A0A3Q0KF90_SCHMA Loading...

PDZ domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KF90, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 197 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	50.2	Low	57.6	Low	245 Å²	245	155.5 Å²	155.5	100%	1.207	85%	0.852	S	S	*	*				0	120.2	0	-78.3	171.1	-169.3	0	0	107.1
2	N	41.2	Very low	58.2	Low	149 Å²	149	158.1 Å²	158.1	80%	0.797	85%	0.854	S	S	*	*			trans	-61.9	166.7	179.3	-62.8	-10.2	0	0	0	109.9
3	L	56.3	Low	57.9	Low	146 Å²	146	153.3 Å²	153.3	76%	0.764	84%	0.836	S	S	*	*				-157	120.4	86.5	-77.9	168.5	0	0	0	111	F5	L3-F5 HydrophobicContact CB-CD2 4.45Å; L3-F5 HydrophobicContact CB-CE2 4.2Å; L3-F5 HydrophobicContact CD1-CE2 4.22Å
4	Y	47.4	Very low	57.9	Low	231 Å²	231	147.8 Å²	147.8	91%	0.906	83%	0.832	S	S	*	*			trans	-81.8	133	161.4	-119.3	-103.6	0	0	0	107.9
5	F	70	Confident	57.6	Low	183 Å²	183	149.2 Å²	149.2	80%	0.803	83%	0.829	S	S	*	*			trans	-122.1	107.7	162.8	-83.8	-79.9	0	0	0	109.3	L3	L3-F5 HydrophobicContact CB-CD2 4.45Å; L3-F5 HydrophobicContact CB-CE2 4.2Å; L3-F5 HydrophobicContact CD1-CE2 4.22Å
6	S	53.1	Low	57.8	Low	110 Å²	110	147.3 Å²	147.3	77%	0.769	83%	0.829	S	S	*	*			trans	-74.9	126.6	161.9	41.4	0	0	0	0	108.9
7	S	69.6	Low	57.7	Low	124 Å²	124	145.2 Å²	145.2	87%	0.867	83%	0.826	S	S	*	*			trans	-117.1	128.4	163.3	-164.4	0	0	0	0	109.2
8	V	65.7	Low	57.7	Low	132 Å²	132	146.1 Å²	146.1	80%	0.8	83%	0.827	S	S	*	*			trans	-90.1	155	-168.6	-78.1	0	0	0	0	111.2
9	A	56.1	Low	57.5	Low	95 Å²	95	143.2 Å²	143.2	79%	0.785	82%	0.817	S	S	*	*			trans	-49.9	147.6	-178.3	0	0	0	0	0	115.7
10	S	61.2	Low	57.3	Low	127 Å²	127	145.4 Å²	145.4	89%	0.888	82%	0.817	S	S	*	*			trans	-148.3	108.4	140.3	-85.4	0	0	0	0	110.2
11	Q	63.2	Low	57.4	Low	169 Å²	169	146.9 Å²	146.9	79%	0.79	82%	0.819	S	S	*	*			trans	-68.6	134.3	167.9	-172.3	95.7	43.6	0	0	109.1
12	Q	65	Low	57.3	Low	186 Å²	186	141.8 Å²	141.8	87%	0.869	80%	0.797	S	S	*	*			trans	-128.9	122.6	150.1	-74.6	-161	-33.7	0	0	108.8
13	P	53.7	Low	58.3	Low	96 Å²	96	140.8 Å²	140.8	62%	0.623	80%	0.797	S	S	*	*			trans	-88.2	107.7	165	29.2	-19.5	0	0	0	108.6	H15	P13-H15 PolarHBondContact O-NE2 3.26Å
14	G	58.7	Low	58	Low	76 Å²	76	140.3 Å²	140.3	78%	0.784	80%	0.795	S	S	*	*			trans	-102.8	105.1	174.2	0	0	0	0	0	110.7
15	H	53.4	Low	58.5	Low	169 Å²	169	134.7 Å²	134.7	78%	0.782	79%	0.785	S	S	*	*			trans	-78.5	127.7	171.1	-4.5	-102.9	0	0	0	109.5	P13	P13-H15 PolarHBondContact O-NE2 3.26Å
16	S	59.9	Low	57.7	Low	119 Å²	119	135.3 Å²	135.3	83%	0.832	79%	0.787	S	S	*	*			trans	-159.1	118.6	158	39.7	0	0	0	0	111.4
17	S	56.1	Low	57.8	Low	111 Å²	111	138.7 Å²	138.7	78%	0.776	79%	0.79	S	S	*	*			trans	-45.6	157.3	166.9	-52.8	0	0	0	0	114.5
18	L	58.3	Low	56.6	Low	161 Å²	161	138 Å²	138	84%	0.843	78%	0.781	S	S	*	*			trans	156.3	103.5	138.7	-82.9	162.7	0	0	0	107.2
19	S	54.6	Low	56	Low	91 Å²	91	139.7 Å²	139.7	64%	0.636	79%	0.786	S	S	*	*				98.8	106.3	86.8	70.3	0	0	0	0	112.7
20	K	53.3	Low	55.5	Low	187 Å²	187	142.2 Å²	142.2	81%	0.813	78%	0.781	S	S	*	*			trans	52.6	120	134.2	-63.7	177.9	-178.8	174.8	0	120.1
21	M	58.6	Low	54.8	Low	177 Å²	177	143.8 Å²	143.8	87%	0.872	78%	0.776	S	S	*	*				58.9	109.7	124.7	-63.9	172.1	172.9	0	0	117.6
22	N	49.2	Very low	54.1	Low	139 Å²	139	142.8 Å²	142.8	74%	0.743	78%	0.777	S	S	*	*			trans	-135.6	108.7	144.5	-169.4	5.2	0	0	0	109.3
23	T	60.4	Low	53.4	Low	128 Å²	128	139.7 Å²	139.7	79%	0.785	77%	0.766	S	S	*	*			trans	-103.2	109.6	164.5	48.2	0	0	0	0	106.9
24	N	51.2	Low	53.4	Low	136 Å²	136	141 Å²	141	73%	0.727	77%	0.768	S	S	*	*			trans	-113.5	95.3	170.5	-135	-6.1	0	0	0	107.3
25	T	57.2	Low	53.1	Low	112 Å²	112	144.1 Å²	144.1	69%	0.687	77%	0.767	S	S	*	*				70.2	110.7	95	-46.9	0	0	0	0	112.4
26	K	54.1	Low	52.7	Low	197 Å²	197	143.6 Å²	143.6	86%	0.857	77%	0.77	S	S	*	*			trans	-60.1	131.5	169	-61.5	170.3	176.5	177	0	109.3
27	H	53.8	Low	52.1	Low	180 Å²	180	142.4 Å²	142.4	83%	0.833	76%	0.759	S	S	*	*			trans	-136.1	101.7	150.1	-121.8	-59.2	0	0	0	109.6	N29	H27-N29 PolarHBondContact O-N 2.94Å
28	T	44.9	Very low	51.3	Low	111 Å²	111	142.2 Å²	142.2	68%	0.681	75%	0.753	S	S	*	*			trans	-50	126.1	154.9	-63.1	0	0	0	0	108.8
29	N	53.2	Low	50.7	Low	167 Å²	167	142.3 Å²	142.3	89%	0.893	75%	0.749	S	S	*	*			trans	-131.1	121.5	155.1	-125.5	1.7	0	0	0	108.4	H27	H27-N29 PolarHBondContact O-N 2.94Å
30	Q	45.3	Very low	49.8	Very low	148 Å²	148	144 Å²	144	69%	0.692	76%	0.76	S	S	*	*			trans	-107.1	152.4	-173.2	-150.1	176.1	52	0	0	107.1
31	M	47.6	Very low	49.5	Very low	159 Å²	159	140.1 Å²	140.1	78%	0.783	76%	0.756	S	S	*	*			trans	82.8	105.8	162.7	-52.8	-178.5	179.9	0	0	118.2
32	N	46.8	Very low	48.8	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	76%	0.755	S	S	*	*				-167	89	123.2	-154.1	11.3	0	0	0	107.7
33	N	51.6	Low	48.5	Very low	121 Å²	121	142.5 Å²	142.5	65%	0.647	76%	0.758	S	S	*	*				57.6	102	97.5	-78.5	-1.9	0	0	0	114.5
34	N	52.9	Low	47.2	Very low	123 Å²	123	145 Å²	145	66%	0.658	76%	0.76	S	S	*	*				148.6	116.9	101.1	-80.3	-20.1	0	0	0	113.3
35	N	52.7	Low	46.9	Very low	142 Å²	142	144.9 Å²	144.9	76%	0.759	76%	0.764	S	S	*	*			trans	62.6	110.7	134.7	-49.1	-27.5	0	0	0	118.8
36	N	45.8	Very low	46.6	Very low	158 Å²	158	144.6 Å²	144.6	85%	0.845	76%	0.762	S	S	*	*				-172	143.5	90.4	-145.5	11	0	0	0	110.7
37	P	46.3	Very low	46	Very low	93 Å²	93	143.4 Å²	143.4	60%	0.604	76%	0.764	S	S	*	*			trans	-100.9	160.5	-168.5	40.2	-30.6	0	0	0	113.9
38	T	39.2	Very low	45.5	Very low	107 Å²	107	139.5 Å²	139.5	66%	0.656	76%	0.757	S	S	*	*			trans	53.4	140.4	139.2	58.1	0	0	0	0	122.1
39	H	47	Very low	45.7	Very low	163 Å²	163	142.4 Å²	142.4	76%	0.755	77%	0.768	S	S	*	*			trans	126	94.5	145.5	-62.1	-70	0	0	0	114.9	C41	H39-C41 PolarHBondContact O-N 3.05Å
40	S	35.7	Very low	45.6	Very low	126 Å²	126	138.7 Å²	138.7	88%	0.881	76%	0.761	S	S	*	*			trans	-39.7	116.8	145.6	178	0	0	0	0	111.3
41	C	46.1	Very low	45.9	Very low	107 Å²	107	139.9 Å²	139.9	72%	0.723	77%	0.771	S	S	*	*			trans	-148.8	120.9	152.8	61.4	0	0	0	0	109.6	H39 Q43	H39-C41 PolarHBondContact O-N 3.05Å; C41-Q43 PolarHBondContact O-N 2.78Å
42	K	43	Very low	45.7	Very low	193 Å²	193	138.8 Å²	138.8	84%	0.839	77%	0.769	S	S	*	*			trans	-67.4	117.3	154.9	-64.3	169.9	178.7	176.1	0	105.6
43	Q	43.8	Very low	45.4	Very low	173 Å²	173	138.1 Å²	138.1	81%	0.808	76%	0.764	S	S	*	*			trans	175.8	126.3	148.4	-96.9	154.5	82.6	0	0	111	C41 V45	C41-Q43 PolarHBondContact O-N 2.78Å; Q43-V45 WeakPolarHBondContact O-CG2 3.47Å
44	H	32.4	Very low	45	Very low	181 Å²	181	140.8 Å²	140.8	84%	0.838	77%	0.77	S	S	*	*			trans	-1	114.4	153.1	-168.9	-104.6	0	0	0	116.4
45	V	45.9	Very low	44.4	Very low	132 Å²	132	141.8 Å²	141.8	80%	0.8	78%	0.781	S	S	*	*			trans	-124.9	112.3	173	-174.1	0	0	0	0	110.3	Q43	Q43-V45 WeakPolarHBondContact O-CG2 3.47Å
46	T	50.4	Low	43.8	Very low	107 Å²	107	137.9 Å²	137.9	66%	0.656	78%	0.775	S	S	*	*			trans	-53.6	135.8	169.4	-47.5	0	0	0	0	111.4	S48	T46-S48 PolarHBondContact O-N 3.07Å
47	L	41.7	Very low	44	Very low	171 Å²	171	138.5 Å²	138.5	90%	0.895	78%	0.778	S	S	*	*			trans	-79.2	102.8	171.3	-66.6	175	0	0	0	109.9
48	S	44.1	Very low	44.2	Very low	99 Å²	99	141.3 Å²	141.3	69%	0.692	79%	0.788	S	S	*	*			trans	-150.1	119.3	152.3	-71.3	0	0	0	0	107.7	T46	T46-S48 PolarHBondContact O-N 3.07Å
49	N	48.2	Very low	44.5	Very low	171 Å²	171	143.4 Å²	143.4	91%	0.914	79%	0.794	S	S	*	*			trans	-156.2	113.4	145.6	-92.6	-20.7	0	0	0	108
50	A	50.2	Low	44.4	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	80%	0.796	S	S	*	*			trans	-69.3	150.9	-179.3	0	0	0	0	0	111.8
51	L	52	Low	44.7	Very low	174 Å²	174	141.7 Å²	141.7	91%	0.911	79%	0.794	S	S	*	*			trans	-134.2	99.9	157	-97.9	141.8	0	0	0	106.5
52	D	43.1	Very low	44.5	Very low	136 Å²	136	140.2 Å²	140.2	73%	0.727	80%	0.798	S	S	*	*			trans	-67.3	142	158.4	-68.5	-56.8	0	0	0	108.9
53	L	40.5	Very low	44.2	Very low	134 Å²	134	136.6 Å²	136.6	70%	0.702	80%	0.796	S	S	*	*				173.4	140.1	115.3	-120	60	0	0	0	112.3
54	F	45	Very low	44.5	Very low	177 Å²	177	135.3 Å²	135.3	78%	0.776	80%	0.8	S	S	*	*			trans	90.5	82.5	161.3	-55.3	-64.8	0	0	0	119.9
55	T	39.6	Very low	44.7	Very low	145 Å²	145	130.8 Å²	130.8	89%	0.89	80%	0.803	S	S	*	*				13.1	120	116.5	-46.9	0	0	0	0	117.4
56	G	39.2	Very low	44.4	Very low	60 Å²	60	127.8 Å²	127.8	62%	0.619	80%	0.798	S	S	*	*			trans	172.6	87.1	157.9	0	0	0	0	0	110.8
57	N	51.2	Low	43.7	Very low	170 Å²	170	131.5 Å²	131.5	91%	0.909	81%	0.812	S	S	*	*			trans	-162.3	127.6	142	-90.8	-24.2	0	0	0	110.9
58	N	50.5	Low	43.8	Very low	153 Å²	153	126.5 Å²	126.5	82%	0.818	80%	0.802	S	S	*	*			trans	-71.8	134	-166	-139.4	-30.7	0	0	0	111.1
59	I	44.4	Very low	43.9	Very low	151 Å²	151	127.6 Å²	127.6	77%	0.774	81%	0.81	S	S	*	*			trans	-85.8	118.5	170.1	-59.6	167.8	0	0	0	106.7
60	T	45.5	Very low	44.1	Very low	130 Å²	130	126.3 Å²	126.3	80%	0.798	80%	0.803	S	S	*	*			trans	-124.6	109.3	155.5	53.6	0	0	0	0	108.5
61	S	41.4	Very low	44.1	Very low	122 Å²	122	133.1 Å²	133.1	85%	0.853	81%	0.809	S	S	*	*			trans	-59.9	133.6	174.6	37.2	0	0	0	0	111.8
62	G	43.1	Very low	44	Very low	77 Å²	77	131.4 Å²	131.4	79%	0.794	80%	0.801	S	S	*	*			trans	-170.2	91.6	174.8	0	0	0	0	0	110
63	S	36.3	Very low	44.5	Very low	116 Å²	116	130 Å²	130	81%	0.811	80%	0.802	S	S	*	*			trans	-59.6	135	172	-57.2	0	0	0	0	111.3
64	V	49.9	Very low	45.2	Very low	147 Å²	147	131.3 Å²	131.3	89%	0.891	80%	0.802	S	S	*	*				179.8	125	127.7	-90.1	0	0	0	0	111.4
65	G	36.8	Very low	45.6	Very low	86 Å²	86	127.8 Å²	127.8	89%	0.887	80%	0.8	S	S	*	*			trans	57.4	133.9	132	0	0	0	0	0	123.2
66	G	38.4	Very low	46.2	Very low	68 Å²	68	127.3 Å²	127.3	70%	0.701	79%	0.79	S	S	*	*			trans	109.1	96.6	148.1	0	0	0	0	0	114.8
67	I	37.2	Very low	46.9	Very low	185 Å²	185	128.4 Å²	128.4	95%	0.949	79%	0.793	S	S	*	*				59.1	116.5	88	-55.9	167.5	0	0	0	112.8
68	G	42.8	Very low	46.6	Very low	67 Å²	67	122.9 Å²	122.9	69%	0.691	78%	0.777	S	S	*	*			trans	157.7	84.7	165.1	0	0	0	0	0	114.4
69	S	46.3	Very low	46.5	Very low	122 Å²	122	123.2 Å²	123.2	85%	0.853	78%	0.779	S	S	*	*			trans	-58.8	154.4	175.2	-55.5	0	0	0	0	113.4
70	N	52	Low	46.9	Very low	144 Å²	144	122.8 Å²	122.8	77%	0.77	78%	0.778	S	S	*	*			trans	76.9	73.2	156.5	-139.4	3.2	0	0	0	116.3
71	R	52	Low	46.9	Very low	232 Å²	232	124 Å²	124	88%	0.875	77%	0.774	S	S	*	*			trans	-106.2	106.7	158.1	-74	-173.6	-77.8	179.2	-4	108.2	S73	R71-S73 PolarHBondContact O-N 3.05Å
72	N	48.9	Very low	47	Very low	138 Å²	138	125.4 Å²	125.4	74%	0.738	77%	0.771	S	S	*	*			trans	-52.7	90.5	158.4	-69.1	-24.7	0	0	0	107.6	F74	N72-F74 VanDerWaalsContact C-N 3.33Å; N72-F74 WeakPolarHBondContact O-CD1 3.42Å; N72-F74 PolarHBondContact O-N 2.97Å
73	S	52.5	Low	47.3	Very low	106 Å²	106	130 Å²	130	74%	0.741	77%	0.769	S	S	*	*			trans	-79.5	89.3	178	-169.4	0	0	0	0	107.2	R71 S75	R71-S73 PolarHBondContact O-N 3.05Å; S73-S75 VanDerWaalsContact C-N 3.27Å; S73-S75 PolarHBondContact O-N 2.97Å
74	F	55.4	Low	47.7	Very low	162 Å²	162	132.9 Å²	132.9	71%	0.711	77%	0.767	S	S	*	*			trans	-69.4	97	158.2	53.3	-86.6	0	0	0	106.1	N72 I76	N72-F74 VanDerWaalsContact C-N 3.33Å; N72-F74 WeakPolarHBondContact O-CD1 3.42Å; N72-F74 PolarHBondContact O-N 2.97Å; F74-I76 VanDerWaalsContact C-N 3.26Å; F74-I76 HydrophobicContact CD2-CD1 3.71Å; F74-I76 HydrophobicContact CD2-CG1 3.95Å; F74-I76 HydrophobicContact CE2-CD1 3.91Å; F74-I76 PolarHBondContact O-N 3.27Å
75	S	54	Low	47.6	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	76%	0.764	S	S	*	*			trans	-67.6	93.5	163.4	49.9	0	0	0	0	107.3	S73 A77	S73-S75 VanDerWaalsContact C-N 3.27Å; S73-S75 PolarHBondContact O-N 2.97Å; S75-A77 PolarHBondContact O-N 3.36Å
76	I	53.3	Low	48.3	Very low	135 Å²	135	134.8 Å²	134.8	69%	0.692	75%	0.747	S	S	*	*			trans	-71.6	86.4	156.2	-67.1	162.3	0	0	0	104.3	F74 G78	F74-I76 VanDerWaalsContact C-N 3.26Å; F74-I76 HydrophobicContact CD2-CD1 3.71Å; F74-I76 HydrophobicContact CD2-CG1 3.95Å; F74-I76 HydrophobicContact CE2-CD1 3.91Å; F74-I76 PolarHBondContact O-N 3.27Å; I76-G78 PolarHBondContact O-N 2.76Å
77	A	54.1	Low	49	Very low	82 Å²	82	140.7 Å²	140.7	68%	0.678	76%	0.757	S	S	*	*			trans	-54.7	116.5	167.6	0	0	0	0	0	106.6	S75 N79	S75-A77 PolarHBondContact O-N 3.36Å; A77-N79 PolarHBondContact O-N 2.78Å
78	G	44.3	Very low	50.6	Low	55 Å²	55	133.3 Å²	133.3	57%	0.567	72%	0.721	S	S	*	*			trans	-53	126.4	-172.1	0	0	0	0	0	111.1	I76 N80	I76-G78 PolarHBondContact O-N 2.76Å; G78-N80 PolarHBondContact O-N 3.09Å
79	N	48	Very low	52.5	Low	160 Å²	160	135 Å²	135	86%	0.856	72%	0.718	S	S	*	*			trans	-67.3	76.2	162.4	-65.6	-26.9	0	0	0	107.8	A77 H81	A77-N79 PolarHBondContact O-N 2.78Å; N79-H81 VanDerWaalsContact C-N 3.29Å; N79-H81 PolarHBondContact O-N 2.71Å
80	N	53.7	Low	54.5	Low	141 Å²	141	133.2 Å²	133.2	75%	0.754	70%	0.703	S	S	*	*			trans	-68.4	98.8	162.8	-77.3	-38.5	0	0	0	106.5	G78 L82	G78-N80 PolarHBondContact O-N 3.09Å; N80-L82 HydrophobicContact CB-CD1 4.49Å; N80-L82 PolarHBondContact O-N 3.3Å
81	H	44.1	Very low	56.5	Low	156 Å²	156	128.3 Å²	128.3	72%	0.722	68%	0.678	S	S	*	*			trans	-61.3	72.5	165.8	-176.6	63.3	0	0	0	109.2	N79 K83	N79-H81 VanDerWaalsContact C-N 3.29Å; N79-H81 PolarHBondContact O-N 2.71Å; H81-K83 PolarHBondContact O-N 3.5Å
82	L	44.2	Very low	58.5	Low	151 Å²	151	122.5 Å²	122.5	79%	0.791	66%	0.664	S	S	*	*			trans	-71.8	113.5	154.1	-103.2	77.8	0	0	0	105.5	N80 K84	N80-L82 HydrophobicContact CB-CD1 4.49Å; N80-L82 PolarHBondContact O-N 3.3Å; L82-K84 PolarHBondContact O-N 3.2Å
83	K	48.8	Very low	60.6	Low	174 Å²	174	116.3 Å²	116.3	76%	0.757	63%	0.631	S	S	*	*			trans	-57.6	83.1	166.3	-64.6	-178.7	-179.9	-176.6	0	108.2	H81 L85	H81-K83 PolarHBondContact O-N 3.5Å; K83-L85 PolarHBondContact O-N 3.41Å; K83-L85 VanDerWaalsContact O-N 3.09Å
84	K	44.6	Very low	62.7	Low	176 Å²	176	114.8 Å²	114.8	77%	0.765	62%	0.617	S	S	*	*			trans	-57.8	113.7	158.5	-169.5	174.1	-178.6	-169.6	0	103.7	L82 E86	L82-K84 PolarHBondContact O-N 3.2Å; K84-E86 PolarHBondContact O-N 3.12Å
85	L	48.4	Very low	64.5	Low	158 Å²	158	107.1 Å²	107.1	83%	0.827	58%	0.584	S	S	*	*			trans	-57.3	92.1	155.4	-89.8	117.2	0	0	0	104.1	K83 E87	K83-L85 PolarHBondContact O-N 3.41Å; K83-L85 VanDerWaalsContact O-N 3.09Å; L85-E87 VanDerWaalsContact C-N 3.29Å; L85-E87 PolarHBondContact O-N 3.09Å
86	E	50.3	Low	66.4	Low	115 Å²	115	111 Å²	111	54%	0.537	58%	0.583	S	S	.	*			trans	-57.7	107.7	164.5	-67.8	-172	171.3	0	0	104.1	K84 T88 R173	K84-E86 PolarHBondContact O-N 3.12Å; E86-T88 HydrophobicContact CB-CG2 4.27Å; E86-T88 PolarHBondContact O-N 3.3Å; E86-R173 WeakPolarHBondContact OE2-CD 3.33Å
87	E	54.3	Low	68.3	Low	192 Å²	192	105.7 Å²	105.7	90%	0.897	55%	0.554	S	S	*	*			trans	-69.3	69.9	173.5	-167.6	165.9	-174.1	0	0	107.1	L85 T89	L85-E87 VanDerWaalsContact C-N 3.29Å; L85-E87 PolarHBondContact O-N 3.09Å; E87-T89 PolarHBondContact O-N 3.04Å
88	T	70.5	Confident	70	Confident	31 Å²	31	106.7 Å²	106.7	19%	0.19	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-64.4	123.4	169.7	51.8	0	0	0	0	106.3	E86 P90 A171 R173	E86-T88 HydrophobicContact CB-CG2 4.27Å; E86-T88 PolarHBondContact O-N 3.3Å; T88-P90 VanDerWaalsContact O-CD 3.28Å; T88-P90 WeakPolarHBondContact O-CD 3.38Å; T88-A171 HydrophobicContact CG2-CB 4.17Å; T88-A171 WeakPolarHBondContact OG1-CB 3.44Å; T88-R173 HydrophobicContact CG2-CG 3.81Å
89	T	82.7	Confident	72.2	Confident	103 Å²	103	106.5 Å²	106.5	63%	0.632	55%	0.552	S	S	*	*	P	Polyproline II helix	trans	-63.7	118.7	176.8	46.5	0	0	0	0	108.7	E87 V91	E87-T89 PolarHBondContact O-N 3.04Å; T89-V91 PolarHBondContact O-N 3.2Å
90	P	88.9	Confident	74.1	Confident	83 Å²	83	103.3 Å²	103.3	54%	0.539	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	122.9	178.3	27.2	-32.6	0	0	0	109.1	T88 L140 T169 V170	T88-P90 VanDerWaalsContact O-CD 3.28Å; T88-P90 WeakPolarHBondContact O-CD 3.38Å; P90-L140 HydrophobicContact CB-CD1 3.99Å; P90-T169 HydrophobicContact CB-CG2 3.73Å; P90-V170 CarbonylContact C-O 3.4Å
91	V	92.7	Very high	75.8	Confident	41 Å²	41	103.9 Å²	103.9	25%	0.248	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.4	177.5	-175.3	0	0	0	0	108.5	T89 I93 T169 V170 R172	T89-V91 PolarHBondContact O-N 3.2Å; V91-I93 HydrophobicContact CG1-CD1 4.42Å; V91-I93 HydrophobicContact CG1-CG1 4.06Å; V91-T169 CarbonylContact O-C 3.52Å; V91-T169 WeakPolarHBondContact O-CA 3.4Å; V91-V170 HydrophobicContact CB-CG2 4.09Å; V91-V170 PolarHBondContact N-O 2.95Å; V91-V170 PolarHBondContact O-N 2.85Å; V91-R172 HydrophobicContact CG2-CG 4.27Å
92	N	94.3	Very high	78	Confident	110 Å²	110	98.5 Å²	98.5	59%	0.588	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.8	173.9	-68.1	-39.9	0	0	0	110	T169	N92-T169 WeakPolarHBondContact OD1-CG2 3.1Å; N92-T169 PolarHBondContact OD1-OG1 3.09Å
93	I	94.5	Very high	80.2	Confident	8 Å²	8	95.2 Å²	95.2	4%	0.041	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.3	-175.7	-68.4	176.5	0	0	0	108.3	V91 L95 I132 L133 Q167 L168 V170	V91-I93 HydrophobicContact CG1-CD1 4.42Å; V91-I93 HydrophobicContact CG1-CG1 4.06Å; I93-L95 HydrophobicContact CG2-CD2 3.7Å; I93-L95 HydrophobicContact CG2-CG 4.07Å; I93-I132 HydrophobicContact CB-CG2 4.38Å; I93-I132 HydrophobicContact CD1-CG2 4.33Å; I93-I132 HydrophobicContact CG1-CG2 4.25Å; I93-I132 HydrophobicContact CG2-CG2 3.39Å; I93-L133 HydrophobicContact CD1-CD2 3.52Å; I93-L133 HydrophobicContact CG2-CD2 4.3Å; I93-Q167 CarbonylContact O-C 3.47Å; I93-Q167 WeakPolarHBondContact O-CA 3.2Å; I93-L168 PolarHBondContact N-O 3.07Å; I93-L168 PolarHBondContact O-N 2.96Å; I93-V170 HydrophobicContact CD1-CG1 4.4Å; I93-V170 HydrophobicContact CD1-CG2 3.47Å; I93-V170 VanDerWaalsContact CD1-CG2 3.47Å; I93-V170 HydrophobicContact CG1-CG2 4.36Å
94	V	94.8	Very high	82.3	Confident	75 Å²	75	87.6 Å²	87.6	46%	0.455	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	116.8	172.6	-178.5	0	0	0	0	107.9	L166 Q167	V94-L166 WeakPolarHBondContact CA-O 3.36Å; V94-Q167 HydrophobicContact CG2-CG 4.3Å
95	L	94.4	Very high	84.7	Confident	0 Å²	0	79.4 Å²	79.4	0%	0	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	141	174.2	-55.7	-175.1	0	0	0	109.3	I93 W104 F106 P128 I132 L133 D165 L166 L168	I93-L95 HydrophobicContact CG2-CD2 3.7Å; I93-L95 HydrophobicContact CG2-CG 4.07Å; L95-W104 HydrophobicContact CB-CE3 3.74Å; L95-W104 HydrophobicContact CB-CZ3 3.6Å; L95-W104 HydrophobicContact CD1-CE3 4.3Å; L95-W104 WeakPolarHBondContact O-CZ3 3.38Å; L95-F106 HydrophobicContact CD1-CD1 4.19Å; L95-F106 HydrophobicContact CD1-CE1 3.74Å; L95-P128 WeakPolarHBondContact CD2-O 3.39Å; L95-I132 HydrophobicContact CD2-CB 3.96Å; L95-I132 HydrophobicContact CD2-CD1 3.83Å; L95-I132 HydrophobicContact CD2-CG1 4.45Å; L95-I132 HydrophobicContact CD2-CG2 3.89Å; L95-L133 HydrophobicContact CD1-CD1 3.85Å; L95-L133 HydrophobicContact CD1-CG 4.47Å; L95-D165 WeakPolarHBondContact O-CA 3.09Å; L95-L166 HydrophobicContact CB-CB 4.46Å; L95-L166 HydrophobicContact CD1-CD2 4.38Å; L95-L166 PolarHBondContact N-O 2.73Å; L95-L166 PolarHBondContact O-N 2.89Å; L95-L168 HydrophobicContact CD1-CD1 4.49Å
96	R	94	Very high	86.9	Confident	185 Å²	185	72.8 Å²	72.8	70%	0.698	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.6	125.2	177.7	-66.8	-168.5	167.6	155	4.4	111.1	P128 T164 D165	R96-P128 WeakPolarHBondContact O-CB 3.49Å; R96-T164 CarbonylContact C-O 3.6Å; R96-T164 WeakPolarHBondContact CA-O 3.46Å; R96-D165 WeakPolarHBondContact CG-OD1 3.37Å; R96-D165 IonicContact CZ-OD1 3.88Å; R96-D165 IonicContact NE-OD1 2.92Å; R96-D165 PolarHBondContact NE-OD1 3.31Å
97	R	92.3	Very high	89	Confident	23 Å²	23	74.8 Å²	74.8	9%	0.087	41%	0.405	C	S	.	.			trans	-114.8	154.9	174.8	62.3	-180	172.6	159.7	3.9	111.2	S99 N100 S102 W104 P128 R160 A162 G163 T164	R97-S99 WeakPolarHBondContact CD-O 3.21Å; R97-S99 WeakPolarHBondContact CG-O 3.31Å; R97-N100 PolarHBondContact NH1-O 3.28Å; R97-N100 PolarHBondContact NH2-O 3.35Å; R97-N100 PolarHBondContact NH2-OD1 3.06Å; R97-S102 WeakPolarHBondContact CD-O 3.17Å; R97-S102 PolarHBondContact NH1-O 3.23Å; R97-W104 HydrophobicContact CB-CE3 4.33Å; R97-W104 HydrophobicContact CB-CH2 4.42Å; R97-W104 HydrophobicContact CB-CZ3 4.01Å; R97-W104 HydrophobicContact CG-CE3 4.27Å; R97-W104 HydrophobicContact CG-CH2 3.69Å; R97-W104 HydrophobicContact CG-CZ2 4.09Å; R97-W104 HydrophobicContact CG-CZ3 3.78Å; R97-W104 VanDerWaalsContact NE-CZ2 3.27Å; R97-P128 HydrophobicContact CB-CG 4.18Å; R97-R160 PolarHBondContact NH2-O 2.81Å; R97-A162 PolarHBondContact NH2-O 2.75Å; R97-G163 PolarHBondContact NE-O 2.73Å; R97-G163 PolarHBondContact NH2-O 2.93Å; R97-T164 PolarHBondContact N-O 3.26Å
98	A	89.3	Confident	90.9	Very high	104 Å²	104	67 Å²	67	86%	0.86	37%	0.37	S	S	*	.	S	Bend	trans	-69.5	-33	-177.4	0	0	0	0	0	113.7
99	S	90.6	Very high	92	Very high	50 Å²	50	70.6 Å²	70.6	35%	0.35	39%	0.385	S	S	.	.	S	Bend	trans	-147	158	-178.4	65.5	0	0	0	0	111.7	R97 D101 S102	R97-S99 WeakPolarHBondContact CD-O 3.21Å; R97-S99 WeakPolarHBondContact CG-O 3.31Å; S99-D101 PolarHBondContact O-N 2.84Å; S99-S102 PolarHBondContact O-N 3.26Å; S99-S102 PolarHBondContact OG-N 2.71Å
100	N	89	Confident	92.6	Very high	93 Å²	93	66 Å²	66	50%	0.497	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-22.8	178.2	-166	9.4	0	0	0	112.7	R97	R97-N100 PolarHBondContact NH1-O 3.28Å; R97-N100 PolarHBondContact NH2-O 3.35Å; R97-N100 PolarHBondContact NH2-OD1 3.06Å
101	D	88.2	Confident	92.9	Very high	154 Å²	154	62.1 Å²	62.1	82%	0.824	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.8	-16.5	177.8	-52.5	-69.6	0	0	0	113	S99	S99-D101 PolarHBondContact O-N 2.84Å
102	S	90.4	Very high	92.9	Very high	43 Å²	43	62.2 Å²	62.2	30%	0.301	34%	0.336	S	S	.	.	S	Bend	trans	-78.2	129.2	-179	-173.6	0	0	0	0	110.9	R97 S99	R97-S102 WeakPolarHBondContact CD-O 3.17Å; R97-S102 PolarHBondContact NH1-O 3.23Å; S99-S102 PolarHBondContact O-N 3.26Å; S99-S102 PolarHBondContact OG-N 2.71Å
103	P	91.2	Very high	92.9	Very high	82 Å²	82	60.4 Å²	60.4	53%	0.532	33%	0.326	S	S	.	.			trans	-66.6	145.1	179.9	28.4	-34.7	0	0	0	111.4	G105	P103-G105 PolarHBondContact O-N 3.29Å
104	W	93.9	Very high	92.9	Very high	13 Å²	13	66.7 Å²	66.7	5%	0.049	35%	0.351	C	S	.	.			trans	-61.8	-24.7	171.3	-66	110.5	0	0	0	113.6	L95 R97 F106 S127 P128 S129 I159 A162 T164 L166	L95-W104 HydrophobicContact CB-CE3 3.74Å; L95-W104 HydrophobicContact CB-CZ3 3.6Å; L95-W104 HydrophobicContact CD1-CE3 4.3Å; L95-W104 WeakPolarHBondContact O-CZ3 3.38Å; R97-W104 HydrophobicContact CB-CE3 4.33Å; R97-W104 HydrophobicContact CB-CH2 4.42Å; R97-W104 HydrophobicContact CB-CZ3 4.01Å; R97-W104 HydrophobicContact CG-CE3 4.27Å; R97-W104 HydrophobicContact CG-CH2 3.69Å; R97-W104 HydrophobicContact CG-CZ2 4.09Å; R97-W104 HydrophobicContact CG-CZ3 3.78Å; R97-W104 VanDerWaalsContact NE-CZ2 3.27Å; W104-F106 HydrophobicContact CB-CD1 3.71Å; W104-F106 HydrophobicContact CB-CE1 3.41Å; W104-F106 VanDerWaalsContact CB-CE1 3.41Å; W104-F106 HydrophobicContact CB-CZ 4.35Å; W104-F106 HydrophobicContact CG-CE1 4.07Å; W104-S127 PolarHBondContact O-OG 3.39Å; W104-P128 HydrophobicContact CE3-CG 4.03Å; W104-S129 WeakPolarHBondContact O-CB 3.4Å; W104-S129 PolarHBondContact O-N 3.27Å; W104-S129 PolarHBondContact O-OG 2.93Å; W104-I159 VanDerWaalsContact CD1-CG2 3.48Å; W104-I159 HydrophobicContact CG-CG2 4.33Å; W104-I159 PolarHBondContact NE1-O 3.48Å; W104-A162 HydrophobicContact CZ2-CB 4.08Å; W104-A162 VanDerWaalsContact CZ2-O 3.28Å; W104-A162 WeakPolarHBondContact CZ2-O 3.17Å; W104-T164 WeakPolarHBondContact CH2-O 3.35Å; W104-L166 HydrophobicContact CD2-CB 4.19Å; W104-L166 HydrophobicContact CD2-CD2 3.77Å; W104-L166 HydrophobicContact CE3-CB 4.18Å; W104-L166 HydrophobicContact CE3-CD2 4.25Å; W104-L166 HydrophobicContact CG-CD2 4.02Å; W104-L166 HydrophobicContact CH2-CB 3.32Å; W104-L166 HydrophobicContact CZ2-CB 3.31Å; W104-L166 HydrophobicContact CZ2-CD2 4.23Å; W104-L166 HydrophobicContact CZ2-CG 4.34Å; W104-L166 HydrophobicContact CZ3-CB 3.79Å
105	G	93.9	Very high	92.8	Very high	4 Å²	4	71.5 Å²	71.5	4%	0.041	37%	0.368	C	S	.	.			trans	80.1	30.3	173.7	0	0	0	0	0	115.1	P103 T123 Q124 S127 S129	P103-G105 PolarHBondContact O-N 3.29Å; G105-T123 CarbonylContact O-C 3.59Å; G105-Q124 WeakPolarHBondContact O-CA 3.36Å; G105-Q124 WeakPolarHBondContact O-CB 3.41Å; G105-Q124 PolarHBondContact O-N 2.82Å; G105-S127 PolarHBondContact O-OG 2.79Å; G105-S129 VanDerWaalsContact C-OG 3.3Å; G105-S129 PolarHBondContact O-OG 3.4Å
106	F	94.9	Very high	92.7	Very high	20 Å²	20	77 Å²	77	9%	0.088	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	165.9	168.7	62.1	-90.1	0	0	0	111.6	L95 W104 V108 I120 K122 T123 L133 I159 L166 L168	L95-F106 HydrophobicContact CD1-CD1 4.19Å; L95-F106 HydrophobicContact CD1-CE1 3.74Å; W104-F106 HydrophobicContact CB-CD1 3.71Å; W104-F106 HydrophobicContact CB-CE1 3.41Å; W104-F106 VanDerWaalsContact CB-CE1 3.41Å; W104-F106 HydrophobicContact CB-CZ 4.35Å; W104-F106 HydrophobicContact CG-CE1 4.07Å; F106-V108 HydrophobicContact CD2-CG2 3.64Å; F106-V108 HydrophobicContact CE2-CG2 3.43Å; F106-V108 VanDerWaalsContact CE2-CG2 3.43Å; F106-I120 HydrophobicContact CB-CG2 4.44Å; F106-I120 HydrophobicContact CD2-CD1 3.52Å; F106-I120 HydrophobicContact CE2-CD1 3.77Å; F106-I120 HydrophobicContact CG-CD1 4.36Å; F106-K122 CarbonylContact C-O 3.5Å; F106-K122 VanDerWaalsContact CA-O 3.26Å; F106-K122 WeakPolarHBondContact CA-O 3.29Å; F106-T123 HydrophobicContact CB-CG2 4.16Å; F106-L133 HydrophobicContact CB-CD1 4.4Å; F106-L133 HydrophobicContact CD1-CD1 3.71Å; F106-L133 HydrophobicContact CD2-CD1 4.31Å; F106-L133 HydrophobicContact CE1-CD1 3.93Å; F106-L133 HydrophobicContact CG-CD1 3.9Å; F106-L133 HydrophobicContact CZ-CD1 4.34Å; F106-I159 HydrophobicContact CE2-CD1 4.16Å; F106-I159 HydrophobicContact CZ-CD1 4.24Å; F106-I159 HydrophobicContact CZ-CG2 3.88Å; F106-L166 HydrophobicContact CE1-CD2 4.07Å; F106-L166 HydrophobicContact CZ-CD2 3.98Å; F106-L168 HydrophobicContact CZ-CD1 4.04Å
107	R	94.5	Very high	92.6	Very high	157 Å²	157	70.5 Å²	70.5	59%	0.592	37%	0.374	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.2	140.5	174.7	-65.7	-69.4	-172.8	-82.9	-1.9	108.8	I120 C121 K122	R107-I120 WeakPolarHBondContact O-CA 3.28Å; R107-C121 HydrophobicContact CB-CB 4.14Å; R107-C121 PolarHBondContact O-N 3.16Å; R107-K122 PolarHBondContact N-O 3.23Å
108	V	93.8	Very high	92.6	Very high	27 Å²	27	69.5 Å²	69.5	16%	0.164	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	146.3	177.5	-169.7	0	0	0	0	108.6	F106 L118 T119 I120 I139 H152 I159	F106-V108 HydrophobicContact CD2-CG2 3.64Å; F106-V108 HydrophobicContact CE2-CG2 3.43Å; F106-V108 VanDerWaalsContact CE2-CG2 3.43Å; V108-L118 HydrophobicContact CG1-CB 4.21Å; V108-L118 HydrophobicContact CG1-CD2 3.53Å; V108-L118 HydrophobicContact CG1-CG 4.48Å; V108-T119 CarbonylContact C-O 3.56Å; V108-T119 WeakPolarHBondContact CA-O 3.49Å; V108-I120 HydrophobicContact CG2-CD1 4.13Å; V108-I139 HydrophobicContact CG1-CD1 3.93Å; V108-I139 HydrophobicContact CG2-CD1 4.08Å; V108-H152 PolarHBondContact O-CE1 3.16Å; V108-I159 HydrophobicContact CG2-CD1 4.26Å
109	Q	94.2	Very high	92.9	Very high	107 Å²	107	65.1 Å²	65.1	50%	0.5	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	164.2	168.8	63.4	-172.3	-5.8	0	0	110.4	L118 T119 C121	Q109-L118 CarbonylContact O-C 3.32Å; Q109-L118 WeakPolarHBondContact O-CA 3.43Å; Q109-T119 PolarHBondContact N-O 2.91Å; Q109-T119 PolarHBondContact O-N 2.99Å; Q109-C121 WeakPolarHBondContact CB-SG 3.48Å; Q109-C121 WeakPolarHBondContact CG-SG 2.9Å; Q109-C121 PolarHBondContact OE1-SG 3.23Å; Q109-C121 VanDerWaalsContact OE1-SG 3.4Å
110	G	94.8	Very high	93	Very high	8 Å²	8	62.8 Å²	62.8	8%	0.082	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	80.2	-166.6	-177.6	0	0	0	0	0	112.1	L118 H152	G110-L118 WeakPolarHBondContact O-CD2 3.45Å; G110-H152 WeakPolarHBondContact O-CB 3.31Å; G110-H152 PolarHBondContact O-ND1 2.83Å
111	G	94.3	Very high	93.2	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	139.6	157.7	-166.6	0	0	0	0	0	110.2	D113 Y114 H115 L116	G111-D113 VanDerWaalsContact CA-OD1 3.28Å; G111-D113 WeakPolarHBondContact CA-OD1 3.44Å; G111-D113 PolarHBondContact O-N 2.77Å; G111-Y114 PolarHBondContact O-N 2.71Å; G111-H115 PolarHBondContact O-N 3.34Å; G111-L116 CarbonylContact C-O 3.54Å; G111-L116 PolarHBondContact N-O 2.9Å; G111-L116 PolarHBondContact O-N 3.48Å
112	S	93.5	Very high	93.3	Very high	42 Å²	42	60.2 Å²	60.2	29%	0.294	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-60.7	-28.3	179.4	66.9	0	0	0	0	112.7	Y114 H115 I149 L150 S151	S112-Y114 VanDerWaalsContact C-N 3.35Å; S112-H115 PolarHBondContact O-N 2.92Å; S112-H115 PolarHBondContact O-ND1 2.87Å; S112-I149 WeakPolarHBondContact CB-O 3.32Å; S112-I149 PolarHBondContact OG-O 2.74Å; S112-I149 VanDerWaalsContact OG-O 3.04Å; S112-L150 WeakPolarHBondContact CB-O 3.46Å; S112-L150 PolarHBondContact N-O 3.4Å; S112-L150 PolarHBondContact OG-O 2.9Å; S112-L150 VanDerWaalsContact OG-O 3.09Å; S112-S151 WeakPolarHBondContact OG-CA 3.47Å; S112-S151 PolarHBondContact OG-N 3.15Å; S112-S151 VanDerWaalsContact OG-N 3.12Å
113	D	94.9	Very high	93.4	Very high	72 Å²	72	60 Å²	60	39%	0.385	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-64.3	-33	174	56.1	-39.9	0	0	0	113.5	G111 H152	G111-D113 VanDerWaalsContact CA-OD1 3.28Å; G111-D113 WeakPolarHBondContact CA-OD1 3.44Å; G111-D113 PolarHBondContact O-N 2.77Å; D113-H152 WeakPolarHBondContact OD1-CB 3.46Å; D113-H152 PolarHBondContact OD1-N 3.42Å
114	Y	93.6	Very high	93.5	Very high	141 Å²	141	60.9 Å²	60.9	55%	0.553	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-94.2	1.3	175.3	-62	-77	0	0	0	113.2	G111 S112 L116 H152	G111-Y114 PolarHBondContact O-N 2.71Å; S112-Y114 VanDerWaalsContact C-N 3.35Å; Y114-L116 PolarHBondContact O-N 2.6Å; Y114-H152 HydrophobicContact CD2-CB 4.23Å; Y114-H152 HydrophobicContact CE2-CB 3.82Å
115	H	92.2	Very high	93.4	Very high	176 Å²	176	64.7 Å²	64.7	82%	0.815	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	30.8	-171	-48.6	-48.9	0	0	0	113.1	G111 S112	G111-H115 PolarHBondContact O-N 3.34Å; S112-H115 PolarHBondContact O-N 2.92Å; S112-H115 PolarHBondContact O-ND1 2.87Å
116	L	92.3	Very high	93.2	Very high	115 Å²	115	68 Å²	68	60%	0.602	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.3	-179.4	-70	174.2	0	0	0	110	G111 Y114 L118	G111-L116 CarbonylContact C-O 3.54Å; G111-L116 PolarHBondContact N-O 2.9Å; G111-L116 PolarHBondContact O-N 3.48Å; Y114-L116 PolarHBondContact O-N 2.6Å; L116-L118 PolarHBondContact O-N 3.22Å
117	Q	91.8	Very high	93	Very high	48 Å²	48	67.9 Å²	67.9	22%	0.224	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	135.6	174	-172.4	60.6	64.9	0	0	110.4	T119 E138 I139	Q117-T119 PolarHBondContact O-N 3.39Å; Q117-T119 VanDerWaalsContact O-N 3.15Å; Q117-T119 PolarHBondContact O-OG1 2.72Å; Q117-E138 HydrophobicContact CG-CB 3.86Å; Q117-E138 HydrophobicContact CG-CG 4.06Å; Q117-I139 PolarHBondContact NE2-O 3.35Å
118	L	94.2	Very high	92.9	Very high	2 Å²	2	62 Å²	62	1%	0.01	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	119.8	172.8	-79.2	159.5	0	0	0	109.3	V108 Q109 G110 L116 E138 I139 A147 A155	V108-L118 HydrophobicContact CG1-CB 4.21Å; V108-L118 HydrophobicContact CG1-CD2 3.53Å; V108-L118 HydrophobicContact CG1-CG 4.48Å; Q109-L118 CarbonylContact O-C 3.32Å; Q109-L118 WeakPolarHBondContact O-CA 3.43Å; G110-L118 WeakPolarHBondContact O-CD2 3.45Å; L116-L118 PolarHBondContact O-N 3.22Å; L118-E138 CarbonylContact O-C 3.57Å; L118-E138 WeakPolarHBondContact O-CA 3.28Å; L118-I139 HydrophobicContact CB-CB 4.05Å; L118-I139 HydrophobicContact CB-CD1 4.43Å; L118-I139 HydrophobicContact CB-CG1 4.49Å; L118-I139 PolarHBondContact O-N 3.37Å; L118-A147 HydrophobicContact CD1-CB 3.89Å; L118-A147 WeakPolarHBondContact CD1-O 3.49Å; L118-A155 HydrophobicContact CD1-CB 3.41Å; L118-A155 VanDerWaalsContact CD1-CB 3.41Å; L118-A155 HydrophobicContact CD2-CB 4.04Å; L118-A155 HydrophobicContact CG-CB 4.4Å
119	T	93.6	Very high	92.8	Very high	13 Å²	13	60.8 Å²	60.8	8%	0.08	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	142.9	-172.5	-53	0	0	0	0	110.4	V108 Q109 Q117 C121 D137 E138	V108-T119 CarbonylContact C-O 3.56Å; V108-T119 WeakPolarHBondContact CA-O 3.49Å; Q109-T119 PolarHBondContact N-O 2.91Å; Q109-T119 PolarHBondContact O-N 2.99Å; Q117-T119 PolarHBondContact O-N 3.39Å; Q117-T119 VanDerWaalsContact O-N 3.15Å; Q117-T119 PolarHBondContact O-OG1 2.72Å; T119-C121 PolarHBondContact O-N 3.45Å; T119-D137 CarbonylContact C-O 3.6Å; T119-D137 VanDerWaalsContact CA-O 3.31Å; T119-D137 WeakPolarHBondContact CA-O 3.33Å; T119-D137 WeakPolarHBondContact CG2-O 3.34Å; T119-E138 HydrophobicContact CG2-CG 4.42Å
120	I	93.8	Very high	92.6	Very high	1 Å²	1	60 Å²	60	1%	0.005	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	121.8	174.7	-54.3	-60.6	0	0	0	110	F106 R107 V108 T123 L133 Q134 S135 G136 D137 I139	F106-I120 HydrophobicContact CB-CG2 4.44Å; F106-I120 HydrophobicContact CD2-CD1 3.52Å; F106-I120 HydrophobicContact CE2-CD1 3.77Å; F106-I120 HydrophobicContact CG-CD1 4.36Å; R107-I120 WeakPolarHBondContact O-CA 3.28Å; V108-I120 HydrophobicContact CG2-CD1 4.13Å; I120-T123 HydrophobicContact CG2-CG2 4.28Å; I120-L133 HydrophobicContact CD1-CD1 4.15Å; I120-L133 HydrophobicContact CG1-CD1 4.49Å; I120-Q134 WeakPolarHBondContact CB-O 3.33Å; I120-S135 WeakPolarHBondContact O-CA 3.45Å; I120-G136 PolarHBondContact O-N 3.14Å; I120-D137 HydrophobicContact CB-CB 4.33Å; I120-D137 HydrophobicContact CG1-CB 4.01Å; I120-D137 PolarHBondContact N-O 3.24Å; I120-I139 HydrophobicContact CD1-CD1 3.7Å; I120-I139 HydrophobicContact CD1-CG1 3.99Å; I120-I139 HydrophobicContact CG1-CG1 4.38Å
121	C	92.3	Very high	92.3	Very high	47 Å²	47	63.1 Å²	63.1	32%	0.318	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-47.1	176.6	-55.9	0	0	0	0	112	R107 Q109 T119 S135	R107-C121 HydrophobicContact CB-CB 4.14Å; R107-C121 PolarHBondContact O-N 3.16Å; Q109-C121 WeakPolarHBondContact CB-SG 3.48Å; Q109-C121 WeakPolarHBondContact CG-SG 2.9Å; Q109-C121 PolarHBondContact OE1-SG 3.23Å; Q109-C121 VanDerWaalsContact OE1-SG 3.4Å; T119-C121 PolarHBondContact O-N 3.45Å; C121-S135 VanDerWaalsContact O-CB 3.32Å; C121-S135 WeakPolarHBondContact O-CB 3.36Å; C121-S135 PolarHBondContact O-OG 3.24Å
122	K	91	Very high	92.1	Very high	145 Å²	145	66.3 Å²	66.3	63%	0.63	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-157.7	141.5	-168.5	-174.3	168.7	-176.6	174.7	0	110.2	F106 R107	F106-K122 CarbonylContact C-O 3.5Å; F106-K122 VanDerWaalsContact CA-O 3.26Å; F106-K122 WeakPolarHBondContact CA-O 3.29Å; R107-K122 PolarHBondContact N-O 3.23Å
123	T	92.5	Very high	92.1	Very high	38 Å²	38	64.5 Å²	64.5	23%	0.233	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	152.8	168.7	54.4	0	0	0	0	110.2	G105 F106 I120 L133	G105-T123 CarbonylContact O-C 3.59Å; F106-T123 HydrophobicContact CB-CG2 4.16Å; I120-T123 HydrophobicContact CG2-CG2 4.28Å; T123-L133 HydrophobicContact CG2-CB 3.87Å; T123-L133 WeakPolarHBondContact CG2-O 3.33Å
124	Q	92.7	Very high	91.8	Very high	101 Å²	101	66.1 Å²	66.1	47%	0.472	37%	0.369	S	S	.	.			trans	-101.8	134.1	179.5	-176.5	174.8	-7	0	0	108.4	G105 S127	G105-Q124 WeakPolarHBondContact O-CA 3.36Å; G105-Q124 WeakPolarHBondContact O-CB 3.41Å; G105-Q124 PolarHBondContact O-N 2.82Å; Q124-S127 WeakPolarHBondContact O-CB 3.48Å; Q124-S127 PolarHBondContact O-N 3.15Å; Q124-S127 PolarHBondContact O-OG 3.01Å
125	S	91.6	Very high	91.7	Very high	93 Å²	93	62.9 Å²	62.9	65%	0.65	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	143.9	175	-170.1	0	0	0	0	111	S127 E130	S125-S127 VanDerWaalsContact C-N 3.32Å; S125-E130 WeakPolarHBondContact CA-OE1 3.31Å; S125-E130 WeakPolarHBondContact CB-OE1 3.46Å; S125-E130 PolarHBondContact OG-OE1 3.48Å
126	G	90.2	Very high	91.6	Very high	74 Å²	74	55.6 Å²	55.6	76%	0.763	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	12.2	-174.3	0	0	0	0	0	114.6	E130	G126-E130 PolarHBondContact N-OE2 2.72Å
127	S	91.7	Very high	91.6	Very high	17 Å²	17	50.3 Å²	50.3	12%	0.119	31%	0.312	C	S	.	.	S	Bend	trans	-108.4	158.9	-179.4	79.4	0	0	0	0	111.5	W104 G105 Q124 S125 S129 E130	W104-S127 PolarHBondContact O-OG 3.39Å; G105-S127 PolarHBondContact O-OG 2.79Å; Q124-S127 WeakPolarHBondContact O-CB 3.48Å; Q124-S127 PolarHBondContact O-N 3.15Å; Q124-S127 PolarHBondContact O-OG 3.01Å; S125-S127 VanDerWaalsContact C-N 3.32Å; S127-S129 PolarHBondContact O-N 2.8Å; S127-S129 PolarHBondContact OG-OG 3.46Å; S127-E130 WeakPolarHBondContact O-CB 3.06Å; S127-E130 PolarHBondContact O-N 2.93Å
128	P	90.7	Very high	91.6	Very high	35 Å²	35	49.7 Å²	49.7	23%	0.227	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-15.4	179.9	28.2	-37.5	0	0	0	113.6	L95 R96 R97 W104 I132	L95-P128 WeakPolarHBondContact CD2-O 3.39Å; R96-P128 WeakPolarHBondContact O-CB 3.49Å; R97-P128 HydrophobicContact CB-CG 4.18Å; W104-P128 HydrophobicContact CE3-CG 4.03Å; P128-I132 WeakPolarHBondContact O-CD1 3.17Å
129	S	91.7	Very high	91.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-15.7	175.1	69.8	0	0	0	0	114.7	W104 G105 S127 G131 I132 L133	W104-S129 WeakPolarHBondContact O-CB 3.4Å; W104-S129 PolarHBondContact O-N 3.27Å; W104-S129 PolarHBondContact O-OG 2.93Å; G105-S129 VanDerWaalsContact C-OG 3.3Å; G105-S129 PolarHBondContact O-OG 3.4Å; S127-S129 PolarHBondContact O-N 2.8Å; S127-S129 PolarHBondContact OG-OG 3.46Å; S129-G131 PolarHBondContact O-N 2.87Å; S129-I132 PolarHBondContact O-N 3.41Å; S129-L133 PolarHBondContact O-N 2.91Å; S129-L133 VanDerWaalsContact O-N 3.09Å
130	E	90.5	Very high	91.7	Very high	92 Å²	92	50.4 Å²	50.4	43%	0.43	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	130.9	-178.4	-175.7	174.1	-149.5	0	0	111	S125 G126 S127 I132	S125-E130 WeakPolarHBondContact CA-OE1 3.31Å; S125-E130 WeakPolarHBondContact CB-OE1 3.46Å; S125-E130 PolarHBondContact OG-OE1 3.48Å; G126-E130 PolarHBondContact N-OE2 2.72Å; S127-E130 WeakPolarHBondContact O-CB 3.06Å; S127-E130 PolarHBondContact O-N 2.93Å; E130-I132 PolarHBondContact O-N 2.68Å
131	G	88	Confident	91.7	Very high	73 Å²	73	51.3 Å²	51.3	75%	0.753	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-18.8	-179.3	0	0	0	0	0	115.3	S129	S129-G131 PolarHBondContact O-N 2.87Å
132	I	91.7	Very high	91.9	Very high	68 Å²	68	49 Å²	49	35%	0.349	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-46	-179.5	-50.8	-178.1	0	0	0	111.2	I93 L95 P128 S129 E130 R172	I93-I132 HydrophobicContact CB-CG2 4.38Å; I93-I132 HydrophobicContact CD1-CG2 4.33Å; I93-I132 HydrophobicContact CG1-CG2 4.25Å; I93-I132 HydrophobicContact CG2-CG2 3.39Å; L95-I132 HydrophobicContact CD2-CB 3.96Å; L95-I132 HydrophobicContact CD2-CD1 3.83Å; L95-I132 HydrophobicContact CD2-CG1 4.45Å; L95-I132 HydrophobicContact CD2-CG2 3.89Å; P128-I132 WeakPolarHBondContact O-CD1 3.17Å; S129-I132 PolarHBondContact O-N 3.41Å; E130-I132 PolarHBondContact O-N 2.68Å; I132-R172 PolarHBondContact O-NH2 2.83Å
133	L	92	Very high	92	Very high	4 Å²	4	45.5 Å²	45.5	2%	0.021	29%	0.291	C	S	.	.	S	Bend	trans	-98.1	144.8	175.6	-69.8	178	0	0	0	111.3	I93 L95 F106 I120 T123 S129 L168 V170	I93-L133 HydrophobicContact CD1-CD2 3.52Å; I93-L133 HydrophobicContact CG2-CD2 4.3Å; L95-L133 HydrophobicContact CD1-CD1 3.85Å; L95-L133 HydrophobicContact CD1-CG 4.47Å; F106-L133 HydrophobicContact CB-CD1 4.4Å; F106-L133 HydrophobicContact CD1-CD1 3.71Å; F106-L133 HydrophobicContact CD2-CD1 4.31Å; F106-L133 HydrophobicContact CE1-CD1 3.93Å; F106-L133 HydrophobicContact CG-CD1 3.9Å; F106-L133 HydrophobicContact CZ-CD1 4.34Å; I120-L133 HydrophobicContact CD1-CD1 4.15Å; I120-L133 HydrophobicContact CG1-CD1 4.49Å; T123-L133 HydrophobicContact CG2-CB 3.87Å; T123-L133 WeakPolarHBondContact CG2-O 3.33Å; S129-L133 PolarHBondContact O-N 2.91Å; S129-L133 VanDerWaalsContact O-N 3.09Å; L133-L168 HydrophobicContact CD1-CD1 4.09Å; L133-L168 HydrophobicContact CD2-CD1 4.38Å; L133-V170 HydrophobicContact CD2-CG1 4.13Å
134	Q	90.5	Very high	92	Very high	105 Å²	105	46.7 Å²	46.7	49%	0.491	31%	0.311	S	S	.	.			trans	-118.3	149	176.1	-60.5	-177.5	3.6	0	0	111.3	I120 G136 D137	I120-Q134 WeakPolarHBondContact CB-O 3.33Å; Q134-G136 PolarHBondContact O-N 3.03Å; Q134-D137 PolarHBondContact N-OD2 2.74Å; Q134-D137 VanDerWaalsContact O-CB 3.31Å; Q134-D137 WeakPolarHBondContact O-CB 3.46Å; Q134-D137 VanDerWaalsContact O-CG 3.29Å; Q134-D137 PolarHBondContact O-N 2.73Å; Q134-D137 VanDerWaalsContact O-N 3.16Å
135	S	89.9	Confident	92.1	Very high	73 Å²	73	46.2 Å²	46.2	51%	0.51	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	128.1	170.7	-70.3	0	0	0	0	109.9	I120 C121	I120-S135 WeakPolarHBondContact O-CA 3.45Å; C121-S135 VanDerWaalsContact O-CB 3.32Å; C121-S135 WeakPolarHBondContact O-CB 3.36Å; C121-S135 PolarHBondContact O-OG 3.24Å
136	G	90.2	Very high	92.3	Very high	23 Å²	23	45.7 Å²	45.7	24%	0.237	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	97.6	-7.8	-174.5	0	0	0	0	0	114.6	I120 Q134 E138	I120-G136 PolarHBondContact O-N 3.14Å; Q134-G136 PolarHBondContact O-N 3.03Å; G136-E138 PolarHBondContact O-N 3.24Å
137	D	92.2	Very high	92.4	Very high	5 Å²	5	42.2 Å²	42.2	3%	0.027	26%	0.263	C	S	.	.			trans	-63.9	128.3	174.2	-75.5	-7.6	0	0	0	110.6	T119 I120 Q134 V170 R172	T119-D137 CarbonylContact C-O 3.6Å; T119-D137 VanDerWaalsContact CA-O 3.31Å; T119-D137 WeakPolarHBondContact CA-O 3.33Å; T119-D137 WeakPolarHBondContact CG2-O 3.34Å; I120-D137 HydrophobicContact CB-CB 4.33Å; I120-D137 HydrophobicContact CG1-CB 4.01Å; I120-D137 PolarHBondContact N-O 3.24Å; Q134-D137 PolarHBondContact N-OD2 2.74Å; Q134-D137 VanDerWaalsContact O-CB 3.31Å; Q134-D137 WeakPolarHBondContact O-CB 3.46Å; Q134-D137 VanDerWaalsContact O-CG 3.29Å; Q134-D137 PolarHBondContact O-N 2.73Å; Q134-D137 VanDerWaalsContact O-N 3.16Å; D137-V170 HydrophobicContact CB-CB 4.19Å; D137-V170 HydrophobicContact CB-CG1 4.46Å; D137-V170 HydrophobicContact CB-CG2 4.34Å; D137-R172 WeakPolarHBondContact OD1-CG 3.15Å; D137-R172 IonicContact OD1-NE 3.69Å; D137-R172 IonicContact OD2-NE 3.6Å
138	E	93.3	Very high	92.4	Very high	35 Å²	35	48.2 Å²	48.2	16%	0.164	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	116.6	-179.9	-70.8	-175.1	177.3	0	0	111	Q117 L118 T119 G136 L140 V170 A171 R173	Q117-E138 HydrophobicContact CG-CB 3.86Å; Q117-E138 HydrophobicContact CG-CG 4.06Å; L118-E138 CarbonylContact O-C 3.57Å; L118-E138 WeakPolarHBondContact O-CA 3.28Å; T119-E138 HydrophobicContact CG2-CG 4.42Å; G136-E138 PolarHBondContact O-N 3.24Å; E138-L140 PolarHBondContact O-N 2.69Å; E138-V170 CarbonylContact O-C 3.43Å; E138-V170 WeakPolarHBondContact O-CA 3.11Å; E138-A171 HydrophobicContact CB-CB 4.11Å; E138-A171 PolarHBondContact N-O 3.47Å; E138-A171 PolarHBondContact O-N 3.06Å; E138-R173 IonicContact OE1-CZ 2.71Å; E138-R173 IonicContact OE1-NE 2.6Å; E138-R173 PolarHBondContact OE1-NE 2.92Å; E138-R173 IonicContact OE1-NH2 3.17Å; E138-R173 PolarHBondContact OE1-NH2 3.41Å
139	I	94.4	Very high	92.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	113.3	179.3	-49.3	178.7	0	0	0	109.4	V108 Q117 L118 I120 I142 A147 L168 V170	V108-I139 HydrophobicContact CG1-CD1 3.93Å; V108-I139 HydrophobicContact CG2-CD1 4.08Å; Q117-I139 PolarHBondContact NE2-O 3.35Å; L118-I139 HydrophobicContact CB-CB 4.05Å; L118-I139 HydrophobicContact CB-CD1 4.43Å; L118-I139 HydrophobicContact CB-CG1 4.49Å; L118-I139 PolarHBondContact O-N 3.37Å; I120-I139 HydrophobicContact CD1-CD1 3.7Å; I120-I139 HydrophobicContact CD1-CG1 3.99Å; I120-I139 HydrophobicContact CG1-CG1 4.38Å; I139-I142 HydrophobicContact CG2-CD1 4.33Å; I139-I142 HydrophobicContact CG2-CG1 3.72Å; I139-A147 HydrophobicContact CG2-CB 3.95Å; I139-A147 WeakPolarHBondContact O-CB 3.49Å; I139-L168 HydrophobicContact CG2-CD2 4.29Å; I139-V170 HydrophobicContact CG1-CG1 4.43Å
140	L	93.9	Very high	92.7	Very high	29 Å²	29	53.3 Å²	53.3	15%	0.152	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	-36.4	174.9	-59.1	-179.1	0	0	0	112.1	P90 E138 N146 A147 T169 A171	P90-L140 HydrophobicContact CB-CD1 3.99Å; E138-L140 PolarHBondContact O-N 2.69Å; L140-N146 PolarHBondContact O-OD1 2.8Å; L140-A147 WeakPolarHBondContact O-CB 3.45Å; L140-A147 PolarHBondContact O-N 3.07Å; L140-T169 WeakPolarHBondContact CA-O 3.13Å; L140-T169 HydrophobicContact CB-CG2 4.31Å; L140-T169 WeakPolarHBondContact CB-O 3.41Å; L140-T169 HydrophobicContact CD1-CG2 4.26Å; L140-T169 PolarHBondContact N-O 3.25Å; L140-A171 HydrophobicContact CD1-CB 3.94Å; L140-A171 HydrophobicContact CD2-CB 4.04Å; L140-A171 HydrophobicContact CG-CB 3.97Å
141	S	94.9	Very high	93	Very high	20 Å²	20	50 Å²	50	14%	0.14	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	153.6	178.4	75.9	0	0	0	0	113	E145 L168 T169	S141-E145 CarbonylContact C-O 3.49Å; S141-E145 WeakPolarHBondContact CA-O 3.4Å; S141-E145 WeakPolarHBondContact CB-O 3.38Å; S141-L168 WeakPolarHBondContact O-CA 3.32Å; S141-T169 PolarHBondContact N-O 2.84Å; S141-T169 PolarHBondContact O-N 2.76Å; S141-T169 WeakPolarHBondContact OG-CB 3.4Å; S141-T169 PolarHBondContact OG-OG1 2.77Å
142	I	95.7	Very high	93.3	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	116.8	179	-57.6	166.4	0	0	0	107.8	I139 G144 E145 A147 L150 A155 K158 I159 L166 L168	I139-I142 HydrophobicContact CG2-CD1 4.33Å; I139-I142 HydrophobicContact CG2-CG1 3.72Å; I142-G144 PolarHBondContact O-N 2.94Å; I142-G144 VanDerWaalsContact O-N 3.14Å; I142-E145 PolarHBondContact N-O 2.87Å; I142-E145 WeakPolarHBondContact O-CB 3.14Å; I142-E145 PolarHBondContact O-N 2.76Å; I142-A147 HydrophobicContact CD1-CB 4.27Å; I142-A147 HydrophobicContact CG1-CB 4.24Å; I142-L150 HydrophobicContact CD1-CD1 4.39Å; I142-A155 HydrophobicContact CD1-CB 3.68Å; I142-K158 HydrophobicContact CG2-CB 4.06Å; I142-I159 HydrophobicContact CD1-CD1 4Å; I142-I159 HydrophobicContact CD1-CG1 4.08Å; I142-I159 HydrophobicContact CG1-CG1 4.48Å; I142-I159 HydrophobicContact CG2-CG1 3.93Å; I142-L166 HydrophobicContact CG2-CD1 4.01Å; I142-L168 HydrophobicContact CB-CD2 4.21Å; I142-L168 HydrophobicContact CG1-CD2 3.84Å; I142-L168 HydrophobicContact CG2-CD2 4.08Å
143	N	94.3	Very high	93.5	Very high	70 Å²	70	52 Å²	52	37%	0.374	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.6	35.4	-176.5	-70.1	-23.3	0	0	0	114.1	E145 A162 Q167	N143-E145 VanDerWaalsContact C-N 3.35Å; N143-A162 VanDerWaalsContact ND2-CB 3.3Å; N143-A162 WeakPolarHBondContact ND2-CB 3.45Å; N143-Q167 PolarHBondContact N-O 2.77Å; N143-Q167 PolarHBondContact OD1-N 2.76Å; N143-Q167 PolarHBondContact OD1-O 3.44Å
144	G	92.9	Very high	93.7	Very high	64 Å²	64	56.2 Å²	56.2	66%	0.66	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.6	-6.7	-178.3	0	0	0	0	0	114.8	I142	I142-G144 PolarHBondContact O-N 2.94Å; I142-G144 VanDerWaalsContact O-N 3.14Å
145	E	94.7	Very high	94	Very high	91 Å²	91	51.2 Å²	51.2	43%	0.425	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	137.9	175.6	-64.2	-169.6	-137.7	0	0	112	S141 I142 N143 A147 K158	S141-E145 CarbonylContact C-O 3.49Å; S141-E145 WeakPolarHBondContact CA-O 3.4Å; S141-E145 WeakPolarHBondContact CB-O 3.38Å; I142-E145 PolarHBondContact N-O 2.87Å; I142-E145 WeakPolarHBondContact O-CB 3.14Å; I142-E145 PolarHBondContact O-N 2.76Å; N143-E145 VanDerWaalsContact C-N 3.35Å; E145-A147 PolarHBondContact O-N 3.33Å; E145-K158 IonicContact OE1-NZ 2.77Å; E145-K158 PolarHBondContact OE1-NZ 3.02Å; E145-K158 WeakPolarHBondContact OE2-CE 3.29Å; E145-K158 IonicContact OE2-NZ 2.68Å; E145-K158 PolarHBondContact OE2-NZ 3.29Å
146	N	94.2	Very high	94.2	Very high	81 Å²	81	49.1 Å²	49.1	43%	0.433	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	116.4	-176.2	-169.8	-27.4	0	0	0	111.2	L140 R148 I149 L150	L140-N146 PolarHBondContact O-OD1 2.8Å; N146-R148 VanDerWaalsContact C-N 3.26Å; N146-R148 PolarHBondContact O-N 3.07Å; N146-R148 WeakPolarHBondContact OD1-CB 3.48Å; N146-R148 WeakPolarHBondContact OD1-CG 3.31Å; N146-R148 PolarHBondContact OD1-N 2.87Å; N146-I149 HydrophobicContact CB-CG1 4.47Å; N146-I149 VanDerWaalsContact O-CG1 3.31Å; N146-I149 WeakPolarHBondContact O-CG1 3.43Å; N146-L150 WeakPolarHBondContact O-CG 3.41Å
147	A	93.6	Very high	94.4	Very high	1 Å²	1	53 Å²	53	1%	0.008	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-15.2	-177.3	0	0	0	0	0	113.1	L118 I139 L140 I142 E145 I149 L150	L118-A147 HydrophobicContact CD1-CB 3.89Å; L118-A147 WeakPolarHBondContact CD1-O 3.49Å; I139-A147 HydrophobicContact CG2-CB 3.95Å; I139-A147 WeakPolarHBondContact O-CB 3.49Å; L140-A147 WeakPolarHBondContact O-CB 3.45Å; L140-A147 PolarHBondContact O-N 3.07Å; I142-A147 HydrophobicContact CD1-CB 4.27Å; I142-A147 HydrophobicContact CG1-CB 4.24Å; E145-A147 PolarHBondContact O-N 3.33Å; A147-I149 VanDerWaalsContact C-N 3.27Å; A147-I149 PolarHBondContact O-N 3.5Å; A147-L150 PolarHBondContact O-N 2.87Å
148	R	92	Very high	94.5	Very high	144 Å²	144	55.4 Å²	55.4	54%	0.543	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	-28	180	-62.9	-173.1	170	171.2	0.7	113.8	N146	N146-R148 VanDerWaalsContact C-N 3.26Å; N146-R148 PolarHBondContact O-N 3.07Å; N146-R148 WeakPolarHBondContact OD1-CB 3.48Å; N146-R148 WeakPolarHBondContact OD1-CG 3.31Å; N146-R148 PolarHBondContact OD1-N 2.87Å
149	I	93.4	Very high	94.6	Very high	128 Å²	128	54.3 Å²	54.3	66%	0.656	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.9	-15.6	-179	59.8	168.8	0	0	0	112.6	S112 N146 A147	S112-I149 WeakPolarHBondContact CB-O 3.32Å; S112-I149 PolarHBondContact OG-O 2.74Å; S112-I149 VanDerWaalsContact OG-O 3.04Å; N146-I149 HydrophobicContact CB-CG1 4.47Å; N146-I149 VanDerWaalsContact O-CG1 3.31Å; N146-I149 WeakPolarHBondContact O-CG1 3.43Å; A147-I149 VanDerWaalsContact C-N 3.27Å; A147-I149 PolarHBondContact O-N 3.5Å
150	L	94.2	Very high	94.5	Very high	13 Å²	13	62.6 Å²	62.6	7%	0.068	31%	0.311	C	S	.	.	S	Bend	trans	-78.7	136.5	-177.4	-62.8	177.4	0	0	0	111.2	S112 I142 N146 A147 E154 A155 K158	S112-L150 WeakPolarHBondContact CB-O 3.46Å; S112-L150 PolarHBondContact N-O 3.4Å; S112-L150 PolarHBondContact OG-O 2.9Å; S112-L150 VanDerWaalsContact OG-O 3.09Å; I142-L150 HydrophobicContact CD1-CD1 4.39Å; N146-L150 WeakPolarHBondContact O-CG 3.41Å; A147-L150 PolarHBondContact O-N 2.87Å; L150-E154 HydrophobicContact CB-CB 4.43Å; L150-E154 HydrophobicContact CD2-CB 4.32Å; L150-A155 HydrophobicContact CB-CB 4.27Å; L150-K158 HydrophobicContact CD1-CD 3.77Å
151	S	96.2	Very high	94.4	Very high	24 Å²	24	65.3 Å²	65.3	17%	0.168	33%	0.333	C	S	.	.			trans	-66.2	160.7	168.2	62.1	0	0	0	0	110.8	S112 E153 E154 A155	S112-S151 WeakPolarHBondContact OG-CA 3.47Å; S112-S151 PolarHBondContact OG-N 3.15Å; S112-S151 VanDerWaalsContact OG-N 3.12Å; S151-E153 PolarHBondContact O-N 3.16Å; S151-E154 WeakPolarHBondContact CB-OE2 3.3Å; S151-E154 PolarHBondContact N-OE2 3.14Å; S151-E154 PolarHBondContact O-N 2.82Å; S151-E154 WeakPolarHBondContact OG-CB 3.37Å; S151-E154 VanDerWaalsContact OG-CD 3.27Å; S151-E154 WeakPolarHBondContact OG-CG 3.32Å; S151-E154 PolarHBondContact OG-N 2.96Å; S151-E154 PolarHBondContact OG-OE2 3.37Å; S151-A155 WeakPolarHBondContact O-CB 3.33Å; S151-A155 PolarHBondContact O-N 3.17Å
152	H	95.5	Very high	94.1	Very high	55 Å²	55	64.6 Å²	64.6	26%	0.255	33%	0.328	S	S	.	.	H	α-helix	trans	-52.3	-43.3	175.5	-176.4	78.8	0	0	0	112.5	V108 G110 D113 Y114 T156	V108-H152 PolarHBondContact O-CE1 3.16Å; G110-H152 WeakPolarHBondContact O-CB 3.31Å; G110-H152 PolarHBondContact O-ND1 2.83Å; D113-H152 WeakPolarHBondContact OD1-CB 3.46Å; D113-H152 PolarHBondContact OD1-N 3.42Å; Y114-H152 HydrophobicContact CD2-CB 4.23Å; Y114-H152 HydrophobicContact CE2-CB 3.82Å; H152-T156 WeakPolarHBondContact O-CB 3.26Å; H152-T156 PolarHBondContact O-N 3.4Å; H152-T156 PolarHBondContact O-OG1 2.99Å
153	E	96.2	Very high	93.9	Very high	127 Å²	127	66.1 Å²	66.1	59%	0.593	34%	0.343	S	S	*	.	H	α-helix	trans	-67.1	-50.2	179.9	-177.2	170.6	-166.2	0	0	111.5	S151 A155 T156 Q157	S151-E153 PolarHBondContact O-N 3.16Å; E153-A155 VanDerWaalsContact C-N 3.33Å; E153-A155 PolarHBondContact O-N 3.37Å; E153-T156 PolarHBondContact O-N 2.81Å; E153-T156 VanDerWaalsContact O-N 3.15Å; E153-Q157 HydrophobicContact CG-CG 4.34Å; E153-Q157 WeakPolarHBondContact O-CG 3.49Å; E153-Q157 PolarHBondContact O-N 2.75Å; E153-Q157 PolarHBondContact OE1-NE2 3.32Å
154	E	96.2	Very high	93.8	Very high	92 Å²	92	66.1 Å²	66.1	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-59.4	-43.4	178.6	-72	168.6	128.4	0	0	111.9	L150 S151 T156 Q157 K158	L150-E154 HydrophobicContact CB-CB 4.43Å; L150-E154 HydrophobicContact CD2-CB 4.32Å; S151-E154 WeakPolarHBondContact CB-OE2 3.3Å; S151-E154 PolarHBondContact N-OE2 3.14Å; S151-E154 PolarHBondContact O-N 2.82Å; S151-E154 WeakPolarHBondContact OG-CB 3.37Å; S151-E154 VanDerWaalsContact OG-CD 3.27Å; S151-E154 WeakPolarHBondContact OG-CG 3.32Å; S151-E154 PolarHBondContact OG-N 2.96Å; S151-E154 PolarHBondContact OG-OE2 3.37Å; E154-T156 VanDerWaalsContact C-N 3.34Å; E154-T156 PolarHBondContact O-N 2.96Å; E154-Q157 PolarHBondContact O-N 3.23Å; E154-K158 WeakPolarHBondContact O-CG 3.14Å; E154-K158 PolarHBondContact O-N 2.9Å
155	A	95.6	Very high	93.9	Very high	1 Å²	1	66.4 Å²	66.4	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-61.1	-44.2	176	0	0	0	0	0	111.6	L118 I142 L150 S151 E153 K158 I159	L118-A155 HydrophobicContact CD1-CB 3.41Å; L118-A155 VanDerWaalsContact CD1-CB 3.41Å; L118-A155 HydrophobicContact CD2-CB 4.04Å; L118-A155 HydrophobicContact CG-CB 4.4Å; I142-A155 HydrophobicContact CD1-CB 3.68Å; L150-A155 HydrophobicContact CB-CB 4.27Å; S151-A155 WeakPolarHBondContact O-CB 3.33Å; S151-A155 PolarHBondContact O-N 3.17Å; E153-A155 VanDerWaalsContact C-N 3.33Å; E153-A155 PolarHBondContact O-N 3.37Å; A155-K158 PolarHBondContact O-N 3.31Å; A155-I159 VanDerWaalsContact O-CG1 3.29Å; A155-I159 WeakPolarHBondContact O-CG1 3.41Å; A155-I159 PolarHBondContact O-N 2.92Å
156	T	94.7	Very high	93.9	Very high	28 Å²	28	62.1 Å²	62.1	17%	0.172	31%	0.313	C	S	.	.	H	α-helix	trans	-64.1	-42	177.1	-61.8	0	0	0	0	111.7	H152 E153 E154 I159 R160	H152-T156 WeakPolarHBondContact O-CB 3.26Å; H152-T156 PolarHBondContact O-N 3.4Å; H152-T156 PolarHBondContact O-OG1 2.99Å; E153-T156 PolarHBondContact O-N 2.81Å; E153-T156 VanDerWaalsContact O-N 3.15Å; E154-T156 VanDerWaalsContact C-N 3.34Å; E154-T156 PolarHBondContact O-N 2.96Å; T156-I159 PolarHBondContact O-N 2.81Å; T156-R160 WeakPolarHBondContact O-CB 3.39Å; T156-R160 VanDerWaalsContact O-CG 3.31Å; T156-R160 WeakPolarHBondContact O-CG 3.47Å; T156-R160 PolarHBondContact O-N 2.78Å
157	Q	94.8	Very high	94	Very high	106 Å²	106	62.5 Å²	62.5	50%	0.495	31%	0.312	S	S	.	.	H	α-helix	trans	-61.3	-46.9	176	-72.6	179.7	6.7	0	0	110.9	E153 E154 I159 R160 S161	E153-Q157 HydrophobicContact CG-CG 4.34Å; E153-Q157 WeakPolarHBondContact O-CG 3.49Å; E153-Q157 PolarHBondContact O-N 2.75Å; E153-Q157 PolarHBondContact OE1-NE2 3.32Å; E154-Q157 PolarHBondContact O-N 3.23Å; Q157-I159 VanDerWaalsContact C-N 3.35Å; Q157-I159 PolarHBondContact O-N 3.35Å; Q157-R160 PolarHBondContact O-N 2.81Å; Q157-S161 WeakPolarHBondContact O-CB 3.41Å; Q157-S161 PolarHBondContact O-N 2.7Å; Q157-S161 PolarHBondContact O-OG 2.89Å
158	K	94.7	Very high	94.1	Very high	54 Å²	54	62.5 Å²	62.5	24%	0.235	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-39.6	176.9	-74.1	-177.4	-169.5	-74.4	0	113.4	I142 E145 L150 E154 A155 S161 A162	I142-K158 HydrophobicContact CG2-CB 4.06Å; E145-K158 IonicContact OE1-NZ 2.77Å; E145-K158 PolarHBondContact OE1-NZ 3.02Å; E145-K158 WeakPolarHBondContact OE2-CE 3.29Å; E145-K158 IonicContact OE2-NZ 2.68Å; E145-K158 PolarHBondContact OE2-NZ 3.29Å; L150-K158 HydrophobicContact CD1-CD 3.77Å; E154-K158 WeakPolarHBondContact O-CG 3.14Å; E154-K158 PolarHBondContact O-N 2.9Å; A155-K158 PolarHBondContact O-N 3.31Å; K158-S161 WeakPolarHBondContact CA-OG 3.42Å; K158-S161 PolarHBondContact O-OG 3.04Å; K158-A162 PolarHBondContact O-N 2.93Å
159	I	94	Very high	94.2	Very high	13 Å²	13	56.6 Å²	56.6	7%	0.067	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-45	174.9	-72.3	165.3	0	0	0	110.2	W104 F106 V108 I142 A155 T156 Q157 A162 L166	W104-I159 VanDerWaalsContact CD1-CG2 3.48Å; W104-I159 HydrophobicContact CG-CG2 4.33Å; W104-I159 PolarHBondContact NE1-O 3.48Å; F106-I159 HydrophobicContact CE2-CD1 4.16Å; F106-I159 HydrophobicContact CZ-CD1 4.24Å; F106-I159 HydrophobicContact CZ-CG2 3.88Å; V108-I159 HydrophobicContact CG2-CD1 4.26Å; I142-I159 HydrophobicContact CD1-CD1 4Å; I142-I159 HydrophobicContact CD1-CG1 4.08Å; I142-I159 HydrophobicContact CG1-CG1 4.48Å; I142-I159 HydrophobicContact CG2-CG1 3.93Å; A155-I159 VanDerWaalsContact O-CG1 3.29Å; A155-I159 WeakPolarHBondContact O-CG1 3.41Å; A155-I159 PolarHBondContact O-N 2.92Å; T156-I159 PolarHBondContact O-N 2.81Å; Q157-I159 VanDerWaalsContact C-N 3.35Å; Q157-I159 PolarHBondContact O-N 3.35Å; I159-A162 WeakPolarHBondContact O-CB 3.28Å; I159-A162 PolarHBondContact O-N 2.87Å; I159-L166 HydrophobicContact CG1-CD1 4.37Å; I159-L166 HydrophobicContact CG1-CD2 4.45Å; I159-L166 HydrophobicContact CG2-CD2 3.89Å
160	R	92	Very high	94.3	Very high	173 Å²	173	50.5 Å²	50.5	65%	0.653	26%	0.261	S	S	*	.	H	α-helix	trans	-68.5	-36.3	179.3	-71.7	176.1	-176.1	169.9	4.4	112.8	R97 T156 Q157 A162	R97-R160 PolarHBondContact NH2-O 2.81Å; T156-R160 WeakPolarHBondContact O-CB 3.39Å; T156-R160 VanDerWaalsContact O-CG 3.31Å; T156-R160 WeakPolarHBondContact O-CG 3.47Å; T156-R160 PolarHBondContact O-N 2.78Å; Q157-R160 PolarHBondContact O-N 2.81Å; R160-A162 VanDerWaalsContact C-N 3.33Å
161	S	92.5	Very high	94.1	Very high	87 Å²	87	49.9 Å²	49.9	61%	0.608	26%	0.257	S	S	*	.	H	α-helix	trans	-79.4	-14.1	179.3	69	0	0	0	0	113.5	Q157 K158 G163	Q157-S161 WeakPolarHBondContact O-CB 3.41Å; Q157-S161 PolarHBondContact O-N 2.7Å; Q157-S161 PolarHBondContact O-OG 2.89Å; K158-S161 WeakPolarHBondContact CA-OG 3.42Å; K158-S161 PolarHBondContact O-OG 3.04Å; S161-G163 PolarHBondContact O-N 3.24Å
162	A	88.7	Confident	93.7	Very high	5 Å²	5	52.7 Å²	52.7	4%	0.041	26%	0.264	C	S	.	.			trans	-62.9	108.3	168.8	0	0	0	0	0	107.6	R97 W104 N143 K158 I159 R160 L166	R97-A162 PolarHBondContact NH2-O 2.75Å; W104-A162 HydrophobicContact CZ2-CB 4.08Å; W104-A162 VanDerWaalsContact CZ2-O 3.28Å; W104-A162 WeakPolarHBondContact CZ2-O 3.17Å; N143-A162 VanDerWaalsContact ND2-CB 3.3Å; N143-A162 WeakPolarHBondContact ND2-CB 3.45Å; K158-A162 PolarHBondContact O-N 2.93Å; I159-A162 WeakPolarHBondContact O-CB 3.28Å; I159-A162 PolarHBondContact O-N 2.87Å; R160-A162 VanDerWaalsContact C-N 3.33Å; A162-L166 HydrophobicContact CB-CB 3.97Å; A162-L166 HydrophobicContact CB-CD1 3.61Å; A162-L166 HydrophobicContact CB-CG 4.35Å
163	G	90.9	Very high	92.6	Very high	31 Å²	31	55.1 Å²	55.1	32%	0.32	27%	0.271	S	S	.	.			trans	-57.5	-100	-169.5	0	0	0	0	0	113.9	R97 S161	R97-G163 PolarHBondContact NE-O 2.73Å; R97-G163 PolarHBondContact NH2-O 2.93Å; S161-G163 PolarHBondContact O-N 3.24Å
164	T	93.7	Very high	91	Very high	71 Å²	71	58 Å²	58	44%	0.436	28%	0.284	S	S	.	.	S	Bend	trans	-91.1	-22.9	178.6	48.2	0	0	0	0	113.2	R96 R97 W104	R96-T164 CarbonylContact C-O 3.6Å; R96-T164 WeakPolarHBondContact CA-O 3.46Å; R97-T164 PolarHBondContact N-O 3.26Å; W104-T164 WeakPolarHBondContact CH2-O 3.35Å
165	D	93.8	Very high	89	Confident	70 Å²	70	58.2 Å²	58.2	37%	0.374	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	130.4	-174.9	-61.9	-100.4	0	0	0	109.4	L95 R96	L95-D165 WeakPolarHBondContact O-CA 3.09Å; R96-D165 WeakPolarHBondContact CG-OD1 3.37Å; R96-D165 IonicContact CZ-OD1 3.88Å; R96-D165 IonicContact NE-OD1 2.92Å; R96-D165 PolarHBondContact NE-OD1 3.31Å
166	L	95.5	Very high	86.6	Confident	0 Å²	0	63 Å²	63	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.7	176.4	170.4	67.2	0	0	0	108.9	V94 L95 W104 F106 I142 I159 A162 L168	V94-L166 WeakPolarHBondContact CA-O 3.36Å; L95-L166 HydrophobicContact CB-CB 4.46Å; L95-L166 HydrophobicContact CD1-CD2 4.38Å; L95-L166 PolarHBondContact N-O 2.73Å; L95-L166 PolarHBondContact O-N 2.89Å; W104-L166 HydrophobicContact CD2-CB 4.19Å; W104-L166 HydrophobicContact CD2-CD2 3.77Å; W104-L166 HydrophobicContact CE3-CB 4.18Å; W104-L166 HydrophobicContact CE3-CD2 4.25Å; W104-L166 HydrophobicContact CG-CD2 4.02Å; W104-L166 HydrophobicContact CH2-CB 3.32Å; W104-L166 HydrophobicContact CZ2-CB 3.31Å; W104-L166 HydrophobicContact CZ2-CD2 4.23Å; W104-L166 HydrophobicContact CZ2-CG 4.34Å; W104-L166 HydrophobicContact CZ3-CB 3.79Å; F106-L166 HydrophobicContact CE1-CD2 4.07Å; F106-L166 HydrophobicContact CZ-CD2 3.98Å; I142-L166 HydrophobicContact CG2-CD1 4.01Å; I159-L166 HydrophobicContact CG1-CD1 4.37Å; I159-L166 HydrophobicContact CG1-CD2 4.45Å; I159-L166 HydrophobicContact CG2-CD2 3.89Å; A162-L166 HydrophobicContact CB-CB 3.97Å; A162-L166 HydrophobicContact CB-CD1 3.61Å; A162-L166 HydrophobicContact CB-CG 4.35Å; L166-L168 HydrophobicContact CD1-CD2 3.92Å; L166-L168 HydrophobicContact CD1-CG 4.37Å; L166-L168 HydrophobicContact CD2-CD1 4.13Å; L166-L168 HydrophobicContact CD2-CD2 4.27Å; L166-L168 HydrophobicContact CD2-CG 4.21Å; L166-L168 HydrophobicContact CG-CD1 4.43Å; L166-L168 HydrophobicContact CG-CD2 4.06Å; L166-L168 HydrophobicContact CG-CG 3.98Å
167	Q	95.9	Very high	84.4	Confident	90 Å²	90	67.1 Å²	67.1	42%	0.421	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	124.6	175	-175.8	176.6	-19.5	0	0	109.5	I93 V94 N143	I93-Q167 CarbonylContact O-C 3.47Å; I93-Q167 WeakPolarHBondContact O-CA 3.2Å; V94-Q167 HydrophobicContact CG2-CG 4.3Å; N143-Q167 PolarHBondContact N-O 2.77Å; N143-Q167 PolarHBondContact OD1-N 2.76Å; N143-Q167 PolarHBondContact OD1-O 3.44Å
168	L	95.7	Very high	82.4	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	138.3	175.7	-60.5	175.6	0	0	0	109	I93 L95 F106 L133 I139 S141 I142 L166 V170	I93-L168 PolarHBondContact N-O 3.07Å; I93-L168 PolarHBondContact O-N 2.96Å; L95-L168 HydrophobicContact CD1-CD1 4.49Å; F106-L168 HydrophobicContact CZ-CD1 4.04Å; L133-L168 HydrophobicContact CD1-CD1 4.09Å; L133-L168 HydrophobicContact CD2-CD1 4.38Å; I139-L168 HydrophobicContact CG2-CD2 4.29Å; S141-L168 WeakPolarHBondContact O-CA 3.32Å; I142-L168 HydrophobicContact CB-CD2 4.21Å; I142-L168 HydrophobicContact CG1-CD2 3.84Å; I142-L168 HydrophobicContact CG2-CD2 4.08Å; L166-L168 HydrophobicContact CD1-CD2 3.92Å; L166-L168 HydrophobicContact CD1-CG 4.37Å; L166-L168 HydrophobicContact CD2-CD1 4.13Å; L166-L168 HydrophobicContact CD2-CD2 4.27Å; L166-L168 HydrophobicContact CD2-CG 4.21Å; L166-L168 HydrophobicContact CG-CD1 4.43Å; L166-L168 HydrophobicContact CG-CD2 4.06Å; L166-L168 HydrophobicContact CG-CG 3.98Å; L168-V170 HydrophobicContact CB-CG1 4.31Å
169	T	95.1	Very high	80.6	Confident	21 Å²	21	68.4 Å²	68.4	13%	0.129	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	121.2	162.1	-56.4	0	0	0	0	107.4	P90 V91 N92 L140 S141	P90-T169 HydrophobicContact CB-CG2 3.73Å; V91-T169 CarbonylContact O-C 3.52Å; V91-T169 WeakPolarHBondContact O-CA 3.4Å; N92-T169 WeakPolarHBondContact OD1-CG2 3.1Å; N92-T169 PolarHBondContact OD1-OG1 3.09Å; L140-T169 WeakPolarHBondContact CA-O 3.13Å; L140-T169 HydrophobicContact CB-CG2 4.31Å; L140-T169 WeakPolarHBondContact CB-O 3.41Å; L140-T169 HydrophobicContact CD1-CG2 4.26Å; L140-T169 PolarHBondContact N-O 3.25Å; S141-T169 PolarHBondContact N-O 2.84Å; S141-T169 PolarHBondContact O-N 2.76Å; S141-T169 WeakPolarHBondContact OG-CB 3.4Å; S141-T169 PolarHBondContact OG-OG1 2.77Å
170	V	94	Very high	78.9	Confident	0 Å²	0	73.9 Å²	73.9	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	146.2	179.8	-56.3	0	0	0	0	111.7	P90 V91 I93 L133 D137 E138 I139 L168	P90-V170 CarbonylContact C-O 3.4Å; V91-V170 HydrophobicContact CB-CG2 4.09Å; V91-V170 PolarHBondContact N-O 2.95Å; V91-V170 PolarHBondContact O-N 2.85Å; I93-V170 HydrophobicContact CD1-CG1 4.4Å; I93-V170 HydrophobicContact CD1-CG2 3.47Å; I93-V170 VanDerWaalsContact CD1-CG2 3.47Å; I93-V170 HydrophobicContact CG1-CG2 4.36Å; L133-V170 HydrophobicContact CD2-CG1 4.13Å; D137-V170 HydrophobicContact CB-CB 4.19Å; D137-V170 HydrophobicContact CB-CG1 4.46Å; D137-V170 HydrophobicContact CB-CG2 4.34Å; E138-V170 CarbonylContact O-C 3.43Å; E138-V170 WeakPolarHBondContact O-CA 3.11Å; I139-V170 HydrophobicContact CG1-CG1 4.43Å; L168-V170 HydrophobicContact CB-CG1 4.31Å
171	A	91.5	Very high	77.5	Confident	0 Å²	0	71.3 Å²	71.3	0%	0	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	118.7	166.9	0	0	0	0	0	108.2	T88 E138 L140 R173	T88-A171 HydrophobicContact CG2-CB 4.17Å; T88-A171 WeakPolarHBondContact OG1-CB 3.44Å; E138-A171 HydrophobicContact CB-CB 4.11Å; E138-A171 PolarHBondContact N-O 3.47Å; E138-A171 PolarHBondContact O-N 3.06Å; L140-A171 HydrophobicContact CD1-CB 3.94Å; L140-A171 HydrophobicContact CD2-CB 4.04Å; L140-A171 HydrophobicContact CG-CB 3.97Å; A171-R173 PolarHBondContact O-N 3.19Å
172	R	86.3	Confident	75.9	Confident	83 Å²	83	76.7 Å²	76.7	31%	0.313	40%	0.398	S	S	.	.			trans	-87.4	103.2	169.6	-56.9	-155.4	176.6	136	-2.1	107.4	V91 I132 D137 Q174	V91-R172 HydrophobicContact CG2-CG 4.27Å; I132-R172 PolarHBondContact O-NH2 2.83Å; D137-R172 WeakPolarHBondContact OD1-CG 3.15Å; D137-R172 IonicContact OD1-NE 3.69Å; D137-R172 IonicContact OD2-NE 3.6Å; R172-Q174 PolarHBondContact O-N 3.3Å
173	R	73.3	Confident	74.9	Confident	105 Å²	105	80.1 Å²	80.1	40%	0.396	42%	0.42	S	S	.	.			trans	-61.7	126.4	160	-81.2	-167.9	-79.3	112.3	0.8	105.5	E86 T88 E138 A171 T175	E86-R173 WeakPolarHBondContact OE2-CD 3.33Å; T88-R173 HydrophobicContact CG2-CG 3.81Å; E138-R173 IonicContact OE1-CZ 2.71Å; E138-R173 IonicContact OE1-NE 2.6Å; E138-R173 PolarHBondContact OE1-NE 2.92Å; E138-R173 IonicContact OE1-NH2 3.17Å; E138-R173 PolarHBondContact OE1-NH2 3.41Å; A171-R173 PolarHBondContact O-N 3.19Å; R173-T175 PolarHBondContact O-N 2.72Å
174	Q	63.2	Low	73.5	Confident	187 Å²	187	88 Å²	88	87%	0.874	45%	0.445	S	S	*	.			trans	-60.5	91.7	164.2	-66.4	179.2	5.6	0	0	104.5	R172 C176	R172-Q174 PolarHBondContact O-N 3.3Å; Q174-C176 PolarHBondContact O-N 2.71Å
175	T	53.4	Low	72.1	Confident	98 Å²	98	87 Å²	87	60%	0.601	45%	0.45	S	S	*	.			trans	-59.7	106.8	166.4	52.7	0	0	0	0	102.4	R173 D177	R173-T175 PolarHBondContact O-N 2.72Å; T175-D177 VanDerWaalsContact C-N 3.34Å; T175-D177 PolarHBondContact O-N 3.42Å
176	C	44.9	Very low	71	Confident	101 Å²	101	91.4 Å²	91.4	68%	0.682	47%	0.472	S	S	*	.			trans	-45.7	110.1	173.9	-54.8	0	0	0	0	105	Q174 L178	Q174-C176 PolarHBondContact O-N 2.71Å; C176-L178 HydrophobicContact CB-CD2 4.13Å; C176-L178 WeakPolarHBondContact O-CG 3.33Å; C176-L178 PolarHBondContact O-N 3.21Å
177	D	48.3	Very low	69.3	Low	115 Å²	115	97 Å²	97	62%	0.615	50%	0.502	S	S	*	.			trans	-66.5	95	-178.3	-170.8	5.6	0	0	0	105	T175 S179 D180	T175-D177 VanDerWaalsContact C-N 3.34Å; T175-D177 PolarHBondContact O-N 3.42Å; D177-S179 PolarHBondContact O-N 3.49Å; D177-S179 WeakPolarHBondContact OD1-CB 3.4Å; D177-S179 PolarHBondContact OD1-N 3.17Å; D177-S179 PolarHBondContact OD1-OG 2.86Å; D177-S179 PolarHBondContact OD2-OG 3Å; D177-D180 PolarHBondContact O-N 3.48Å
178	L	53.1	Low	67.9	Low	116 Å²	116	100.8 Å²	100.8	61%	0.607	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-68.1	3.7	-179.9	-50.6	176.1	0	0	0	110.2	C176 D180 I181	C176-L178 HydrophobicContact CB-CD2 4.13Å; C176-L178 WeakPolarHBondContact O-CG 3.33Å; C176-L178 PolarHBondContact O-N 3.21Å; L178-D180 PolarHBondContact O-N 2.68Å; L178-I181 HydrophobicContact CB-CB 4.37Å; L178-I181 HydrophobicContact CB-CD1 4.02Å; L178-I181 HydrophobicContact CB-CG1 4.19Å; L178-I181 HydrophobicContact CD2-CD1 3.23Å; L178-I181 HydrophobicContact CD2-CG1 4.15Å; L178-I181 HydrophobicContact CG-CD1 4.11Å; L178-I181 WeakPolarHBondContact O-CB 3.34Å; L178-I181 PolarHBondContact O-N 3.4Å
179	S	57.2	Low	66.5	Low	70 Å²	70	109.6 Å²	109.6	49%	0.49	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-54	-29	166.8	72.5	0	0	0	0	112	D177	D177-S179 PolarHBondContact O-N 3.49Å; D177-S179 WeakPolarHBondContact OD1-CB 3.4Å; D177-S179 PolarHBondContact OD1-N 3.17Å; D177-S179 PolarHBondContact OD1-OG 2.86Å; D177-S179 PolarHBondContact OD2-OG 3Å
180	D	57.8	Low	65.5	Low	129 Å²	129	113.9 Å²	113.9	69%	0.69	58%	0.582	S	S	*	*	G	3₁₀ helix	trans	-80.3	-11.9	173.1	-81.9	-31.3	0	0	0	114.5	D177 L178 R182	D177-D180 PolarHBondContact O-N 3.48Å; L178-D180 PolarHBondContact O-N 2.68Å; D180-R182 PolarHBondContact O-N 2.67Å
181	I	62	Low	64.8	Low	119 Å²	119	117.7 Å²	117.7	61%	0.61	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-80.8	0.8	174.8	-56.2	-172.5	0	0	0	111.4	L178 P183	L178-I181 HydrophobicContact CB-CB 4.37Å; L178-I181 HydrophobicContact CB-CD1 4.02Å; L178-I181 HydrophobicContact CB-CG1 4.19Å; L178-I181 HydrophobicContact CD2-CD1 3.23Å; L178-I181 HydrophobicContact CD2-CG1 4.15Å; L178-I181 HydrophobicContact CG-CD1 4.11Å; L178-I181 WeakPolarHBondContact O-CB 3.34Å; L178-I181 PolarHBondContact O-N 3.4Å; I181-P183 WeakPolarHBondContact O-CD 3.48Å
182	R	60.6	Low	64	Low	199 Å²	199	123.8 Å²	123.8	75%	0.751	65%	0.653	S	S	*	*	S	Bend	trans	-62.9	116	169.2	-161.5	171.9	98.5	-178.7	6	108.4	D180 K184	D180-R182 PolarHBondContact O-N 2.67Å; R182-K184 PolarHBondContact O-N 2.91Å
183	P	66.1	Low	63.4	Low	78 Å²	78	128.2 Å²	128.2	51%	0.506	68%	0.677	S	S	.	*			trans	-57.4	115.3	175.8	22.3	-30.8	0	0	0	107.9	I181 G185 L187	I181-P183 WeakPolarHBondContact O-CD 3.48Å; P183-G185 PolarHBondContact O-N 2.71Å; P183-L187 HydrophobicContact CB-CD2 4.25Å; P183-L187 HydrophobicContact CG-CD1 4.22Å; P183-L187 HydrophobicContact CG-CD2 4.17Å; P183-L187 HydrophobicContact CG-CG 4.3Å
184	K	61.2	Low	63.4	Low	195 Å²	195	129.2 Å²	129.2	85%	0.848	69%	0.69	S	S	*	*	S	Bend	trans	-75.7	77.6	173.9	-67.5	-169.1	-177.4	175.2	0	107.8	R182	R182-K184 PolarHBondContact O-N 2.91Å
185	G	66	Low	63.4	Low	52 Å²	52	127.3 Å²	127.3	54%	0.536	69%	0.686	S	S	.	*	S	Bend	trans	175.9	145.8	179.7	0	0	0	0	0	111.4	P183 L187	P183-G185 PolarHBondContact O-N 2.71Å; G185-L187 PolarHBondContact O-N 3.05Å
186	L	69.8	Low	64.3	Low	161 Å²	161	133.4 Å²	133.4	84%	0.843	70%	0.698	S	S	*	*			trans	-60.5	109.9	165.9	-174.7	71	0	0	0	107.2	K188	L186-K188 PolarHBondContact O-N 3.06Å
187	L	60	Low	65.4	Low	119 Å²	119	143.7 Å²	143.7	62%	0.623	72%	0.722	S	S	*	*			trans	-63.9	91	169.7	-67.5	175.6	0	0	0	107.6	P183 G185 F189	P183-L187 HydrophobicContact CB-CD2 4.25Å; P183-L187 HydrophobicContact CG-CD1 4.22Å; P183-L187 HydrophobicContact CG-CD2 4.17Å; P183-L187 HydrophobicContact CG-CG 4.3Å; G185-L187 PolarHBondContact O-N 3.05Å; L187-F189 VanDerWaalsContact C-N 3.34Å; L187-F189 HydrophobicContact CB-CD2 4.27Å; L187-F189 HydrophobicContact CB-CE2 4.13Å; L187-F189 HydrophobicContact CD1-CE2 4.45Å; L187-F189 PolarHBondContact O-N 3.29Å
188	K	67.1	Low	66.3	Low	168 Å²	168	145.1 Å²	145.1	73%	0.73	73%	0.728	S	S	*	*			trans	-81.9	86	177.4	-168.9	168.6	-177.4	171.8	0	108.4	L186 T190	L186-K188 PolarHBondContact O-N 3.06Å; K188-T190 HydrophobicContact CG-CG2 4.28Å; K188-T190 PolarHBondContact O-N 3.02Å
189	F	65.5	Low	66.9	Low	186 Å²	186	146.6 Å²	146.6	82%	0.816	73%	0.734	S	S	*	*			trans	-69.7	96.8	164.3	-77.5	-83.1	0	0	0	108.7	L187	L187-F189 VanDerWaalsContact C-N 3.34Å; L187-F189 HydrophobicContact CB-CD2 4.27Å; L187-F189 HydrophobicContact CB-CE2 4.13Å; L187-F189 HydrophobicContact CD1-CE2 4.45Å; L187-F189 PolarHBondContact O-N 3.29Å
190	T	74.7	Confident	67.5	Low	111 Å²	111	150.9 Å²	150.9	68%	0.681	75%	0.748	S	S	*	*			trans	-83.6	114.3	163.5	34.8	0	0	0	0	108.8	K188	K188-T190 HydrophobicContact CG-CG2 4.28Å; K188-T190 PolarHBondContact O-N 3.02Å
191	A	78.6	Confident	68.1	Low	80 Å²	80	152.2 Å²	152.2	66%	0.661	75%	0.751	S	S	*	*			trans	-61.5	138.6	174.2	0	0	0	0	0	110.5	Q193	A191-Q193 PolarHBondContact O-N 3.43Å
192	P	74.9	Confident	68.4	Low	128 Å²	128	154.3 Å²	154.3	83%	0.831	76%	0.76	S	S	*	*			trans	-66.3	119.6	177.5	25.1	-30.8	0	0	0	110.2	N194	P192-N194 PolarHBondContact O-N 2.92Å
193	Q	74.3	Confident	69	Low	175 Å²	175	151.3 Å²	151.3	82%	0.818	76%	0.76	S	S	*	*			trans	-80.2	105.8	171.4	-72.1	-75.9	-24.8	0	0	108.5	A191 N195	A191-Q193 PolarHBondContact O-N 3.43Å; Q193-N195 PolarHBondContact O-N 2.72Å
194	N	73.8	Confident	69.2	Low	127 Å²	127	156.5 Å²	156.5	68%	0.679	78%	0.778	S	S	*	*			trans	-88.7	97.6	172.1	-174.2	6.5	0	0	0	109.5	P192 R196	P192-N194 PolarHBondContact O-N 2.92Å; N194-R196 PolarHBondContact O-N 2.73Å; N194-R196 VanDerWaalsContact O-N 3.16Å
195	N	62.5	Low	69.8	Low	147 Å²	147	153.5 Å²	153.5	79%	0.786	77%	0.773	S	S	*	*			trans	-74.9	98.4	165.4	-98.6	7	0	0	0	108.7	Q193 R197	Q193-N195 PolarHBondContact O-N 2.72Å; N195-R197 PolarHBondContact O-N 3.37Å
196	R	71.9	Confident	70.1	Confident	225 Å²	225	162 Å²	162	85%	0.849	79%	0.793	S	S	*	*			trans	-67.5	115.3	161.2	-73.9	-172.1	-177.7	166.4	0.8	108.3	N194	N194-R196 PolarHBondContact O-N 2.73Å; N194-R196 VanDerWaalsContact O-N 3.16Å
197	R	68.2	Low	70.1	Confident	317 Å²	317	162.1 Å²	162.1	100%	1.196	79%	0.788	S	S	*	*			trans	-71.1	0	158.1	-86.4	-176.4	168.4	170.9	-3.3	110.2	N195	N195-R197 PolarHBondContact O-N 3.37Å

Retrieved 197 of 197 residues in 267.9 ms (Link to these results)

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