00 0.01 0.00 90.56 0.25 102 K E E 111.35 8.49 21.60 30.95 118.25 -137.79 -98.37 133.46 1.07 98.93 0.00 0.94 0.06 0.00 0.00 0.00 0.00 98.96 0.03 103 V E E 15.55 21.56 13.81 35.16 121.68 -167.33 -117.60 131.26 0.98 99.02 0.00 0.93 0.03 0.00 0.00 0.00 0.00 99.02 0.02 104 D E E 81.83 4.68 22.86 27.83 116.32 -150.51 -100.50 127.64 2.47 97.52 0.01 2.42 0.07 0.01 0.00 0.00 0.00 97.39 0.10 105 I E E 30.13 20.60 10.56 30.17 115.40 -160.01 -100.96 125.80 21.96 77.99 0.05 22.16 0.25 0.04 0.02 0.02 0.00 76.67 0.84 106 K C C 132.77 3.59 19.51 23.90 115.63 -160.75 -99.85 129.30 99.42 0.58 0.00 99.46 0.05 0.01 0.00 0.00 0.00 0.46 0.01