A0A077Z8Z1_TRITR Loading...

Zf-C2H2 3 and Acetyltransf 13 domain containing p rotein

AlphaFold DB , UniProt , Accession A0A077Z8Z1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 260 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	35.4	Very low	38.3	Very low	235 Å²	235	139.5 Å²	139.5	100%	1.158	72%	0.721	S	S	*	*				0	102.5	0	-66.4	170.1	-179.2	0	0	108.5
2	R	35.2	Very low	38.3	Very low	245 Å²	245	133.2 Å²	133.2	93%	0.925	71%	0.705	S	S	*	*			trans	-91.6	100.5	165.4	-79.7	-175.8	177.7	177.9	-1.8	105.6	T4	R2-T4 PolarHBondContact O-N 3.22Å
3	Q	32.4	Very low	37.9	Very low	170 Å²	170	133.8 Å²	133.8	79%	0.794	72%	0.721	S	S	*	*			trans	-62.2	102.9	167.9	-71.2	174.6	-7.6	0	0	106.4	T5	Q3-T5 VanDerWaalsContact C-N 3.28Å; Q3-T5 PolarHBondContact O-N 3.4Å
4	T	40.4	Very low	37.9	Very low	136 Å²	136	130.1 Å²	130.1	83%	0.834	73%	0.73	S	S	*	*			trans	-66.2	95.5	166	27.6	0	0	0	0	106.7	R2	R2-T4 PolarHBondContact O-N 3.22Å
5	T	36.2	Very low	37.9	Very low	89 Å²	89	125.1 Å²	125.1	55%	0.546	71%	0.712	S	S	.	*			trans	-65.2	144.1	177.4	44	0	0	0	0	109.7	Q3 S7 Y8	Q3-T5 VanDerWaalsContact C-N 3.28Å; Q3-T5 PolarHBondContact O-N 3.4Å; T5-S7 PolarHBondContact O-N 3.35Å; T5-S7 PolarHBondContact OG1-OG 2.82Å; T5-Y8 PolarHBondContact O-N 2.88Å
6	L	38.2	Very low	37.7	Very low	138 Å²	138	129.7 Å²	129.7	72%	0.723	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-54.7	-8.1	-179.6	-88.3	160.6	0	0	0	114.7	Y8 C9	L6-Y8 PolarHBondContact O-N 3.21Å; L6-C9 PolarHBondContact O-N 3.4Å; L6-C9 VanDerWaalsContact O-N 3.14Å
7	S	38.4	Very low	37.5	Very low	77 Å²	77	131.3 Å²	131.3	54%	0.538	72%	0.719	S	S	.	*	G	3₁₀ helix	trans	-60.1	-22.9	174.7	55.3	0	0	0	0	113.4	T5 C9 F10	T5-S7 PolarHBondContact O-N 3.35Å; T5-S7 PolarHBondContact OG1-OG 2.82Å; S7-C9 PolarHBondContact O-N 3.17Å; S7-F10 PolarHBondContact O-N 3.43Å
8	Y	39.5	Very low	37.7	Very low	171 Å²	171	133.6 Å²	133.6	67%	0.671	72%	0.721	S	S	*	*	G	3₁₀ helix	trans	-64.9	-24.9	175.8	-160.9	-97.7	0	0	0	113.2	T5 L6	T5-Y8 PolarHBondContact O-N 2.88Å; L6-Y8 PolarHBondContact O-N 3.21Å
9	C	42.8	Very low	37.6	Very low	66 Å²	66	131.7 Å²	131.7	45%	0.446	72%	0.718	S	S	.	*	G	3₁₀ helix	trans	-85	-22.2	-178.9	-62.6	0	0	0	0	113.1	L6 S7	L6-C9 PolarHBondContact O-N 3.4Å; L6-C9 VanDerWaalsContact O-N 3.14Å; S7-C9 PolarHBondContact O-N 3.17Å
10	F	44.7	Very low	37.3	Very low	142 Å²	142	131.5 Å²	131.5	62%	0.623	72%	0.716	S	S	*	*	S	Bend	trans	-113	83.9	-176.9	-61.2	-73.8	0	0	0	108.8	S7 A12	S7-F10 PolarHBondContact O-N 3.43Å; F10-A12 PolarHBondContact O-N 3.38Å
11	G	38.1	Very low	37	Very low	65 Å²	65	131.4 Å²	131.4	67%	0.67	73%	0.725	S	S	*	*			trans	-38	107.3	-168.8	0	0	0	0	0	115.6
12	A	38.1	Very low	36.9	Very low	64 Å²	64	124.9 Å²	124.9	53%	0.529	70%	0.702	S	S	.	*			trans	-66.2	147.2	159	0	0	0	0	0	109.9	F10 G14 A15	F10-A12 PolarHBondContact O-N 3.38Å; A12-G14 PolarHBondContact O-N 3.02Å; A12-G14 VanDerWaalsContact O-N 3.09Å; A12-A15 PolarHBondContact O-N 3.39Å; A12-A15 VanDerWaalsContact O-N 3.15Å
13	P	33.8	Very low	36.7	Very low	142 Å²	142	119.1 Å²	119.1	92%	0.922	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.6	115.7	172.6	-13.6	26.7	0	0	0	109.1
14	G	37.4	Very low	37	Very low	81 Å²	81	116.9 Å²	116.9	84%	0.835	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	116.4	-9.7	-176.9	0	0	0	0	0	115.1	A12 K16	A12-G14 PolarHBondContact O-N 3.02Å; A12-G14 VanDerWaalsContact O-N 3.09Å; G14-K16 PolarHBondContact O-N 2.87Å
15	A	37.7	Very low	36.7	Very low	56 Å²	56	115 Å²	115	46%	0.463	70%	0.698	S	S	.	*	P	Polyproline II helix	trans	-73.1	117.8	170.8	0	0	0	0	0	110.4	A12 K17	A12-A15 PolarHBondContact O-N 3.39Å; A12-A15 VanDerWaalsContact O-N 3.15Å; A15-K17 PolarHBondContact O-N 2.61Å
16	K	34.4	Very low	36.6	Very low	198 Å²	198	122.3 Å²	122.3	86%	0.861	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-57.4	126.3	173.8	-68	-174.4	178.2	-177.1	0	109.1	G14 F18	G14-K16 PolarHBondContact O-N 2.87Å; K16-F18 PolarHBondContact O-N 2.91Å
17	K	34.8	Very low	36.5	Very low	157 Å²	157	121.5 Å²	121.5	68%	0.683	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-59.5	128.9	173.9	-71.1	179.3	-179.1	172.5	0	108.2	A15 C19 D20	A15-K17 PolarHBondContact O-N 2.61Å; K17-C19 PolarHBondContact O-N 2.68Å; K17-D20 PolarHBondContact O-N 2.8Å
18	F	41.1	Very low	36.5	Very low	173 Å²	173	123 Å²	123	76%	0.759	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.2	-5.9	-180	-146.8	-92.9	0	0	0	113.3	K16	K16-F18 PolarHBondContact O-N 2.91Å
19	C	35	Very low	36.6	Very low	97 Å²	97	121.2 Å²	121.2	66%	0.655	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.8	36.7	-179.3	61.8	0	0	0	0	113.4	K17	K17-C19 PolarHBondContact O-N 2.68Å
20	D	32.3	Very low	36.6	Very low	128 Å²	128	121 Å²	121	68%	0.684	75%	0.748	S	S	*	*			trans	-121.8	94.3	164	-73.7	-37.3	0	0	0	108.6	K17 S22	K17-D20 PolarHBondContact O-N 2.8Å; D20-S22 PolarHBondContact O-N 3.36Å
21	S	31.5	Very low	36.3	Very low	129 Å²	129	123.8 Å²	123.8	90%	0.902	76%	0.763	S	S	*	*			trans	-81.9	94.1	173.3	-59.8	0	0	0	0	108.6
22	S	32.6	Very low	36.4	Very low	98 Å²	98	128.9 Å²	128.9	69%	0.685	77%	0.771	S	S	*	*			trans	-130.3	110.2	159.1	61.4	0	0	0	0	108.3	D20 P24	D20-S22 PolarHBondContact O-N 3.36Å; S22-P24 WeakPolarHBondContact O-CD 3.42Å
23	S	31.1	Very low	36.7	Very low	125 Å²	125	131.1 Å²	131.1	87%	0.874	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-57.1	124.2	-179.3	-59.5	0	0	0	0	111.9
24	P	38.2	Very low	37.3	Very low	123 Å²	123	131.2 Å²	131.2	80%	0.799	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-87.7	141.6	160.2	-1.8	21.7	0	0	0	109.9	S22	S22-P24 WeakPolarHBondContact O-CD 3.42Å
25	A	35	Very low	37.9	Very low	95 Å²	95	136.2 Å²	136.2	79%	0.785	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-57.3	152.6	176.8	0	0	0	0	0	113.3	P27	A25-P27 WeakPolarHBondContact O-CD 3.45Å
26	R	34.6	Very low	38.9	Very low	243 Å²	243	138.7 Å²	138.7	92%	0.917	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.3	120.8	-174.2	-168.4	178.7	-164.8	-140.1	3.9	112.4
27	P	35.5	Very low	40.2	Very low	121 Å²	121	136 Å²	136	79%	0.786	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-79	143.5	166.6	-7.6	24.8	0	0	0	110.9	A25	A25-P27 WeakPolarHBondContact O-CD 3.45Å
28	S	37.6	Very low	41.8	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-64.4	154.6	177.6	-58.1	0	0	0	0	112.9	G30	S28-G30 PolarHBondContact O-N 3.1Å
29	P	43.2	Very low	43.1	Very low	134 Å²	134	132 Å²	132	87%	0.87	78%	0.779	S	S	*	*			trans	-77.8	85.1	-173.1	30.5	-30	0	0	0	110.8
30	G	41.9	Very low	45.2	Very low	62 Å²	62	131 Å²	131	64%	0.639	77%	0.767	S	S	*	*			trans	-87.6	122.4	164.7	0	0	0	0	0	109.7	S28 M32	S28-G30 PolarHBondContact O-N 3.1Å; G30-M32 PolarHBondContact O-N 3.36Å; G30-M32 VanDerWaalsContact O-N 3.15Å
31	Q	39.3	Very low	47.4	Very low	200 Å²	200	130.9 Å²	130.9	94%	0.935	77%	0.774	S	S	*	*			trans	-44.4	113.4	180	-68.5	165.9	-20	0	0	112.1
32	M	39.2	Very low	49.9	Very low	172 Å²	172	133 Å²	133	85%	0.847	77%	0.767	S	S	*	*			trans	-92.8	140.9	164.5	-79.1	-168	81.8	0	0	109.9	G30 T34	G30-M32 PolarHBondContact O-N 3.36Å; G30-M32 VanDerWaalsContact O-N 3.15Å; M32-T34 PolarHBondContact O-N 2.85Å
33	P	45.1	Very low	52.2	Low	110 Å²	110	132.4 Å²	132.4	71%	0.714	75%	0.753	S	S	*	*			trans	-61.5	133.8	-176.7	-15.9	28.1	0	0	0	110.5	K35	P33-K35 PolarHBondContact O-N 3.49Å
34	T	46.9	Very low	54.6	Low	145 Å²	145	134.3 Å²	134.3	89%	0.89	75%	0.753	S	S	*	*			trans	-61.4	85.1	171.9	47.2	0	0	0	0	109.4	M32 S36	M32-T34 PolarHBondContact O-N 2.85Å; T34-S36 PolarHBondContact O-N 2.57Å
35	K	49.4	Very low	56.2	Low	186 Å²	186	133.3 Å²	133.3	81%	0.809	74%	0.744	S	S	*	*			trans	-63.1	123.8	162	-73.6	-178.3	178.4	177	0	106.1	P33 L37	P33-K35 PolarHBondContact O-N 3.49Å; K35-L37 PolarHBondContact O-N 3.13Å
36	S	57.4	Low	58	Low	108 Å²	108	135.6 Å²	135.6	76%	0.755	74%	0.742	S	S	*	*			trans	-29.7	122.8	173.6	-177.7	0	0	0	0	110.8	T34 N38	T34-S36 PolarHBondContact O-N 2.57Å; S36-N38 PolarHBondContact O-N 2.95Å
37	L	62.4	Low	59.3	Low	140 Å²	140	130.1 Å²	130.1	73%	0.733	73%	0.73	S	S	*	*			trans	-51.2	136.6	166.3	-65.6	169.5	0	0	0	107.7	K35 N39	K35-L37 PolarHBondContact O-N 3.13Å; L37-N39 VanDerWaalsContact C-N 3.34Å; L37-N39 PolarHBondContact O-N 2.89Å
38	N	67.6	Low	61	Low	114 Å²	114	128.3 Å²	128.3	61%	0.61	73%	0.726	S	S	*	*			trans	-67.4	97.3	172.1	-174.6	24.4	0	0	0	107.5	S36 D40 Q43	S36-N38 PolarHBondContact O-N 2.95Å; N38-D40 PolarHBondContact O-N 3.04Å; N38-Q43 PolarHBondContact ND2-OE1 3.31Å
39	N	69.9	Low	62.3	Low	133 Å²	133	126 Å²	126	71%	0.711	72%	0.719	S	S	*	*			trans	-85.2	30.6	-179.9	-73.8	-18.4	0	0	0	112	L37 P41	L37-N39 VanDerWaalsContact C-N 3.34Å; L37-N39 PolarHBondContact O-N 2.89Å; N39-P41 WeakPolarHBondContact O-CD 3.19Å
40	D	78	Confident	63.3	Low	75 Å²	75	126.7 Å²	126.7	40%	0.401	71%	0.71	S	S	.	*			trans	-69.4	112.1	174.6	-175.5	-3	0	0	0	109	N38 K42 Q43	N38-D40 PolarHBondContact O-N 3.04Å; D40-K42 PolarHBondContact O-N 2.83Å; D40-K42 VanDerWaalsContact O-N 3.1Å; D40-K42 VanDerWaalsContact OD1-CB 3.31Å; D40-K42 WeakPolarHBondContact OD1-CB 3.47Å; D40-K42 PolarHBondContact OD1-N 2.83Å; D40-Q43 HydrophobicContact CB-CB 4.36Å; D40-Q43 VanDerWaalsContact O-CB 3.25Å; D40-Q43 WeakPolarHBondContact O-CB 3.41Å; D40-Q43 PolarHBondContact O-N 3.39Å
41	P	80	Confident	64.4	Low	127 Å²	127	133.3 Å²	133.3	83%	0.825	72%	0.722	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-12.8	178.1	29	-35.7	0	0	0	112.7	N39 Q43	N39-P41 WeakPolarHBondContact O-CD 3.19Å; P41-Q43 VanDerWaalsContact C-N 3.34Å
42	K	83.8	Confident	65.5	Low	174 Å²	174	131.9 Å²	131.9	76%	0.757	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-4	172.5	-59.3	-177.7	178.7	179.7	0	113.2	D40 L44	D40-K42 PolarHBondContact O-N 2.83Å; D40-K42 VanDerWaalsContact O-N 3.1Å; D40-K42 VanDerWaalsContact OD1-CB 3.31Å; D40-K42 WeakPolarHBondContact OD1-CB 3.47Å; D40-K42 PolarHBondContact OD1-N 2.83Å; K42-L44 PolarHBondContact O-N 2.78Å
43	Q	81.1	Confident	66.7	Low	84 Å²	84	130.6 Å²	130.6	39%	0.393	71%	0.705	S	S	.	*			trans	-69.9	96.2	177.2	-171.9	-176.3	-53.8	0	0	109.9	N38 D40 P41 V45	N38-Q43 PolarHBondContact ND2-OE1 3.31Å; D40-Q43 HydrophobicContact CB-CB 4.36Å; D40-Q43 VanDerWaalsContact O-CB 3.25Å; D40-Q43 WeakPolarHBondContact O-CB 3.41Å; D40-Q43 PolarHBondContact O-N 3.39Å; P41-Q43 VanDerWaalsContact C-N 3.34Å; Q43-V45 VanDerWaalsContact C-N 3.31Å; Q43-V45 WeakPolarHBondContact CG-O 3.41Å; Q43-V45 PolarHBondContact NE2-O 3.34Å
44	L	80.5	Confident	68.2	Low	166 Å²	166	127.6 Å²	127.6	87%	0.869	69%	0.685	S	S	*	*			trans	-81.1	-11.4	176.5	-61.3	-180	0	0	0	113.6	K42	K42-L44 PolarHBondContact O-N 2.78Å
45	V	71.1	Confident	70.2	Confident	101 Å²	101	124.5 Å²	124.5	61%	0.612	67%	0.666	S	S	*	*			trans	-110.8	117.3	-174.1	-177	0	0	0	0	109.4	Q43	Q43-V45 VanDerWaalsContact C-N 3.31Å; Q43-V45 WeakPolarHBondContact CG-O 3.41Å; Q43-V45 PolarHBondContact NE2-O 3.34Å
46	I	73	Confident	72	Confident	144 Å²	144	123.2 Å²	123.2	74%	0.738	66%	0.656	S	S	*	*			trans	-100.7	107	172.2	-57.4	175.3	0	0	0	107.4	A48	I46-A48 HydrophobicContact CG2-CB 4.43Å; I46-A48 PolarHBondContact O-N 2.83Å
47	D	63	Low	73.6	Confident	128 Å²	128	122.2 Å²	122.2	68%	0.684	65%	0.648	S	S	*	*			trans	-82	91.7	170.4	-171.9	-6.1	0	0	0	109.2	G49	D47-G49 PolarHBondContact O-N 2.63Å; D47-G49 PolarHBondContact OD1-N 2.86Å
48	A	70.7	Confident	74.9	Confident	83 Å²	83	116.2 Å²	116.2	69%	0.686	62%	0.618	S	S	*	*			trans	-86.2	29.7	180	0	0	0	0	0	113.3	I46 Q50	I46-A48 HydrophobicContact CG2-CB 4.43Å; I46-A48 PolarHBondContact O-N 2.83Å; A48-Q50 PolarHBondContact O-N 3.12Å
49	G	65.9	Low	75.8	Confident	60 Å²	60	114.9 Å²	114.9	62%	0.619	62%	0.622	S	S	*	*			trans	68.2	33.2	171.6	0	0	0	0	0	114.7	D47 K51	D47-G49 PolarHBondContact O-N 2.63Å; D47-G49 PolarHBondContact OD1-N 2.86Å; G49-K51 PolarHBondContact O-N 3.48Å
50	Q	62.9	Low	76.5	Confident	148 Å²	148	112.2 Å²	112.2	69%	0.692	61%	0.611	S	S	*	*			trans	-63.5	124.3	174.8	-74.2	-176.1	2.2	0	0	110.3	A48 H52	A48-Q50 PolarHBondContact O-N 3.12Å; Q50-H52 PolarHBondContact O-N 2.69Å
51	K	66.3	Low	76.8	Confident	202 Å²	202	109 Å²	109	88%	0.878	59%	0.594	S	S	*	*	S	Bend	trans	-65.1	-17.6	179.6	-65.5	179.9	180	176.4	0	113.4	G49	G49-K51 PolarHBondContact O-N 3.48Å
52	H	61.4	Low	77.1	Confident	169 Å²	169	111.9 Å²	111.9	78%	0.782	59%	0.588	S	S	*	*	S	Bend	trans	-95.5	101.8	171.6	-95.5	2.2	0	0	0	109.4	Q50	Q50-H52 PolarHBondContact O-N 2.69Å
53	F	64.7	Low	77.4	Confident	146 Å²	146	105.2 Å²	105.2	64%	0.64	56%	0.56	S	S	*	*			trans	-68.5	127.3	174.2	-79.1	-90	0	0	0	109.5	V55	F53-V55 PolarHBondContact O-N 2.67Å
54	P	76.9	Confident	77.9	Confident	47 Å²	47	103.5 Å²	103.5	31%	0.305	56%	0.557	S	S	.	*	S	Bend	trans	-72.6	-18.8	-176	31.2	-37.6	0	0	0	112	R56 N66 P67 D68	P54-R56 PolarHBondContact O-N 2.93Å; P54-N66 WeakPolarHBondContact CB-OD1 3.34Å; P54-N66 VanDerWaalsContact CG-ND2 3.27Å; P54-N66 WeakPolarHBondContact CG-ND2 3.23Å; P54-P67 WeakPolarHBondContact O-CD 3.23Å; P54-D68 WeakPolarHBondContact CB-OD2 3.35Å
55	V	87.5	Confident	78.5	Confident	79 Å²	79	97.8 Å²	97.8	48%	0.479	52%	0.524	S	S	.	.			trans	-67	116.3	177.1	-176.9	0	0	0	0	110.6	F53 P64 Y65 N66	F53-V55 PolarHBondContact O-N 2.67Å; V55-P64 HydrophobicContact CG1-CB 3.68Å; V55-Y65 CarbonylContact C-O 3.57Å; V55-Y65 WeakPolarHBondContact CA-O 3.27Å; V55-N66 HydrophobicContact CG2-CB 4.37Å
56	R	88.8	Confident	79.5	Confident	159 Å²	159	93.8 Å²	93.8	60%	0.6	50%	0.499	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.5	147.3	175.6	-60.1	-177	-174.3	-174.2	3	110	P54 P64 Y65 P67	P54-R56 PolarHBondContact O-N 2.93Å; R56-P64 CarbonylContact O-C 3.5Å; R56-P64 VanDerWaalsContact O-CA 3.3Å; R56-P64 WeakPolarHBondContact O-CA 3.37Å; R56-Y65 HydrophobicContact CB-CE1 4.39Å; R56-Y65 PolarHBondContact N-O 3.18Å; R56-Y65 VanDerWaalsContact O-CD1 3.31Å; R56-Y65 WeakPolarHBondContact O-CD1 3.34Å; R56-Y65 PolarHBondContact O-N 2.9Å; R56-P67 HydrophobicContact CG-CG 4.38Å
57	C	90.9	Very high	80.3	Confident	87 Å²	87	88.7 Å²	88.7	59%	0.588	48%	0.475	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.7	126.4	169.5	-66.8	0	0	0	0	109.9	A59	C57-A59 PolarHBondContact O-N 3.26Å
58	C	89.9	Confident	81.5	Confident	15 Å²	15	88.4 Å²	88.4	10%	0.101	47%	0.474	C	S	.	.			trans	-62.2	131.4	174.8	-179.7	0	0	0	0	111.3	V60 C61 R62 M63 Y65 H76 H80	C58-V60 PolarHBondContact O-N 3.42Å; C58-C61 HydrophobicContact CB-CB 4.47Å; C58-C61 WeakPolarHBondContact CB-SG 3.32Å; C58-C61 PolarHBondContact SG-N 3.36Å; C58-C61 PolarHBondContact SG-SG 2.94Å; C58-R62 WeakPolarHBondContact O-CA 3.3Å; C58-R62 WeakPolarHBondContact O-CD 3.43Å; C58-R62 PolarHBondContact O-N 3.44Å; C58-M63 PolarHBondContact N-O 3.4Å; C58-Y65 HydrophobicContact CB-CE1 4.2Å; C58-H76 WeakPolarHBondContact CB-NE2 3.45Å; C58-H76 PolarHBondContact SG-NE2 3.45Å; C58-H76 VanDerWaalsContact SG-NE2 3.37Å; C58-H80 PolarHBondContact SG-ND1 3.26Å
59	A	85.9	Confident	82.4	Confident	85 Å²	85	88.2 Å²	88.2	70%	0.702	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-29.3	-178.5	0	0	0	0	0	113.4	C57 R62	C57-A59 PolarHBondContact O-N 3.26Å; A59-R62 PolarHBondContact O-NE 2.96Å; A59-R62 VanDerWaalsContact O-NE 3.16Å
60	V	83.6	Confident	83.6	Confident	78 Å²	78	88.5 Å²	88.5	47%	0.473	46%	0.457	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-60.5	-177.1	-176.7	0	0	0	0	111.2	C58 T84	C58-V60 PolarHBondContact O-N 3.42Å; V60-T84 HydrophobicContact CG1-CG2 3.76Å
61	C	85.7	Confident	85	Confident	7 Å²	7	86.9 Å²	86.9	5%	0.047	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-12.8	-173.4	82.5	0	0	0	0	113	C58 M63 H76 Y79 H80 I83	C58-C61 HydrophobicContact CB-CB 4.47Å; C58-C61 WeakPolarHBondContact CB-SG 3.32Å; C58-C61 PolarHBondContact SG-N 3.36Å; C58-C61 PolarHBondContact SG-SG 2.94Å; C61-M63 PolarHBondContact O-N 2.89Å; C61-M63 VanDerWaalsContact SG-CB 3.51Å; C61-H76 VanDerWaalsContact SG-CD2 3.57Å; C61-H76 PolarHBondContact SG-NE2 2.92Å; C61-Y79 HydrophobicContact CB-CD1 4.31Å; C61-Y79 HydrophobicContact CB-CE1 4.24Å; C61-H80 HydrophobicContact CB-CB 4.25Å; C61-I83 HydrophobicContact CB-CD1 3.6Å; C61-I83 HydrophobicContact CB-CG1 3.87Å
62	R	85.6	Confident	86.3	Confident	187 Å²	187	80.1 Å²	80.1	71%	0.706	43%	0.427	S	S	*	.			trans	58.6	8.3	-177.8	-57.3	-61.3	-177.2	104.6	-0.9	115.5	C58 A59 P64	C58-R62 WeakPolarHBondContact O-CA 3.3Å; C58-R62 WeakPolarHBondContact O-CD 3.43Å; C58-R62 PolarHBondContact O-N 3.44Å; A59-R62 PolarHBondContact O-NE 2.96Å; A59-R62 VanDerWaalsContact O-NE 3.16Å; R62-P64 WeakPolarHBondContact O-CD 3.34Å
63	M	89.2	Confident	87.9	Confident	35 Å²	35	74.9 Å²	74.9	17%	0.172	41%	0.406	C	S	.	.			trans	-71	127.1	173.7	-158.3	-171.7	90.9	0	0	109.8	C58 C61 H76 Y79	C58-M63 PolarHBondContact N-O 3.4Å; C61-M63 PolarHBondContact O-N 2.89Å; C61-M63 VanDerWaalsContact SG-CB 3.51Å; M63-H76 HydrophobicContact CE-CB 3.48Å; M63-H76 VanDerWaalsContact CE-CB 3.48Å; M63-Y79 HydrophobicContact CB-CD1 3.8Å; M63-Y79 HydrophobicContact CB-CE1 3.93Å; M63-Y79 HydrophobicContact CG-CD1 3.98Å; M63-Y79 HydrophobicContact CG-CE1 4.25Å; M63-Y79 HydrophobicContact CG-CG 4.42Å; M63-Y79 VanDerWaalsContact SD-CB 3.51Å; M63-Y79 HydrophobicContact SD-CD1 3.53Å; M63-Y79 VanDerWaalsContact SD-CD1 3.53Å; M63-Y79 HydrophobicContact SD-CD2 4.26Å; M63-Y79 HydrophobicContact SD-CE1 4.33Å; M63-Y79 HydrophobicContact SD-CG 3.49Å
64	P	91.7	Very high	89.4	Confident	48 Å²	48	73.3 Å²	73.3	31%	0.312	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	135.7	165.8	-14.8	29.9	0	0	0	109.9	V55 R56 R62	V55-P64 HydrophobicContact CG1-CB 3.68Å; R56-P64 CarbonylContact O-C 3.5Å; R56-P64 VanDerWaalsContact O-CA 3.3Å; R56-P64 WeakPolarHBondContact O-CA 3.37Å; R62-P64 WeakPolarHBondContact O-CD 3.34Å
65	Y	93.6	Very high	90.3	Very high	45 Å²	45	75.7 Å²	75.7	18%	0.176	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	147.3	176.2	74.5	-75.2	0	0	0	110.3	V55 R56 C58 P67 V73 H76	V55-Y65 CarbonylContact C-O 3.57Å; V55-Y65 WeakPolarHBondContact CA-O 3.27Å; R56-Y65 HydrophobicContact CB-CE1 4.39Å; R56-Y65 PolarHBondContact N-O 3.18Å; R56-Y65 VanDerWaalsContact O-CD1 3.31Å; R56-Y65 WeakPolarHBondContact O-CD1 3.34Å; R56-Y65 PolarHBondContact O-N 2.9Å; C58-Y65 HydrophobicContact CB-CE1 4.2Å; Y65-P67 HydrophobicContact CE2-CB 4.01Å; Y65-V73 HydrophobicContact CD2-CG2 4.44Å; Y65-H76 HydrophobicContact CD1-CB 4.4Å; Y65-H76 AromaticContact CD1-CD2 3.84Å; Y65-H76 AromaticContact CD1-CG 3.93Å; Y65-H76 HydrophobicContact CD2-CB 4.07Å; Y65-H76 HydrophobicContact CG-CB 3.86Å; Y65-H76 AromaticContact CG-CG 3.85Å
66	N	91.7	Very high	90.7	Very high	17 Å²	17	73.1 Å²	73.1	9%	0.091	39%	0.389	C	S	.	.			trans	-87.5	116.7	170.7	-173.6	-21.7	0	0	0	109.9	P54 V55 D68 L69 D72	P54-N66 WeakPolarHBondContact CB-OD1 3.34Å; P54-N66 VanDerWaalsContact CG-ND2 3.27Å; P54-N66 WeakPolarHBondContact CG-ND2 3.23Å; V55-N66 HydrophobicContact CG2-CB 4.37Å; N66-D68 PolarHBondContact O-N 3.41Å; N66-D68 WeakPolarHBondContact OD1-CA 3.31Å; N66-D68 VanDerWaalsContact OD1-CB 3.3Å; N66-D68 WeakPolarHBondContact OD1-CB 3.34Å; N66-D68 PolarHBondContact OD1-N 2.87Å; N66-L69 HydrophobicContact CB-CB 4.17Å; N66-L69 HydrophobicContact CB-CD1 3.93Å; N66-L69 HydrophobicContact CB-CG 4.02Å; N66-L69 PolarHBondContact O-N 2.83Å; N66-D72 HydrophobicContact CB-CB 4.29Å; N66-D72 VanDerWaalsContact CB-OD2 3.29Å; N66-D72 WeakPolarHBondContact CB-OD2 3.4Å; N66-D72 PolarHBondContact N-OD2 3.38Å; N66-D72 VanDerWaalsContact O-CB 3.32Å; N66-D72 WeakPolarHBondContact O-CB 3.28Å
67	P	89.8	Confident	90.9	Very high	38 Å²	38	68.1 Å²	68.1	25%	0.247	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-18.1	178.2	32.8	-34.2	0	0	0	113.1	P54 R56 Y65 V73	P54-P67 WeakPolarHBondContact O-CD 3.23Å; R56-P67 HydrophobicContact CG-CG 4.38Å; Y65-P67 HydrophobicContact CE2-CB 4.01Å; P67-V73 WeakPolarHBondContact O-CG2 3.21Å
68	D	88.3	Confident	91.1	Very high	122 Å²	122	72.2 Å²	72.2	65%	0.652	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-12.3	180	-51.9	-40.9	0	0	0	112	P54 N66	P54-D68 WeakPolarHBondContact CB-OD2 3.35Å; N66-D68 PolarHBondContact O-N 3.41Å; N66-D68 WeakPolarHBondContact OD1-CA 3.31Å; N66-D68 VanDerWaalsContact OD1-CB 3.3Å; N66-D68 WeakPolarHBondContact OD1-CB 3.34Å; N66-D68 PolarHBondContact OD1-N 2.87Å
69	L	89.6	Confident	91.1	Very high	79 Å²	79	74.2 Å²	74.2	41%	0.414	39%	0.391	S	S	.	.	S	Bend	trans	-102.6	115.9	175.4	-62.4	178.3	0	0	0	110.1	N66 D71 D72 V73	N66-L69 HydrophobicContact CB-CB 4.17Å; N66-L69 HydrophobicContact CB-CD1 3.93Å; N66-L69 HydrophobicContact CB-CG 4.02Å; N66-L69 PolarHBondContact O-N 2.83Å; L69-D71 PolarHBondContact O-N 2.84Å; L69-D72 HydrophobicContact CB-CB 4.07Å; L69-D72 PolarHBondContact O-N 3.34Å; L69-V73 WeakPolarHBondContact O-CG2 3.32Å; L69-V73 PolarHBondContact O-N 3.34Å; L69-V73 VanDerWaalsContact O-N 3.08Å
70	A	90.6	Very high	91.3	Very high	66 Å²	66	72.5 Å²	72.5	55%	0.545	37%	0.368	S	S	.	.	H	α-helix	trans	-58.5	-33.9	-177.1	0	0	0	0	0	113.3	V73 K74	A70-V73 PolarHBondContact O-N 2.86Å; A70-K74 VanDerWaalsContact O-CG 3.27Å; A70-K74 WeakPolarHBondContact O-CG 3.34Å; A70-K74 PolarHBondContact O-N 2.88Å
71	D	93.3	Very high	91.6	Very high	114 Å²	114	71.7 Å²	71.7	61%	0.61	37%	0.369	S	S	*	.	H	α-helix	trans	-73.8	-37.9	-179.6	-66.2	-25.4	0	0	0	112.2	L69 V73 K74 E75	L69-D71 PolarHBondContact O-N 2.84Å; D71-V73 VanDerWaalsContact C-N 3.34Å; D71-V73 PolarHBondContact O-N 3.23Å; D71-K74 PolarHBondContact O-N 3.4Å; D71-K74 IonicContact OD1-NZ 2.57Å; D71-K74 PolarHBondContact OD1-NZ 3.14Å; D71-E75 WeakPolarHBondContact O-CB 3.4Å; D71-E75 PolarHBondContact O-N 3.13Å
72	D	94.4	Very high	91.6	Very high	60 Å²	60	79.6 Å²	79.6	32%	0.321	40%	0.398	S	S	.	.	H	α-helix	trans	-62.3	-41.8	171.4	-85.9	29.3	0	0	0	111.3	N66 L69 E75 H76	N66-D72 HydrophobicContact CB-CB 4.29Å; N66-D72 VanDerWaalsContact CB-OD2 3.29Å; N66-D72 WeakPolarHBondContact CB-OD2 3.4Å; N66-D72 PolarHBondContact N-OD2 3.38Å; N66-D72 VanDerWaalsContact O-CB 3.32Å; N66-D72 WeakPolarHBondContact O-CB 3.28Å; L69-D72 HydrophobicContact CB-CB 4.07Å; L69-D72 PolarHBondContact O-N 3.34Å; D72-E75 PolarHBondContact O-N 3.44Å; D72-H76 WeakPolarHBondContact O-CB 3.46Å; D72-H76 PolarHBondContact O-N 2.97Å
73	V	94.3	Very high	91.4	Very high	58 Å²	58	71.7 Å²	71.7	35%	0.352	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-42.7	177	174.7	0	0	0	0	111.2	Y65 P67 L69 A70 D71 A77	Y65-V73 HydrophobicContact CD2-CG2 4.44Å; P67-V73 WeakPolarHBondContact O-CG2 3.21Å; L69-V73 WeakPolarHBondContact O-CG2 3.32Å; L69-V73 PolarHBondContact O-N 3.34Å; L69-V73 VanDerWaalsContact O-N 3.08Å; A70-V73 PolarHBondContact O-N 2.86Å; D71-V73 VanDerWaalsContact C-N 3.34Å; D71-V73 PolarHBondContact O-N 3.23Å; V73-A77 WeakPolarHBondContact O-CB 3.37Å; V73-A77 PolarHBondContact O-N 3.1Å
74	K	96.6	Very high	91	Very high	114 Å²	114	72.5 Å²	72.5	50%	0.496	38%	0.377	S	S	.	.	H	α-helix	trans	-64.3	-45.8	176.2	-71.9	168.7	-163.6	160.4	0	111.4	A70 D71 A77 R78	A70-K74 VanDerWaalsContact O-CG 3.27Å; A70-K74 WeakPolarHBondContact O-CG 3.34Å; A70-K74 PolarHBondContact O-N 2.88Å; D71-K74 PolarHBondContact O-N 3.4Å; D71-K74 IonicContact OD1-NZ 2.57Å; D71-K74 PolarHBondContact OD1-NZ 3.14Å; K74-A77 PolarHBondContact O-N 2.86Å; K74-R78 WeakPolarHBondContact O-CG 3.04Å; K74-R78 PolarHBondContact O-N 3.17Å
75	E	95.3	Very high	90.2	Very high	97 Å²	97	72.4 Å²	72.4	45%	0.453	38%	0.38	S	S	.	.	H	α-helix	trans	-67.3	-40.1	179.8	-170.2	56.3	-153	0	0	111.3	D71 D72 A77 R78 Y79	D71-E75 WeakPolarHBondContact O-CB 3.4Å; D71-E75 PolarHBondContact O-N 3.13Å; D72-E75 PolarHBondContact O-N 3.44Å; E75-A77 PolarHBondContact O-N 3.08Å; E75-R78 PolarHBondContact O-N 3.1Å; E75-R78 IonicContact OE2-NH1 3.49Å; E75-Y79 WeakPolarHBondContact O-CB 3.47Å; E75-Y79 PolarHBondContact O-N 2.96Å
76	H	95	Very high	89	Confident	24 Å²	24	76.5 Å²	76.5	11%	0.111	41%	0.412	C	S	.	.	H	α-helix	trans	-56.7	-49	170	168.2	-107.3	0	0	0	111.6	C58 C61 M63 Y65 D72 R78 Y79 H80	C58-H76 WeakPolarHBondContact CB-NE2 3.45Å; C58-H76 PolarHBondContact SG-NE2 3.45Å; C58-H76 VanDerWaalsContact SG-NE2 3.37Å; C61-H76 VanDerWaalsContact SG-CD2 3.57Å; C61-H76 PolarHBondContact SG-NE2 2.92Å; M63-H76 HydrophobicContact CE-CB 3.48Å; M63-H76 VanDerWaalsContact CE-CB 3.48Å; Y65-H76 HydrophobicContact CD1-CB 4.4Å; Y65-H76 AromaticContact CD1-CD2 3.84Å; Y65-H76 AromaticContact CD1-CG 3.93Å; Y65-H76 HydrophobicContact CD2-CB 4.07Å; Y65-H76 HydrophobicContact CG-CB 3.86Å; Y65-H76 AromaticContact CG-CG 3.85Å; D72-H76 WeakPolarHBondContact O-CB 3.46Å; D72-H76 PolarHBondContact O-N 2.97Å; H76-R78 VanDerWaalsContact C-N 3.34Å; H76-R78 PolarHBondContact O-N 3.19Å; H76-Y79 PolarHBondContact O-N 3.36Å; H76-H80 AromaticContact CE1-ND1 3.96Å; H76-H80 AromaticContact NE2-ND1 3.49Å; H76-H80 PolarHBondContact NE2-ND1 2.91Å; H76-H80 WeakPolarHBondContact O-CA 3.27Å; H76-H80 WeakPolarHBondContact O-CB 3.44Å; H76-H80 PolarHBondContact O-N 2.86Å
77	A	94.2	Very high	88.5	Confident	54 Å²	54	77.7 Å²	77.7	45%	0.446	42%	0.418	S	S	.	.	H	α-helix	trans	-60.9	-42.6	179.7	0	0	0	0	0	111.9	V73 K74 E75 A81	V73-A77 WeakPolarHBondContact O-CB 3.37Å; V73-A77 PolarHBondContact O-N 3.1Å; K74-A77 PolarHBondContact O-N 2.86Å; E75-A77 PolarHBondContact O-N 3.08Å; A77-A81 VanDerWaalsContact O-CB 3.24Å; A77-A81 WeakPolarHBondContact O-CB 3.43Å; A77-A81 PolarHBondContact O-N 2.89Å
78	R	94.3	Very high	88.5	Confident	173 Å²	173	76.3 Å²	76.3	65%	0.653	41%	0.409	S	S	*	.	H	α-helix	trans	-63	-50.1	176.3	-71.9	172.4	-179.9	173.9	-1.4	111.8	K74 E75 H76 R82	K74-R78 WeakPolarHBondContact O-CG 3.04Å; K74-R78 PolarHBondContact O-N 3.17Å; E75-R78 PolarHBondContact O-N 3.1Å; E75-R78 IonicContact OE2-NH1 3.49Å; H76-R78 VanDerWaalsContact C-N 3.34Å; H76-R78 PolarHBondContact O-N 3.19Å; R78-R82 WeakPolarHBondContact O-CB 3.16Å; R78-R82 PolarHBondContact O-N 2.85Å
79	Y	91	Very high	88.7	Confident	58 Å²	58	77.4 Å²	77.4	23%	0.227	40%	0.404	C	S	.	.	H	α-helix	trans	-62.9	-46.7	178.6	178.6	-93.1	0	0	0	111.5	C61 M63 E75 H76 R82 I83	C61-Y79 HydrophobicContact CB-CD1 4.31Å; C61-Y79 HydrophobicContact CB-CE1 4.24Å; M63-Y79 HydrophobicContact CB-CD1 3.8Å; M63-Y79 HydrophobicContact CB-CE1 3.93Å; M63-Y79 HydrophobicContact CG-CD1 3.98Å; M63-Y79 HydrophobicContact CG-CE1 4.25Å; M63-Y79 HydrophobicContact CG-CG 4.42Å; M63-Y79 VanDerWaalsContact SD-CB 3.51Å; M63-Y79 HydrophobicContact SD-CD1 3.53Å; M63-Y79 VanDerWaalsContact SD-CD1 3.53Å; M63-Y79 HydrophobicContact SD-CD2 4.26Å; M63-Y79 HydrophobicContact SD-CE1 4.33Å; M63-Y79 HydrophobicContact SD-CG 3.49Å; E75-Y79 WeakPolarHBondContact O-CB 3.47Å; E75-Y79 PolarHBondContact O-N 2.96Å; H76-Y79 PolarHBondContact O-N 3.36Å; Y79-R82 VanDerWaalsContact CD2-NH2 3.31Å; Y79-R82 WeakPolarHBondContact O-CB 3.46Å; Y79-R82 PolarHBondContact O-N 3.49Å; Y79-I83 HydrophobicContact CD1-CD1 4.32Å; Y79-I83 HydrophobicContact CD1-CG1 4.08Å; Y79-I83 HydrophobicContact CD1-CG2 4.43Å; Y79-I83 HydrophobicContact CD2-CG2 4.34Å; Y79-I83 HydrophobicContact CE1-CB 4.48Å; Y79-I83 HydrophobicContact CE1-CD1 3.5Å; Y79-I83 HydrophobicContact CE1-CG1 3.7Å; Y79-I83 HydrophobicContact CE1-CG2 3.97Å; Y79-I83 HydrophobicContact CE2-CG2 3.85Å; Y79-I83 WeakPolarHBondContact O-CG1 3.1Å; Y79-I83 PolarHBondContact O-N 3.07Å
80	H	90.1	Very high	88.9	Confident	49 Å²	49	73.7 Å²	73.7	23%	0.227	39%	0.385	C	S	.	.	H	α-helix	trans	-56.7	-55.5	178.1	-171	111.6	0	0	0	109.7	C58 C61 H76 R82 I83 T84	C58-H80 PolarHBondContact SG-ND1 3.26Å; C61-H80 HydrophobicContact CB-CB 4.25Å; H76-H80 AromaticContact CE1-ND1 3.96Å; H76-H80 AromaticContact NE2-ND1 3.49Å; H76-H80 PolarHBondContact NE2-ND1 2.91Å; H76-H80 WeakPolarHBondContact O-CA 3.27Å; H76-H80 WeakPolarHBondContact O-CB 3.44Å; H76-H80 PolarHBondContact O-N 2.86Å; H80-R82 PolarHBondContact O-N 2.88Å; H80-I83 PolarHBondContact O-N 2.98Å; H80-I83 VanDerWaalsContact O-N 3.12Å; H80-T84 PolarHBondContact CD2-OG1 2.9Å; H80-T84 WeakPolarHBondContact O-CB 3.46Å; H80-T84 WeakPolarHBondContact O-CG2 3.36Å; H80-T84 PolarHBondContact O-N 2.76Å; H80-T84 PolarHBondContact O-OG1 3.27Å
81	A	89.2	Confident	88.9	Confident	60 Å²	60	73 Å²	73	50%	0.496	38%	0.375	S	S	.	.	H	α-helix	trans	-56.3	-38.7	178.1	0	0	0	0	0	112.5	A77 A85	A77-A81 VanDerWaalsContact O-CB 3.24Å; A77-A81 WeakPolarHBondContact O-CB 3.43Å; A77-A81 PolarHBondContact O-N 2.89Å; A81-A85 WeakPolarHBondContact O-CA 3.4Å; A81-A85 WeakPolarHBondContact O-CB 3.34Å; A81-A85 PolarHBondContact O-N 2.9Å
82	R	86	Confident	88.8	Confident	173 Å²	173	70.3 Å²	70.3	65%	0.653	37%	0.365	S	S	*	.	H	α-helix	trans	-65.3	-45	177	-175.8	177.2	66.2	176.7	-0.3	112.4	R78 Y79 H80 A85	R78-R82 WeakPolarHBondContact O-CB 3.16Å; R78-R82 PolarHBondContact O-N 2.85Å; Y79-R82 VanDerWaalsContact CD2-NH2 3.31Å; Y79-R82 WeakPolarHBondContact O-CB 3.46Å; Y79-R82 PolarHBondContact O-N 3.49Å; H80-R82 PolarHBondContact O-N 2.88Å; R82-A85 VanDerWaalsContact O-CB 3.25Å; R82-A85 WeakPolarHBondContact O-CB 3.44Å
83	I	82.2	Confident	88.6	Confident	21 Å²	21	72.6 Å²	72.6	11%	0.108	37%	0.373	C	S	.	.	H	α-helix	trans	-90.6	-17	-175	72.9	145.1	0	0	0	114.5	C61 Y79 H80	C61-I83 HydrophobicContact CB-CD1 3.6Å; C61-I83 HydrophobicContact CB-CG1 3.87Å; Y79-I83 HydrophobicContact CD1-CD1 4.32Å; Y79-I83 HydrophobicContact CD1-CG1 4.08Å; Y79-I83 HydrophobicContact CD1-CG2 4.43Å; Y79-I83 HydrophobicContact CD2-CG2 4.34Å; Y79-I83 HydrophobicContact CE1-CB 4.48Å; Y79-I83 HydrophobicContact CE1-CD1 3.5Å; Y79-I83 HydrophobicContact CE1-CG1 3.7Å; Y79-I83 HydrophobicContact CE1-CG2 3.97Å; Y79-I83 HydrophobicContact CE2-CG2 3.85Å; Y79-I83 WeakPolarHBondContact O-CG1 3.1Å; Y79-I83 PolarHBondContact O-N 3.07Å; H80-I83 PolarHBondContact O-N 2.98Å; H80-I83 VanDerWaalsContact O-N 3.12Å
84	T	78.9	Confident	88.5	Confident	53 Å²	53	70.1 Å²	70.1	33%	0.325	36%	0.358	S	S	.	.	S	Bend	trans	-95.9	5.6	167.3	69.7	0	0	0	0	111.9	V60 H80	V60-T84 HydrophobicContact CG1-CG2 3.76Å; H80-T84 PolarHBondContact CD2-OG1 2.9Å; H80-T84 WeakPolarHBondContact O-CB 3.46Å; H80-T84 WeakPolarHBondContact O-CG2 3.36Å; H80-T84 PolarHBondContact O-N 2.76Å; H80-T84 PolarHBondContact O-OG1 3.27Å
85	A	75.6	Confident	88.3	Confident	46 Å²	46	65.3 Å²	65.3	38%	0.38	34%	0.34	S	S	.	.	S	Bend	trans	-48.8	145.1	174.1	0	0	0	0	0	109.1	A81 R82 L87	A81-A85 WeakPolarHBondContact O-CA 3.4Å; A81-A85 WeakPolarHBondContact O-CB 3.34Å; A81-A85 PolarHBondContact O-N 2.9Å; R82-A85 VanDerWaalsContact O-CB 3.25Å; R82-A85 WeakPolarHBondContact O-CB 3.44Å; A85-L87 PolarHBondContact O-N 2.94Å
86	P	67.9	Low	88	Confident	131 Å²	131	70 Å²	70	85%	0.851	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-51.6	116.1	-178	-24.9	32.9	0	0	0	110.2
87	L	81.6	Confident	87.8	Confident	41 Å²	41	76.5 Å²	76.5	22%	0.215	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-60.4	151.9	170.9	-67.7	172.6	0	0	0	109.2	A85 R89 C163 K165 W200 S202	A85-L87 PolarHBondContact O-N 2.94Å; L87-R89 PolarHBondContact O-N 3.37Å; L87-C163 HydrophobicContact CB-CB 3.83Å; L87-C163 HydrophobicContact CD1-CB 4.25Å; L87-K165 HydrophobicContact CD1-CG 4.04Å; L87-W200 HydrophobicContact CD2-CH2 4.02Å; L87-S202 VanDerWaalsContact CD2-CB 3.45Å
88	V	90.5	Very high	87.8	Confident	10 Å²	10	74.6 Å²	74.6	6%	0.061	36%	0.363	C	S	.	.			trans	-50	114.8	175.7	-178.9	0	0	0	0	109.4	L124 E127 V128 V131 I164	V88-L124 HydrophobicContact CG1-CD1 3.55Å; V88-E127 HydrophobicContact CG1-CB 4.29Å; V88-E127 VanDerWaalsContact CG1-CD 3.48Å; V88-E127 HydrophobicContact CG1-CG 4.02Å; V88-E127 HydrophobicContact CG2-CB 4.45Å; V88-E127 HydrophobicContact CG2-CG 3.76Å; V88-V128 HydrophobicContact CB-CG2 4.07Å; V88-V128 HydrophobicContact CG1-CG2 3.84Å; V88-V128 HydrophobicContact CG2-CG2 4.23Å; V88-V131 HydrophobicContact CG2-CG2 4.03Å; V88-I164 HydrophobicContact CG1-CD1 4.32Å; V88-I164 PolarHBondContact O-N 3.04Å
89	R	92.2	Very high	87.8	Confident	145 Å²	145	72 Å²	72	55%	0.547	36%	0.359	S	S	.	.	B	Isolated β-bridge	trans	-92.2	129.3	-175.9	-168	173.4	-165.5	174	-0.3	109.4	L87 P91 S160 T161	L87-R89 PolarHBondContact O-N 3.37Å; R89-P91 VanDerWaalsContact O-CD 3.32Å; R89-P91 WeakPolarHBondContact O-CD 3.42Å; R89-S160 PolarHBondContact NH2-O 3.43Å; R89-T161 PolarHBondContact NE-O 3.14Å
90	V	93.5	Very high	88.1	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-82.4	119.4	176.1	-172.9	0	0	0	0	109.2	L94 A95 L98 L124 I156 R162 I164	V90-L94 HydrophobicContact CG1-CB 4.37Å; V90-L94 HydrophobicContact CG1-CG 4.42Å; V90-A95 HydrophobicContact CG1-CB 3.92Å; V90-L98 HydrophobicContact CG1-CD1 3.95Å; V90-L124 HydrophobicContact CG1-CD2 4.33Å; V90-L124 HydrophobicContact CG2-CD1 4.33Å; V90-L124 HydrophobicContact CG2-CD2 4.25Å; V90-I156 HydrophobicContact CG2-CD1 4.04Å; V90-I156 HydrophobicContact CG2-CG1 4.08Å; V90-I156 HydrophobicContact CG2-CG2 4.16Å; V90-R162 HydrophobicContact CB-CB 4.46Å; V90-R162 PolarHBondContact N-O 3.3Å; V90-I164 HydrophobicContact CG2-CD1 3.87Å; V90-I164 HydrophobicContact CG2-CG1 3.75Å
91	P	92	Very high	88.4	Confident	52 Å²	52	71.2 Å²	71.2	34%	0.338	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-60.9	149.3	176	-24.4	35.4	0	0	0	112.6	R89 H93 L94 A95	R89-P91 VanDerWaalsContact O-CD 3.32Å; R89-P91 WeakPolarHBondContact O-CD 3.42Å; P91-H93 VanDerWaalsContact C-N 3.33Å; P91-H93 WeakPolarHBondContact CB-CE1 3.39Å; P91-H93 PolarHBondContact O-N 3.24Å; P91-L94 HydrophobicContact CB-CB 4.37Å; P91-L94 PolarHBondContact O-N 2.89Å; P91-L94 VanDerWaalsContact O-N 3.09Å; P91-A95 PolarHBondContact O-N 3.06Å
92	S	90.6	Very high	88.7	Confident	58 Å²	58	69.4 Å²	69.4	41%	0.406	35%	0.348	S	S	.	.	H	α-helix	trans	-58.3	-40.2	-176.4	-165.2	0	0	0	0	114.6	L94 R162	S92-L94 VanDerWaalsContact C-N 3.32Å; S92-R162 PolarHBondContact OG-NH1 3.15Å
93	H	90.2	Very high	89.2	Confident	108 Å²	108	68.8 Å²	68.8	50%	0.5	35%	0.353	S	S	.	.	H	α-helix	trans	-67.9	-35.8	179	61.1	-94.4	0	0	0	111.5	P91	P91-H93 VanDerWaalsContact C-N 3.33Å; P91-H93 WeakPolarHBondContact CB-CE1 3.39Å; P91-H93 PolarHBondContact O-N 3.24Å
94	L	92.3	Very high	89.9	Confident	5 Å²	5	71.2 Å²	71.2	3%	0.026	36%	0.362	C	S	.	.	H	α-helix	trans	-75.6	-43.3	179.4	-173.9	55.9	0	0	0	111	V90 P91 S92 R96 K97 L98 T121 L124	V90-L94 HydrophobicContact CG1-CB 4.37Å; V90-L94 HydrophobicContact CG1-CG 4.42Å; P91-L94 HydrophobicContact CB-CB 4.37Å; P91-L94 PolarHBondContact O-N 2.89Å; P91-L94 VanDerWaalsContact O-N 3.09Å; S92-L94 VanDerWaalsContact C-N 3.32Å; L94-R96 PolarHBondContact O-N 2.75Å; L94-R96 VanDerWaalsContact O-N 3.08Å; L94-K97 PolarHBondContact O-N 2.88Å; L94-L98 HydrophobicContact CD1-CD2 4.23Å; L94-L98 HydrophobicContact CG-CD2 4.17Å; L94-L98 WeakPolarHBondContact O-CG 3.31Å; L94-L98 PolarHBondContact O-N 3.48Å; L94-L98 VanDerWaalsContact O-N 3.17Å; L94-T121 HydrophobicContact CD1-CG2 3.78Å; L94-L124 HydrophobicContact CD2-CB 4.04Å; L94-L124 HydrophobicContact CD2-CD2 3.72Å; L94-L124 HydrophobicContact CD2-CG 4.4Å
95	A	91.7	Very high	90.6	Very high	14 Å²	14	77.4 Å²	77.4	12%	0.116	39%	0.393	C	S	.	.	H	α-helix	trans	-54.1	-32.5	-179.5	0	0	0	0	0	113.7	V90 P91	V90-A95 HydrophobicContact CG1-CB 3.92Å; P91-A95 PolarHBondContact O-N 3.06Å
96	R	89.8	Confident	91.4	Very high	194 Å²	194	78 Å²	78	73%	0.732	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-20.7	176.9	-69.8	-177	-70.2	150	-3.6	114.2	L94	L94-R96 PolarHBondContact O-N 2.75Å; L94-R96 VanDerWaalsContact O-N 3.08Å
97	K	90.9	Very high	92.8	Very high	162 Å²	162	72 Å²	72	70%	0.704	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-15.7	-179.6	-65.4	-175.5	176.9	-171.2	0	113	L94	L94-K97 PolarHBondContact O-N 2.88Å
98	L	93.6	Very high	93.5	Very high	13 Å²	13	71.1 Å²	71.1	7%	0.068	35%	0.345	C	S	.	.	S	Bend	trans	-63	137.1	-178.7	-67.7	-174.6	0	0	0	111	V90 L94 V100 A110 L112 T121 I156	V90-L98 HydrophobicContact CG1-CD1 3.95Å; L94-L98 HydrophobicContact CD1-CD2 4.23Å; L94-L98 HydrophobicContact CG-CD2 4.17Å; L94-L98 WeakPolarHBondContact O-CG 3.31Å; L94-L98 PolarHBondContact O-N 3.48Å; L94-L98 VanDerWaalsContact O-N 3.17Å; L98-V100 PolarHBondContact O-N 2.78Å; L98-A110 HydrophobicContact CB-CB 3.95Å; L98-A110 HydrophobicContact CD1-CB 4.13Å; L98-L112 HydrophobicContact CD2-CD2 3.58Å; L98-T121 HydrophobicContact CD2-CG2 4.1Å; L98-I156 HydrophobicContact CD1-CD1 3.43Å; L98-I156 VanDerWaalsContact CD1-CD1 3.43Å
99	H	94.5	Very high	93.9	Very high	119 Å²	119	70.6 Å²	70.6	55%	0.551	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	95.5	173.5	-179	-144.5	0	0	0	109.8	A110 R111	H99-A110 CarbonylContact O-C 3.57Å; H99-A110 VanDerWaalsContact O-CA 3.23Å; H99-A110 WeakPolarHBondContact O-CA 3.43Å; H99-R111 PolarHBondContact O-N 3.37Å
100	V	96	Very high	94.1	Very high	58 Å²	58	63.7 Å²	63.7	35%	0.352	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	123.4	178.9	-179.1	0	0	0	0	109.7	L98 Q103 Y108	L98-V100 PolarHBondContact O-N 2.78Å; V100-Q103 HydrophobicContact CG1-CG 3.93Å; V100-Y108 HydrophobicContact CB-CD2 4.44Å; V100-Y108 HydrophobicContact CG1-CD2 3.96Å; V100-Y108 HydrophobicContact CG1-CG 4.36Å; V100-Y108 HydrophobicContact CG2-CD2 3.68Å; V100-Y108 HydrophobicContact CG2-CE2 3.87Å
101	V	96.5	Very high	94.2	Very high	32 Å²	32	66.1 Å²	66.1	19%	0.194	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-18.5	-176.8	-66.7	0	0	0	0	113.4	I109 R111 Y153 T217	V101-I109 HydrophobicContact CG2-CB 4.22Å; V101-I109 HydrophobicContact CG2-CG2 3.74Å; V101-I109 WeakPolarHBondContact CG2-O 3.41Å; V101-I109 PolarHBondContact N-O 3.2Å; V101-R111 HydrophobicContact CG1-CB 4.02Å; V101-Y153 HydrophobicContact CG1-CE1 4.49Å; V101-Y153 HydrophobicContact CG2-CD1 3.87Å; V101-Y153 HydrophobicContact CG2-CE1 4.01Å; V101-T217 HydrophobicContact CB-CG2 4.26Å; V101-T217 HydrophobicContact CG2-CG2 3.48Å; V101-T217 VanDerWaalsContact CG2-CG2 3.48Å
102	A	96.9	Very high	94.3	Very high	22 Å²	22	63.8 Å²	63.8	18%	0.182	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	148.9	174.1	0	0	0	0	0	111.1	F104 Y108 I109 T217	A102-F104 HydrophobicContact CB-CE2 3.76Å; A102-F104 HydrophobicContact CB-CZ 3.88Å; A102-Y108 CarbonylContact O-C 3.54Å; A102-Y108 WeakPolarHBondContact O-CA 3.49Å; A102-Y108 VanDerWaalsContact O-CB 3.3Å; A102-Y108 WeakPolarHBondContact O-CB 3.35Å; A102-I109 HydrophobicContact CB-CB 4.29Å; A102-I109 PolarHBondContact N-O 3.38Å; A102-I109 PolarHBondContact O-N 3.13Å; A102-T217 HydrophobicContact CB-CG2 3.98Å
103	Q	96.4	Very high	94.3	Very high	161 Å²	161	64.6 Å²	64.6	75%	0.752	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-125.4	144.3	178.9	-66.7	-176.5	64.7	0	0	110.8	V100	V100-Q103 HydrophobicContact CG1-CG 3.93Å
104	F	95.6	Very high	94.3	Very high	71 Å²	71	60.2 Å²	60.2	31%	0.311	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	166.2	-178.9	-53.3	-83.6	0	0	0	110	A102 D106 G107 I109 F155 R213	A102-F104 HydrophobicContact CB-CE2 3.76Å; A102-F104 HydrophobicContact CB-CZ 3.88Å; F104-D106 VanDerWaalsContact C-N 3.26Å; F104-D106 WeakPolarHBondContact CB-OD1 3.32Å; F104-D106 PolarHBondContact O-N 2.95Å; F104-G107 CarbonylContact C-O 3.56Å; F104-G107 WeakPolarHBondContact CA-O 3.45Å; F104-G107 WeakPolarHBondContact CB-O 3.47Å; F104-G107 PolarHBondContact N-O 2.79Å; F104-G107 PolarHBondContact O-N 2.88Å; F104-I109 HydrophobicContact CE2-CD1 3.63Å; F104-I109 HydrophobicContact CE2-CG1 3.85Å; F104-I109 HydrophobicContact CZ-CD1 4.1Å; F104-F155 AromaticContact CD2-CE2 3.84Å; F104-F155 HydrophobicContact CD2-CE2 3.84Å; F104-F155 HydrophobicContact CE2-CE2 4.4Å; F104-F155 HydrophobicContact CG-CE2 4.48Å; F104-R213 VanDerWaalsContact CB-NH1 3.25Å; F104-R213 HydrophobicContact CE1-CB 4.43Å; F104-R213 HydrophobicContact CE1-CG 3.91Å; F104-R213 HydrophobicContact CZ-CB 4.04Å; F104-R213 HydrophobicContact CZ-CG 4.03Å
105	L	93.6	Very high	94	Very high	184 Å²	184	62 Å²	62	96%	0.963	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-34.8	179.5	-66.5	171.6	0	0	0	112.9
106	D	93.8	Very high	93.7	Very high	57 Å²	57	70.4 Å²	70.4	31%	0.305	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	-4.5	-175.4	63.1	-29.5	0	0	0	114.1	F104 S158 R213	F104-D106 VanDerWaalsContact C-N 3.26Å; F104-D106 WeakPolarHBondContact CB-OD1 3.32Å; F104-D106 PolarHBondContact O-N 2.95Å; D106-S158 PolarHBondContact O-N 3.02Å; D106-S158 VanDerWaalsContact O-N 3.1Å; D106-R213 IonicContact OD1-CZ 2.79Å; D106-R213 IonicContact OD1-NH1 3.25Å; D106-R213 PolarHBondContact OD1-NH1 3.35Å; D106-R213 IonicContact OD1-NH2 3.34Å; D106-R213 PolarHBondContact OD1-NH2 3.39Å; D106-R213 IonicContact OD2-CZ 3.81Å; D106-R213 IonicContact OD2-NH1 3.99Å; D106-R213 IonicContact OD2-NH2 3.22Å; D106-R213 PolarHBondContact OD2-NH2 3.25Å
107	G	95.9	Very high	93.5	Very high	5 Å²	5	62.8 Å²	62.8	5%	0.052	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	165.5	-165.2	-174.8	0	0	0	0	0	113.8	F104 I156	F104-G107 CarbonylContact C-O 3.56Å; F104-G107 WeakPolarHBondContact CA-O 3.45Å; F104-G107 WeakPolarHBondContact CB-O 3.47Å; F104-G107 PolarHBondContact N-O 2.79Å; F104-G107 PolarHBondContact O-N 2.88Å; G107-I156 CarbonylContact C-O 3.5Å; G107-I156 WeakPolarHBondContact CA-O 3.45Å
108	Y	97.1	Very high	93.4	Very high	23 Å²	23	60.6 Å²	60.6	9%	0.09	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	158.2	-179.9	60.2	-85.9	0	0	0	110.3	V100 A102 A110 I156	V100-Y108 HydrophobicContact CB-CD2 4.44Å; V100-Y108 HydrophobicContact CG1-CD2 3.96Å; V100-Y108 HydrophobicContact CG1-CG 4.36Å; V100-Y108 HydrophobicContact CG2-CD2 3.68Å; V100-Y108 HydrophobicContact CG2-CE2 3.87Å; A102-Y108 CarbonylContact O-C 3.54Å; A102-Y108 WeakPolarHBondContact O-CA 3.49Å; A102-Y108 VanDerWaalsContact O-CB 3.3Å; A102-Y108 WeakPolarHBondContact O-CB 3.35Å; Y108-A110 HydrophobicContact CE2-CB 4.49Å; Y108-I156 HydrophobicContact CD2-CD1 4.42Å; Y108-I156 HydrophobicContact CE1-CB 4.12Å; Y108-I156 HydrophobicContact CE1-CG2 4Å; Y108-I156 HydrophobicContact CE2-CB 4.08Å; Y108-I156 HydrophobicContact CE2-CD1 3.62Å; Y108-I156 HydrophobicContact CE2-CG1 4.43Å; Y108-I156 HydrophobicContact CE2-CG2 4.5Å; Y108-I156 PolarHBondContact N-O 3.08Å; Y108-I156 PolarHBondContact O-N 3.44Å
109	I	98.1	Very high	93.2	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	129.8	174.9	-64.9	170.1	0	0	0	108.7	V101 A102 F104 Y153 V154 F155 R213 L214 T217	V101-I109 HydrophobicContact CG2-CB 4.22Å; V101-I109 HydrophobicContact CG2-CG2 3.74Å; V101-I109 WeakPolarHBondContact CG2-O 3.41Å; V101-I109 PolarHBondContact N-O 3.2Å; A102-I109 HydrophobicContact CB-CB 4.29Å; A102-I109 PolarHBondContact N-O 3.38Å; A102-I109 PolarHBondContact O-N 3.13Å; F104-I109 HydrophobicContact CE2-CD1 3.63Å; F104-I109 HydrophobicContact CE2-CG1 3.85Å; F104-I109 HydrophobicContact CZ-CD1 4.1Å; I109-Y153 HydrophobicContact CG2-CD1 4.14Å; I109-V154 VanDerWaalsContact CA-O 3.27Å; I109-V154 WeakPolarHBondContact CA-O 3.16Å; I109-F155 HydrophobicContact CD1-CD2 4.25Å; I109-F155 HydrophobicContact CG1-CB 4.29Å; I109-F155 HydrophobicContact CG1-CD2 3.72Å; I109-F155 HydrophobicContact CG1-CG 4.44Å; I109-R213 HydrophobicContact CD1-CB 4.16Å; I109-L214 HydrophobicContact CD1-CD2 4.09Å; I109-L214 HydrophobicContact CD1-CG 4.4Å; I109-L214 HydrophobicContact CG1-CD2 4.2Å; I109-L214 HydrophobicContact CG2-CD2 4.26Å; I109-T217 HydrophobicContact CB-CG2 4.27Å; I109-T217 HydrophobicContact CD1-CG2 4.29Å; I109-T217 VanDerWaalsContact CD1-OG1 3.28Å; I109-T217 WeakPolarHBondContact CD1-OG1 3.46Å; I109-T217 HydrophobicContact CG2-CG2 3.88Å
110	A	97	Very high	92.8	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144.7	172.8	0	0	0	0	0	110.7	L98 H99 Y108 Y153 V154 I156	L98-A110 HydrophobicContact CB-CB 3.95Å; L98-A110 HydrophobicContact CD1-CB 4.13Å; H99-A110 CarbonylContact O-C 3.57Å; H99-A110 VanDerWaalsContact O-CA 3.23Å; H99-A110 WeakPolarHBondContact O-CA 3.43Å; Y108-A110 HydrophobicContact CE2-CB 4.49Å; A110-Y153 WeakPolarHBondContact O-CA 3.46Å; A110-V154 HydrophobicContact CB-CG2 4.27Å; A110-V154 PolarHBondContact N-O 3.15Å; A110-V154 PolarHBondContact O-N 3.35Å; A110-I156 HydrophobicContact CB-CD1 4.16Å
111	R	96.3	Very high	92.6	Very high	51 Å²	51	62.7 Å²	62.7	19%	0.192	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	133	171	179.6	174.7	159.1	165.2	-2.1	109.6	H99 V101 E113 M152 Y153	H99-R111 PolarHBondContact O-N 3.37Å; V101-R111 HydrophobicContact CG1-CB 4.02Å; R111-E113 IonicContact CZ-OE1 2.76Å; R111-E113 IonicContact NE-OE1 3.49Å; R111-E113 PolarHBondContact NE-OE1 2.99Å; R111-E113 IonicContact NH2-OE1 3.75Å; R111-E113 PolarHBondContact NH2-OE1 3.23Å; R111-E113 IonicContact NH2-OE2 3.78Å; R111-M152 WeakPolarHBondContact CA-O 3.46Å; R111-Y153 HydrophobicContact CB-CD1 4.02Å; R111-Y153 HydrophobicContact CB-CE1 3.86Å; R111-Y153 HydrophobicContact CG-CD1 4.45Å; R111-Y153 HydrophobicContact CG-CE1 4.06Å
112	L	93.9	Very high	92.4	Very high	3 Å²	3	65.3 Å²	65.3	2%	0.016	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	133.9	172.8	-60.2	-179.6	0	0	0	109.1	L98 T121 L124 M152 V154	L98-L112 HydrophobicContact CD2-CD2 3.58Å; L112-T121 HydrophobicContact CD2-CG2 4.44Å; L112-L124 HydrophobicContact CD1-CD2 4.42Å; L112-M152 HydrophobicContact CB-CB 4.44Å; L112-M152 HydrophobicContact CB-CG 4.4Å; L112-M152 HydrophobicContact CD1-CE 3.99Å; L112-M152 PolarHBondContact N-O 3.19Å; L112-M152 PolarHBondContact O-N 2.77Å; L112-V154 HydrophobicContact CD1-CG1 3.76Å; L112-V154 HydrophobicContact CD1-CG2 3.88Å; L112-V154 HydrophobicContact CG-CG1 4.48Å; L112-V154 HydrophobicContact CG-CG2 4.06Å
113	E	90.2	Very high	92.2	Very high	75 Å²	75	69.7 Å²	69.7	35%	0.35	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	135.8	176.5	-68.4	-59.3	143	0	0	110.5	R111 P117	R111-E113 IonicContact CZ-OE1 2.76Å; R111-E113 IonicContact NE-OE1 3.49Å; R111-E113 PolarHBondContact NE-OE1 2.99Å; R111-E113 IonicContact NH2-OE1 3.75Å; R111-E113 PolarHBondContact NH2-OE1 3.23Å; R111-E113 IonicContact NH2-OE2 3.78Å; E113-P117 WeakPolarHBondContact O-CB 3.2Å
114	L	89.8	Confident	92.1	Very high	15 Å²	15	62.3 Å²	62.3	8%	0.079	31%	0.311	C	S	.	.	S	Bend	trans	-99.6	-36.5	178.6	-69.2	178.3	0	0	0	112.6	T125 L129 R150 M152 V169	L114-T125 HydrophobicContact CD2-CG2 3.48Å; L114-T125 VanDerWaalsContact CD2-CG2 3.48Å; L114-L129 HydrophobicContact CD2-CD1 4.21Å; L114-R150 HydrophobicContact CD1-CB 3.74Å; L114-M152 HydrophobicContact CD1-CB 4.03Å; L114-M152 HydrophobicContact CD2-CB 4.06Å; L114-M152 HydrophobicContact CD2-SD 3.83Å; L114-M152 HydrophobicContact CG-CB 3.92Å; L114-V169 HydrophobicContact CD1-CG1 3.83Å
115	S	86.2	Confident	92	Very high	44 Å²	44	59.1 Å²	59.1	31%	0.308	30%	0.297	S	S	.	.	S	Bend	trans	-79.3	-35.2	-173.7	-52.7	0	0	0	0	113.4
116	K	85.5	Confident	92	Very high	189 Å²	189	57.1 Å²	57.1	82%	0.822	28%	0.277	S	S	*	.	S	Bend	trans	-141.9	64.8	-179.4	-64	-176.3	-178	178.7	0	110.9
117	P	86.1	Confident	92	Very high	35 Å²	35	59.4 Å²	59.4	23%	0.227	29%	0.286	C	S	.	.			trans	-69.4	149.4	177.4	28.4	-33.3	0	0	0	111.8	E113 E122	E113-P117 WeakPolarHBondContact O-CB 3.2Å; P117-E122 HydrophobicContact CB-CB 3.86Å; P117-E122 HydrophobicContact CB-CG 4.44Å; P117-E122 HydrophobicContact CG-CB 3.71Å; P117-E122 HydrophobicContact CG-CG 3.75Å
118	D	89.4	Confident	92	Very high	115 Å²	115	59.2 Å²	59.2	62%	0.615	28%	0.284	S	S	*	.			trans	-63.5	149.3	161	-64.9	-40.7	0	0	0	109.7	S120 T121 E122	D118-S120 PolarHBondContact O-N 2.83Å; D118-T121 PolarHBondContact N-OG1 2.99Å; D118-T121 CarbonylContact O-C 3.54Å; D118-T121 PolarHBondContact O-N 2.85Å; D118-T121 PolarHBondContact O-OG1 2.83Å; D118-E122 PolarHBondContact O-N 2.79Å
119	K	88	Confident	91.9	Very high	176 Å²	176	58.1 Å²	58.1	77%	0.765	28%	0.279	S	S	*	.	H	α-helix	trans	-49.6	-39.7	-178.8	-173.2	176.1	-178.2	177.1	0	114
120	S	87.1	Confident	91.6	Very high	44 Å²	44	61.7 Å²	61.7	31%	0.308	30%	0.304	S	S	.	.	H	α-helix	trans	-74.7	-33.8	178.3	53.5	0	0	0	0	113.7	D118	D118-S120 PolarHBondContact O-N 2.83Å
121	T	92.2	Very high	91.4	Very high	15 Å²	15	64.3 Å²	64.3	9%	0.092	32%	0.32	C	S	.	.	H	α-helix	trans	-77.8	-30.9	176.4	54.2	0	0	0	0	110.9	L94 L98 L112 D118 L123 L124 T125	L94-T121 HydrophobicContact CD1-CG2 3.78Å; L98-T121 HydrophobicContact CD2-CG2 4.1Å; L112-T121 HydrophobicContact CD2-CG2 4.44Å; D118-T121 PolarHBondContact N-OG1 2.99Å; D118-T121 CarbonylContact O-C 3.54Å; D118-T121 PolarHBondContact O-N 2.85Å; D118-T121 PolarHBondContact O-OG1 2.83Å; T121-L123 PolarHBondContact O-N 3.02Å; T121-L124 PolarHBondContact O-N 2.84Å; T121-T125 VanDerWaalsContact O-CB 3.3Å; T121-T125 WeakPolarHBondContact O-CB 3.26Å; T121-T125 PolarHBondContact O-N 3.46Å; T121-T125 PolarHBondContact O-OG1 2.9Å
122	E	92.6	Very high	91.4	Very high	86 Å²	86	61.9 Å²	61.9	40%	0.402	31%	0.311	S	S	.	.	H	α-helix	trans	-58.3	-49.3	176.1	-170	-174.4	163.6	0	0	111.9	P117 D118 L124 T125 R126	P117-E122 HydrophobicContact CB-CB 3.86Å; P117-E122 HydrophobicContact CB-CG 4.44Å; P117-E122 HydrophobicContact CG-CB 3.71Å; P117-E122 HydrophobicContact CG-CG 3.75Å; D118-E122 PolarHBondContact O-N 2.79Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.29Å; E122-T125 PolarHBondContact O-N 3.07Å; E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 WeakPolarHBondContact O-CG 3.41Å; E122-R126 PolarHBondContact O-N 3.02Å
123	L	92.6	Very high	91.4	Very high	115 Å²	115	62 Å²	62	60%	0.602	31%	0.312	S	S	*	.	H	α-helix	trans	-59.8	-45.8	177.5	-70.8	171.6	0	0	0	111.5	T121 R126 E127	T121-L123 PolarHBondContact O-N 3.02Å; L123-R126 PolarHBondContact O-N 2.83Å; L123-E127 WeakPolarHBondContact O-CB 3.19Å; L123-E127 PolarHBondContact O-N 3.09Å
124	L	93.4	Very high	91.5	Very high	6 Å²	6	63.2 Å²	63.2	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-61.2	-47.5	176.9	-178.5	69.2	0	0	0	111.3	V88 V90 L94 L112 T121 E122 R126 E127 V128 I164	V88-L124 HydrophobicContact CG1-CD1 3.55Å; V90-L124 HydrophobicContact CG1-CD2 4.33Å; V90-L124 HydrophobicContact CG2-CD1 4.33Å; V90-L124 HydrophobicContact CG2-CD2 4.25Å; L94-L124 HydrophobicContact CD2-CB 4.04Å; L94-L124 HydrophobicContact CD2-CD2 3.72Å; L94-L124 HydrophobicContact CD2-CG 4.4Å; L112-L124 HydrophobicContact CD1-CD2 4.42Å; T121-L124 PolarHBondContact O-N 2.84Å; E122-L124 VanDerWaalsContact C-N 3.35Å; E122-L124 PolarHBondContact O-N 3.29Å; L124-R126 VanDerWaalsContact C-N 3.35Å; L124-R126 PolarHBondContact O-N 2.89Å; L124-E127 PolarHBondContact O-N 2.82Å; L124-V128 HydrophobicContact CD1-CG2 4.36Å; L124-V128 HydrophobicContact CG-CG2 4.41Å; L124-V128 WeakPolarHBondContact O-CG2 3.43Å; L124-V128 PolarHBondContact O-N 2.93Å; L124-I164 HydrophobicContact CD1-CD1 3.84Å; L124-I164 HydrophobicContact CD2-CD1 4.23Å; L124-I164 HydrophobicContact CG-CD1 4.12Å
125	T	94.4	Very high	91.6	Very high	4 Å²	4	66.7 Å²	66.7	3%	0.025	35%	0.345	C	S	.	.	H	α-helix	trans	-57.2	-47.6	177.9	-68.5	0	0	0	0	111.1	L114 T121 E122 V128 L129 M152	L114-T125 HydrophobicContact CD2-CG2 3.48Å; L114-T125 VanDerWaalsContact CD2-CG2 3.48Å; T121-T125 VanDerWaalsContact O-CB 3.3Å; T121-T125 WeakPolarHBondContact O-CB 3.26Å; T121-T125 PolarHBondContact O-N 3.46Å; T121-T125 PolarHBondContact O-OG1 2.9Å; E122-T125 PolarHBondContact O-N 3.07Å; T125-V128 PolarHBondContact O-N 2.98Å; T125-L129 HydrophobicContact CG2-CD1 4Å; T125-L129 WeakPolarHBondContact O-CB 3.33Å; T125-L129 WeakPolarHBondContact O-CG 3.3Å; T125-L129 PolarHBondContact O-N 2.95Å; T125-M152 HydrophobicContact CG2-CE 4.45Å; T125-M152 HydrophobicContact CG2-SD 3.86Å
126	R	93.5	Very high	91.9	Very high	141 Å²	141	66.8 Å²	66.8	53%	0.532	34%	0.343	S	S	.	.	H	α-helix	trans	-62.9	-43.5	179.2	-73.8	-174.8	69.8	-171.4	-0.4	112.1	E122 L123 L124 S130 M144	E122-R126 WeakPolarHBondContact O-CB 3.36Å; E122-R126 WeakPolarHBondContact O-CG 3.41Å; E122-R126 PolarHBondContact O-N 3.02Å; L123-R126 PolarHBondContact O-N 2.83Å; L124-R126 VanDerWaalsContact C-N 3.35Å; L124-R126 PolarHBondContact O-N 2.89Å; R126-S130 VanDerWaalsContact O-CB 3.29Å; R126-S130 WeakPolarHBondContact O-CB 3.45Å; R126-S130 PolarHBondContact O-N 2.79Å; R126-M144 HydrophobicContact CG-SD 3.8Å
127	E	93.6	Very high	92.2	Very high	105 Å²	105	61.2 Å²	61.2	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-62.2	-47.7	178.2	-166.9	-174.3	164.9	0	0	111.2	V88 L123 L124 S130 V131	V88-E127 HydrophobicContact CG1-CB 4.29Å; V88-E127 VanDerWaalsContact CG1-CD 3.48Å; V88-E127 HydrophobicContact CG1-CG 4.02Å; V88-E127 HydrophobicContact CG2-CB 4.45Å; V88-E127 HydrophobicContact CG2-CG 3.76Å; L123-E127 WeakPolarHBondContact O-CB 3.19Å; L123-E127 PolarHBondContact O-N 3.09Å; L124-E127 PolarHBondContact O-N 2.82Å; E127-S130 WeakPolarHBondContact O-CB 3.45Å; E127-S130 PolarHBondContact O-N 3.12Å; E127-V131 WeakPolarHBondContact O-CG2 3.3Å; E127-V131 PolarHBondContact O-N 3.45Å; E127-V131 VanDerWaalsContact O-N 3.09Å
128	V	94.8	Very high	92.4	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.012	35%	0.345	C	S	.	.	H	α-helix	trans	-63	-46.6	179.2	176	0	0	0	0	111.7	V88 L124 T125 S130 V131 A132 M152 V154 I164 V167	V88-V128 HydrophobicContact CB-CG2 4.07Å; V88-V128 HydrophobicContact CG1-CG2 3.84Å; V88-V128 HydrophobicContact CG2-CG2 4.23Å; L124-V128 HydrophobicContact CD1-CG2 4.36Å; L124-V128 HydrophobicContact CG-CG2 4.41Å; L124-V128 WeakPolarHBondContact O-CG2 3.43Å; L124-V128 PolarHBondContact O-N 2.93Å; T125-V128 PolarHBondContact O-N 2.98Å; V128-S130 VanDerWaalsContact C-N 3.31Å; V128-S130 PolarHBondContact O-N 3.48Å; V128-V131 PolarHBondContact O-N 3.15Å; V128-A132 WeakPolarHBondContact O-CB 3.47Å; V128-A132 PolarHBondContact O-N 2.96Å; V128-M152 HydrophobicContact CB-CE 3.98Å; V128-M152 HydrophobicContact CG1-CE 3.67Å; V128-V154 HydrophobicContact CG1-CG1 4.32Å; V128-I164 HydrophobicContact CG1-CG2 4.05Å; V128-I164 HydrophobicContact CG2-CB 4.44Å; V128-I164 HydrophobicContact CG2-CD1 3.2Å; V128-I164 HydrophobicContact CG2-CG1 4.36Å; V128-I164 HydrophobicContact CG2-CG2 4.27Å; V128-V167 HydrophobicContact CG1-CB 4.08Å; V128-V167 HydrophobicContact CG1-CG1 4.31Å; V128-V167 HydrophobicContact CG1-CG2 4.34Å
129	L	95	Very high	92.6	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-38.1	177.6	-73.2	178.1	0	0	0	111	L114 T125 V131 A132 C133 A140 L143 M144 M152 V169 L198	L114-L129 HydrophobicContact CD2-CD1 4.21Å; T125-L129 HydrophobicContact CG2-CD1 4Å; T125-L129 WeakPolarHBondContact O-CB 3.33Å; T125-L129 WeakPolarHBondContact O-CG 3.3Å; T125-L129 PolarHBondContact O-N 2.95Å; L129-V131 PolarHBondContact O-N 2.94Å; L129-A132 PolarHBondContact O-N 3.3Å; L129-C133 WeakPolarHBondContact O-CB 3.48Å; L129-C133 PolarHBondContact O-N 2.7Å; L129-C133 PolarHBondContact O-SG 2.84Å; L129-A140 HydrophobicContact CB-CB 4.07Å; L129-L143 HydrophobicContact CD2-CD1 4.12Å; L129-M144 HydrophobicContact CD1-CG 3.47Å; L129-M144 VanDerWaalsContact CD1-CG 3.47Å; L129-M144 HydrophobicContact CD1-SD 4.01Å; L129-M152 HydrophobicContact CD1-SD 4.35Å; L129-M152 HydrophobicContact CD2-CE 4.36Å; L129-M152 HydrophobicContact CD2-SD 4.13Å; L129-M152 HydrophobicContact CG-CE 4.26Å; L129-M152 HydrophobicContact CG-SD 4.12Å; L129-V169 HydrophobicContact CD2-CG2 3.96Å; L129-L198 HydrophobicContact CD2-CD2 3.87Å
130	S	93.4	Very high	92.8	Very high	75 Å²	75	51.8 Å²	51.8	52%	0.524	31%	0.308	S	S	.	.	H	α-helix	trans	-58.4	-47.1	175.8	-171.5	0	0	0	0	111.8	R126 E127 V128 S134	R126-S130 VanDerWaalsContact O-CB 3.29Å; R126-S130 WeakPolarHBondContact O-CB 3.45Å; R126-S130 PolarHBondContact O-N 2.79Å; E127-S130 WeakPolarHBondContact O-CB 3.45Å; E127-S130 PolarHBondContact O-N 3.12Å; V128-S130 VanDerWaalsContact C-N 3.31Å; V128-S130 PolarHBondContact O-N 3.48Å; S130-S134 WeakPolarHBondContact O-CB 3.39Å; S130-S134 PolarHBondContact O-N 3.32Å; S130-S134 VanDerWaalsContact O-N 3.09Å
131	V	92.7	Very high	92.9	Very high	55 Å²	55	54 Å²	54	33%	0.333	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-52.3	177.7	174.3	0	0	0	0	111	V88 E127 V128 L129 C133 S134 E135 W200	V88-V131 HydrophobicContact CG2-CG2 4.03Å; E127-V131 WeakPolarHBondContact O-CG2 3.3Å; E127-V131 PolarHBondContact O-N 3.45Å; E127-V131 VanDerWaalsContact O-N 3.09Å; V128-V131 PolarHBondContact O-N 3.15Å; L129-V131 PolarHBondContact O-N 2.94Å; V131-C133 PolarHBondContact O-N 3.35Å; V131-S134 PolarHBondContact O-N 2.91Å; V131-E135 PolarHBondContact O-N 2.8Å; V131-E135 VanDerWaalsContact O-N 3.13Å; V131-W200 HydrophobicContact CG1-CH2 4.24Å; V131-W200 HydrophobicContact CG1-CZ2 4.01Å
132	A	94.8	Very high	92.8	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-64.1	-43.5	-175.7	0	0	0	0	0	112.5	V128 L129 E135 V136 V167 L198 W200	V128-A132 WeakPolarHBondContact O-CB 3.47Å; V128-A132 PolarHBondContact O-N 2.96Å; L129-A132 PolarHBondContact O-N 3.3Å; A132-E135 PolarHBondContact O-N 3.08Å; A132-V136 WeakPolarHBondContact O-CG2 3.38Å; A132-V136 PolarHBondContact O-N 3.13Å; A132-V167 HydrophobicContact CB-CG1 3.61Å; A132-L198 HydrophobicContact CB-CD2 4.04Å; A132-W200 HydrophobicContact CB-CB 3.8Å; A132-W200 HydrophobicContact CB-CD2 3.84Å; A132-W200 HydrophobicContact CB-CE3 4.15Å; A132-W200 HydrophobicContact CB-CG 3.71Å
133	C	94.6	Very high	92.8	Very high	5 Å²	5	52.1 Å²	52.1	3%	0.034	32%	0.316	C	S	.	.	H	α-helix	trans	-67.5	-39.4	178.2	-71.3	0	0	0	0	112	L129 V131 E135 V136 G137 A138 A140 L143	L129-C133 WeakPolarHBondContact O-CB 3.48Å; L129-C133 PolarHBondContact O-N 2.7Å; L129-C133 PolarHBondContact O-SG 2.84Å; V131-C133 PolarHBondContact O-N 3.35Å; C133-E135 VanDerWaalsContact C-N 3.27Å; C133-E135 PolarHBondContact O-N 3.48Å; C133-V136 PolarHBondContact O-N 3.02Å; C133-G137 WeakPolarHBondContact O-CA 3.33Å; C133-G137 PolarHBondContact O-N 3.37Å; C133-A138 HydrophobicContact CB-CB 4.19Å; C133-A138 WeakPolarHBondContact CB-O 3.38Å; C133-A138 PolarHBondContact O-N 2.98Å; C133-A140 HydrophobicContact CB-CB 4.09Å; C133-L143 WeakPolarHBondContact SG-CD1 3.39Å
134	S	92.1	Very high	92.5	Very high	101 Å²	101	49.2 Å²	49.2	71%	0.706	30%	0.3	S	S	*	.	H	α-helix	trans	-62.5	-34.8	175.9	-175.4	0	0	0	0	112.3	S130 V131	S130-S134 WeakPolarHBondContact O-CB 3.39Å; S130-S134 PolarHBondContact O-N 3.32Å; S130-S134 VanDerWaalsContact O-N 3.09Å; V131-S134 PolarHBondContact O-N 2.91Å
135	E	90.9	Very high	92.1	Very high	88 Å²	88	52.2 Å²	52.2	41%	0.411	32%	0.316	S	S	.	.	H	α-helix	trans	-77.8	-36.9	177.7	-77.3	-167.2	-152.5	0	0	113.4	V131 A132 C133 W200 R206	V131-E135 PolarHBondContact O-N 2.8Å; V131-E135 VanDerWaalsContact O-N 3.13Å; A132-E135 PolarHBondContact O-N 3.08Å; C133-E135 VanDerWaalsContact C-N 3.27Å; C133-E135 PolarHBondContact O-N 3.48Å; E135-W200 PolarHBondContact OE2-NE1 3.09Å; E135-R206 IonicContact OE2-NH2 2.91Å; E135-R206 PolarHBondContact OE2-NH2 3.47Å
136	V	92.8	Very high	91.3	Very high	46 Å²	46	55.6 Å²	55.6	28%	0.279	34%	0.34	S	S	.	.	H	α-helix	trans	-86	-17.6	-177.2	178.8	0	0	0	0	112.2	A132 C133 L198 W200 T239	A132-V136 WeakPolarHBondContact O-CG2 3.38Å; A132-V136 PolarHBondContact O-N 3.13Å; C133-V136 PolarHBondContact O-N 3.02Å; V136-L198 HydrophobicContact CB-CD1 4.13Å; V136-L198 HydrophobicContact CG1-CD1 4.13Å; V136-L198 HydrophobicContact CG2-CD1 4.08Å; V136-W200 HydrophobicContact CG2-CB 4.23Å; V136-W200 HydrophobicContact CG2-CG 4.47Å; V136-T239 HydrophobicContact CG1-CG2 3.87Å; V136-T239 WeakPolarHBondContact O-CG2 3.46Å
137	G	92.3	Very high	90.7	Very high	72 Å²	72	57.9 Å²	57.9	74%	0.742	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.3	26.3	-172	0	0	0	0	0	113.1	C133	C133-G137 WeakPolarHBondContact O-CA 3.33Å; C133-G137 PolarHBondContact O-N 3.37Å
138	A	91.3	Very high	90.2	Very high	42 Å²	42	59.9 Å²	59.9	35%	0.347	36%	0.357	S	S	.	.			trans	-95.5	168.4	179.6	0	0	0	0	0	111.9	C133 L198	C133-A138 HydrophobicContact CB-CB 4.19Å; C133-A138 WeakPolarHBondContact CB-O 3.38Å; C133-A138 PolarHBondContact O-N 2.98Å; A138-L198 HydrophobicContact CB-CD1 4.31Å
139	C	91.9	Very high	89.9	Confident	69 Å²	69	65.6 Å²	65.6	47%	0.466	38%	0.383	S	S	.	.			trans	-104.6	107.9	177.9	-173.9	0	0	0	0	111.3	T142 L143	C139-T142 WeakPolarHBondContact CB-OG1 3.27Å; C139-T142 WeakPolarHBondContact O-CB 3.44Å; C139-T142 PolarHBondContact O-N 2.91Å; C139-T142 VanDerWaalsContact O-N 3.15Å; C139-T142 PolarHBondContact SG-OG1 2.84Å; C139-L143 PolarHBondContact O-N 2.85Å
140	A	92.1	Very high	89.8	Confident	16 Å²	16	66 Å²	66	13%	0.132	39%	0.385	C	S	.	.	H	α-helix	trans	-59.5	-44.5	-179	0	0	0	0	0	113.9	L129 C133 T142 L143 M144	L129-A140 HydrophobicContact CB-CB 4.07Å; C133-A140 HydrophobicContact CB-CB 4.09Å; A140-T142 VanDerWaalsContact C-N 3.25Å; A140-T142 PolarHBondContact O-N 3.45Å; A140-L143 PolarHBondContact O-N 2.89Å; A140-L143 VanDerWaalsContact O-N 3.11Å; A140-M144 WeakPolarHBondContact O-CG 3.07Å; A140-M144 PolarHBondContact O-N 2.61Å
141	P	90.5	Very high	89.8	Confident	90 Å²	90	62.7 Å²	62.7	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-56.5	-37.6	173.4	-27.3	34.8	0	0	0	113.6	L143 M144 N145	P141-L143 VanDerWaalsContact C-N 3.32Å; P141-L143 PolarHBondContact O-N 2.93Å; P141-M144 PolarHBondContact O-N 2.79Å; P141-N145 PolarHBondContact O-N 3.29Å
142	T	90.6	Very high	90	Very high	61 Å²	61	60 Å²	60	37%	0.374	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-41.7	177.2	-54	0	0	0	0	110.5	C139 A140 N145 R150 M260	C139-T142 WeakPolarHBondContact CB-OG1 3.27Å; C139-T142 WeakPolarHBondContact O-CB 3.44Å; C139-T142 PolarHBondContact O-N 2.91Å; C139-T142 VanDerWaalsContact O-N 3.15Å; C139-T142 PolarHBondContact SG-OG1 2.84Å; A140-T142 VanDerWaalsContact C-N 3.25Å; A140-T142 PolarHBondContact O-N 3.45Å; T142-N145 WeakPolarHBondContact O-CB 3.37Å; T142-N145 PolarHBondContact O-N 3.49Å; T142-R150 PolarHBondContact O-NH1 3.45Å; T142-M260 HydrophobicContact CG2-CE 3.69Å; T142-M260 HydrophobicContact CG2-CG 4.32Å; T142-M260 HydrophobicContact CG2-SD 3.81Å
143	L	91.3	Very high	90.1	Very high	2 Å²	2	60 Å²	60	1%	0.01	35%	0.345	C	S	.	.	H	α-helix	trans	-67.7	-37.6	177.5	-70.3	165.3	0	0	0	113.3	L129 C133 C139 A140 P141 N145 R150 V169 L197 L198 M260	L129-L143 HydrophobicContact CD2-CD1 4.12Å; C133-L143 WeakPolarHBondContact SG-CD1 3.39Å; C139-L143 PolarHBondContact O-N 2.85Å; A140-L143 PolarHBondContact O-N 2.89Å; A140-L143 VanDerWaalsContact O-N 3.11Å; P141-L143 VanDerWaalsContact C-N 3.32Å; P141-L143 PolarHBondContact O-N 2.93Å; L143-N145 PolarHBondContact O-N 3.13Å; L143-R150 VanDerWaalsContact O-CD 3.3Å; L143-R150 WeakPolarHBondContact O-CD 3.3Å; L143-R150 PolarHBondContact O-NH1 3.34Å; L143-V169 HydrophobicContact CD2-CB 4.21Å; L143-V169 HydrophobicContact CD2-CG1 4.04Å; L143-L197 HydrophobicContact CD2-CB 3.63Å; L143-L197 HydrophobicContact CD2-CD1 4.26Å; L143-L198 HydrophobicContact CD1-CB 3.96Å; L143-L198 HydrophobicContact CD1-CD2 3.68Å; L143-L198 HydrophobicContact CD1-CG 4.33Å; L143-L198 HydrophobicContact CD2-CB 4.21Å; L143-M260 HydrophobicContact CB-CE 4.47Å; L143-M260 HydrophobicContact CD2-CE 3.47Å; L143-M260 VanDerWaalsContact CD2-CE 3.47Å; L143-M260 HydrophobicContact CD2-SD 4.2Å; L143-M260 HydrophobicContact CG-CE 3.95Å
144	M	87.3	Confident	90.3	Very high	54 Å²	54	59.8 Å²	59.8	27%	0.266	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77	3	-179.9	-64.9	-174.9	-64.4	0	0	114.3	R126 L129 A140 P141 S146	R126-M144 HydrophobicContact CG-SD 3.8Å; L129-M144 HydrophobicContact CD1-CG 3.47Å; L129-M144 VanDerWaalsContact CD1-CG 3.47Å; L129-M144 HydrophobicContact CD1-SD 4.01Å; A140-M144 WeakPolarHBondContact O-CG 3.07Å; A140-M144 PolarHBondContact O-N 2.61Å; P141-M144 PolarHBondContact O-N 2.79Å; M144-S146 PolarHBondContact O-N 2.88Å; M144-S146 VanDerWaalsContact O-N 3.08Å
145	N	83.9	Confident	90.6	Very high	69 Å²	69	55 Å²	55	37%	0.369	31%	0.31	S	S	.	.			trans	-62.4	111.1	-180	-176.7	-10.9	0	0	0	112.3	P141 T142 L143 K147 R148	P141-N145 PolarHBondContact O-N 3.29Å; T142-N145 WeakPolarHBondContact O-CB 3.37Å; T142-N145 PolarHBondContact O-N 3.49Å; L143-N145 PolarHBondContact O-N 3.13Å; N145-K147 PolarHBondContact O-N 3.34Å; N145-K147 VanDerWaalsContact O-N 3.13Å; N145-K147 WeakPolarHBondContact OD1-CB 3.45Å; N145-K147 WeakPolarHBondContact OD1-CG 3.24Å; N145-K147 PolarHBondContact OD1-N 2.98Å; N145-R148 PolarHBondContact O-N 2.83Å
146	S	77.7	Confident	90.8	Very high	75 Å²	75	50.8 Å²	50.8	52%	0.524	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-6	-177.5	-49.2	0	0	0	0	115.5	M144 R148	M144-S146 PolarHBondContact O-N 2.88Å; M144-S146 VanDerWaalsContact O-N 3.08Å; S146-R148 PolarHBondContact O-N 3.44Å
147	K	81.9	Confident	90.9	Very high	189 Å²	189	48.8 Å²	48.8	82%	0.822	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-13.6	177.4	-64.7	-178	-178.8	-178	0	113.4	N145	N145-K147 PolarHBondContact O-N 3.34Å; N145-K147 VanDerWaalsContact O-N 3.13Å; N145-K147 WeakPolarHBondContact OD1-CB 3.45Å; N145-K147 WeakPolarHBondContact OD1-CG 3.24Å; N145-K147 PolarHBondContact OD1-N 2.98Å
148	R	82.3	Confident	90.6	Very high	146 Å²	146	48.2 Å²	48.2	55%	0.551	26%	0.262	S	S	*	.	S	Bend	trans	-117.3	141.2	-179.8	-61.2	-69.9	-172.4	158.3	2.9	109.4	N145 S146 R150	N145-R148 PolarHBondContact O-N 2.83Å; S146-R148 PolarHBondContact O-N 3.44Å; R148-R150 HydrophobicContact CB-CG 4.21Å; R148-R150 PolarHBondContact O-N 3.43Å
149	H	87.6	Confident	89.8	Confident	123 Å²	123	55.2 Å²	55.2	57%	0.569	28%	0.28	S	S	*	.			trans	-77.6	94.9	174.3	-178.8	-97.4	0	0	0	109.7
150	R	93.3	Very high	89.2	Confident	9 Å²	9	56.5 Å²	56.5	3%	0.034	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	141.3	-179	-72.9	170.2	-179.6	170.8	-2.1	110.9	L114 T142 L143 R148 V169 V170 E171 L197 M260	L114-R150 HydrophobicContact CD1-CB 3.74Å; T142-R150 PolarHBondContact O-NH1 3.45Å; L143-R150 VanDerWaalsContact O-CD 3.3Å; L143-R150 WeakPolarHBondContact O-CD 3.3Å; L143-R150 PolarHBondContact O-NH1 3.34Å; R148-R150 HydrophobicContact CB-CG 4.21Å; R148-R150 PolarHBondContact O-N 3.43Å; R150-V169 HydrophobicContact CB-CG1 4.47Å; R150-V170 WeakPolarHBondContact CA-O 3.32Å; R150-E171 HydrophobicContact CG-CB 3.9Å; R150-E171 IonicContact CZ-OE2 2.87Å; R150-E171 IonicContact NE-OE2 2.61Å; R150-E171 PolarHBondContact NE-OE2 3.29Å; R150-E171 IonicContact NH2-OE2 3.13Å; R150-E171 PolarHBondContact NH2-OE2 3.03Å; R150-L197 HydrophobicContact CG-CD1 3.9Å; R150-M260 VanDerWaalsContact NH2-CE 3.31Å
151	Q	94	Very high	88.7	Confident	4 Å²	4	58.9 Å²	58.9	2%	0.019	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	135.4	174.7	-61.5	177.7	5.8	0	0	109.4	Y153 V169 V170 F222	Q151-Y153 HydrophobicContact CB-CD2 4.44Å; Q151-Y153 HydrophobicContact CB-CE2 3.65Å; Q151-Y153 PolarHBondContact OE1-OH 3.29Å; Q151-V169 WeakPolarHBondContact O-CA 3.4Å; Q151-V170 HydrophobicContact CB-CG2 3.96Å; Q151-V170 PolarHBondContact N-O 3.43Å; Q151-V170 PolarHBondContact O-N 3.5Å; Q151-F222 HydrophobicContact CG-CD2 4.28Å; Q151-F222 HydrophobicContact CG-CE2 4.28Å; Q151-F222 PolarHBondContact NE2-O 3.39Å; Q151-F222 VanDerWaalsContact NE2-O 3.12Å
152	M	96.5	Very high	88.7	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	134.2	175.2	176.4	171.4	166.3	0	0	109.8	R111 L112 L114 T125 V128 L129 V154 V167 V168 V169	R111-M152 WeakPolarHBondContact CA-O 3.46Å; L112-M152 HydrophobicContact CB-CB 4.44Å; L112-M152 HydrophobicContact CB-CG 4.4Å; L112-M152 HydrophobicContact CD1-CE 3.99Å; L112-M152 PolarHBondContact N-O 3.19Å; L112-M152 PolarHBondContact O-N 2.77Å; L114-M152 HydrophobicContact CD1-CB 4.03Å; L114-M152 HydrophobicContact CD2-CB 4.06Å; L114-M152 HydrophobicContact CD2-SD 3.83Å; L114-M152 HydrophobicContact CG-CB 3.92Å; T125-M152 HydrophobicContact CG2-CE 4.45Å; T125-M152 HydrophobicContact CG2-SD 3.86Å; V128-M152 HydrophobicContact CB-CE 3.98Å; V128-M152 HydrophobicContact CG1-CE 3.67Å; L129-M152 HydrophobicContact CD1-SD 4.35Å; L129-M152 HydrophobicContact CD2-CE 4.36Å; L129-M152 HydrophobicContact CD2-SD 4.13Å; L129-M152 HydrophobicContact CG-CE 4.26Å; L129-M152 HydrophobicContact CG-SD 4.12Å; M152-V154 HydrophobicContact CE-CG1 3.54Å; M152-V154 HydrophobicContact CG-CG1 4.44Å; M152-V167 HydrophobicContact CE-CB 4.5Å; M152-V167 HydrophobicContact CE-CG2 3.48Å; M152-V167 VanDerWaalsContact CE-CG2 3.48Å; M152-V167 HydrophobicContact CG-CG2 3.79Å; M152-V167 HydrophobicContact SD-CG2 4.12Å; M152-V168 WeakPolarHBondContact CA-O 3.47Å; M152-V169 HydrophobicContact CB-CG2 4.35Å; M152-V169 HydrophobicContact CG-CG2 4.2Å; M152-V169 HydrophobicContact SD-CG2 4.48Å
153	Y	98.2	Very high	88.9	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.3	175.7	-61.9	-94.9	0	0	0	109.3	V101 I109 A110 R111 Q151 V167 V168 V170 T217 A218 N221	V101-Y153 HydrophobicContact CG1-CE1 4.49Å; V101-Y153 HydrophobicContact CG2-CD1 3.87Å; V101-Y153 HydrophobicContact CG2-CE1 4.01Å; I109-Y153 HydrophobicContact CG2-CD1 4.14Å; A110-Y153 WeakPolarHBondContact O-CA 3.46Å; R111-Y153 HydrophobicContact CB-CD1 4.02Å; R111-Y153 HydrophobicContact CB-CE1 3.86Å; R111-Y153 HydrophobicContact CG-CD1 4.45Å; R111-Y153 HydrophobicContact CG-CE1 4.06Å; Q151-Y153 HydrophobicContact CB-CD2 4.44Å; Q151-Y153 HydrophobicContact CB-CE2 3.65Å; Q151-Y153 PolarHBondContact OE1-OH 3.29Å; Y153-V167 CarbonylContact O-C 3.38Å; Y153-V167 VanDerWaalsContact O-CA 3.31Å; Y153-V167 WeakPolarHBondContact O-CA 3.44Å; Y153-V168 HydrophobicContact CD2-CG1 4.24Å; Y153-V168 HydrophobicContact CG-CG1 4.45Å; Y153-V168 PolarHBondContact N-O 3.29Å; Y153-V168 PolarHBondContact O-N 3.46Å; Y153-V170 HydrophobicContact CE2-CG2 4.19Å; Y153-T217 HydrophobicContact CD1-CG2 4.42Å; Y153-A218 HydrophobicContact CD2-CB 3.54Å; Y153-A218 HydrophobicContact CE2-CB 3.6Å; Y153-A218 HydrophobicContact CG-CB 4.24Å; Y153-N221 HydrophobicContact CE1-CB 4.15Å; Y153-N221 WeakPolarHBondContact OH-CB 3.36Å
154	V	97.9	Very high	89.1	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	137.2	179.7	-65.8	0	0	0	0	110.5	I109 A110 L112 V128 M152 I156 I164 G166 V167	I109-V154 VanDerWaalsContact CA-O 3.27Å; I109-V154 WeakPolarHBondContact CA-O 3.16Å; A110-V154 HydrophobicContact CB-CG2 4.27Å; A110-V154 PolarHBondContact N-O 3.15Å; A110-V154 PolarHBondContact O-N 3.35Å; L112-V154 HydrophobicContact CD1-CG1 3.76Å; L112-V154 HydrophobicContact CD1-CG2 3.88Å; L112-V154 HydrophobicContact CG-CG1 4.48Å; L112-V154 HydrophobicContact CG-CG2 4.06Å; V128-V154 HydrophobicContact CG1-CG1 4.32Å; M152-V154 HydrophobicContact CE-CG1 3.54Å; M152-V154 HydrophobicContact CG-CG1 4.44Å; V154-I156 HydrophobicContact CG2-CD1 4.01Å; V154-I156 HydrophobicContact CG2-CG1 4.15Å; V154-I164 HydrophobicContact CB-CD1 4.46Å; V154-I164 HydrophobicContact CB-CG2 4.25Å; V154-I164 HydrophobicContact CG1-CD1 4.49Å; V154-I164 HydrophobicContact CG1-CG2 4.4Å; V154-G166 CarbonylContact C-O 3.59Å; V154-G166 WeakPolarHBondContact CA-O 3.42Å; V154-V167 HydrophobicContact CG1-CB 4.3Å; V154-V167 HydrophobicContact CG1-CG2 4.06Å
155	F	97.9	Very high	89.5	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	123.2	170.4	-174.4	-78.9	0	0	0	109.2	F104 I109 I164 K165 G166 I210 L214	F104-F155 AromaticContact CD2-CE2 3.84Å; F104-F155 HydrophobicContact CD2-CE2 3.84Å; F104-F155 HydrophobicContact CE2-CE2 4.4Å; F104-F155 HydrophobicContact CG-CE2 4.48Å; I109-F155 HydrophobicContact CD1-CD2 4.25Å; I109-F155 HydrophobicContact CG1-CB 4.29Å; I109-F155 HydrophobicContact CG1-CD2 3.72Å; I109-F155 HydrophobicContact CG1-CG 4.44Å; F155-I164 CarbonylContact O-C 3.58Å; F155-I164 WeakPolarHBondContact O-CA 3.38Å; F155-K165 HydrophobicContact CD1-CB 3.99Å; F155-K165 HydrophobicContact CE1-CD 4.34Å; F155-K165 PolarHBondContact O-N 3.45Å; F155-G166 PolarHBondContact N-O 3.09Å; F155-I210 HydrophobicContact CB-CG2 3.8Å; F155-I210 HydrophobicContact CD1-CD1 4.13Å; F155-I210 HydrophobicContact CD1-CG1 4.48Å; F155-I210 HydrophobicContact CD1-CG2 4.31Å; F155-I210 HydrophobicContact CD2-CG2 4.17Å; F155-I210 HydrophobicContact CE1-CD1 4.13Å; F155-I210 HydrophobicContact CE1-CG1 4.45Å; F155-I210 HydrophobicContact CG-CG2 3.83Å; F155-I210 HydrophobicContact CZ-CG1 4.49Å; F155-L214 HydrophobicContact CB-CD1 4.45Å; F155-L214 HydrophobicContact CB-CD2 4.12Å; F155-L214 HydrophobicContact CB-CG 4.36Å
156	I	96.5	Very high	90.1	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	129.8	-178.8	-59.2	159.3	0	0	0	108.4	V90 L98 G107 Y108 A110 V154 R162 C163 I164	V90-I156 HydrophobicContact CG2-CD1 4.04Å; V90-I156 HydrophobicContact CG2-CG1 4.08Å; V90-I156 HydrophobicContact CG2-CG2 4.16Å; L98-I156 HydrophobicContact CD1-CD1 3.43Å; L98-I156 VanDerWaalsContact CD1-CD1 3.43Å; G107-I156 CarbonylContact C-O 3.5Å; G107-I156 WeakPolarHBondContact CA-O 3.45Å; Y108-I156 HydrophobicContact CD2-CD1 4.42Å; Y108-I156 HydrophobicContact CE1-CB 4.12Å; Y108-I156 HydrophobicContact CE1-CG2 4Å; Y108-I156 HydrophobicContact CE2-CB 4.08Å; Y108-I156 HydrophobicContact CE2-CD1 3.62Å; Y108-I156 HydrophobicContact CE2-CG1 4.43Å; Y108-I156 HydrophobicContact CE2-CG2 4.5Å; Y108-I156 PolarHBondContact N-O 3.08Å; Y108-I156 PolarHBondContact O-N 3.44Å; A110-I156 HydrophobicContact CB-CD1 4.16Å; V154-I156 HydrophobicContact CG2-CD1 4.01Å; V154-I156 HydrophobicContact CG2-CG1 4.15Å; I156-R162 HydrophobicContact CG2-CB 4.37Å; I156-C163 WeakPolarHBondContact CA-O 3.45Å; I156-I164 HydrophobicContact CG1-CG1 3.97Å
157	S	94.1	Very high	91	Very high	3 Å²	3	48.3 Å²	48.3	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	160.8	175.5	61.4	0	0	0	0	112.4	T161 R162 C163	S157-T161 PolarHBondContact OG-OG1 3.5Å; S157-R162 PolarHBondContact OG-N 2.98Å; S157-C163 PolarHBondContact N-O 2.97Å; S157-C163 PolarHBondContact OG-N 3.32Å; S157-C163 PolarHBondContact OG-O 3.45Å
158	S	86.2	Confident	91.8	Very high	60 Å²	60	39.3 Å²	39.3	42%	0.42	19%	0.191	S	C	.	.			trans	-49.1	162.9	178.3	-170.4	0	0	0	0	114.9	D106 S160 T161 R162	D106-S158 PolarHBondContact O-N 3.02Å; D106-S158 VanDerWaalsContact O-N 3.1Å; S158-S160 PolarHBondContact O-N 3.28Å; S158-T161 PolarHBondContact O-N 3.47Å; S158-T161 VanDerWaalsContact O-N 3.15Å; S158-R162 PolarHBondContact O-N 2.9Å; S158-R162 VanDerWaalsContact O-N 3.12Å
159	R	75	Confident	92.5	Very high	189 Å²	189	32.4 Å²	32.4	71%	0.713	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55	-23.1	-163.8	-97	172	165.1	80.9	-2.7	116.1
160	S	78.1	Confident	92.9	Very high	96 Å²	96	26.5 Å²	26.5	67%	0.671	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-43.7	178.7	55	0	0	0	0	112.5	R89 S158	R89-S160 PolarHBondContact NH2-O 3.43Å; S158-S160 PolarHBondContact O-N 3.28Å
161	T	82.1	Confident	93	Very high	67 Å²	67	26.7 Å²	26.7	41%	0.411	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100	-44.6	-175.5	50.8	0	0	0	0	112.2	R89 S157 S158 C163	R89-T161 PolarHBondContact NE-O 3.14Å; S157-T161 PolarHBondContact OG-OG1 3.5Å; S158-T161 PolarHBondContact O-N 3.47Å; S158-T161 VanDerWaalsContact O-N 3.15Å; T161-C163 VanDerWaalsContact C-N 3.34Å; T161-C163 PolarHBondContact O-N 3.33Å
162	R	91.3	Very high	92.9	Very high	53 Å²	53	29.6 Å²	29.6	20%	0.2	16%	0.163	C	C	.	.			trans	48.7	52.3	-175.9	-62.1	179.1	-65.2	-156.9	-2.7	112.7	V90 S92 I156 S157 S158	V90-R162 HydrophobicContact CB-CB 4.46Å; V90-R162 PolarHBondContact N-O 3.3Å; S92-R162 PolarHBondContact OG-NH1 3.15Å; I156-R162 HydrophobicContact CG2-CB 4.37Å; S157-R162 PolarHBondContact OG-N 2.98Å; S158-R162 PolarHBondContact O-N 2.9Å; S158-R162 VanDerWaalsContact O-N 3.12Å
163	C	93.5	Very high	92.5	Very high	25 Å²	25	30.4 Å²	30.4	17%	0.169	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-104.8	143	178.1	-71.8	0	0	0	0	109.9	L87 I156 S157 T161 K165	L87-C163 HydrophobicContact CB-CB 3.83Å; L87-C163 HydrophobicContact CD1-CB 4.25Å; I156-C163 WeakPolarHBondContact CA-O 3.45Å; S157-C163 PolarHBondContact N-O 2.97Å; S157-C163 PolarHBondContact OG-N 3.32Å; S157-C163 PolarHBondContact OG-O 3.45Å; T161-C163 VanDerWaalsContact C-N 3.34Å; T161-C163 PolarHBondContact O-N 3.33Å; C163-K165 PolarHBondContact O-N 3.01Å
164	I	95.5	Very high	91.7	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	116.7	174.8	-67.4	174.2	0	0	0	108.7	V88 V90 L124 V128 V154 F155 I156	V88-I164 HydrophobicContact CG1-CD1 4.32Å; V88-I164 PolarHBondContact O-N 3.04Å; V90-I164 HydrophobicContact CG2-CD1 3.87Å; V90-I164 HydrophobicContact CG2-CG1 3.75Å; L124-I164 HydrophobicContact CD1-CD1 3.84Å; L124-I164 HydrophobicContact CD2-CD1 4.23Å; L124-I164 HydrophobicContact CG-CD1 4.12Å; V128-I164 HydrophobicContact CG1-CG2 4.05Å; V128-I164 HydrophobicContact CG2-CB 4.44Å; V128-I164 HydrophobicContact CG2-CD1 3.2Å; V128-I164 HydrophobicContact CG2-CG1 4.36Å; V128-I164 HydrophobicContact CG2-CG2 4.27Å; V154-I164 HydrophobicContact CB-CD1 4.46Å; V154-I164 HydrophobicContact CB-CG2 4.25Å; V154-I164 HydrophobicContact CG1-CD1 4.49Å; V154-I164 HydrophobicContact CG1-CG2 4.4Å; F155-I164 CarbonylContact O-C 3.58Å; F155-I164 WeakPolarHBondContact O-CA 3.38Å; I156-I164 HydrophobicContact CG1-CG1 3.97Å
165	K	95.2	Very high	91.1	Very high	49 Å²	49	41.3 Å²	41.3	21%	0.213	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	-10.8	-179.3	-66	-175.6	158.5	-165.4	0	113.4	L87 F155 C163 V201 S202 S205 I210	L87-K165 HydrophobicContact CD1-CG 4.04Å; F155-K165 HydrophobicContact CD1-CB 3.99Å; F155-K165 HydrophobicContact CE1-CD 4.34Å; F155-K165 PolarHBondContact O-N 3.45Å; C163-K165 PolarHBondContact O-N 3.01Å; K165-V201 CarbonylContact O-C 3.6Å; K165-V201 WeakPolarHBondContact O-CA 3.49Å; K165-V201 WeakPolarHBondContact O-CG1 3.42Å; K165-S202 PolarHBondContact O-N 3.39Å; K165-S202 PolarHBondContact O-OG 2.9Å; K165-S205 VanDerWaalsContact CD-OG 3.27Å; K165-S205 WeakPolarHBondContact CD-OG 3.45Å; K165-S205 WeakPolarHBondContact CE-OG 3.41Å; K165-I210 HydrophobicContact CB-CD1 4.01Å; K165-I210 HydrophobicContact CD-CD1 4.27Å
166	G	97.1	Very high	90.8	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.8	159.2	176.1	0	0	0	0	0	112.7	V154 F155 W200	V154-G166 CarbonylContact C-O 3.59Å; V154-G166 WeakPolarHBondContact CA-O 3.42Å; F155-G166 PolarHBondContact N-O 3.09Å; G166-W200 CarbonylContact C-O 3.54Å; G166-W200 WeakPolarHBondContact CA-O 3.34Å
167	V	97.9	Very high	90.6	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	144.9	176.2	62.7	0	0	0	0	109.8	V128 A132 M152 Y153 V154 V169 L198 W200	V128-V167 HydrophobicContact CG1-CB 4.08Å; V128-V167 HydrophobicContact CG1-CG1 4.31Å; V128-V167 HydrophobicContact CG1-CG2 4.34Å; A132-V167 HydrophobicContact CB-CG1 3.61Å; M152-V167 HydrophobicContact CE-CB 4.5Å; M152-V167 HydrophobicContact CE-CG2 3.48Å; M152-V167 VanDerWaalsContact CE-CG2 3.48Å; M152-V167 HydrophobicContact CG-CG2 3.79Å; M152-V167 HydrophobicContact SD-CG2 4.12Å; Y153-V167 CarbonylContact O-C 3.38Å; Y153-V167 VanDerWaalsContact O-CA 3.31Å; Y153-V167 WeakPolarHBondContact O-CA 3.44Å; V154-V167 HydrophobicContact CG1-CB 4.3Å; V154-V167 HydrophobicContact CG1-CG2 4.06Å; V167-V169 HydrophobicContact CG2-CG2 4.32Å; V167-L198 HydrophobicContact CG1-CD2 4.12Å; V167-W200 HydrophobicContact CG1-CB 3.87Å; V167-W200 HydrophobicContact CG1-CE3 4.03Å; V167-W200 PolarHBondContact N-O 2.93Å; V167-W200 PolarHBondContact O-N 2.92Å
168	V	98.1	Very high	90.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	137.7	162.1	69.6	0	0	0	0	109.5	M152 Y153 V170 V196 L198 I199 L214 V215 A218	M152-V168 WeakPolarHBondContact CA-O 3.47Å; Y153-V168 HydrophobicContact CD2-CG1 4.24Å; Y153-V168 HydrophobicContact CG-CG1 4.45Å; Y153-V168 PolarHBondContact N-O 3.29Å; Y153-V168 PolarHBondContact O-N 3.46Å; V168-V170 HydrophobicContact CG2-CG1 3.75Å; V168-V196 HydrophobicContact CG2-CG1 3.85Å; V168-L198 CarbonylContact C-O 3.54Å; V168-L198 VanDerWaalsContact CA-O 3.24Å; V168-L198 WeakPolarHBondContact CA-O 3.34Å; V168-L198 WeakPolarHBondContact CG2-O 3.25Å; V168-I199 HydrophobicContact CG2-CB 4.41Å; V168-L214 HydrophobicContact CB-CB 4.1Å; V168-L214 HydrophobicContact CG1-CB 3.81Å; V168-L214 HydrophobicContact CG1-CD2 4.23Å; V168-V215 HydrophobicContact CG2-CG2 4.41Å; V168-A218 HydrophobicContact CG1-CB 4.09Å
169	V	97.3	Very high	90.7	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	129.9	172	-174.8	0	0	0	0	107.9	L114 L129 L143 R150 Q151 M152 V167 L197 L198	L114-V169 HydrophobicContact CD1-CG1 3.83Å; L129-V169 HydrophobicContact CD2-CG2 3.96Å; L143-V169 HydrophobicContact CD2-CB 4.21Å; L143-V169 HydrophobicContact CD2-CG1 4.04Å; R150-V169 HydrophobicContact CB-CG1 4.47Å; Q151-V169 WeakPolarHBondContact O-CA 3.4Å; M152-V169 HydrophobicContact CB-CG2 4.35Å; M152-V169 HydrophobicContact CG-CG2 4.2Å; M152-V169 HydrophobicContact SD-CG2 4.48Å; V167-V169 HydrophobicContact CG2-CG2 4.32Å; V169-L197 HydrophobicContact CB-CB 4.44Å; V169-L197 HydrophobicContact CG1-CB 4.44Å; V169-L197 HydrophobicContact CG1-CD1 4.13Å; V169-L197 PolarHBondContact O-N 3.06Å; V169-L198 HydrophobicContact CB-CB 4.12Å; V169-L198 HydrophobicContact CG2-CB 4.16Å; V169-L198 HydrophobicContact CG2-CD2 4.27Å; V169-L198 PolarHBondContact N-O 3.37Å; V169-L198 PolarHBondContact O-N 2.94Å
170	V	96	Very high	91.3	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134	151.8	-172.4	-56.2	0	0	0	0	112.3	R150 Q151 Y153 V168 F194 G195 V196 A218 F222	R150-V170 WeakPolarHBondContact CA-O 3.32Å; Q151-V170 HydrophobicContact CB-CG2 3.96Å; Q151-V170 PolarHBondContact N-O 3.43Å; Q151-V170 PolarHBondContact O-N 3.5Å; Y153-V170 HydrophobicContact CE2-CG2 4.19Å; V168-V170 HydrophobicContact CG2-CG1 3.75Å; V170-F194 HydrophobicContact CB-CE1 4.31Å; V170-F194 HydrophobicContact CB-CE2 3.86Å; V170-F194 HydrophobicContact CB-CZ 3.65Å; V170-F194 HydrophobicContact CG1-CE1 3.89Å; V170-F194 HydrophobicContact CG1-CE2 4.25Å; V170-F194 HydrophobicContact CG1-CZ 3.52Å; V170-F194 HydrophobicContact CG2-CE2 3.79Å; V170-F194 HydrophobicContact CG2-CZ 3.79Å; V170-G195 CarbonylContact C-O 3.6Å; V170-G195 WeakPolarHBondContact CA-O 3.36Å; V170-V196 HydrophobicContact CG1-CG2 4.29Å; V170-A218 HydrophobicContact CG1-CB 4.13Å; V170-A218 HydrophobicContact CG2-CB 4.22Å; V170-F222 HydrophobicContact CG2-CD2 3.77Å; V170-F222 HydrophobicContact CG2-CE2 3.99Å
171	E	93.7	Very high	91.7	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.056	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	167.8	172.3	73.3	-177.4	-177	0	0	112.3	R150 G195 L197	R150-E171 HydrophobicContact CG-CB 3.9Å; R150-E171 IonicContact CZ-OE2 2.87Å; R150-E171 IonicContact NE-OE2 2.61Å; R150-E171 PolarHBondContact NE-OE2 3.29Å; R150-E171 IonicContact NH2-OE2 3.13Å; R150-E171 PolarHBondContact NH2-OE2 3.03Å; E171-G195 PolarHBondContact N-O 3.21Å; E171-G195 WeakPolarHBondContact O-CA 3.15Å; E171-G195 PolarHBondContact O-N 3.44Å; E171-L197 HydrophobicContact CB-CD1 4.01Å; E171-L197 HydrophobicContact CG-CD1 3.74Å; E171-L197 HydrophobicContact CG-CD2 3.92Å; E171-L197 HydrophobicContact CG-CG 3.95Å; E171-L197 WeakPolarHBondContact OE1-CD2 3.4Å
172	A	91.9	Very high	91.8	Very high	66 Å²	66	35.1 Å²	35.1	55%	0.545	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	124.6	166.7	0	0	0	0	0	108.2	F222	A172-F222 HydrophobicContact CB-CE1 4Å; A172-F222 HydrophobicContact CB-CZ 4.03Å; A172-F222 VanDerWaalsContact N-CZ 3.31Å
173	T	88.1	Confident	91.3	Very high	16 Å²	16	35.2 Å²	35.2	10%	0.098	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	136.5	173.9	-178.3	0	0	0	0	110.6	K175 L192 A193 A234 F258	T173-K175 PolarHBondContact OG1-O 3.34Å; T173-L192 CarbonylContact O-C 3.59Å; T173-L192 VanDerWaalsContact O-CA 3.27Å; T173-L192 WeakPolarHBondContact O-CA 3.47Å; T173-A193 HydrophobicContact CG2-CB 3.79Å; T173-A193 WeakPolarHBondContact CG2-O 3.49Å; T173-A193 PolarHBondContact N-O 3.07Å; T173-A193 PolarHBondContact O-N 2.76Å; T173-A234 HydrophobicContact CG2-CB 4.36Å; T173-F258 HydrophobicContact CG2-CD1 4.17Å; T173-F258 HydrophobicContact CG2-CD2 4.27Å; T173-F258 HydrophobicContact CG2-CE1 4.25Å; T173-F258 HydrophobicContact CG2-CE2 4.33Å; T173-F258 HydrophobicContact CG2-CG 4.18Å; T173-F258 HydrophobicContact CG2-CZ 4.31Å
174	A	83	Confident	90.8	Very high	59 Å²	59	37.5 Å²	37.5	49%	0.488	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	-19.8	-179.2	0	0	0	0	0	113	S191 L192	A174-S191 WeakPolarHBondContact O-CA 3.46Å; A174-L192 PolarHBondContact O-N 2.89Å
175	K	85.2	Confident	90.3	Very high	170 Å²	170	40.9 Å²	40.9	74%	0.739	27%	0.269	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.6	118.3	-174.6	-63.9	-175.7	-179.5	-177.7	0	110.3	T173 F258	T173-K175 PolarHBondContact OG1-O 3.34Å; K175-F258 VanDerWaalsContact O-CB 3.26Å; K175-F258 WeakPolarHBondContact O-CB 3.35Å
176	A	91.7	Very high	89.7	Confident	2 Å²	2	40.8 Å²	40.8	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	138.3	166	0	0	0	0	0	109.6	T189 K190 A193 A234 L256 L257 F258	A176-T189 CarbonylContact O-C 3.55Å; A176-T189 WeakPolarHBondContact O-CA 3.49Å; A176-K190 PolarHBondContact N-O 3.25Å; A176-K190 PolarHBondContact O-N 3.46Å; A176-A193 HydrophobicContact CB-CB 4.15Å; A176-A234 HydrophobicContact CB-CB 3.65Å; A176-L256 HydrophobicContact CB-CB 4.08Å; A176-L256 HydrophobicContact CB-CD2 4.33Å; A176-L257 CarbonylContact C-O 3.52Å; A176-L257 WeakPolarHBondContact CA-O 3.25Å; A176-F258 HydrophobicContact CB-CB 4.41Å
177	A	92	Very high	88.8	Confident	32 Å²	32	48.6 Å²	48.6	26%	0.264	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	138.7	175.7	0	0	0	0	0	109.4	L256 L257	A177-L256 WeakPolarHBondContact O-CA 3.29Å; A177-L257 PolarHBondContact N-O 2.94Å; A177-L257 PolarHBondContact O-N 3.39Å
178	L	91.7	Very high	88	Confident	39 Å²	39	55.7 Å²	55.7	20%	0.204	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	124.3	172.7	-173	72	0	0	0	109	S186 K188 D254 L256	L178-S186 WeakPolarHBondContact O-CB 3.34Å; L178-S186 PolarHBondContact O-N 3.48Å; L178-K188 PolarHBondContact N-O 2.81Å; L178-D254 HydrophobicContact CD1-CB 3.83Å; L178-D254 HydrophobicContact CD2-CB 4.26Å; L178-D254 HydrophobicContact CG-CB 4.09Å; L178-L256 HydrophobicContact CB-CD2 4.2Å; L178-L256 HydrophobicContact CD1-CD2 4.08Å; L178-L256 HydrophobicContact CD1-CG 4.46Å
179	V	91.1	Very high	87.2	Confident	24 Å²	24	60.7 Å²	60.7	15%	0.145	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	123.4	178.9	-179.2	0	0	0	0	109.1	A185 D254 I255 L257	V179-A185 HydrophobicContact CG2-CB 4.47Å; V179-D254 WeakPolarHBondContact O-CA 3.43Å; V179-I255 PolarHBondContact N-O 2.94Å; V179-I255 PolarHBondContact O-N 2.82Å; V179-L257 HydrophobicContact CB-CD1 3.88Å; V179-L257 HydrophobicContact CB-CG 4.22Å; V179-L257 HydrophobicContact CG1-CD1 4.19Å; V179-L257 HydrophobicContact CG2-CB 4.07Å; V179-L257 HydrophobicContact CG2-CD1 3.86Å; V179-L257 HydrophobicContact CG2-CG 4.1Å
180	G	87.9	Confident	86.4	Confident	9 Å²	9	63.4 Å²	63.4	9%	0.093	39%	0.39	C	S	.	.			trans	-75.8	177.2	-176.8	0	0	0	0	0	114.2	D182 G183 C184 D254	G180-D182 PolarHBondContact O-N 3.25Å; G180-G183 PolarHBondContact O-N 3.11Å; G180-G183 VanDerWaalsContact O-N 3.08Å; G180-C184 PolarHBondContact N-O 3.4Å; G180-D254 WeakPolarHBondContact CA-OD1 3.32Å
181	A	84.7	Confident	85.5	Confident	62 Å²	62	68.1 Å²	68.1	51%	0.512	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-33.7	176.1	0	0	0	0	0	113.3	G183 N253	A181-G183 PolarHBondContact O-N 3.28Å; A181-N253 HydrophobicContact CB-CB 3.77Å
182	D	85.2	Confident	84.6	Confident	118 Å²	118	73.4 Å²	73.4	63%	0.631	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-6.1	179.4	61.8	-12.2	0	0	0	113.4	G180 C184	G180-D182 PolarHBondContact O-N 3.25Å; D182-C184 VanDerWaalsContact CG-SG 3.54Å; D182-C184 PolarHBondContact O-N 3.44Å; D182-C184 WeakPolarHBondContact OD1-CB 3.38Å; D182-C184 PolarHBondContact OD1-N 3.21Å; D182-C184 WeakPolarHBondContact OD2-CB 3.4Å; D182-C184 PolarHBondContact OD2-SG 3.3Å
183	G	80.8	Confident	84.1	Confident	54 Å²	54	70.7 Å²	70.7	56%	0.557	43%	0.429	S	S	*	.	S	Bend	trans	80.1	1.4	-175.5	0	0	0	0	0	113.6	G180 A181	G180-G183 PolarHBondContact O-N 3.11Å; G180-G183 VanDerWaalsContact O-N 3.08Å; A181-G183 PolarHBondContact O-N 3.28Å
184	C	83.5	Confident	84.4	Confident	74 Å²	74	70 Å²	70	50%	0.5	42%	0.424	S	S	.	.	P	Polyproline II helix	trans	-74.7	130.1	175.5	-65	0	0	0	0	109.5	G180 D182	G180-C184 PolarHBondContact N-O 3.4Å; D182-C184 VanDerWaalsContact CG-SG 3.54Å; D182-C184 PolarHBondContact O-N 3.44Å; D182-C184 WeakPolarHBondContact OD1-CB 3.38Å; D182-C184 PolarHBondContact OD1-N 3.21Å; D182-C184 WeakPolarHBondContact OD2-CB 3.4Å; D182-C184 PolarHBondContact OD2-SG 3.3Å
185	A	84.2	Confident	85	Confident	72 Å²	72	67.2 Å²	67.2	60%	0.595	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.2	130.2	169.4	0	0	0	0	0	109.1	V179	V179-A185 HydrophobicContact CG2-CB 4.47Å
186	S	82	Confident	85.5	Confident	47 Å²	47	59.2 Å²	59.2	33%	0.329	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	148	168.1	-174.2	0	0	0	0	109.8	L178 K188	L178-S186 WeakPolarHBondContact O-CB 3.34Å; L178-S186 PolarHBondContact O-N 3.48Å; S186-K188 PolarHBondContact O-N 3.16Å; S186-K188 VanDerWaalsContact O-N 3.1Å; S186-K188 PolarHBondContact OG-N 3.3Å
187	D	79.1	Confident	85.7	Confident	164 Å²	164	59.8 Å²	59.8	88%	0.877	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-62.5	-14.1	170.3	-67.1	-33.3	0	0	0	112.9	T189	D187-T189 PolarHBondContact O-N 3.09Å; D187-T189 VanDerWaalsContact O-N 3.13Å
188	K	80	Confident	85.9	Confident	149 Å²	149	58.5 Å²	58.5	65%	0.648	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.3	109.3	174.8	-66.1	-179.9	-177.4	175.7	0	109.8	L178 S186	L178-K188 PolarHBondContact N-O 2.81Å; S186-K188 PolarHBondContact O-N 3.16Å; S186-K188 VanDerWaalsContact O-N 3.1Å; S186-K188 PolarHBondContact OG-N 3.3Å
189	T	82.8	Confident	86.2	Confident	106 Å²	106	58.1 Å²	58.1	65%	0.65	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.1	146.3	169.7	58.2	0	0	0	0	110.5	A176 D187	A176-T189 CarbonylContact O-C 3.55Å; A176-T189 WeakPolarHBondContact O-CA 3.49Å; D187-T189 PolarHBondContact O-N 3.09Å; D187-T189 VanDerWaalsContact O-N 3.13Å
190	K	80.2	Confident	86.5	Confident	56 Å²	56	57.5 Å²	57.5	24%	0.243	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	119.3	170.8	-165.8	165.3	-171.9	152.9	0	109.1	A176 A231 D232 L256	A176-K190 PolarHBondContact N-O 3.25Å; A176-K190 PolarHBondContact O-N 3.46Å; K190-A231 PolarHBondContact NZ-O 3.37Å; K190-D232 WeakPolarHBondContact CE-OD1 3.38Å; K190-D232 WeakPolarHBondContact CE-OD2 3.47Å; K190-D232 IonicContact NZ-OD1 3.52Å; K190-D232 PolarHBondContact NZ-OD1 2.91Å; K190-D232 IonicContact NZ-OD2 3.6Å; K190-D232 PolarHBondContact NZ-OD2 3.47Å; K190-L256 HydrophobicContact CB-CD1 4.34Å; K190-L256 HydrophobicContact CB-CD2 4.18Å; K190-L256 HydrophobicContact CD-CD1 3.67Å
191	S	76.2	Confident	86.9	Confident	99 Å²	99	57.9 Å²	57.9	69%	0.692	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	118.7	170	-170	0	0	0	0	107.6	A174	A174-S191 WeakPolarHBondContact O-CA 3.46Å
192	L	76.3	Confident	87.3	Confident	123 Å²	123	55 Å²	55	64%	0.644	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	72.3	99.2	-174.7	-51.9	169.8	0	0	0	113.9	T173 A174	T173-L192 CarbonylContact O-C 3.59Å; T173-L192 VanDerWaalsContact O-CA 3.27Å; T173-L192 WeakPolarHBondContact O-CA 3.47Å; A174-L192 PolarHBondContact O-N 2.89Å
193	A	81.6	Confident	87.5	Confident	9 Å²	9	50.8 Å²	50.8	7%	0.074	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	158.5	173.9	0	0	0	0	0	111.2	T173 A176 G195 D232 A234	T173-A193 HydrophobicContact CG2-CB 3.79Å; T173-A193 WeakPolarHBondContact CG2-O 3.49Å; T173-A193 PolarHBondContact N-O 3.07Å; T173-A193 PolarHBondContact O-N 2.76Å; A176-A193 HydrophobicContact CB-CB 4.15Å; A193-G195 PolarHBondContact O-N 2.93Å; A193-D232 WeakPolarHBondContact CB-O 3.25Å; A193-A234 HydrophobicContact CB-CB 3.92Å
194	F	93.1	Very high	87.7	Confident	2 Å²	2	50.2 Å²	50.2	1%	0.009	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	101.1	169.7	-179.7	-103.7	0	0	0	109	V170 V196 V215 A218 R219 F222 L228 D232 V233 A234	V170-F194 HydrophobicContact CB-CE1 4.31Å; V170-F194 HydrophobicContact CB-CE2 3.86Å; V170-F194 HydrophobicContact CB-CZ 3.65Å; V170-F194 HydrophobicContact CG1-CE1 3.89Å; V170-F194 HydrophobicContact CG1-CE2 4.25Å; V170-F194 HydrophobicContact CG1-CZ 3.52Å; V170-F194 HydrophobicContact CG2-CE2 3.79Å; V170-F194 HydrophobicContact CG2-CZ 3.79Å; F194-V196 HydrophobicContact CD1-CG2 4.36Å; F194-V196 HydrophobicContact CE1-CG2 4.09Å; F194-V215 HydrophobicContact CE1-CG1 4.25Å; F194-A218 HydrophobicContact CZ-CB 3.72Å; F194-R219 HydrophobicContact CD1-CG 3.7Å; F194-R219 HydrophobicContact CE1-CG 3.5Å; F194-R219 VanDerWaalsContact CE1-CG 3.5Å; F194-R219 HydrophobicContact CE2-CG 4.49Å; F194-R219 HydrophobicContact CG-CG 4.26Å; F194-R219 HydrophobicContact CZ-CG 3.9Å; F194-F222 HydrophobicContact CD2-CB 4.11Å; F194-F222 AromaticContact CD2-CD1 3.99Å; F194-F222 HydrophobicContact CD2-CD1 3.99Å; F194-F222 HydrophobicContact CD2-CD2 4.16Å; F194-F222 AromaticContact CD2-CG 3.81Å; F194-F222 HydrophobicContact CD2-CG 3.81Å; F194-F222 HydrophobicContact CE2-CB 3.65Å; F194-F222 HydrophobicContact CE2-CD1 4.2Å; F194-F222 AromaticContact CE2-CD2 3.62Å; F194-F222 HydrophobicContact CE2-CD2 3.62Å; F194-F222 HydrophobicContact CE2-CE2 4.35Å; F194-F222 AromaticContact CE2-CG 3.54Å; F194-F222 HydrophobicContact CE2-CG 3.54Å; F194-L228 HydrophobicContact CB-CD1 3.87Å; F194-L228 HydrophobicContact CD2-CD1 3.45Å; F194-L228 VanDerWaalsContact CD2-CD1 3.45Å; F194-L228 HydrophobicContact CE2-CD1 4.3Å; F194-L228 HydrophobicContact CG-CD1 3.94Å; F194-D232 PolarHBondContact N-O 2.96Å; F194-V233 HydrophobicContact CD1-CG1 4.28Å; F194-V233 HydrophobicContact CD1-CG2 4.08Å; F194-V233 WeakPolarHBondContact O-CA 3.41Å; F194-A234 PolarHBondContact O-N 3.13Å
195	G	95.2	Very high	88	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	116.8	-174.2	0	0	0	0	0	112.7	V170 E171 A193 A234 F258	V170-G195 CarbonylContact C-O 3.6Å; V170-G195 WeakPolarHBondContact CA-O 3.36Å; E171-G195 PolarHBondContact N-O 3.21Å; E171-G195 WeakPolarHBondContact O-CA 3.15Å; E171-G195 PolarHBondContact O-N 3.44Å; A193-G195 PolarHBondContact O-N 2.93Å; G195-A234 CarbonylContact C-O 3.57Å; G195-A234 WeakPolarHBondContact CA-O 3.31Å; G195-F258 VanDerWaalsContact CA-CE1 3.46Å; G195-F258 VanDerWaalsContact CA-CZ 3.47Å
196	V	97	Very high	88.4	Confident	3 Å²	3	47.3 Å²	47.3	2%	0.018	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	108.1	167.7	179.1	0	0	0	0	108.7	V168 V170 F194 I199 V215 V233 A234 F235 A236	V168-V196 HydrophobicContact CG2-CG1 3.85Å; V170-V196 HydrophobicContact CG1-CG2 4.29Å; F194-V196 HydrophobicContact CD1-CG2 4.36Å; F194-V196 HydrophobicContact CE1-CG2 4.09Å; V196-I199 HydrophobicContact CG1-CB 4.07Å; V196-I199 HydrophobicContact CG1-CG2 4.26Å; V196-V215 HydrophobicContact CG2-CG1 4.3Å; V196-V233 HydrophobicContact CG2-CG1 3.82Å; V196-A234 PolarHBondContact N-O 2.96Å; V196-F235 HydrophobicContact CB-CD1 3.76Å; V196-F235 HydrophobicContact CB-CE1 4.01Å; V196-F235 HydrophobicContact CB-CG 4.45Å; V196-F235 HydrophobicContact CG1-CD1 3.92Å; V196-F235 HydrophobicContact CG1-CE1 4.08Å; V196-F235 HydrophobicContact CG2-CD1 4.27Å; V196-F235 HydrophobicContact CG2-CE1 4.05Å; V196-A236 PolarHBondContact O-N 3.34Å
197	L	95.8	Very high	88.8	Confident	13 Å²	13	56 Å²	56	7%	0.068	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	-33.7	-177.7	-61.2	173.1	0	0	0	113.2	L143 R150 V169 E171 A236 F258 M260	L143-L197 HydrophobicContact CD2-CB 3.63Å; L143-L197 HydrophobicContact CD2-CD1 4.26Å; R150-L197 HydrophobicContact CG-CD1 3.9Å; V169-L197 HydrophobicContact CB-CB 4.44Å; V169-L197 HydrophobicContact CG1-CB 4.44Å; V169-L197 HydrophobicContact CG1-CD1 4.13Å; V169-L197 PolarHBondContact O-N 3.06Å; E171-L197 HydrophobicContact CB-CD1 4.01Å; E171-L197 HydrophobicContact CG-CD1 3.74Å; E171-L197 HydrophobicContact CG-CD2 3.92Å; E171-L197 HydrophobicContact CG-CG 3.95Å; E171-L197 WeakPolarHBondContact OE1-CD2 3.4Å; L197-A236 HydrophobicContact CD2-CB 4.14Å; L197-F258 HydrophobicContact CD2-CE2 3.72Å; L197-F258 HydrophobicContact CD2-CZ 3.64Å; L197-M260 HydrophobicContact CD1-CE 4.21Å; L197-M260 HydrophobicContact CD2-CE 4.36Å; L197-M260 HydrophobicContact CD2-CG 4.16Å; L197-M260 HydrophobicContact CD2-SD 4.47Å
198	L	96.6	Very high	89.5	Confident	5 Å²	5	52.8 Å²	52.8	3%	0.026	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	134	176.9	176.6	68.1	0	0	0	107.4	L129 A132 V136 A138 L143 V167 V168 V169	L129-L198 HydrophobicContact CD2-CD2 3.87Å; A132-L198 HydrophobicContact CB-CD2 4.04Å; V136-L198 HydrophobicContact CB-CD1 4.13Å; V136-L198 HydrophobicContact CG1-CD1 4.13Å; V136-L198 HydrophobicContact CG2-CD1 4.08Å; A138-L198 HydrophobicContact CB-CD1 4.31Å; L143-L198 HydrophobicContact CD1-CB 3.96Å; L143-L198 HydrophobicContact CD1-CD2 3.68Å; L143-L198 HydrophobicContact CD1-CG 4.33Å; L143-L198 HydrophobicContact CD2-CB 4.21Å; V167-L198 HydrophobicContact CG1-CD2 4.12Å; V168-L198 CarbonylContact C-O 3.54Å; V168-L198 VanDerWaalsContact CA-O 3.24Å; V168-L198 WeakPolarHBondContact CA-O 3.34Å; V168-L198 WeakPolarHBondContact CG2-O 3.25Å; V169-L198 HydrophobicContact CB-CB 4.12Å; V169-L198 HydrophobicContact CG2-CB 4.16Å; V169-L198 HydrophobicContact CG2-CD2 4.27Å; V169-L198 PolarHBondContact N-O 3.37Å; V169-L198 PolarHBondContact O-N 2.94Å
199	I	97.8	Very high	90.3	Very high	32 Å²	32	47.3 Å²	47.3	16%	0.164	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	129.2	163	-179.2	160.9	0	0	0	108.5	V168 V196 V215 F245	V168-I199 HydrophobicContact CG2-CB 4.41Å; V196-I199 HydrophobicContact CG1-CB 4.07Å; V196-I199 HydrophobicContact CG1-CG2 4.26Å; I199-V215 HydrophobicContact CD1-CG2 3.69Å; I199-F245 HydrophobicContact CD1-CD1 3.98Å; I199-F245 HydrophobicContact CD1-CE1 3.42Å; I199-F245 VanDerWaalsContact CD1-CE1 3.42Å; I199-F245 HydrophobicContact CD1-CE2 4.36Å; I199-F245 HydrophobicContact CD1-CZ 3.63Å
200	W	97.3	Very high	91	Very high	10 Å²	10	42.3 Å²	42.3	4%	0.038	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	140.6	178.2	173.2	88.1	0	0	0	110.2	L87 V131 A132 E135 V136 G166 V167	L87-W200 HydrophobicContact CD2-CH2 4.02Å; V131-W200 HydrophobicContact CG1-CH2 4.24Å; V131-W200 HydrophobicContact CG1-CZ2 4.01Å; A132-W200 HydrophobicContact CB-CB 3.8Å; A132-W200 HydrophobicContact CB-CD2 3.84Å; A132-W200 HydrophobicContact CB-CE3 4.15Å; A132-W200 HydrophobicContact CB-CG 3.71Å; E135-W200 PolarHBondContact OE2-NE1 3.09Å; V136-W200 HydrophobicContact CG2-CB 4.23Å; V136-W200 HydrophobicContact CG2-CG 4.47Å; G166-W200 CarbonylContact C-O 3.54Å; G166-W200 WeakPolarHBondContact CA-O 3.34Å; V167-W200 HydrophobicContact CG1-CB 3.87Å; V167-W200 HydrophobicContact CG1-CE3 4.03Å; V167-W200 PolarHBondContact N-O 2.93Å; V167-W200 PolarHBondContact O-N 2.92Å
201	V	96.1	Very high	91.8	Very high	17 Å²	17	40.1 Å²	40.1	10%	0.103	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	131.7	171.8	-179.9	0	0	0	0	106.8	K165 S203 S205 R206 I210	K165-V201 CarbonylContact O-C 3.6Å; K165-V201 WeakPolarHBondContact O-CA 3.49Å; K165-V201 WeakPolarHBondContact O-CG1 3.42Å; V201-S203 PolarHBondContact O-N 3.27Å; V201-S205 WeakPolarHBondContact CG1-O 3.36Å; V201-R206 HydrophobicContact CB-CG 4.06Å; V201-R206 HydrophobicContact CG1-CG 4.05Å; V201-R206 WeakPolarHBondContact O-CG 3.49Å; V201-R206 PolarHBondContact O-NE 3.09Å; V201-I210 HydrophobicContact CG1-CB 4.11Å; V201-I210 HydrophobicContact CG1-CD1 4.35Å; V201-I210 HydrophobicContact CG1-CG2 4.19Å; V201-I210 HydrophobicContact CG2-CB 4.28Å; V201-I210 HydrophobicContact CG2-CG2 4.03Å
202	S	93	Very high	92.9	Very high	3 Å²	3	38 Å²	38	2%	0.021	20%	0.195	C	C	.	.			trans	-54.6	139.7	179.1	66.6	0	0	0	0	110.6	L87 K165 C204 S205 R206	L87-S202 VanDerWaalsContact CD2-CB 3.45Å; K165-S202 PolarHBondContact O-N 3.39Å; K165-S202 PolarHBondContact O-OG 2.9Å; S202-C204 PolarHBondContact O-N 2.89Å; S202-C204 VanDerWaalsContact O-N 3.09Å; S202-S205 CarbonylContact O-C 3.5Å; S202-S205 WeakPolarHBondContact O-CA 3.46Å; S202-S205 PolarHBondContact O-N 2.83Å; S202-S205 WeakPolarHBondContact OG-CB 3.48Å; S202-S205 PolarHBondContact OG-OG 2.77Å; S202-R206 WeakPolarHBondContact O-CG 3.48Å; S202-R206 PolarHBondContact O-N 2.95Å; S202-R206 VanDerWaalsContact O-N 3.13Å
203	S	88.2	Confident	93.9	Very high	28 Å²	28	34.2 Å²	34.2	20%	0.196	17%	0.172	C	C	.	.	G	3₁₀ helix	trans	-49.8	-42.4	-173.2	-63.3	0	0	0	0	113.2	V201 S205 R206	V201-S203 PolarHBondContact O-N 3.27Å; S203-S205 VanDerWaalsContact C-N 3.26Å; S203-S205 PolarHBondContact O-N 3.42Å; S203-R206 PolarHBondContact O-N 3.35Å; S203-R206 PolarHBondContact OG-NH2 2.81Å
204	C	86	Confident	94.7	Very high	43 Å²	43	33.8 Å²	33.8	29%	0.291	17%	0.169	S	C	.	.	G	3₁₀ helix	trans	-72.6	-11.5	179.4	-57.9	0	0	0	0	114.9	S202 Q208	S202-C204 PolarHBondContact O-N 2.89Å; S202-C204 VanDerWaalsContact O-N 3.09Å; C204-Q208 PolarHBondContact O-NE2 3.13Å
205	S	90.2	Very high	94.9	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.021	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-117.2	5.3	-178.8	-44.8	0	0	0	0	113.1	K165 V201 S202 S203	K165-S205 VanDerWaalsContact CD-OG 3.27Å; K165-S205 WeakPolarHBondContact CD-OG 3.45Å; K165-S205 WeakPolarHBondContact CE-OG 3.41Å; V201-S205 WeakPolarHBondContact CG1-O 3.36Å; S202-S205 CarbonylContact O-C 3.5Å; S202-S205 WeakPolarHBondContact O-CA 3.46Å; S202-S205 PolarHBondContact O-N 2.83Å; S202-S205 WeakPolarHBondContact OG-CB 3.48Å; S202-S205 PolarHBondContact OG-OG 2.77Å; S203-S205 VanDerWaalsContact C-N 3.26Å; S203-S205 PolarHBondContact O-N 3.42Å
206	R	91.8	Very high	95	Very high	81 Å²	81	37 Å²	37	31%	0.306	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.8	156.9	175.1	-71.8	175.1	-169.4	172.8	5.8	110.8	E135 V201 S202 S203 Q208	E135-R206 IonicContact OE2-NH2 2.91Å; E135-R206 PolarHBondContact OE2-NH2 3.47Å; V201-R206 HydrophobicContact CB-CG 4.06Å; V201-R206 HydrophobicContact CG1-CG 4.05Å; V201-R206 WeakPolarHBondContact O-CG 3.49Å; V201-R206 PolarHBondContact O-NE 3.09Å; S202-R206 WeakPolarHBondContact O-CG 3.48Å; S202-R206 PolarHBondContact O-N 2.95Å; S202-R206 VanDerWaalsContact O-N 3.13Å; S203-R206 PolarHBondContact O-N 3.35Å; S203-R206 PolarHBondContact OG-NH2 2.81Å; R206-Q208 PolarHBondContact O-N 3.45Å; R206-Q208 VanDerWaalsContact O-N 3.15Å
207	R	91	Very high	95	Very high	230 Å²	230	37.4 Å²	37.4	87%	0.868	19%	0.188	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.2	19.9	177.8	-46.6	-65.5	-83.8	-171.2	-6.7	114.6
208	Q	93	Very high	95	Very high	96 Å²	96	36.8 Å²	36.8	45%	0.449	19%	0.185	S	C	.	.	S	Bend	trans	-107.6	26.8	173.1	-62.2	170.5	23.2	0	0	111.7	C204 R206 I210 R213	C204-Q208 PolarHBondContact O-NE2 3.13Å; R206-Q208 PolarHBondContact O-N 3.45Å; R206-Q208 VanDerWaalsContact O-N 3.15Å; Q208-I210 PolarHBondContact O-N 3.24Å; Q208-R213 PolarHBondContact O-NH2 3.35Å
209	G	96.5	Very high	95	Very high	35 Å²	35	37.1 Å²	37.1	36%	0.361	19%	0.186	S	C	.	.	S	Bend	trans	67.2	3.2	-179.2	0	0	0	0	0	116	G211 T212 R213	G209-G211 PolarHBondContact O-N 3.45Å; G209-T212 PolarHBondContact O-N 3.15Å; G209-R213 WeakPolarHBondContact O-CG 3.36Å; G209-R213 PolarHBondContact O-N 3.47Å
210	I	97.7	Very high	94.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	20%	0.195	C	C	.	.	H	α-helix	trans	-59.2	-45.4	-178.7	-65.2	177.3	0	0	0	111.7	F155 K165 V201 Q208 T212 R213 L214	F155-I210 HydrophobicContact CB-CG2 3.8Å; F155-I210 HydrophobicContact CD1-CD1 4.13Å; F155-I210 HydrophobicContact CD1-CG1 4.48Å; F155-I210 HydrophobicContact CD1-CG2 4.31Å; F155-I210 HydrophobicContact CD2-CG2 4.17Å; F155-I210 HydrophobicContact CE1-CD1 4.13Å; F155-I210 HydrophobicContact CE1-CG1 4.45Å; F155-I210 HydrophobicContact CG-CG2 3.83Å; F155-I210 HydrophobicContact CZ-CG1 4.49Å; K165-I210 HydrophobicContact CB-CD1 4.01Å; K165-I210 HydrophobicContact CD-CD1 4.27Å; V201-I210 HydrophobicContact CG1-CB 4.11Å; V201-I210 HydrophobicContact CG1-CD1 4.35Å; V201-I210 HydrophobicContact CG1-CG2 4.19Å; V201-I210 HydrophobicContact CG2-CB 4.28Å; V201-I210 HydrophobicContact CG2-CG2 4.03Å; Q208-I210 PolarHBondContact O-N 3.24Å; I210-T212 PolarHBondContact O-N 3.24Å; I210-R213 PolarHBondContact O-N 3.03Å; I210-L214 HydrophobicContact CG2-CD1 3.87Å; I210-L214 HydrophobicContact CG2-CG 4.35Å; I210-L214 WeakPolarHBondContact O-CB 3.35Å; I210-L214 WeakPolarHBondContact O-CG 3.21Å; I210-L214 PolarHBondContact O-N 3.39Å
211	G	97.9	Very high	94.6	Very high	9 Å²	9	40 Å²	40	9%	0.093	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-47.9	178.8	0	0	0	0	0	112.3	G209 R213 L214 V215	G209-G211 PolarHBondContact O-N 3.45Å; G211-R213 PolarHBondContact O-N 3.4Å; G211-L214 WeakPolarHBondContact O-CB 3.5Å; G211-L214 PolarHBondContact O-N 2.97Å; G211-V215 WeakPolarHBondContact O-CG2 3.45Å; G211-V215 PolarHBondContact O-N 3.49Å
212	T	97.9	Very high	94.4	Very high	55 Å²	55	40 Å²	40	34%	0.337	21%	0.207	S	C	.	.	H	α-helix	trans	-59.4	-45.8	175.6	-53	0	0	0	0	111.7	G209 I210 L214 V215 N216 Y249	G209-T212 PolarHBondContact O-N 3.15Å; I210-T212 PolarHBondContact O-N 3.24Å; T212-L214 VanDerWaalsContact C-N 3.32Å; T212-L214 PolarHBondContact O-N 3.47Å; T212-V215 PolarHBondContact O-N 3.37Å; T212-N216 WeakPolarHBondContact O-CB 3.29Å; T212-N216 VanDerWaalsContact O-CG 3.31Å; T212-N216 PolarHBondContact O-N 3.5Å; T212-Y249 HydrophobicContact CG2-CD2 3.99Å; T212-Y249 HydrophobicContact CG2-CE2 4.02Å
213	R	98.1	Very high	94.2	Very high	44 Å²	44	43.5 Å²	43.5	17%	0.166	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-40.5	177.4	-73.5	-174.2	-76.4	174.7	-4.8	112.3	F104 D106 I109 Q208 G209 I210 G211 T217	F104-R213 VanDerWaalsContact CB-NH1 3.25Å; F104-R213 HydrophobicContact CE1-CB 4.43Å; F104-R213 HydrophobicContact CE1-CG 3.91Å; F104-R213 HydrophobicContact CZ-CB 4.04Å; F104-R213 HydrophobicContact CZ-CG 4.03Å; D106-R213 IonicContact OD1-CZ 2.79Å; D106-R213 IonicContact OD1-NH1 3.25Å; D106-R213 PolarHBondContact OD1-NH1 3.35Å; D106-R213 IonicContact OD1-NH2 3.34Å; D106-R213 PolarHBondContact OD1-NH2 3.39Å; D106-R213 IonicContact OD2-CZ 3.81Å; D106-R213 IonicContact OD2-NH1 3.99Å; D106-R213 IonicContact OD2-NH2 3.22Å; D106-R213 PolarHBondContact OD2-NH2 3.25Å; I109-R213 HydrophobicContact CD1-CB 4.16Å; Q208-R213 PolarHBondContact O-NH2 3.35Å; G209-R213 WeakPolarHBondContact O-CG 3.36Å; G209-R213 PolarHBondContact O-N 3.47Å; I210-R213 PolarHBondContact O-N 3.03Å; G211-R213 PolarHBondContact O-N 3.4Å; R213-T217 VanDerWaalsContact O-CB 3.23Å; R213-T217 WeakPolarHBondContact O-CB 3.39Å; R213-T217 PolarHBondContact O-N 2.91Å; R213-T217 PolarHBondContact O-OG1 3.28Å
214	L	98.6	Very high	94	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.8	-51	176.1	-78.7	167	0	0	0	111.7	I109 F155 V168 I210 G211 T212 T217 A218	I109-L214 HydrophobicContact CD1-CD2 4.09Å; I109-L214 HydrophobicContact CD1-CG 4.4Å; I109-L214 HydrophobicContact CG1-CD2 4.2Å; I109-L214 HydrophobicContact CG2-CD2 4.26Å; F155-L214 HydrophobicContact CB-CD1 4.45Å; F155-L214 HydrophobicContact CB-CD2 4.12Å; F155-L214 HydrophobicContact CB-CG 4.36Å; V168-L214 HydrophobicContact CB-CB 4.1Å; V168-L214 HydrophobicContact CG1-CB 3.81Å; V168-L214 HydrophobicContact CG1-CD2 4.23Å; I210-L214 HydrophobicContact CG2-CD1 3.87Å; I210-L214 HydrophobicContact CG2-CG 4.35Å; I210-L214 WeakPolarHBondContact O-CB 3.35Å; I210-L214 WeakPolarHBondContact O-CG 3.21Å; I210-L214 PolarHBondContact O-N 3.39Å; G211-L214 WeakPolarHBondContact O-CB 3.5Å; G211-L214 PolarHBondContact O-N 2.97Å; T212-L214 VanDerWaalsContact C-N 3.32Å; T212-L214 PolarHBondContact O-N 3.47Å; L214-T217 PolarHBondContact O-N 3.04Å; L214-A218 WeakPolarHBondContact O-CB 3.36Å; L214-A218 PolarHBondContact O-N 3.14Å
215	V	97.8	Very high	94	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-65.6	-44.1	-179.3	-174.4	0	0	0	0	111.2	V168 F194 V196 I199 G211 T212 T217 A218 R219 V233 F245 Y249	V168-V215 HydrophobicContact CG2-CG2 4.41Å; F194-V215 HydrophobicContact CE1-CG1 4.25Å; V196-V215 HydrophobicContact CG2-CG1 4.3Å; I199-V215 HydrophobicContact CD1-CG2 3.69Å; G211-V215 WeakPolarHBondContact O-CG2 3.45Å; G211-V215 PolarHBondContact O-N 3.49Å; T212-V215 PolarHBondContact O-N 3.37Å; V215-T217 VanDerWaalsContact C-N 3.35Å; V215-T217 PolarHBondContact O-N 3.01Å; V215-A218 PolarHBondContact O-N 3.34Å; V215-R219 HydrophobicContact CG1-CG 4.4Å; V215-R219 VanDerWaalsContact O-CG 3.32Å; V215-R219 WeakPolarHBondContact O-CG 3.05Å; V215-R219 PolarHBondContact O-N 2.86Å; V215-V233 HydrophobicContact CG1-CG1 4.23Å; V215-F245 HydrophobicContact CG2-CE1 4.04Å; V215-F245 HydrophobicContact CG2-CZ 4Å; V215-Y249 HydrophobicContact CB-CE2 3.84Å; V215-Y249 HydrophobicContact CG1-CE1 3.95Å; V215-Y249 HydrophobicContact CG1-CE2 3.98Å; V215-Y249 VanDerWaalsContact CG1-CZ 3.48Å; V215-Y249 WeakPolarHBondContact CG1-OH 3.35Å
216	N	96.8	Very high	93.5	Very high	69 Å²	69	53.2 Å²	53.2	37%	0.369	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-44.5	176.9	-74.7	-4	0	0	0	112	T212 A218 R219 A220 Y249	T212-N216 WeakPolarHBondContact O-CB 3.29Å; T212-N216 VanDerWaalsContact O-CG 3.31Å; T212-N216 PolarHBondContact O-N 3.5Å; N216-A218 VanDerWaalsContact C-N 3.34Å; N216-R219 PolarHBondContact O-N 3.4Å; N216-R219 PolarHBondContact OD1-NH1 3.22Å; N216-A220 WeakPolarHBondContact O-CB 3.1Å; N216-A220 PolarHBondContact O-N 3.17Å; N216-Y249 WeakPolarHBondContact OD1-CE2 3.33Å; N216-Y249 PolarHBondContact OD1-OH 3.32Å
217	T	96.8	Very high	93.2	Very high	12 Å²	12	55.9 Å²	55.9	7%	0.074	32%	0.323	C	S	.	.	H	α-helix	trans	-63.7	-43.6	178.1	-57.8	0	0	0	0	110.7	V101 A102 I109 Y153 R213 L214 V215 A220 N221	V101-T217 HydrophobicContact CB-CG2 4.26Å; V101-T217 HydrophobicContact CG2-CG2 3.48Å; V101-T217 VanDerWaalsContact CG2-CG2 3.48Å; A102-T217 HydrophobicContact CB-CG2 3.98Å; I109-T217 HydrophobicContact CB-CG2 4.27Å; I109-T217 HydrophobicContact CD1-CG2 4.29Å; I109-T217 VanDerWaalsContact CD1-OG1 3.28Å; I109-T217 WeakPolarHBondContact CD1-OG1 3.46Å; I109-T217 HydrophobicContact CG2-CG2 3.88Å; Y153-T217 HydrophobicContact CD1-CG2 4.42Å; R213-T217 VanDerWaalsContact O-CB 3.23Å; R213-T217 WeakPolarHBondContact O-CB 3.39Å; R213-T217 PolarHBondContact O-N 2.91Å; R213-T217 PolarHBondContact O-OG1 3.28Å; L214-T217 PolarHBondContact O-N 3.04Å; V215-T217 VanDerWaalsContact C-N 3.35Å; V215-T217 PolarHBondContact O-N 3.01Å; T217-A220 PolarHBondContact O-N 2.91Å; T217-N221 WeakPolarHBondContact O-CB 3.44Å; T217-N221 PolarHBondContact O-N 3.12Å; T217-N221 VanDerWaalsContact O-N 3.17Å; T217-N221 PolarHBondContact O-ND2 3Å
218	A	96.6	Very high	93	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.6	-45.1	178.1	0	0	0	0	0	111.3	Y153 V168 V170 F194 L214 V215 N216 A220 N221 F222	Y153-A218 HydrophobicContact CD2-CB 3.54Å; Y153-A218 HydrophobicContact CE2-CB 3.6Å; Y153-A218 HydrophobicContact CG-CB 4.24Å; V168-A218 HydrophobicContact CG1-CB 4.09Å; V170-A218 HydrophobicContact CG1-CB 4.13Å; V170-A218 HydrophobicContact CG2-CB 4.22Å; F194-A218 HydrophobicContact CZ-CB 3.72Å; L214-A218 WeakPolarHBondContact O-CB 3.36Å; L214-A218 PolarHBondContact O-N 3.14Å; V215-A218 PolarHBondContact O-N 3.34Å; N216-A218 VanDerWaalsContact C-N 3.34Å; A218-A220 PolarHBondContact O-N 2.91Å; A218-N221 CarbonylContact O-C 3.49Å; A218-N221 PolarHBondContact O-N 3.23Å; A218-F222 VanDerWaalsContact O-CB 3.31Å; A218-F222 WeakPolarHBondContact O-CB 3.29Å; A218-F222 PolarHBondContact O-N 3.19Å
219	R	95.1	Very high	92.7	Very high	11 Å²	11	45 Å²	45	4%	0.042	29%	0.288	C	S	.	.	H	α-helix	trans	-59.4	-42.8	176.1	-73.9	166.4	57.3	-157.7	-5.6	113.4	F194 V215 N216 N221 L228 P229 D230 V233 Y249	F194-R219 HydrophobicContact CD1-CG 3.7Å; F194-R219 HydrophobicContact CE1-CG 3.5Å; F194-R219 VanDerWaalsContact CE1-CG 3.5Å; F194-R219 HydrophobicContact CE2-CG 4.49Å; F194-R219 HydrophobicContact CG-CG 4.26Å; F194-R219 HydrophobicContact CZ-CG 3.9Å; V215-R219 HydrophobicContact CG1-CG 4.4Å; V215-R219 VanDerWaalsContact O-CG 3.32Å; V215-R219 WeakPolarHBondContact O-CG 3.05Å; V215-R219 PolarHBondContact O-N 2.86Å; N216-R219 PolarHBondContact O-N 3.4Å; N216-R219 PolarHBondContact OD1-NH1 3.22Å; R219-N221 PolarHBondContact O-N 2.92Å; R219-L228 PolarHBondContact NE-O 3.43Å; R219-L228 PolarHBondContact NH2-O 2.86Å; R219-P229 VanDerWaalsContact NH2-C 3.27Å; R219-D230 IonicContact CZ-OD1 3.48Å; R219-D230 IonicContact CZ-OD2 2.83Å; R219-D230 IonicContact NH1-OD1 2.69Å; R219-D230 PolarHBondContact NH1-OD1 2.82Å; R219-D230 IonicContact NH1-OD2 2.83Å; R219-D230 PolarHBondContact NH1-OD2 3.19Å; R219-D230 IonicContact NH2-OD1 3.55Å; R219-D230 PolarHBondContact NH2-OD1 3.33Å; R219-D230 IonicContact NH2-OD2 3.22Å; R219-V233 HydrophobicContact CG-CG2 4.28Å; R219-Y249 WeakPolarHBondContact CD-OH 3.44Å; R219-Y249 PolarHBondContact NH1-OH 3.31Å
220	A	94.2	Very high	92.3	Very high	44 Å²	44	46.7 Å²	46.7	36%	0.364	29%	0.29	S	S	.	.	H	α-helix	trans	-71.4	-18.7	-179.3	0	0	0	0	0	113.4	N216 T217 A218	N216-A220 WeakPolarHBondContact O-CB 3.1Å; N216-A220 PolarHBondContact O-N 3.17Å; T217-A220 PolarHBondContact O-N 2.91Å; A218-A220 PolarHBondContact O-N 2.91Å
221	N	93.4	Very high	91.7	Very high	60 Å²	60	50 Å²	50	32%	0.321	32%	0.317	S	S	.	.	H	α-helix	trans	-115.8	-0	-176.7	-70.4	-89.3	0	0	0	113.4	Y153 T217 A218 R219	Y153-N221 HydrophobicContact CE1-CB 4.15Å; Y153-N221 WeakPolarHBondContact OH-CB 3.36Å; T217-N221 WeakPolarHBondContact O-CB 3.44Å; T217-N221 PolarHBondContact O-N 3.12Å; T217-N221 VanDerWaalsContact O-N 3.17Å; T217-N221 PolarHBondContact O-ND2 3Å; A218-N221 CarbonylContact O-C 3.49Å; A218-N221 PolarHBondContact O-N 3.23Å; R219-N221 PolarHBondContact O-N 2.92Å
222	F	91.3	Very high	91.3	Very high	15 Å²	15	51.2 Å²	51.2	7%	0.066	32%	0.321	C	S	.	.	H	α-helix	trans	-69.9	-48.6	-174.6	-168.7	-106.1	0	0	0	112.2	Q151 V170 A172 F194 A218 L228	Q151-F222 HydrophobicContact CG-CD2 4.28Å; Q151-F222 HydrophobicContact CG-CE2 4.28Å; Q151-F222 PolarHBondContact NE2-O 3.39Å; Q151-F222 VanDerWaalsContact NE2-O 3.12Å; V170-F222 HydrophobicContact CG2-CD2 3.77Å; V170-F222 HydrophobicContact CG2-CE2 3.99Å; A172-F222 HydrophobicContact CB-CE1 4Å; A172-F222 HydrophobicContact CB-CZ 4.03Å; A172-F222 VanDerWaalsContact N-CZ 3.31Å; F194-F222 HydrophobicContact CD2-CB 4.11Å; F194-F222 AromaticContact CD2-CD1 3.99Å; F194-F222 HydrophobicContact CD2-CD1 3.99Å; F194-F222 HydrophobicContact CD2-CD2 4.16Å; F194-F222 AromaticContact CD2-CG 3.81Å; F194-F222 HydrophobicContact CD2-CG 3.81Å; F194-F222 HydrophobicContact CE2-CB 3.65Å; F194-F222 HydrophobicContact CE2-CD1 4.2Å; F194-F222 AromaticContact CE2-CD2 3.62Å; F194-F222 HydrophobicContact CE2-CD2 3.62Å; F194-F222 HydrophobicContact CE2-CE2 4.35Å; F194-F222 AromaticContact CE2-CG 3.54Å; F194-F222 HydrophobicContact CE2-CG 3.54Å; A218-F222 VanDerWaalsContact O-CB 3.31Å; A218-F222 WeakPolarHBondContact O-CB 3.29Å; A218-F222 PolarHBondContact O-N 3.19Å; F222-L228 HydrophobicContact CB-CD1 4.05Å; F222-L228 HydrophobicContact CD1-CD1 3.77Å; F222-L228 HydrophobicContact CG-CD1 4.24Å
223	L	88.5	Confident	91.2	Very high	78 Å²	78	48.7 Å²	48.7	41%	0.408	31%	0.306	S	S	.	.	S	Bend	trans	-115	129	174.6	-66.6	179.5	0	0	0	109.3	G225 S226 L228	L223-G225 PolarHBondContact O-N 3.49Å; L223-S226 WeakPolarHBondContact CB-OG 3.45Å; L223-S226 PolarHBondContact O-N 2.75Å; L223-L228 HydrophobicContact CD1-CD2 4.03Å
224	P	84.7	Confident	91.1	Very high	131 Å²	131	46.6 Å²	46.6	85%	0.851	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	133.1	174.3	-24.4	34.4	0	0	0	111.7	S226	P224-S226 PolarHBondContact O-N 3.38Å
225	G	85.3	Confident	90.9	Very high	95 Å²	95	46.8 Å²	46.8	98%	0.979	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.5	5.4	173.2	0	0	0	0	0	116	L223	L223-G225 PolarHBondContact O-N 3.49Å
226	S	81.5	Confident	90.8	Very high	51 Å²	51	47.3 Å²	47.3	36%	0.357	30%	0.303	S	S	.	.			trans	-132.4	150	173.6	61	0	0	0	0	112	L223 P224	L223-S226 WeakPolarHBondContact CB-OG 3.45Å; L223-S226 PolarHBondContact O-N 2.75Å; P224-S226 PolarHBondContact O-N 3.38Å
227	M	84.4	Confident	90.6	Very high	138 Å²	138	48.9 Å²	48.9	68%	0.68	31%	0.311	S	S	*	.			trans	-111.5	115.1	172	-174.5	-178.7	-63.8	0	0	107.8
228	L	86.9	Confident	90.5	Very high	31 Å²	31	50.1 Å²	50.1	16%	0.162	32%	0.32	C	S	.	.			trans	-69.2	132.4	179.5	-66	171.3	0	0	0	110	F194 R219 F222 L223	F194-L228 HydrophobicContact CB-CD1 3.87Å; F194-L228 HydrophobicContact CD2-CD1 3.45Å; F194-L228 VanDerWaalsContact CD2-CD1 3.45Å; F194-L228 HydrophobicContact CE2-CD1 4.3Å; F194-L228 HydrophobicContact CG-CD1 3.94Å; R219-L228 PolarHBondContact NE-O 3.43Å; R219-L228 PolarHBondContact NH2-O 2.86Å; F222-L228 HydrophobicContact CB-CD1 4.05Å; F222-L228 HydrophobicContact CD1-CD1 3.77Å; F222-L228 HydrophobicContact CG-CD1 4.24Å; L223-L228 HydrophobicContact CD1-CD2 4.03Å
229	P	87.7	Confident	90.4	Very high	65 Å²	65	52.9 Å²	52.9	42%	0.422	34%	0.337	S	S	.	.			trans	-62.1	155.8	180	-22	32.1	0	0	0	114	R219 A231 D232	R219-P229 VanDerWaalsContact NH2-C 3.27Å; P229-A231 PolarHBondContact O-N 2.8Å; P229-D232 WeakPolarHBondContact O-CB 3.24Å; P229-D232 PolarHBondContact O-N 3.17Å; P229-D232 VanDerWaalsContact O-N 3.1Å
230	D	87.2	Confident	90.3	Very high	72 Å²	72	60.6 Å²	60.6	39%	0.385	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-61.4	-35.9	176.1	-61.1	53.1	0	0	0	111	R219 D232 V233	R219-D230 IonicContact CZ-OD1 3.48Å; R219-D230 IonicContact CZ-OD2 2.83Å; R219-D230 IonicContact NH1-OD1 2.69Å; R219-D230 PolarHBondContact NH1-OD1 2.82Å; R219-D230 IonicContact NH1-OD2 2.83Å; R219-D230 PolarHBondContact NH1-OD2 3.19Å; R219-D230 IonicContact NH2-OD1 3.55Å; R219-D230 PolarHBondContact NH2-OD1 3.33Å; R219-D230 IonicContact NH2-OD2 3.22Å; D230-D232 PolarHBondContact O-N 3.29Å; D230-D232 VanDerWaalsContact O-N 3.13Å; D230-V233 WeakPolarHBondContact O-CB 3.03Å; D230-V233 WeakPolarHBondContact O-CG2 3.46Å; D230-V233 PolarHBondContact O-N 3.28Å
231	A	86	Confident	90.3	Very high	70 Å²	70	63.5 Å²	63.5	58%	0.579	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-68.7	-4.1	177.2	0	0	0	0	0	114.1	K190 P229 L256	K190-A231 PolarHBondContact NZ-O 3.37Å; P229-A231 PolarHBondContact O-N 2.8Å; A231-L256 WeakPolarHBondContact O-CD1 3.27Å
232	D	88.9	Confident	90.4	Very high	35 Å²	35	61.1 Å²	61.1	19%	0.187	37%	0.37	C	S	.	.	G	3₁₀ helix	trans	-105.1	-0.6	179	-66.4	36.8	0	0	0	111.3	K190 A193 F194 P229 D230 A234	K190-D232 WeakPolarHBondContact CE-OD1 3.38Å; K190-D232 WeakPolarHBondContact CE-OD2 3.47Å; K190-D232 IonicContact NZ-OD1 3.52Å; K190-D232 PolarHBondContact NZ-OD1 2.91Å; K190-D232 IonicContact NZ-OD2 3.6Å; K190-D232 PolarHBondContact NZ-OD2 3.47Å; A193-D232 WeakPolarHBondContact CB-O 3.25Å; F194-D232 PolarHBondContact N-O 2.96Å; P229-D232 WeakPolarHBondContact O-CB 3.24Å; P229-D232 PolarHBondContact O-N 3.17Å; P229-D232 VanDerWaalsContact O-N 3.1Å; D230-D232 PolarHBondContact O-N 3.29Å; D230-D232 VanDerWaalsContact O-N 3.13Å; D232-A234 PolarHBondContact O-N 3.15Å
233	V	94.9	Very high	90.5	Very high	2 Å²	2	62.4 Å²	62.4	1%	0.012	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	117.5	179.2	-175.4	0	0	0	0	109.5	F194 V196 V215 R219 D230 F235 Y249	F194-V233 HydrophobicContact CD1-CG1 4.28Å; F194-V233 HydrophobicContact CD1-CG2 4.08Å; F194-V233 WeakPolarHBondContact O-CA 3.41Å; V196-V233 HydrophobicContact CG2-CG1 3.82Å; V215-V233 HydrophobicContact CG1-CG1 4.23Å; R219-V233 HydrophobicContact CG-CG2 4.28Å; D230-V233 WeakPolarHBondContact O-CB 3.03Å; D230-V233 WeakPolarHBondContact O-CG2 3.46Å; D230-V233 PolarHBondContact O-N 3.28Å; V233-F235 HydrophobicContact CB-CE2 4.43Å; V233-F235 HydrophobicContact CG1-CD2 4.32Å; V233-F235 HydrophobicContact CG1-CE1 4.39Å; V233-F235 HydrophobicContact CG1-CE2 3.59Å; V233-F235 HydrophobicContact CG1-CZ 3.64Å; V233-Y249 HydrophobicContact CB-CE1 4.33Å; V233-Y249 HydrophobicContact CG1-CE1 4.32Å; V233-Y249 HydrophobicContact CG2-CE1 3.98Å
234	A	95.8	Very high	90.8	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	148.2	172.9	0	0	0	0	0	110.3	T173 A176 A193 F194 G195 V196 D232 L256 F258	T173-A234 HydrophobicContact CG2-CB 4.36Å; A176-A234 HydrophobicContact CB-CB 3.65Å; A193-A234 HydrophobicContact CB-CB 3.92Å; F194-A234 PolarHBondContact O-N 3.13Å; G195-A234 CarbonylContact C-O 3.57Å; G195-A234 WeakPolarHBondContact CA-O 3.31Å; V196-A234 PolarHBondContact N-O 2.96Å; D232-A234 PolarHBondContact O-N 3.15Å; A234-L256 CarbonylContact C-O 3.44Å; A234-L256 WeakPolarHBondContact CA-O 3.35Å; A234-L256 HydrophobicContact CB-CB 3.7Å; A234-F258 HydrophobicContact CB-CD1 3.67Å; A234-F258 HydrophobicContact CB-CE1 3.99Å
235	F	96.2	Very high	91.4	Very high	3 Å²	3	57 Å²	57	1%	0.013	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	132	-179.6	-64.7	-94.4	0	0	0	110.7	V196 V233 P238 F245 A246 Y249 L256 L257 F258	V196-F235 HydrophobicContact CB-CD1 3.76Å; V196-F235 HydrophobicContact CB-CE1 4.01Å; V196-F235 HydrophobicContact CB-CG 4.45Å; V196-F235 HydrophobicContact CG1-CD1 3.92Å; V196-F235 HydrophobicContact CG1-CE1 4.08Å; V196-F235 HydrophobicContact CG2-CD1 4.27Å; V196-F235 HydrophobicContact CG2-CE1 4.05Å; V233-F235 HydrophobicContact CB-CE2 4.43Å; V233-F235 HydrophobicContact CG1-CD2 4.32Å; V233-F235 HydrophobicContact CG1-CE1 4.39Å; V233-F235 HydrophobicContact CG1-CE2 3.59Å; V233-F235 HydrophobicContact CG1-CZ 3.64Å; F235-P238 HydrophobicContact CB-CB 4.48Å; F235-P238 HydrophobicContact CB-CG 4.39Å; F235-F245 HydrophobicContact CE1-CD1 4.1Å; F235-F245 AromaticContact CE1-CE1 3.95Å; F235-F245 HydrophobicContact CE1-CE1 3.95Å; F235-F245 HydrophobicContact CZ-CD1 4.41Å; F235-F245 HydrophobicContact CZ-CE1 4.15Å; F235-A246 HydrophobicContact CD1-CB 4.22Å; F235-A246 HydrophobicContact CD2-CB 3.51Å; F235-A246 HydrophobicContact CE1-CB 4.14Å; F235-A246 HydrophobicContact CE2-CB 3.41Å; F235-A246 VanDerWaalsContact CE2-CB 3.41Å; F235-A246 HydrophobicContact CG-CB 3.93Å; F235-A246 HydrophobicContact CZ-CB 3.74Å; F235-Y249 HydrophobicContact CZ-CD1 4.37Å; F235-L256 PolarHBondContact N-O 2.86Å; F235-L257 HydrophobicContact CB-CD2 4.08Å; F235-L257 WeakPolarHBondContact O-CA 3.36Å; F235-L257 WeakPolarHBondContact O-CD2 3.31Å; F235-F258 PolarHBondContact O-N 2.88Å
236	A	95	Very high	91.9	Very high	11 Å²	11	52.4 Å²	52.4	9%	0.091	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	124.9	174.1	0	0	0	0	0	110	V196 L197 P238 F258	V196-A236 PolarHBondContact O-N 3.34Å; L197-A236 HydrophobicContact CD2-CB 4.14Å; A236-P238 VanDerWaalsContact C-CD 3.5Å; A236-P238 VanDerWaalsContact C-N 3.34Å; A236-F258 WeakPolarHBondContact CA-O 3.12Å; A236-F258 HydrophobicContact CB-CD1 4.38Å; A236-F258 HydrophobicContact CB-CD2 4.44Å; A236-F258 HydrophobicContact CB-CE1 3.89Å; A236-F258 HydrophobicContact CB-CE2 3.97Å; A236-F258 HydrophobicContact CB-CZ 3.68Å
237	D	92.7	Very high	92.5	Very high	102 Å²	102	53.1 Å²	53.1	55%	0.545	30%	0.295	S	S	.	.	S	Bend	trans	39.2	53	168.2	-54.7	-55.8	0	0	0	114.6	F258 M260	D237-F258 PolarHBondContact N-O 3.1Å; D237-M260 PolarHBondContact OD2-N 3.31Å
238	P	94.5	Very high	93	Very high	38 Å²	38	51 Å²	51	25%	0.247	30%	0.295	C	S	.	.			trans	-68.5	142.4	-171.7	28.8	-35.5	0	0	0	111.8	F235 A236 L243 L257	F235-P238 HydrophobicContact CB-CB 4.48Å; F235-P238 HydrophobicContact CB-CG 4.39Å; A236-P238 VanDerWaalsContact C-CD 3.5Å; A236-P238 VanDerWaalsContact C-N 3.34Å; P238-L243 HydrophobicContact CG-CD1 3.98Å; P238-L257 HydrophobicContact CG-CD2 3.71Å
239	T	94.4	Very high	93.4	Very high	59 Å²	59	50.6 Å²	50.6	36%	0.362	29%	0.291	S	S	.	.			trans	-64.2	167.1	165.5	62	0	0	0	0	110.7	V136 M241 G242 L243	V136-T239 HydrophobicContact CG1-CG2 3.87Å; V136-T239 WeakPolarHBondContact O-CG2 3.46Å; T239-M241 PolarHBondContact O-N 3.49Å; T239-G242 CarbonylContact O-C 3.6Å; T239-G242 WeakPolarHBondContact O-CA 2.88Å; T239-G242 PolarHBondContact O-N 3.08Å; T239-G242 PolarHBondContact OG1-N 3Å; T239-G242 VanDerWaalsContact OG1-N 3.13Å; T239-L243 WeakPolarHBondContact O-CB 3.3Å; T239-L243 PolarHBondContact O-N 2.78Å
240	E	93.2	Very high	93.7	Very high	172 Å²	172	49 Å²	49	80%	0.804	28%	0.281	S	S	*	.	H	α-helix	trans	-52.9	-42.1	174.6	-172.6	-172.3	168.8	0	0	112.3	L243 A244	E240-L243 WeakPolarHBondContact O-CB 3.4Å; E240-L243 PolarHBondContact O-N 3.4Å; E240-A244 PolarHBondContact O-N 2.88Å
241	M	93.2	Very high	93.9	Very high	106 Å²	106	49 Å²	49	52%	0.522	30%	0.298	S	S	.	.	H	α-helix	trans	-66.3	-40.1	174.3	-70.2	-164.7	69.5	0	0	112.6	T239 L243 A244 F245	T239-M241 PolarHBondContact O-N 3.49Å; M241-L243 VanDerWaalsContact C-N 3.33Å; M241-A244 PolarHBondContact O-N 3.49Å; M241-F245 PolarHBondContact O-N 2.83Å
242	G	95.3	Very high	94.2	Very high	10 Å²	10	48.4 Å²	48.4	10%	0.103	29%	0.287	C	S	.	.	H	α-helix	trans	-63.2	-39.3	175.3	0	0	0	0	0	112.1	T239 F245 A246	T239-G242 CarbonylContact O-C 3.6Å; T239-G242 WeakPolarHBondContact O-CA 2.88Å; T239-G242 PolarHBondContact O-N 3.08Å; T239-G242 PolarHBondContact OG1-N 3Å; T239-G242 VanDerWaalsContact OG1-N 3.13Å; G242-F245 WeakPolarHBondContact O-CB 3.48Å; G242-F245 PolarHBondContact O-N 3.34Å; G242-A246 WeakPolarHBondContact O-CB 3.49Å; G242-A246 PolarHBondContact O-N 2.88Å
243	L	94.8	Very high	94.3	Very high	41 Å²	41	51.1 Å²	51.1	22%	0.215	30%	0.302	C	S	.	.	H	α-helix	trans	-64.1	-46.3	176.4	-167	78.4	0	0	0	111.1	P238 T239 E240 M241 F245 A246 R247 I255	P238-L243 HydrophobicContact CG-CD1 3.98Å; T239-L243 WeakPolarHBondContact O-CB 3.3Å; T239-L243 PolarHBondContact O-N 2.78Å; E240-L243 WeakPolarHBondContact O-CB 3.4Å; E240-L243 PolarHBondContact O-N 3.4Å; M241-L243 VanDerWaalsContact C-N 3.33Å; L243-F245 VanDerWaalsContact C-N 3.3Å; L243-F245 PolarHBondContact O-N 3.35Å; L243-A246 PolarHBondContact O-N 3.42Å; L243-R247 WeakPolarHBondContact O-CG 3.36Å; L243-R247 PolarHBondContact O-N 3.22Å; L243-I255 HydrophobicContact CD1-CD1 3.15Å; L243-I255 HydrophobicContact CD1-CG1 4.46Å; L243-I255 HydrophobicContact CG-CD1 4.13Å
244	A	95.1	Very high	94.1	Very high	55 Å²	55	54.9 Å²	54.9	46%	0.455	32%	0.322	S	S	.	.	H	α-helix	trans	-62.3	-38.3	175.2	0	0	0	0	0	112	E240 M241 S248	E240-A244 PolarHBondContact O-N 2.88Å; M241-A244 PolarHBondContact O-N 3.49Å; A244-S248 WeakPolarHBondContact O-CB 3.17Å; A244-S248 PolarHBondContact O-N 3.29Å; A244-S248 VanDerWaalsContact O-N 3.13Å
245	F	96.6	Very high	94	Very high	40 Å²	40	55 Å²	55	18%	0.175	32%	0.322	C	S	.	.	H	α-helix	trans	-63	-50	171.6	169.2	-94.6	0	0	0	111.4	I199 V215 F235 M241 G242 L243 R247 S248 Y249	I199-F245 HydrophobicContact CD1-CD1 3.98Å; I199-F245 HydrophobicContact CD1-CE1 3.42Å; I199-F245 VanDerWaalsContact CD1-CE1 3.42Å; I199-F245 HydrophobicContact CD1-CE2 4.36Å; I199-F245 HydrophobicContact CD1-CZ 3.63Å; V215-F245 HydrophobicContact CG2-CE1 4.04Å; V215-F245 HydrophobicContact CG2-CZ 4Å; F235-F245 HydrophobicContact CE1-CD1 4.1Å; F235-F245 AromaticContact CE1-CE1 3.95Å; F235-F245 HydrophobicContact CE1-CE1 3.95Å; F235-F245 HydrophobicContact CZ-CD1 4.41Å; F235-F245 HydrophobicContact CZ-CE1 4.15Å; M241-F245 PolarHBondContact O-N 2.83Å; G242-F245 WeakPolarHBondContact O-CB 3.48Å; G242-F245 PolarHBondContact O-N 3.34Å; L243-F245 VanDerWaalsContact C-N 3.3Å; L243-F245 PolarHBondContact O-N 3.35Å; F245-R247 VanDerWaalsContact C-N 3.34Å; F245-R247 PolarHBondContact O-N 2.98Å; F245-S248 PolarHBondContact O-N 2.76Å; F245-Y249 HydrophobicContact CE1-CD2 4.45Å; F245-Y249 HydrophobicContact CE1-CG 4.29Å; F245-Y249 HydrophobicContact CE2-CD2 4.46Å; F245-Y249 AromaticContact CZ-CD2 3.85Å; F245-Y249 HydrophobicContact CZ-CD2 3.85Å; F245-Y249 HydrophobicContact CZ-CG 4.08Å; F245-Y249 WeakPolarHBondContact O-CB 3.41Å; F245-Y249 PolarHBondContact O-N 3.41Å
246	A	95.8	Very high	93.9	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-55.9	-47.2	-179	0	0	0	0	0	111.7	F235 G242 L243 Y249 C250 I255	F235-A246 HydrophobicContact CD1-CB 4.22Å; F235-A246 HydrophobicContact CD2-CB 3.51Å; F235-A246 HydrophobicContact CE1-CB 4.14Å; F235-A246 HydrophobicContact CE2-CB 3.41Å; F235-A246 VanDerWaalsContact CE2-CB 3.41Å; F235-A246 HydrophobicContact CG-CB 3.93Å; F235-A246 HydrophobicContact CZ-CB 3.74Å; G242-A246 WeakPolarHBondContact O-CB 3.49Å; G242-A246 PolarHBondContact O-N 2.88Å; L243-A246 PolarHBondContact O-N 3.42Å; A246-Y249 PolarHBondContact O-N 3.18Å; A246-C250 WeakPolarHBondContact O-CB 3.3Å; A246-C250 PolarHBondContact O-N 3.05Å; A246-C250 PolarHBondContact O-SG 3.26Å; A246-C250 VanDerWaalsContact O-SG 3.38Å; A246-I255 HydrophobicContact CB-CD1 4.3Å; A246-I255 HydrophobicContact CB-CG2 4.39Å
247	R	94.1	Very high	93.9	Very high	65 Å²	65	56.8 Å²	56.8	25%	0.245	33%	0.33	C	S	.	.	H	α-helix	trans	-62.4	-46.2	177.1	-68.5	175.5	175.4	161.1	-2.4	112.5	L243 F245 Y249 G251 T252 I255	L243-R247 WeakPolarHBondContact O-CG 3.36Å; L243-R247 PolarHBondContact O-N 3.22Å; F245-R247 VanDerWaalsContact C-N 3.34Å; F245-R247 PolarHBondContact O-N 2.98Å; R247-Y249 VanDerWaalsContact C-N 3.26Å; R247-Y249 PolarHBondContact O-N 3.19Å; R247-G251 PolarHBondContact O-N 3.25Å; R247-T252 VanDerWaalsContact CA-O 3.3Å; R247-T252 WeakPolarHBondContact CA-O 3.45Å; R247-T252 PolarHBondContact O-N 2.86Å; R247-I255 HydrophobicContact CG-CG2 3.74Å
248	S	94.8	Very high	93.9	Very high	95 Å²	95	52.7 Å²	52.7	66%	0.664	31%	0.308	S	S	*	.	H	α-helix	trans	-64.2	-33.3	177	-179.2	0	0	0	0	112.6	A244 F245	A244-S248 WeakPolarHBondContact O-CB 3.17Å; A244-S248 PolarHBondContact O-N 3.29Å; A244-S248 VanDerWaalsContact O-N 3.13Å; F245-S248 PolarHBondContact O-N 2.76Å
249	Y	95.7	Very high	93.7	Very high	22 Å²	22	61.1 Å²	61.1	9%	0.086	34%	0.335	C	S	.	.	H	α-helix	trans	-76.6	-47.1	-178.8	174.3	-88.4	0	0	0	111.2	T212 V215 N216 R219 V233 F235 F245 A246 R247 G251	T212-Y249 HydrophobicContact CG2-CD2 3.99Å; T212-Y249 HydrophobicContact CG2-CE2 4.02Å; V215-Y249 HydrophobicContact CB-CE2 3.84Å; V215-Y249 HydrophobicContact CG1-CE1 3.95Å; V215-Y249 HydrophobicContact CG1-CE2 3.98Å; V215-Y249 VanDerWaalsContact CG1-CZ 3.48Å; V215-Y249 WeakPolarHBondContact CG1-OH 3.35Å; N216-Y249 WeakPolarHBondContact OD1-CE2 3.33Å; N216-Y249 PolarHBondContact OD1-OH 3.32Å; R219-Y249 WeakPolarHBondContact CD-OH 3.44Å; R219-Y249 PolarHBondContact NH1-OH 3.31Å; V233-Y249 HydrophobicContact CB-CE1 4.33Å; V233-Y249 HydrophobicContact CG1-CE1 4.32Å; V233-Y249 HydrophobicContact CG2-CE1 3.98Å; F235-Y249 HydrophobicContact CZ-CD1 4.37Å; F245-Y249 HydrophobicContact CE1-CD2 4.45Å; F245-Y249 HydrophobicContact CE1-CG 4.29Å; F245-Y249 HydrophobicContact CE2-CD2 4.46Å; F245-Y249 AromaticContact CZ-CD2 3.85Å; F245-Y249 HydrophobicContact CZ-CD2 3.85Å; F245-Y249 HydrophobicContact CZ-CG 4.08Å; F245-Y249 WeakPolarHBondContact O-CB 3.41Å; F245-Y249 PolarHBondContact O-N 3.41Å; A246-Y249 PolarHBondContact O-N 3.18Å; R247-Y249 VanDerWaalsContact C-N 3.26Å; R247-Y249 PolarHBondContact O-N 3.19Å; Y249-G251 VanDerWaalsContact C-N 3.28Å; Y249-G251 PolarHBondContact O-N 3.22Å
250	C	93.2	Very high	93.2	Very high	30 Å²	30	62.8 Å²	62.8	20%	0.203	34%	0.339	C	S	.	.	H	α-helix	trans	-76.5	-13.6	179.2	-61.8	0	0	0	0	113.3	A246 T252	A246-C250 WeakPolarHBondContact O-CB 3.3Å; A246-C250 PolarHBondContact O-N 3.05Å; A246-C250 PolarHBondContact O-SG 3.26Å; A246-C250 VanDerWaalsContact O-SG 3.38Å; C250-T252 HydrophobicContact CB-CG2 3.9Å; C250-T252 PolarHBondContact O-N 3.19Å
251	G	92.3	Very high	93.2	Very high	72 Å²	72	57.3 Å²	57.3	74%	0.742	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	17.6	-178.1	0	0	0	0	0	114	R247 Y249	R247-G251 PolarHBondContact O-N 3.25Å; Y249-G251 VanDerWaalsContact C-N 3.28Å; Y249-G251 PolarHBondContact O-N 3.22Å
252	T	91.7	Very high	93.2	Very high	58 Å²	58	54.7 Å²	54.7	36%	0.356	31%	0.305	S	S	.	.	S	Bend	trans	-143.6	153.9	-178.9	178.7	0	0	0	0	110.4	R247 C250 D254	R247-T252 VanDerWaalsContact CA-O 3.3Å; R247-T252 WeakPolarHBondContact CA-O 3.45Å; R247-T252 PolarHBondContact O-N 2.86Å; C250-T252 HydrophobicContact CB-CG2 3.9Å; C250-T252 PolarHBondContact O-N 3.19Å; T252-D254 VanDerWaalsContact C-N 3.34Å; T252-D254 WeakPolarHBondContact CG2-O 3.27Å; T252-D254 PolarHBondContact OG1-N 2.93Å; T252-D254 VanDerWaalsContact OG1-N 3.14Å
253	N	90.9	Very high	93	Very high	93 Å²	93	57.2 Å²	57.2	50%	0.497	32%	0.316	S	S	.	.	S	Bend	trans	-81.3	-17.9	171.7	-69.4	-57.8	0	0	0	113	A181 I255	A181-N253 HydrophobicContact CB-CB 3.77Å; N253-I255 PolarHBondContact O-N 3.22Å
254	D	91.2	Very high	92.9	Very high	80 Å²	80	58.2 Å²	58.2	43%	0.428	32%	0.322	S	S	.	.			trans	-89.3	102.3	178.6	-57.6	-21.7	0	0	0	108.8	L178 V179 G180 T252	L178-D254 HydrophobicContact CD1-CB 3.83Å; L178-D254 HydrophobicContact CD2-CB 4.26Å; L178-D254 HydrophobicContact CG-CB 4.09Å; V179-D254 WeakPolarHBondContact O-CA 3.43Å; G180-D254 WeakPolarHBondContact CA-OD1 3.32Å; T252-D254 VanDerWaalsContact C-N 3.34Å; T252-D254 WeakPolarHBondContact CG2-O 3.27Å; T252-D254 PolarHBondContact OG1-N 2.93Å; T252-D254 VanDerWaalsContact OG1-N 3.14Å
255	I	92.7	Very high	92.8	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	149	-171.9	57.8	167.3	0	0	0	110.9	V179 L243 A246 R247 N253 L257	V179-I255 PolarHBondContact N-O 2.94Å; V179-I255 PolarHBondContact O-N 2.82Å; L243-I255 HydrophobicContact CD1-CD1 3.15Å; L243-I255 HydrophobicContact CD1-CG1 4.46Å; L243-I255 HydrophobicContact CG-CD1 4.13Å; A246-I255 HydrophobicContact CB-CD1 4.3Å; A246-I255 HydrophobicContact CB-CG2 4.39Å; R247-I255 HydrophobicContact CG-CG2 3.74Å; N253-I255 PolarHBondContact O-N 3.22Å; I255-L257 HydrophobicContact CD1-CD1 4.28Å; I255-L257 HydrophobicContact CD1-CD2 3.65Å; I255-L257 HydrophobicContact CD1-CG 4.06Å; I255-L257 HydrophobicContact CG1-CD2 4.16Å; I255-L257 HydrophobicContact CG1-CG 4.15Å
256	L	94.5	Very high	92.6	Very high	17 Å²	17	59.6 Å²	59.6	9%	0.089	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	121.7	174.7	-68.7	173.2	0	0	0	109.8	A176 A177 L178 K190 A231 A234 F235	A176-L256 HydrophobicContact CB-CB 4.08Å; A176-L256 HydrophobicContact CB-CD2 4.33Å; A177-L256 WeakPolarHBondContact O-CA 3.29Å; L178-L256 HydrophobicContact CB-CD2 4.2Å; L178-L256 HydrophobicContact CD1-CD2 4.08Å; L178-L256 HydrophobicContact CD1-CG 4.46Å; K190-L256 HydrophobicContact CB-CD1 4.34Å; K190-L256 HydrophobicContact CB-CD2 4.18Å; K190-L256 HydrophobicContact CD-CD1 3.67Å; A231-L256 WeakPolarHBondContact O-CD1 3.27Å; A234-L256 CarbonylContact C-O 3.44Å; A234-L256 WeakPolarHBondContact CA-O 3.35Å; A234-L256 HydrophobicContact CB-CB 3.7Å; F235-L256 PolarHBondContact N-O 2.86Å
257	L	94.4	Very high	92.3	Very high	36 Å²	36	63.9 Å²	63.9	19%	0.188	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	146.8	176.6	-61.4	-174	0	0	0	110.8	A176 A177 V179 F235 P238 I255	A176-L257 CarbonylContact C-O 3.52Å; A176-L257 WeakPolarHBondContact CA-O 3.25Å; A177-L257 PolarHBondContact N-O 2.94Å; A177-L257 PolarHBondContact O-N 3.39Å; V179-L257 HydrophobicContact CB-CD1 3.88Å; V179-L257 HydrophobicContact CB-CG 4.22Å; V179-L257 HydrophobicContact CG1-CD1 4.19Å; V179-L257 HydrophobicContact CG2-CB 4.07Å; V179-L257 HydrophobicContact CG2-CD1 3.86Å; V179-L257 HydrophobicContact CG2-CG 4.1Å; F235-L257 HydrophobicContact CB-CD2 4.08Å; F235-L257 WeakPolarHBondContact O-CA 3.36Å; F235-L257 WeakPolarHBondContact O-CD2 3.31Å; P238-L257 HydrophobicContact CG-CD2 3.71Å; I255-L257 HydrophobicContact CD1-CD1 4.28Å; I255-L257 HydrophobicContact CD1-CD2 3.65Å; I255-L257 HydrophobicContact CD1-CG 4.06Å; I255-L257 HydrophobicContact CG1-CD2 4.16Å; I255-L257 HydrophobicContact CG1-CG 4.15Å
258	F	93.3	Very high	92.2	Very high	15 Å²	15	63.8 Å²	63.8	7%	0.066	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	167.8	171.8	71.3	-73.6	0	0	0	110	T173 K175 A176 G195 L197 A234 F235 A236 D237	T173-F258 HydrophobicContact CG2-CD1 4.17Å; T173-F258 HydrophobicContact CG2-CD2 4.27Å; T173-F258 HydrophobicContact CG2-CE1 4.25Å; T173-F258 HydrophobicContact CG2-CE2 4.33Å; T173-F258 HydrophobicContact CG2-CG 4.18Å; T173-F258 HydrophobicContact CG2-CZ 4.31Å; K175-F258 VanDerWaalsContact O-CB 3.26Å; K175-F258 WeakPolarHBondContact O-CB 3.35Å; A176-F258 HydrophobicContact CB-CB 4.41Å; G195-F258 VanDerWaalsContact CA-CE1 3.46Å; G195-F258 VanDerWaalsContact CA-CZ 3.47Å; L197-F258 HydrophobicContact CD2-CE2 3.72Å; L197-F258 HydrophobicContact CD2-CZ 3.64Å; A234-F258 HydrophobicContact CB-CD1 3.67Å; A234-F258 HydrophobicContact CB-CE1 3.99Å; F235-F258 PolarHBondContact O-N 2.88Å; A236-F258 WeakPolarHBondContact CA-O 3.12Å; A236-F258 HydrophobicContact CB-CD1 4.38Å; A236-F258 HydrophobicContact CB-CD2 4.44Å; A236-F258 HydrophobicContact CB-CE1 3.89Å; A236-F258 HydrophobicContact CB-CE2 3.97Å; A236-F258 HydrophobicContact CB-CZ 3.68Å; D237-F258 PolarHBondContact N-O 3.1Å
259	R	90.1	Very high	92	Very high	216 Å²	216	61.2 Å²	61.2	82%	0.815	33%	0.328	S	S	*	.			trans	-105.5	142	174.8	-69.2	-164.4	-82.3	157	-8.4	109.9
260	M	83.5	Confident	91.6	Very high	93 Å²	93	64.7 Å²	64.7	46%	0.458	35%	0.35	S	S	.	.			trans	-72.9	0	179.5	-166.8	175.5	-173.4	0	0	113.5	T142 L143 R150 L197 D237	T142-M260 HydrophobicContact CG2-CE 3.69Å; T142-M260 HydrophobicContact CG2-CG 4.32Å; T142-M260 HydrophobicContact CG2-SD 3.81Å; L143-M260 HydrophobicContact CB-CE 4.47Å; L143-M260 HydrophobicContact CD2-CE 3.47Å; L143-M260 VanDerWaalsContact CD2-CE 3.47Å; L143-M260 HydrophobicContact CD2-SD 4.2Å; L143-M260 HydrophobicContact CG-CE 3.95Å; R150-M260 VanDerWaalsContact NH2-CE 3.31Å; L197-M260 HydrophobicContact CD1-CE 4.21Å; L197-M260 HydrophobicContact CD2-CE 4.36Å; L197-M260 HydrophobicContact CD2-CG 4.16Å; L197-M260 HydrophobicContact CD2-SD 4.47Å; D237-M260 PolarHBondContact OD2-N 3.31Å

Retrieved 260 of 260 residues in 182.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).