A0A061IPE5_CRIGR Loading...

Fibroleukin

AlphaFold DB , UniProt , Accession A0A061IPE5, Species CRIGR (Cricetulus griseus, Chinese hamster), Gene Fgl2, Length 433 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	30.8	Very low	234 Å²	234	160.8 Å²	160.8	100%	1.153	80%	0.799	S	S	*	*				0	120.9	0	-120.7	168.4	173.1	0	0	108.2
2	R	29.2	Very low	30.6	Very low	235 Å²	235	157.8 Å²	157.8	89%	0.887	80%	0.795	S	S	*	*			trans	67.3	108.9	156.5	-64	-173.3	177.3	-174.4	-0.8	121.2
3	L	31.9	Very low	30.3	Very low	165 Å²	165	155.8 Å²	155.8	86%	0.864	80%	0.795	S	S	*	*			trans	-56	161.5	140.1	-71.8	158.5	0	0	0	111.7
4	P	41.9	Very low	30.2	Very low	124 Å²	124	150.8 Å²	150.8	81%	0.805	79%	0.789	S	S	*	*				-139.9	160.4	98.3	29.8	-11.3	0	0	0	112.1
5	G	31.3	Very low	29.9	Very low	58 Å²	58	149.1 Å²	149.1	60%	0.598	79%	0.787	S	S	*	*			cis	98.4	86.8	32.4	0	0	0	0	0	109.6
6	W	28.8	Very low	29.7	Very low	208 Å²	208	150.4 Å²	150.4	79%	0.788	79%	0.794	S	S	*	*				91.7	152.4	96.5	-82.5	31.5	0	0	0	116.4
7	Y	28.5	Very low	29.5	Very low	183 Å²	183	146.6 Å²	146.6	72%	0.718	79%	0.788	S	S	*	*			trans	96.5	103.6	164.9	-54.5	-75.4	0	0	0	118
8	W	28.4	Very low	29.3	Very low	200 Å²	200	143.6 Å²	143.6	76%	0.758	79%	0.787	S	S	*	*				85	125.2	64.2	-85	93.8	0	0	0	112.5
9	L	26.6	Very low	29.1	Very low	179 Å²	179	143.4 Å²	143.4	94%	0.937	80%	0.796	S	S	*	*			trans	-152.4	116.7	137.2	-100.8	167.9	0	0	0	109.6
10	S	29	Very low	28.9	Very low	78 Å²	78	140 Å²	140	55%	0.545	80%	0.795	S	S	.	*			trans	-90.1	159.9	164.9	163.5	0	0	0	0	109
11	S	31.4	Very low	29	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	80%	0.802	S	S	*	*				166.5	143.3	126.8	-64.1	0	0	0	0	107.6
12	V	28.1	Very low	28.7	Very low	125 Å²	125	131.5 Å²	131.5	76%	0.758	79%	0.786	S	S	*	*				-172.1	119.7	57.8	159.7	0	0	0	0	108.2
13	V	27.7	Very low	28.5	Very low	131 Å²	131	124.9 Å²	124.9	79%	0.794	78%	0.782	S	S	*	*				79.5	108.3	109.1	178.5	0	0	0	0	116
14	A	28.5	Very low	28.2	Very low	86 Å²	86	125.4 Å²	125.4	71%	0.711	78%	0.78	S	S	*	*				98.7	142.1	85.1	0	0	0	0	0	112.4
15	V	26.3	Very low	27.5	Very low	125 Å²	125	127.7 Å²	127.7	76%	0.758	78%	0.78	S	S	*	*				-172.8	122.8	73.6	168.9	0	0	0	0	107.4
16	L	25.5	Very low	27.3	Very low	171 Å²	171	129 Å²	129	90%	0.895	79%	0.785	S	S	*	*				44.1	145	104.5	-69.7	164.5	0	0	0	116.2
17	A	26.1	Very low	27.2	Very low	85 Å²	85	128.2 Å²	128.2	70%	0.702	79%	0.79	S	S	*	*			cis	-164.9	141.2	14.4	0	0	0	0	0	107.6
18	A	27.3	Very low	27.1	Very low	92 Å²	92	126.7 Å²	126.7	76%	0.76	79%	0.794	S	S	*	*				79.2	142.8	87	0	0	0	0	0	118.6
19	C	24.4	Very low	27	Very low	141 Å²	141	125 Å²	125	95%	0.953	80%	0.799	S	S	*	*			trans	79.8	140.5	165.6	-67	0	0	0	0	118.3
20	G	25.8	Very low	27.1	Very low	75 Å²	75	122.7 Å²	122.7	77%	0.773	79%	0.792	S	S	*	*			cis	-176.6	166.9	7.4	0	0	0	0	0	111.3
21	A	31	Very low	27.1	Very low	115 Å²	115	127.8 Å²	127.8	95%	0.95	81%	0.808	S	S	*	*			trans	-74.5	155.2	179.1	0	0	0	0	0	113.2
22	G	24.6	Very low	27.4	Very low	80 Å²	80	131.7 Å²	131.7	83%	0.825	82%	0.815	S	S	*	*			trans	-164.2	119.5	164.7	0	0	0	0	0	110.5
23	A	26.4	Very low	27.3	Very low	96 Å²	96	133.8 Å²	133.8	79%	0.793	82%	0.82	S	S	*	*			trans	-96.8	140.3	172.3	0	0	0	0	0	109.5
24	E	25.6	Very low	27.6	Very low	177 Å²	177	139 Å²	139	83%	0.827	83%	0.826	S	S	*	*				176.7	134.8	128.8	-102.6	178.2	155.3	0	0	113.4
25	Q	25.5	Very low	27.6	Very low	171 Å²	171	141.4 Å²	141.4	80%	0.799	83%	0.827	S	S	*	*			trans	45.9	113.9	148.2	-87.5	165.1	7.8	0	0	124.4
26	A	27.2	Very low	28	Very low	86 Å²	86	140.5 Å²	140.5	71%	0.711	83%	0.832	S	S	*	*				46.9	114.6	125.5	0	0	0	0	0	120.4
27	H	27	Very low	28.5	Very low	192 Å²	192	136.7 Å²	136.7	89%	0.889	82%	0.82	S	S	*	*				-170.5	142.9	114.2	-111.3	-83.7	0	0	0	111.3
28	N	26.1	Very low	28.8	Very low	150 Å²	150	136.4 Å²	136.4	80%	0.802	82%	0.818	S	S	*	*			trans	-48.8	137.6	168.7	-81.7	-28.2	0	0	0	112.2
29	L	26.2	Very low	29.3	Very low	165 Å²	165	142 Å²	142	86%	0.864	83%	0.828	S	S	*	*				-177.4	130.3	124.2	-97.2	146.5	0	0	0	110.4
30	T	30.3	Very low	30.2	Very low	130 Å²	130	140.4 Å²	140.4	80%	0.798	83%	0.825	S	S	*	*			trans	-45.6	125.3	164.5	38.3	0	0	0	0	112.8
31	E	29	Very low	30.8	Very low	185 Å²	185	140.9 Å²	140.9	86%	0.864	82%	0.822	S	S	*	*			trans	-168.6	153.4	135.5	-114.2	-175.6	178.7	0	0	112.5
32	E	36.6	Very low	31.2	Very low	188 Å²	188	140.6 Å²	140.6	88%	0.879	81%	0.812	S	S	*	*			trans	-57.9	123.5	-169.7	-60.3	175.8	124.3	0	0	113.6
33	L	25.8	Very low	32.6	Very low	168 Å²	168	142.1 Å²	142.1	88%	0.88	81%	0.807	S	S	*	*			trans	-112.3	103	159.7	-87.6	154.8	0	0	0	108.6	D35	L33-D35 VanDerWaalsContact C-N 3.35Å; L33-D35 PolarHBondContact O-N 3.22Å
34	R	34.4	Very low	33.7	Very low	242 Å²	242	139.8 Å²	139.8	91%	0.913	79%	0.787	S	S	*	*			trans	-59.1	97.9	159.9	-76.6	177.5	171.5	-179.1	-2	107.9	A36	R34-A36 PolarHBondContact O-N 3Å
35	D	28	Very low	35	Very low	135 Å²	135	139.9 Å²	139.9	72%	0.722	78%	0.78	S	S	*	*			trans	-82.8	95.4	170.4	-161.9	5.8	0	0	0	109.6	L33 S37	L33-D35 VanDerWaalsContact C-N 3.35Å; L33-D35 PolarHBondContact O-N 3.22Å; D35-S37 PolarHBondContact O-N 3.07Å; D35-S37 VanDerWaalsContact O-N 3.07Å; D35-S37 VanDerWaalsContact OD1-CB 3.31Å; D35-S37 WeakPolarHBondContact OD1-CB 3.31Å
36	A	34.8	Very low	35.9	Very low	106 Å²	106	136.8 Å²	136.8	88%	0.876	77%	0.769	S	S	*	*			trans	-76.2	71.8	165	0	0	0	0	0	108.9	R34	R34-A36 PolarHBondContact O-N 3Å
37	S	37	Very low	37.2	Very low	91 Å²	91	137.2 Å²	137.2	64%	0.636	76%	0.756	S	S	*	*			trans	-159.1	56	176.8	178.3	0	0	0	0	111.8	D35	D35-S37 PolarHBondContact O-N 3.07Å; D35-S37 VanDerWaalsContact O-N 3.07Å; D35-S37 VanDerWaalsContact OD1-CB 3.31Å; D35-S37 WeakPolarHBondContact OD1-CB 3.31Å
38	A	32.9	Very low	38.5	Very low	80 Å²	80	130.9 Å²	130.9	66%	0.661	74%	0.743	S	S	*	*			trans	-154.2	47.9	168	0	0	0	0	0	112.3	A40	A38-A40 PolarHBondContact O-N 3.07Å
39	Q	37.4	Very low	39.6	Very low	210 Å²	210	133.1 Å²	133.1	98%	0.981	74%	0.74	S	S	*	*			trans	-84.3	70.3	168.8	-91.2	171.2	-8.1	0	0	111
40	A	43.7	Very low	41.2	Very low	107 Å²	107	128.5 Å²	128.5	88%	0.884	73%	0.732	S	S	*	*			trans	-154.5	52.1	154.1	0	0	0	0	0	108.3	A38	A38-A40 PolarHBondContact O-N 3.07Å
41	A	37.3	Very low	42.4	Very low	85 Å²	85	132.4 Å²	132.4	70%	0.702	74%	0.738	S	S	*	*			trans	-111.1	126.8	-176	0	0	0	0	0	111.1
42	C	39.3	Very low	43.6	Very low	109 Å²	109	127 Å²	127	74%	0.736	72%	0.72	S	S	*	*			trans	17.8	127.1	162.3	-86.1	0	0	0	0	119.9	A44	C42-A44 PolarHBondContact O-N 3.24Å
43	P	53.4	Low	44.2	Very low	111 Å²	111	126.9 Å²	126.9	72%	0.721	72%	0.72	S	S	*	*	S	Bend	trans	-72.3	-9.9	174	2.8	8.9	0	0	0	114.6	P64	P43-P64 HydrophobicContact CB-CG 3.61Å; P43-P64 VanDerWaalsContact O-CD 3.31Å; P43-P64 WeakPolarHBondContact O-CD 3.46Å; P43-P64 VanDerWaalsContact O-CG 3.28Å; P43-P64 WeakPolarHBondContact O-CG 3.32Å
44	A	51	Low	46	Very low	47 Å²	47	122.2 Å²	122.2	39%	0.388	71%	0.712	S	S	.	*			trans	-101.4	124.4	179.2	0	0	0	0	0	110.1	C42 L61 L63	C42-A44 PolarHBondContact O-N 3.24Å; A44-L61 HydrophobicContact CB-CD1 4.28Å; A44-L63 HydrophobicContact CB-CD2 3.83Å
45	R	52.2	Low	46.9	Very low	179 Å²	179	116.8 Å²	116.8	68%	0.675	71%	0.711	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-106.6	118	-179.9	-150.4	177.2	-164.7	173.9	2.4	109.3	E47 T62	R45-E47 WeakPolarHBondContact CD-OE1 3.5Å; R45-E47 HydrophobicContact CG-CG 4.41Å; R45-E47 IonicContact CZ-OE1 3.01Å; R45-E47 IonicContact NE-OE1 3.47Å; R45-T62 PolarHBondContact N-O 2.9Å; R45-T62 PolarHBondContact O-N 3.5Å
46	L	44.8	Very low	47.8	Very low	106 Å²	106	118.4 Å²	118.4	56%	0.555	71%	0.714	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-104.9	114.8	174.8	-169.2	79.4	0	0	0	108.1	F59 Q60 L61	L46-F59 HydrophobicContact CD1-CB 3.9Å; L46-F59 HydrophobicContact CD2-CB 4.41Å; L46-F59 HydrophobicContact CD2-CD1 4.12Å; L46-F59 HydrophobicContact CD2-CG 4.37Å; L46-F59 HydrophobicContact CG-CB 4.13Å; L46-F59 HydrophobicContact CG-CD1 4.29Å; L46-Q60 CarbonylContact C-O 3.54Å; L46-Q60 WeakPolarHBondContact CA-O 3.43Å; L46-L61 HydrophobicContact CB-CD1 4.21Å; L46-L61 HydrophobicContact CD1-CB 3.73Å; L46-L61 HydrophobicContact CD1-CD1 3.79Å; L46-L61 HydrophobicContact CD1-CG 4.33Å
47	E	54.3	Low	48.8	Very low	95 Å²	95	116 Å²	116	44%	0.444	69%	0.691	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.5	135.1	179.6	-68.6	-178.2	177.8	0	0	110.2	R45 Q60	R45-E47 WeakPolarHBondContact CD-OE1 3.5Å; R45-E47 HydrophobicContact CG-CG 4.41Å; R45-E47 IonicContact CZ-OE1 3.01Å; R45-E47 IonicContact NE-OE1 3.47Å; E47-Q60 PolarHBondContact N-O 2.82Å; E47-Q60 PolarHBondContact O-N 2.97Å
48	G	53.5	Low	49.3	Very low	60 Å²	60	113.9 Å²	113.9	62%	0.619	68%	0.683	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-77.1	131.8	175.1	0	0	0	0	0	110.8
49	R	48.8	Very low	50.2	Low	197 Å²	197	116.6 Å²	116.6	74%	0.743	68%	0.68	S	S	*	*			trans	-98.3	105.7	-179.5	-146.1	-175.9	-167.6	-136.8	2.5	110.2	G58	R49-G58 PolarHBondContact N-O 3.31Å
50	G	59.9	Low	50.5	Low	68 Å²	68	111.2 Å²	111.2	70%	0.701	66%	0.655	S	S	*	*	S	Bend	trans	73.8	170	168.1	0	0	0	0	0	116	C52	G50-C52 PolarHBondContact O-N 2.85Å
51	K	55.7	Low	50.6	Low	212 Å²	212	111 Å²	111	92%	0.922	64%	0.639	S	S	*	*			trans	-62.1	124.3	177.4	-75.1	-177.8	177.1	-179.6	0	109.5	E53	K51-E53 PolarHBondContact O-N 3.27Å
52	C	55.3	Low	51	Low	71 Å²	71	110.4 Å²	110.4	48%	0.48	63%	0.626	S	S	.	*			trans	-67.2	127.2	178.6	-57.5	0	0	0	0	110.8	G50 C57	G50-C52 PolarHBondContact O-N 2.85Å; C52-C57 HydrophobicContact CB-CB 4.31Å; C52-C57 WeakPolarHBondContact CB-SG 3.27Å; C52-C57 WeakPolarHBondContact SG-CB 3.27Å; C52-C57 CovalentContact SG-SG 2.05Å; C52-C57 PolarHBondContact SG-SG 2.86Å
53	E	48.4	Very low	51.1	Low	186 Å²	186	110.9 Å²	110.9	87%	0.869	62%	0.621	S	S	*	*	B	Isolated β-bridge	trans	-92	99.3	164.6	-78.8	-175.6	158.8	0	0	108.4	K51	K51-E53 PolarHBondContact O-N 3.27Å
54	G	63.2	Low	50.8	Low	70 Å²	70	109.3 Å²	109.3	72%	0.722	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	71.9	-139.5	176.3	0	0	0	0	0	114.5	Q56	G54-Q56 PolarHBondContact O-N 3.4Å
55	S	53.3	Low	50.4	Low	128 Å²	128	113.6 Å²	113.6	90%	0.895	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.9	8.8	-169.4	53.3	0	0	0	0	115.5
56	Q	47.7	Very low	49.5	Very low	169 Å²	169	112.8 Å²	112.8	79%	0.79	64%	0.64	S	S	*	*	B	Isolated β-bridge	trans	-123.5	112.4	174.7	-79.7	-177.2	-2.9	0	0	111.1	G54	G54-Q56 PolarHBondContact O-N 3.4Å
57	C	55	Low	49.2	Very low	56 Å²	56	114 Å²	114	38%	0.378	65%	0.652	S	S	.	*			trans	-104.6	133	170.3	-61.2	0	0	0	0	109.5	C52 F59	C52-C57 HydrophobicContact CB-CB 4.31Å; C52-C57 WeakPolarHBondContact CB-SG 3.27Å; C52-C57 WeakPolarHBondContact SG-CB 3.27Å; C52-C57 CovalentContact SG-SG 2.05Å; C52-C57 PolarHBondContact SG-SG 2.86Å; C57-F59 HydrophobicContact CB-CE2 3.88Å; C57-F59 HydrophobicContact CB-CZ 3.93Å; C57-F59 WeakPolarHBondContact O-CD2 3.19Å; C57-F59 WeakPolarHBondContact O-CE2 3.27Å
58	G	47.4	Very low	48.2	Very low	46 Å²	46	116.4 Å²	116.4	47%	0.474	67%	0.667	S	S	.	*			trans	-82.6	131.5	172.3	0	0	0	0	0	111.2	R49	R49-G58 PolarHBondContact N-O 3.31Å
59	F	53.7	Low	47.3	Very low	136 Å²	136	122.9 Å²	122.9	60%	0.596	68%	0.681	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-116.3	143.4	176.4	-61.1	-86.1	0	0	0	111.1	L46 C57	L46-F59 HydrophobicContact CD1-CB 3.9Å; L46-F59 HydrophobicContact CD2-CB 4.41Å; L46-F59 HydrophobicContact CD2-CD1 4.12Å; L46-F59 HydrophobicContact CD2-CG 4.37Å; L46-F59 HydrophobicContact CG-CB 4.13Å; L46-F59 HydrophobicContact CG-CD1 4.29Å; C57-F59 HydrophobicContact CB-CE2 3.88Å; C57-F59 HydrophobicContact CB-CZ 3.93Å; C57-F59 WeakPolarHBondContact O-CD2 3.19Å; C57-F59 WeakPolarHBondContact O-CE2 3.27Å
60	Q	43.7	Very low	46.9	Very low	97 Å²	97	119.4 Å²	119.4	45%	0.453	68%	0.677	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-110.6	116.4	173.7	-176.9	168.7	-13	0	0	109	L46 E47	L46-Q60 CarbonylContact C-O 3.54Å; L46-Q60 WeakPolarHBondContact CA-O 3.43Å; E47-Q60 PolarHBondContact N-O 2.82Å; E47-Q60 PolarHBondContact O-N 2.97Å
61	L	45.6	Very low	46.2	Very low	104 Å²	104	120.3 Å²	120.3	55%	0.545	67%	0.67	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-97.6	121.7	175.8	-177	67.7	0	0	0	109.3	A44 L46 L63	A44-L61 HydrophobicContact CB-CD1 4.28Å; L46-L61 HydrophobicContact CB-CD1 4.21Å; L46-L61 HydrophobicContact CD1-CB 3.73Å; L46-L61 HydrophobicContact CD1-CD1 3.79Å; L46-L61 HydrophobicContact CD1-CG 4.33Å; L61-L63 HydrophobicContact CD2-CD2 4.34Å; L61-L63 HydrophobicContact CG-CD2 4.35Å; L61-L63 HydrophobicContact CG-CG 4.49Å
62	T	44.9	Very low	45.9	Very low	71 Å²	71	118.8 Å²	118.8	44%	0.436	67%	0.666	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-111.2	122.9	174.9	-46.4	0	0	0	0	109	R45	R45-T62 PolarHBondContact N-O 2.9Å; R45-T62 PolarHBondContact O-N 3.5Å
63	L	40.5	Very low	45.5	Very low	120 Å²	120	122 Å²	122	63%	0.628	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-103.8	149.6	178.4	-63.7	174.5	0	0	0	110.4	A44 L61	A44-L63 HydrophobicContact CB-CD2 3.83Å; L61-L63 HydrophobicContact CD2-CD2 4.34Å; L61-L63 HydrophobicContact CG-CD2 4.35Å; L61-L63 HydrophobicContact CG-CG 4.49Å
64	P	48.2	Very low	45.4	Very low	77 Å²	77	117.7 Å²	117.7	50%	0.5	66%	0.657	S	S	.	*	P	Polyproline II helix	trans	-68.1	152.6	174.8	-0.5	12.6	0	0	0	111.4	P43 L66	P43-P64 HydrophobicContact CB-CG 3.61Å; P43-P64 VanDerWaalsContact O-CD 3.31Å; P43-P64 WeakPolarHBondContact O-CD 3.46Å; P43-P64 VanDerWaalsContact O-CG 3.28Å; P43-P64 WeakPolarHBondContact O-CG 3.32Å; P64-L66 PolarHBondContact O-N 3.28Å
65	T	42.5	Very low	44.9	Very low	137 Å²	137	116.3 Å²	116.3	84%	0.84	64%	0.643	S	S	*	*	P	Polyproline II helix	trans	-63.2	118.8	169.6	31.8	0	0	0	0	110.8
66	L	33.8	Very low	45	Very low	162 Å²	162	114.5 Å²	114.5	85%	0.848	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-75.4	121.8	172.9	-88	156	0	0	0	110.1	P64	P64-L66 PolarHBondContact O-N 3.28Å
67	T	37.2	Very low	45.1	Very low	133 Å²	133	112.3 Å²	112.3	82%	0.816	62%	0.615	S	S	*	*			trans	-107.5	112.5	168.8	-41.5	0	0	0	0	108.2
68	L	34.3	Very low	44.9	Very low	144 Å²	144	115.3 Å²	115.3	75%	0.754	62%	0.623	S	S	*	*			trans	-91.7	115.5	177.4	-73.3	166	0	0	0	109.1	L70	L68-L70 PolarHBondContact O-N 2.89Å
69	Q	35	Very low	45.3	Very low	197 Å²	197	117.8 Å²	117.8	92%	0.921	62%	0.622	S	S	*	*			trans	-78.3	105	169.2	-116.7	172.1	-33	0	0	108.5
70	L	39.3	Very low	45.5	Very low	123 Å²	123	115.2 Å²	115.2	64%	0.644	62%	0.617	S	S	*	*			trans	-74.1	142.4	175.6	-71.2	161.7	0	0	0	110.1	L68 L74	L68-L70 PolarHBondContact O-N 2.89Å; L70-L74 HydrophobicContact CD1-CD2 4.21Å; L70-L74 HydrophobicContact CD2-CD2 4.22Å
71	P	45.1	Very low	45.9	Very low	87 Å²	87	115.6 Å²	115.6	57%	0.565	62%	0.622	S	S	*	*			trans	-59.3	141.4	176.1	-21.2	31.7	0	0	0	111.4	Q73 L74	P71-Q73 PolarHBondContact O-N 3.46Å; P71-L74 WeakPolarHBondContact O-CB 3.17Å; P71-L74 PolarHBondContact O-N 2.87Å
72	Q	50.7	Low	46.7	Very low	180 Å²	180	116.1 Å²	116.1	84%	0.841	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-52.9	-27.5	-179.7	-130.7	176.6	5.2	0	0	113.4	L74 G75	Q72-L74 PolarHBondContact O-N 3.06Å; Q72-G75 PolarHBondContact O-N 3.11Å; Q72-G75 VanDerWaalsContact O-N 3.16Å
73	Q	47.3	Very low	47.6	Very low	139 Å²	139	118.1 Å²	118.1	65%	0.65	62%	0.624	S	S	*	*	H	α-helix	trans	-60.7	-25.6	176.8	-60.1	-63.7	-42	0	0	113.9	P71 G75 N76 M77	P71-Q73 PolarHBondContact O-N 3.46Å; Q73-G75 VanDerWaalsContact C-N 3.32Å; Q73-N76 WeakPolarHBondContact O-CB 3.3Å; Q73-N76 PolarHBondContact O-N 2.94Å; Q73-M77 PolarHBondContact O-N 3.17Å
74	L	45.1	Very low	48.4	Very low	95 Å²	95	116.7 Å²	116.7	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-69.7	-31.1	177.4	-133.1	96.5	0	0	0	112	L70 P71 Q72 N76 M77	L70-L74 HydrophobicContact CD1-CD2 4.21Å; L70-L74 HydrophobicContact CD2-CD2 4.22Å; P71-L74 WeakPolarHBondContact O-CB 3.17Å; P71-L74 PolarHBondContact O-N 2.87Å; Q72-L74 PolarHBondContact O-N 3.06Å; L74-N76 VanDerWaalsContact C-N 3.31Å; L74-M77 PolarHBondContact O-N 3.32Å
75	G	52.2	Low	49	Very low	42 Å²	42	121 Å²	121	43%	0.433	63%	0.626	S	S	.	*	H	α-helix	trans	-68.6	-31.2	174.5	0	0	0	0	0	112.6	Q72 Q73 M77 E78 Q79	Q72-G75 PolarHBondContact O-N 3.11Å; Q72-G75 VanDerWaalsContact O-N 3.16Å; Q73-G75 VanDerWaalsContact C-N 3.32Å; G75-M77 VanDerWaalsContact C-N 3.32Å; G75-M77 PolarHBondContact O-N 3.33Å; G75-E78 PolarHBondContact O-N 2.96Å; G75-Q79 PolarHBondContact O-N 3.32Å
76	N	56.6	Low	50	Low	90 Å²	90	117.1 Å²	117.1	48%	0.481	61%	0.609	S	S	.	*	H	α-helix	trans	-67.8	-33.5	176.1	-62.8	-11.7	0	0	0	111.5	Q73 L74 Q79 V80	Q73-N76 WeakPolarHBondContact O-CB 3.3Å; Q73-N76 PolarHBondContact O-N 2.94Å; L74-N76 VanDerWaalsContact C-N 3.31Å; N76-Q79 PolarHBondContact O-N 2.88Å; N76-V80 VanDerWaalsContact O-CG2 3.28Å; N76-V80 WeakPolarHBondContact O-CG2 3.49Å; N76-V80 PolarHBondContact O-N 3.24Å
77	M	48.8	Very low	50.9	Low	123 Å²	123	115.3 Å²	115.3	61%	0.606	60%	0.599	S	S	*	*	H	α-helix	trans	-65.3	-36.5	174	-86.4	-177	57.2	0	0	112.9	Q73 L74 G75 Q79 V80 L81	Q73-M77 PolarHBondContact O-N 3.17Å; L74-M77 PolarHBondContact O-N 3.32Å; G75-M77 VanDerWaalsContact C-N 3.32Å; G75-M77 PolarHBondContact O-N 3.33Å; M77-Q79 VanDerWaalsContact C-N 3.32Å; M77-V80 PolarHBondContact O-N 3.17Å; M77-L81 WeakPolarHBondContact O-CB 3.43Å; M77-L81 WeakPolarHBondContact O-CG 3.39Å; M77-L81 PolarHBondContact O-N 3.48Å
78	E	51.6	Low	52.4	Low	119 Å²	119	115.5 Å²	115.5	56%	0.556	59%	0.589	S	S	*	*	H	α-helix	trans	-67.8	-36.1	176.6	-162.6	-175.2	158.4	0	0	111.4	G75 L81 K82	G75-E78 PolarHBondContact O-N 2.96Å; E78-L81 PolarHBondContact O-N 2.86Å; E78-K82 WeakPolarHBondContact O-CG 3.37Å; E78-K82 PolarHBondContact O-N 3.37Å; E78-K82 VanDerWaalsContact O-N 3.08Å; E78-K82 IonicContact OE1-NZ 3.88Å
79	Q	55.8	Low	53.9	Low	97 Å²	97	114.7 Å²	114.7	45%	0.453	58%	0.581	S	S	.	*	H	α-helix	trans	-67.2	-45.4	174.5	-172.9	61.3	22.9	0	0	111.8	G75 N76 M77 L81 K82 E83	G75-Q79 PolarHBondContact O-N 3.32Å; N76-Q79 PolarHBondContact O-N 2.88Å; M77-Q79 VanDerWaalsContact C-N 3.32Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 3.43Å; Q79-K82 WeakPolarHBondContact O-CB 3.21Å; Q79-K82 PolarHBondContact O-N 3.32Å; Q79-K82 VanDerWaalsContact O-N 3.11Å; Q79-E83 PolarHBondContact NE2-OE1 2.92Å; Q79-E83 PolarHBondContact O-N 3.45Å
80	V	57.5	Low	55.2	Low	82 Å²	82	108.1 Å²	108.1	50%	0.497	56%	0.561	S	S	.	*	H	α-helix	trans	-61.2	-38.8	174.5	171.7	0	0	0	0	111.1	N76 M77 K82 E83 V84	N76-V80 VanDerWaalsContact O-CG2 3.28Å; N76-V80 WeakPolarHBondContact O-CG2 3.49Å; N76-V80 PolarHBondContact O-N 3.24Å; M77-V80 PolarHBondContact O-N 3.17Å; V80-K82 VanDerWaalsContact C-N 3.33Å; V80-K82 PolarHBondContact O-N 3.01Å; V80-E83 PolarHBondContact O-N 2.99Å; V80-V84 HydrophobicContact CG1-CG2 4.36Å; V80-V84 WeakPolarHBondContact O-CB 3.44Å; V80-V84 VanDerWaalsContact O-CG2 3.26Å; V80-V84 WeakPolarHBondContact O-CG2 3.19Å; V80-V84 PolarHBondContact O-N 3.36Å
81	L	52.8	Low	56.3	Low	105 Å²	105	106.4 Å²	106.4	55%	0.55	56%	0.555	S	S	.	*	H	α-helix	trans	-65.2	-33.9	175.1	-85.1	163.6	0	0	0	113.1	M77 E78 Q79 R85	M77-L81 WeakPolarHBondContact O-CB 3.43Å; M77-L81 WeakPolarHBondContact O-CG 3.39Å; M77-L81 PolarHBondContact O-N 3.48Å; E78-L81 PolarHBondContact O-N 2.86Å; Q79-L81 VanDerWaalsContact C-N 3.3Å; Q79-L81 PolarHBondContact O-N 3.43Å; L81-R85 WeakPolarHBondContact O-CB 3.33Å; L81-R85 PolarHBondContact O-N 3.41Å; L81-R85 VanDerWaalsContact O-N 3.16Å
82	K	62.3	Low	57.1	Low	115 Å²	115	106.3 Å²	106.3	50%	0.5	55%	0.55	S	S	.	.	H	α-helix	trans	-69.8	-41.4	174.1	-76.4	174.7	-175.6	166.6	0	111.4	E78 Q79 V80 R85 A86	E78-K82 WeakPolarHBondContact O-CG 3.37Å; E78-K82 PolarHBondContact O-N 3.37Å; E78-K82 VanDerWaalsContact O-N 3.08Å; E78-K82 IonicContact OE1-NZ 3.88Å; Q79-K82 WeakPolarHBondContact O-CB 3.21Å; Q79-K82 PolarHBondContact O-N 3.32Å; Q79-K82 VanDerWaalsContact O-N 3.11Å; V80-K82 VanDerWaalsContact C-N 3.33Å; V80-K82 PolarHBondContact O-N 3.01Å; K82-R85 PolarHBondContact O-N 2.77Å; K82-A86 PolarHBondContact O-N 3.27Å
83	E	63.7	Low	57.5	Low	113 Å²	113	101.2 Å²	101.2	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-66.3	-42.5	177.6	-72.7	170.4	-162.7	0	0	111.9	Q79 V80 R85 A86 L87	Q79-E83 PolarHBondContact NE2-OE1 2.92Å; Q79-E83 PolarHBondContact O-N 3.45Å; V80-E83 PolarHBondContact O-N 2.99Å; E83-R85 VanDerWaalsContact C-N 3.27Å; E83-R85 PolarHBondContact O-N 3.42Å; E83-A86 PolarHBondContact O-N 3.08Å; E83-L87 WeakPolarHBondContact O-CB 3.4Å; E83-L87 PolarHBondContact O-N 2.77Å
84	V	57.3	Low	58.2	Low	90 Å²	90	100.5 Å²	100.5	55%	0.545	53%	0.534	S	S	.	.	H	α-helix	trans	-62.3	-35.2	174.2	171.5	0	0	0	0	111.6	V80 K88	V80-V84 HydrophobicContact CG1-CG2 4.36Å; V80-V84 WeakPolarHBondContact O-CB 3.44Å; V80-V84 VanDerWaalsContact O-CG2 3.26Å; V80-V84 WeakPolarHBondContact O-CG2 3.19Å; V80-V84 PolarHBondContact O-N 3.36Å; V84-K88 WeakPolarHBondContact O-CB 3.37Å; V84-K88 PolarHBondContact O-N 3.21Å
85	R	59.9	Low	59	Low	167 Å²	167	102.2 Å²	102.2	63%	0.63	54%	0.537	S	S	*	.	H	α-helix	trans	-70.8	-43	176.9	-167	178.2	-66.6	170.6	-0.3	112	L81 K82 E83 L87 K88 E89	L81-R85 WeakPolarHBondContact O-CB 3.33Å; L81-R85 PolarHBondContact O-N 3.41Å; L81-R85 VanDerWaalsContact O-N 3.16Å; K82-R85 PolarHBondContact O-N 2.77Å; E83-R85 VanDerWaalsContact C-N 3.27Å; E83-R85 PolarHBondContact O-N 3.42Å; R85-L87 VanDerWaalsContact C-N 3.3Å; R85-L87 PolarHBondContact O-N 2.72Å; R85-K88 WeakPolarHBondContact O-CB 3.36Å; R85-K88 PolarHBondContact O-N 2.76Å; R85-E89 PolarHBondContact O-N 3.3Å; R85-E89 VanDerWaalsContact O-N 3.1Å
86	A	64.1	Low	59.9	Low	57 Å²	57	106.6 Å²	106.6	47%	0.471	54%	0.544	S	S	.	.	H	α-helix	trans	-62.6	-39.2	174.4	0	0	0	0	0	111.7	K82 E83 E89 A90	K82-A86 PolarHBondContact O-N 3.27Å; E83-A86 PolarHBondContact O-N 3.08Å; A86-E89 PolarHBondContact O-N 2.93Å; A86-A90 PolarHBondContact O-N 3.45Å
87	L	53.4	Low	60.2	Low	123 Å²	123	105.3 Å²	105.3	64%	0.644	54%	0.543	S	S	*	.	H	α-helix	trans	-65.5	-39.9	176.4	-151.5	82.7	0	0	0	111.8	E83 R85 E89 A90 V91	E83-L87 WeakPolarHBondContact O-CB 3.4Å; E83-L87 PolarHBondContact O-N 2.77Å; R85-L87 VanDerWaalsContact C-N 3.3Å; R85-L87 PolarHBondContact O-N 2.72Å; L87-E89 VanDerWaalsContact C-N 3.35Å; L87-E89 PolarHBondContact O-N 3.39Å; L87-A90 PolarHBondContact O-N 2.89Å; L87-V91 WeakPolarHBondContact O-CG2 3.22Å; L87-V91 PolarHBondContact O-N 2.78Å
88	K	67.3	Low	60.7	Low	138 Å²	138	103.8 Å²	103.8	60%	0.6	54%	0.543	S	S	*	.	H	α-helix	trans	-59.9	-44.6	174.6	-176.8	-176.6	175.3	-169.8	0	111.6	V84 R85 A90 V91 D92	V84-K88 WeakPolarHBondContact O-CB 3.37Å; V84-K88 PolarHBondContact O-N 3.21Å; R85-K88 WeakPolarHBondContact O-CB 3.36Å; R85-K88 PolarHBondContact O-N 2.76Å; K88-A90 VanDerWaalsContact C-N 3.34Å; K88-A90 PolarHBondContact O-N 2.84Å; K88-V91 PolarHBondContact O-N 3.26Å; K88-D92 WeakPolarHBondContact O-CB 3.16Å; K88-D92 PolarHBondContact O-N 3.28Å
89	E	67.4	Low	61.4	Low	127 Å²	127	103.5 Å²	103.5	59%	0.593	54%	0.542	S	S	*	.	H	α-helix	trans	-64.7	-38.6	178.1	-71	171.8	-171.9	0	0	111.9	R85 A86 L87 D92 S93	R85-E89 PolarHBondContact O-N 3.3Å; R85-E89 VanDerWaalsContact O-N 3.1Å; A86-E89 PolarHBondContact O-N 2.93Å; L87-E89 VanDerWaalsContact C-N 3.35Å; L87-E89 PolarHBondContact O-N 3.39Å; E89-D92 PolarHBondContact O-N 3.03Å; E89-S93 WeakPolarHBondContact O-CB 3.38Å; E89-S93 PolarHBondContact O-N 3.46Å
90	A	61.8	Low	61.7	Low	59 Å²	59	102.7 Å²	102.7	49%	0.488	54%	0.54	S	S	.	.	H	α-helix	trans	-65.3	-42	174.9	0	0	0	0	0	112.5	A86 L87 K88 S93 L94	A86-A90 PolarHBondContact O-N 3.45Å; L87-A90 PolarHBondContact O-N 2.89Å; K88-A90 VanDerWaalsContact C-N 3.34Å; K88-A90 PolarHBondContact O-N 2.84Å; A90-S93 PolarHBondContact O-N 3.31Å; A90-L94 WeakPolarHBondContact O-CB 3.3Å; A90-L94 PolarHBondContact O-N 3.46Å
91	V	61.3	Low	61.7	Low	87 Å²	87	102.6 Å²	102.6	53%	0.527	54%	0.543	S	S	.	.	H	α-helix	trans	-66.3	-41	176.9	170.6	0	0	0	0	111.5	L87 K88 S93 L94 K95	L87-V91 WeakPolarHBondContact O-CG2 3.22Å; L87-V91 PolarHBondContact O-N 2.78Å; K88-V91 PolarHBondContact O-N 3.26Å; V91-S93 VanDerWaalsContact C-N 3.34Å; V91-L94 PolarHBondContact O-N 2.96Å; V91-K95 WeakPolarHBondContact O-CB 3.3Å; V91-K95 PolarHBondContact O-N 3.07Å
92	D	61.9	Low	61.9	Low	84 Å²	84	104.6 Å²	104.6	45%	0.449	55%	0.547	S	S	.	.	H	α-helix	trans	-67.2	-37	177.3	-75.1	-26.2	0	0	0	111.3	K88 E89 K96	K88-D92 WeakPolarHBondContact O-CB 3.16Å; K88-D92 PolarHBondContact O-N 3.28Å; E89-D92 PolarHBondContact O-N 3.03Å; D92-K96 PolarHBondContact O-N 3.33Å
93	S	60.3	Low	61.5	Low	73 Å²	73	105.1 Å²	105.1	51%	0.51	55%	0.554	S	S	.	*	H	α-helix	trans	-64	-44.9	172.6	-173.9	0	0	0	0	112	E89 A90 V91 K96 S97	E89-S93 WeakPolarHBondContact O-CB 3.38Å; E89-S93 PolarHBondContact O-N 3.46Å; A90-S93 PolarHBondContact O-N 3.31Å; V91-S93 VanDerWaalsContact C-N 3.34Å; S93-K96 WeakPolarHBondContact O-CB 3.29Å; S93-K96 PolarHBondContact O-N 3.16Å; S93-S97 PolarHBondContact O-N 3.26Å; S93-S97 PolarHBondContact O-OG 2.94Å
94	L	62.1	Low	61.1	Low	125 Å²	125	106.7 Å²	106.7	65%	0.654	56%	0.562	S	S	*	*	H	α-helix	trans	-66.2	-39	179.2	-158.9	78.9	0	0	0	111.6	A90 V91 K96 S97 C98	A90-L94 WeakPolarHBondContact O-CB 3.3Å; A90-L94 PolarHBondContact O-N 3.46Å; V91-L94 PolarHBondContact O-N 2.96Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 3.15Å; L94-S97 PolarHBondContact O-N 2.83Å; L94-C98 PolarHBondContact O-N 2.81Å
95	K	61.8	Low	60.8	Low	130 Å²	130	105.8 Å²	105.8	57%	0.565	56%	0.564	S	S	*	*	H	α-helix	trans	-61.3	-39.7	174.9	-174	177.4	-179.8	-178.7	0	111.6	V91 C98 Q99	V91-K95 WeakPolarHBondContact O-CB 3.3Å; V91-K95 PolarHBondContact O-N 3.07Å; K95-C98 PolarHBondContact O-N 3.38Å; K95-Q99 WeakPolarHBondContact O-CG 3.26Å; K95-Q99 PolarHBondContact O-N 2.8Å
96	K	69.4	Low	60.3	Low	134 Å²	134	104.1 Å²	104.1	58%	0.583	57%	0.567	S	S	*	*	H	α-helix	trans	-65.2	-46.8	175.2	-168.5	178.9	178.4	-176.3	0	111.4	D92 S93 L94 C98 Q99 D100	D92-K96 PolarHBondContact O-N 3.33Å; S93-K96 WeakPolarHBondContact O-CB 3.29Å; S93-K96 PolarHBondContact O-N 3.16Å; L94-K96 VanDerWaalsContact C-N 3.29Å; L94-K96 PolarHBondContact O-N 3.15Å; K96-C98 VanDerWaalsContact C-N 3.33Å; K96-C98 PolarHBondContact O-N 2.78Å; K96-Q99 PolarHBondContact O-N 2.82Å; K96-Q99 VanDerWaalsContact O-N 3.12Å; K96-D100 VanDerWaalsContact O-CG 3.3Å; K96-D100 PolarHBondContact O-N 3.18Å
97	S	64.5	Low	59.5	Low	64 Å²	64	107.8 Å²	107.8	45%	0.448	58%	0.579	S	S	.	*	H	α-helix	trans	-61.4	-37.4	175.8	-60.5	0	0	0	0	113.3	S93 L94 D100 C101	S93-S97 PolarHBondContact O-N 3.26Å; S93-S97 PolarHBondContact O-OG 2.94Å; L94-S97 PolarHBondContact O-N 2.83Å; S97-D100 PolarHBondContact O-N 3.37Å; S97-C101 PolarHBondContact O-N 3.47Å
98	C	58.8	Low	59.2	Low	91 Å²	91	110 Å²	110	62%	0.615	59%	0.586	S	S	*	*	H	α-helix	trans	-67.6	-35.8	173.8	-99.3	0	0	0	0	113	L94 K95 K96 K102	L94-C98 PolarHBondContact O-N 2.81Å; K95-C98 PolarHBondContact O-N 3.38Å; K96-C98 VanDerWaalsContact C-N 3.33Å; K96-C98 PolarHBondContact O-N 2.78Å; C98-K102 PolarHBondContact O-N 3.4Å; C98-K102 VanDerWaalsContact O-N 3.12Å
99	Q	65.4	Low	58.1	Low	113 Å²	113	107.1 Å²	107.1	53%	0.528	60%	0.596	S	S	.	*	H	α-helix	trans	-68.6	-39.3	174.1	-78	-179.7	-44.9	0	0	111.7	K95 K96 K102 L103	K95-Q99 WeakPolarHBondContact O-CG 3.26Å; K95-Q99 PolarHBondContact O-N 2.8Å; K96-Q99 PolarHBondContact O-N 2.82Å; K96-Q99 VanDerWaalsContact O-N 3.12Å; Q99-K102 PolarHBondContact O-N 3.02Å; Q99-L103 WeakPolarHBondContact O-CG 3.47Å; Q99-L103 PolarHBondContact O-N 3.43Å; Q99-L103 VanDerWaalsContact O-N 3.11Å
100	D	62	Low	56.6	Low	79 Å²	79	108.4 Å²	108.4	42%	0.422	61%	0.606	S	S	.	*	H	α-helix	trans	-66.6	-39.8	177	-66.6	-21.9	0	0	0	111.5	K96 S97 K102 L103 Q104	K96-D100 VanDerWaalsContact O-CG 3.3Å; K96-D100 PolarHBondContact O-N 3.18Å; S97-D100 PolarHBondContact O-N 3.37Å; D100-K102 VanDerWaalsContact C-N 3.32Å; D100-K102 PolarHBondContact O-N 3.08Å; D100-L103 PolarHBondContact O-N 2.94Å; D100-Q104 PolarHBondContact O-N 3.26Å
101	C	59	Low	56.4	Low	81 Å²	81	110.5 Å²	110.5	55%	0.547	62%	0.615	S	S	.	*	H	α-helix	trans	-63.9	-34.9	172.3	-91.9	0	0	0	0	112.9	S97 L103 Q104 A105	S97-C101 PolarHBondContact O-N 3.47Å; C101-L103 VanDerWaalsContact C-N 3.34Å; C101-Q104 PolarHBondContact O-N 2.79Å; C101-A105 PolarHBondContact O-N 3.41Å
102	K	55.3	Low	55.4	Low	147 Å²	147	110.3 Å²	110.3	64%	0.639	63%	0.631	S	S	*	*	H	α-helix	trans	-68.5	-35.7	177.6	-169.3	171.4	-179.3	175.7	0	111.8	C98 Q99 D100 Q104 A105	C98-K102 PolarHBondContact O-N 3.4Å; C98-K102 VanDerWaalsContact O-N 3.12Å; Q99-K102 PolarHBondContact O-N 3.02Å; D100-K102 VanDerWaalsContact C-N 3.32Å; D100-K102 PolarHBondContact O-N 3.08Å; K102-Q104 VanDerWaalsContact C-N 3.35Å; K102-A105 PolarHBondContact O-N 2.78Å
103	L	55.3	Low	54.1	Low	125 Å²	125	110.1 Å²	110.1	65%	0.654	65%	0.648	S	S	*	*	H	α-helix	trans	-71.4	-27.8	175.8	-68.6	167.6	0	0	0	112.9	Q99 D100 C101	Q99-L103 WeakPolarHBondContact O-CG 3.47Å; Q99-L103 PolarHBondContact O-N 3.43Å; Q99-L103 VanDerWaalsContact O-N 3.11Å; D100-L103 PolarHBondContact O-N 2.94Å; C101-L103 VanDerWaalsContact C-N 3.34Å
104	Q	54.4	Low	53.2	Low	147 Å²	147	115.1 Å²	115.1	69%	0.687	67%	0.67	S	S	*	*	H	α-helix	trans	-78.8	-23.4	174.6	-73.4	178.9	-11.5	0	0	113.5	D100 C101 K102	D100-Q104 PolarHBondContact O-N 3.26Å; C101-Q104 PolarHBondContact O-N 2.79Å; K102-Q104 VanDerWaalsContact C-N 3.35Å
105	A	50.9	Low	52.5	Low	71 Å²	71	113 Å²	113	59%	0.587	68%	0.677	S	S	*	*	H	α-helix	trans	-79	-21.3	178.1	0	0	0	0	0	113.5	C101 K102	C101-A105 PolarHBondContact O-N 3.41Å; K102-A105 PolarHBondContact O-N 2.78Å
106	D	50.2	Low	51.2	Low	131 Å²	131	111.9 Å²	111.9	70%	0.701	69%	0.693	S	S	*	*	S	Bend	trans	-88.6	-5.8	-178.5	-73.1	-25.9	0	0	0	113.6
107	D	47.6	Very low	49.9	Very low	135 Å²	135	108.5 Å²	108.5	72%	0.722	70%	0.695	S	S	*	*	S	Bend	trans	-99	-5.6	-177.6	-156.2	38.6	0	0	0	114.4
108	H	45.9	Very low	49	Very low	169 Å²	169	111.1 Å²	111.1	78%	0.782	71%	0.711	S	S	*	*	S	Bend	trans	-122.8	93	174	-80.9	-51.1	0	0	0	111.4	D110	H108-D110 PolarHBondContact O-N 3.42Å
109	G	44	Very low	48.4	Very low	78 Å²	78	110.3 Å²	110.3	80%	0.804	71%	0.711	S	S	*	*			trans	-76.8	115.1	170.5	0	0	0	0	0	113.4
110	D	37.1	Very low	47.6	Very low	153 Å²	153	107.3 Å²	107.3	82%	0.818	71%	0.711	S	S	*	*			trans	58.2	163.6	143.8	-140.4	32.6	0	0	0	120.2	H108	H108-D110 PolarHBondContact O-N 3.42Å
111	P	56.5	Low	47.1	Very low	104 Å²	104	108.6 Å²	108.6	68%	0.675	72%	0.717	S	S	*	*			cis	-126.4	161	-21.2	12.8	11.7	0	0	0	114.7
112	G	41.5	Very low	46.9	Very low	83 Å²	83	109.9 Å²	109.9	86%	0.856	72%	0.719	S	S	*	*			trans	89.5	130.7	145.6	0	0	0	0	0	118.4
113	G	34.2	Very low	47.1	Very low	79 Å²	79	112 Å²	112	81%	0.814	72%	0.722	S	S	*	*			trans	153.9	104.9	164.2	0	0	0	0	0	113.8
114	D	42.3	Very low	47.3	Very low	179 Å²	179	109.7 Å²	109.7	96%	0.957	71%	0.714	S	S	*	*			trans	-54.6	141.5	170.3	-85.7	-41.5	0	0	0	113.3
115	G	46.1	Very low	47.4	Very low	79 Å²	79	107.9 Å²	107.9	81%	0.814	71%	0.705	S	S	*	*			trans	109	97.3	148.6	0	0	0	0	0	117.7
116	A	35.3	Very low	48.4	Very low	108 Å²	108	110 Å²	110	89%	0.893	70%	0.703	S	S	*	*			trans	-153.4	134.1	149.3	0	0	0	0	0	110.6
117	G	41.2	Very low	49	Very low	62 Å²	62	108.6 Å²	108.6	64%	0.639	70%	0.695	S	S	*	*			trans	-79.3	-170.6	-159.8	0	0	0	0	0	118.6	A119	G117-A119 VanDerWaalsContact C-N 3.28Å; G117-A119 PolarHBondContact O-N 2.91Å
118	P	46.6	Very low	49.8	Very low	119 Å²	119	107.6 Å²	107.6	77%	0.773	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	48.3	-158.5	37.1	-38.2	0	0	0	113.9
119	A	45.6	Very low	51.1	Low	75 Å²	75	103 Å²	103	62%	0.62	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.6	-17	-177.2	0	0	0	0	0	114.3	G117	G117-A119 VanDerWaalsContact C-N 3.28Å; G117-A119 PolarHBondContact O-N 2.91Å
120	G	48.6	Very low	52.6	Low	50 Å²	50	103.6 Å²	103.6	52%	0.515	66%	0.655	S	S	.	*	S	Bend	trans	-82.9	-32.7	179.4	0	0	0	0	0	114.2
121	D	50.6	Low	54.4	Low	106 Å²	106	100.8 Å²	100.8	57%	0.567	64%	0.643	S	S	*	*	H	α-helix	trans	-74.1	-36.5	-174	-150.2	7.5	0	0	0	112	R123 V124 Q125	D121-R123 VanDerWaalsContact C-N 3.31Å; D121-R123 PolarHBondContact O-N 3.42Å; D121-V124 PolarHBondContact O-N 2.74Å; D121-Q125 PolarHBondContact O-N 2.92Å
122	N	56.3	Low	55.1	Low	107 Å²	107	101.1 Å²	101.1	57%	0.572	64%	0.639	S	S	*	*	H	α-helix	trans	-64.1	-32.5	177.3	-68.7	-16.4	0	0	0	112.9	E126	N122-E126 VanDerWaalsContact O-CB 3.23Å; N122-E126 WeakPolarHBondContact O-CB 3.31Å; N122-E126 PolarHBondContact O-N 3.32Å
123	R	58.5	Low	57	Low	191 Å²	191	103.6 Å²	103.6	72%	0.721	63%	0.626	S	S	*	*	H	α-helix	trans	-75.7	-32.6	178.1	-87.2	172.2	69.6	-174.2	1.6	112.8	D121 L127	D121-R123 VanDerWaalsContact C-N 3.31Å; D121-R123 PolarHBondContact O-N 3.42Å; R123-L127 WeakPolarHBondContact O-CB 3.48Å; R123-L127 WeakPolarHBondContact O-CD1 3.28Å; R123-L127 WeakPolarHBondContact O-CG 3.42Å; R123-L127 PolarHBondContact O-N 3.2Å
124	V	59.8	Low	58.9	Low	78 Å²	78	105 Å²	105	47%	0.473	62%	0.615	S	S	.	*	H	α-helix	trans	-72.1	-44.3	176.4	178	0	0	0	0	109.7	D121 E126 L127 E128	D121-V124 PolarHBondContact O-N 2.74Å; V124-E126 VanDerWaalsContact C-N 3.34Å; V124-E126 PolarHBondContact O-N 2.87Å; V124-L127 PolarHBondContact O-N 3Å; V124-E128 WeakPolarHBondContact O-CG 3.41Å; V124-E128 PolarHBondContact O-N 3.11Å
125	Q	57.6	Low	60.4	Low	109 Å²	109	100.1 Å²	100.1	51%	0.509	59%	0.594	S	S	.	*	H	α-helix	trans	-63.3	-37.5	174.2	-72.3	-176.9	-4.3	0	0	112.9	D121 E128 S129	D121-Q125 PolarHBondContact O-N 2.92Å; Q125-E128 PolarHBondContact O-N 3.38Å; Q125-S129 VanDerWaalsContact O-CB 3.27Å; Q125-S129 WeakPolarHBondContact O-CB 3.36Å; Q125-S129 PolarHBondContact O-N 2.95Å
126	E	70.4	Confident	61.9	Low	114 Å²	114	99.3 Å²	99.3	53%	0.533	58%	0.576	S	S	.	*	H	α-helix	trans	-62.3	-44.4	173.3	-174.1	80.4	-146.9	0	0	111.3	N122 V124 S129 Q130	N122-E126 VanDerWaalsContact O-CB 3.23Å; N122-E126 WeakPolarHBondContact O-CB 3.31Å; N122-E126 PolarHBondContact O-N 3.32Å; V124-E126 VanDerWaalsContact C-N 3.34Å; V124-E126 PolarHBondContact O-N 2.87Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 2.85Å; E126-Q130 VanDerWaalsContact O-CG 3.29Å; E126-Q130 WeakPolarHBondContact O-CG 3Å; E126-Q130 PolarHBondContact O-N 2.8Å
127	L	64.3	Low	64.1	Low	102 Å²	102	98.7 Å²	98.7	53%	0.534	56%	0.555	S	S	.	*	H	α-helix	trans	-68.3	-39.3	177.9	-78.3	164.6	0	0	0	112.3	R123 V124 Q130 V131	R123-L127 WeakPolarHBondContact O-CB 3.48Å; R123-L127 WeakPolarHBondContact O-CD1 3.28Å; R123-L127 WeakPolarHBondContact O-CG 3.42Å; R123-L127 PolarHBondContact O-N 3.2Å; V124-L127 PolarHBondContact O-N 3Å; L127-Q130 PolarHBondContact O-N 3.33Å; L127-V131 VanDerWaalsContact O-CG2 3.29Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.37Å
128	E	62.5	Low	65.6	Low	114 Å²	114	101.9 Å²	101.9	53%	0.533	56%	0.556	S	S	.	*	H	α-helix	trans	-64.4	-41.3	174.3	-75.5	-177.2	162.7	0	0	111.6	V124 Q125 Q130 V131 N132	V124-E128 WeakPolarHBondContact O-CG 3.41Å; V124-E128 PolarHBondContact O-N 3.11Å; Q125-E128 PolarHBondContact O-N 3.38Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.23Å; E128-V131 PolarHBondContact O-N 2.87Å; E128-N132 WeakPolarHBondContact O-CB 3.28Å; E128-N132 PolarHBondContact O-N 2.84Å; E128-N132 PolarHBondContact O-ND2 3.04Å; E128-N132 VanDerWaalsContact O-ND2 3.08Å
129	S	74.6	Confident	67	Low	72 Å²	72	102.6 Å²	102.6	50%	0.503	55%	0.547	S	S	.	.	H	α-helix	trans	-58.3	-45.6	172.1	168.5	0	0	0	0	111.4	Q125 E126 N132 K133	Q125-S129 VanDerWaalsContact O-CB 3.27Å; Q125-S129 WeakPolarHBondContact O-CB 3.36Å; Q125-S129 PolarHBondContact O-N 2.95Å; E126-S129 WeakPolarHBondContact O-CB 3.5Å; E126-S129 PolarHBondContact O-N 2.85Å; S129-N132 PolarHBondContact O-N 3.15Å; S129-K133 WeakPolarHBondContact O-CB 3.42Å; S129-K133 PolarHBondContact O-N 3.48Å
130	Q	75.9	Confident	68.7	Low	92 Å²	92	103.3 Å²	103.3	43%	0.43	54%	0.541	S	S	.	.	H	α-helix	trans	-65.6	-41	177.7	-73.2	175.9	10.7	0	0	112.5	E126 L127 E128 K133 L134	E126-Q130 VanDerWaalsContact O-CG 3.29Å; E126-Q130 WeakPolarHBondContact O-CG 3Å; E126-Q130 PolarHBondContact O-N 2.8Å; L127-Q130 PolarHBondContact O-N 3.33Å; E128-Q130 VanDerWaalsContact C-N 3.34Å; E128-Q130 PolarHBondContact O-N 3.23Å; Q130-K133 PolarHBondContact O-N 3.29Å; Q130-L134 WeakPolarHBondContact O-CB 3.38Å; Q130-L134 WeakPolarHBondContact O-CG 3.43Å; Q130-L134 PolarHBondContact O-N 3.47Å
131	V	74.3	Confident	70.1	Confident	93 Å²	93	103 Å²	103	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-65.7	-42.7	176.8	169.5	0	0	0	0	111.2	L127 E128 K133 L134 S135	L127-V131 VanDerWaalsContact O-CG2 3.29Å; L127-V131 WeakPolarHBondContact O-CG2 3.48Å; L127-V131 PolarHBondContact O-N 3.37Å; E128-V131 PolarHBondContact O-N 2.87Å; V131-K133 VanDerWaalsContact C-N 3.35Å; V131-L134 PolarHBondContact O-N 3.1Å; V131-S135 WeakPolarHBondContact O-CB 3.31Å; V131-S135 PolarHBondContact O-N 2.91Å
132	N	70.4	Confident	71.3	Confident	111 Å²	111	103.7 Å²	103.7	59%	0.594	53%	0.531	S	S	*	.	H	α-helix	trans	-66.1	-39	178.1	-72.7	-32.6	0	0	0	111.7	E128 S129 S135 S136	E128-N132 WeakPolarHBondContact O-CB 3.28Å; E128-N132 PolarHBondContact O-N 2.84Å; E128-N132 PolarHBondContact O-ND2 3.04Å; E128-N132 VanDerWaalsContact O-ND2 3.08Å; S129-N132 PolarHBondContact O-N 3.15Å; N132-S135 PolarHBondContact O-N 3.31Å; N132-S136 PolarHBondContact O-N 2.88Å
133	K	81	Confident	72.2	Confident	136 Å²	136	102.4 Å²	102.4	59%	0.591	52%	0.524	S	S	*	.	H	α-helix	trans	-62.5	-49.1	174.3	-172.8	-178.9	177.2	-169.3	0	111.6	S129 Q130 V131 S135 S136 E137	S129-K133 WeakPolarHBondContact O-CB 3.42Å; S129-K133 PolarHBondContact O-N 3.48Å; Q130-K133 PolarHBondContact O-N 3.29Å; V131-K133 VanDerWaalsContact C-N 3.35Å; K133-S135 VanDerWaalsContact C-N 3.29Å; K133-S135 PolarHBondContact O-N 2.77Å; K133-S136 WeakPolarHBondContact O-CB 3.23Å; K133-S136 PolarHBondContact O-N 2.8Å; K133-S136 VanDerWaalsContact O-N 3.1Å; K133-E137 VanDerWaalsContact CE-OE1 3.24Å; K133-E137 WeakPolarHBondContact CE-OE1 3.08Å; K133-E137 PolarHBondContact O-N 3.39Å
134	L	75.7	Confident	73.3	Confident	109 Å²	109	100 Å²	100	57%	0.571	52%	0.521	S	S	*	.	H	α-helix	trans	-63.3	-35.5	177.1	-74.4	168.8	0	0	0	112.3	Q130 V131 S136 E137 L138	Q130-L134 WeakPolarHBondContact O-CB 3.38Å; Q130-L134 WeakPolarHBondContact O-CG 3.43Å; Q130-L134 PolarHBondContact O-N 3.47Å; V131-L134 PolarHBondContact O-N 3.1Å; L134-S136 VanDerWaalsContact C-N 3.3Å; L134-S136 PolarHBondContact O-N 3Å; L134-E137 PolarHBondContact O-N 3.42Å; L134-L138 WeakPolarHBondContact O-CB 3.28Å; L134-L138 PolarHBondContact O-N 3.04Å
135	S	73.1	Confident	73.7	Confident	75 Å²	75	101.8 Å²	101.8	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-65.4	-33.8	174.7	-174.9	0	0	0	0	112.4	V131 N132 K133 K139	V131-S135 WeakPolarHBondContact O-CB 3.31Å; V131-S135 PolarHBondContact O-N 2.91Å; N132-S135 PolarHBondContact O-N 3.31Å; K133-S135 VanDerWaalsContact C-N 3.29Å; K133-S135 PolarHBondContact O-N 2.77Å; S135-K139 WeakPolarHBondContact O-CB 3.24Å; S135-K139 PolarHBondContact O-N 2.92Å
136	S	78.4	Confident	73.9	Confident	63 Å²	63	101.8 Å²	101.8	44%	0.441	53%	0.528	S	S	.	.	H	α-helix	trans	-69.2	-49.2	173.8	-167.8	0	0	0	0	110.6	N132 K133 L134 L138 K139 D140	N132-S136 PolarHBondContact O-N 2.88Å; K133-S136 WeakPolarHBondContact O-CB 3.23Å; K133-S136 PolarHBondContact O-N 2.8Å; K133-S136 VanDerWaalsContact O-N 3.1Å; L134-S136 VanDerWaalsContact C-N 3.3Å; L134-S136 PolarHBondContact O-N 3Å; S136-L138 VanDerWaalsContact C-N 3.28Å; S136-L138 PolarHBondContact O-N 3.17Å; S136-K139 WeakPolarHBondContact O-CA 3.34Å; S136-K139 WeakPolarHBondContact O-CB 3.49Å; S136-K139 PolarHBondContact O-N 3.49Å; S136-D140 PolarHBondContact O-N 3.48Å
137	E	81.1	Confident	74.3	Confident	95 Å²	95	98.1 Å²	98.1	44%	0.444	52%	0.52	S	S	.	.	H	α-helix	trans	-60.7	-38	-179.9	-70.1	174.1	-177.4	0	0	111.8	K133 L134 K139 D140 A141	K133-E137 VanDerWaalsContact CE-OE1 3.24Å; K133-E137 WeakPolarHBondContact CE-OE1 3.08Å; K133-E137 PolarHBondContact O-N 3.39Å; L134-E137 PolarHBondContact O-N 3.42Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 2.93Å; E137-D140 PolarHBondContact O-N 3.41Å; E137-A141 WeakPolarHBondContact O-CB 3.39Å; E137-A141 PolarHBondContact O-N 3.38Å
138	L	72.6	Confident	74.6	Confident	129 Å²	129	98.1 Å²	98.1	68%	0.675	52%	0.52	S	S	*	.	H	α-helix	trans	-68.4	-32.6	175.9	-170.8	65.8	0	0	0	112.5	L134 S136 K142	L134-L138 WeakPolarHBondContact O-CB 3.28Å; L134-L138 PolarHBondContact O-N 3.04Å; S136-L138 VanDerWaalsContact C-N 3.28Å; S136-L138 PolarHBondContact O-N 3.17Å; L138-K142 WeakPolarHBondContact O-CB 3.33Å; L138-K142 PolarHBondContact O-N 2.92Å
139	K	75.4	Confident	74.7	Confident	134 Å²	134	98 Å²	98	58%	0.583	52%	0.52	S	S	*	.	H	α-helix	trans	-70.1	-44.2	175.6	-173	-178.5	176.4	-171.8	0	110.7	S135 S136 E137 A141 K142 D143	S135-K139 WeakPolarHBondContact O-CB 3.24Å; S135-K139 PolarHBondContact O-N 2.92Å; S136-K139 WeakPolarHBondContact O-CA 3.34Å; S136-K139 WeakPolarHBondContact O-CB 3.49Å; S136-K139 PolarHBondContact O-N 3.49Å; E137-K139 VanDerWaalsContact C-N 3.33Å; E137-K139 PolarHBondContact O-N 2.93Å; K139-A141 PolarHBondContact O-N 3.46Å; K139-K142 WeakPolarHBondContact O-CB 3.47Å; K139-K142 PolarHBondContact O-N 3.28Å; K139-D143 PolarHBondContact O-N 2.9Å
140	D	82.4	Confident	74.4	Confident	90 Å²	90	96 Å²	96	48%	0.481	51%	0.51	S	S	.	.	H	α-helix	trans	-63.4	-43.3	177.3	-63.2	-25.6	0	0	0	110.8	S136 E137 K142 D143 E144	S136-D140 PolarHBondContact O-N 3.48Å; E137-D140 PolarHBondContact O-N 3.41Å; D140-K142 VanDerWaalsContact C-N 3.31Å; D140-K142 PolarHBondContact O-N 3.19Å; D140-D143 PolarHBondContact O-N 2.89Å; D140-E144 PolarHBondContact O-N 3.2Å
141	A	77.1	Confident	74.3	Confident	43 Å²	43	100 Å²	100	36%	0.355	52%	0.521	S	S	.	.	H	α-helix	trans	-62.4	-36.1	174.5	0	0	0	0	0	112.8	E137 K139 L145	E137-A141 WeakPolarHBondContact O-CB 3.39Å; E137-A141 PolarHBondContact O-N 3.38Å; K139-A141 PolarHBondContact O-N 3.46Å; A141-L145 WeakPolarHBondContact O-CB 3.35Å; A141-L145 WeakPolarHBondContact O-CG 3.39Å; A141-L145 PolarHBondContact O-N 3.4Å
142	K	75.9	Confident	73.8	Confident	121 Å²	121	101.5 Å²	101.5	53%	0.526	53%	0.525	S	S	.	.	H	α-helix	trans	-66.5	-42.4	174.7	179.2	-173.8	174.6	-173.1	0	111.5	L138 K139 D140 E144 L145 Q146	L138-K142 WeakPolarHBondContact O-CB 3.33Å; L138-K142 PolarHBondContact O-N 2.92Å; K139-K142 WeakPolarHBondContact O-CB 3.47Å; K139-K142 PolarHBondContact O-N 3.28Å; D140-K142 VanDerWaalsContact C-N 3.31Å; D140-K142 PolarHBondContact O-N 3.19Å; K142-E144 VanDerWaalsContact C-N 3.33Å; K142-L145 PolarHBondContact O-N 2.84Å; K142-Q146 WeakPolarHBondContact O-CG 3.39Å; K142-Q146 PolarHBondContact O-N 2.94Å
143	D	76.2	Confident	73.5	Confident	79 Å²	79	101.4 Å²	101.4	42%	0.422	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-36.2	178.9	-68.3	-14.2	0	0	0	110.5	K139 D140 Q146 G147	K139-D143 PolarHBondContact O-N 2.9Å; D140-D143 PolarHBondContact O-N 2.89Å; D143-Q146 PolarHBondContact O-N 2.94Å; D143-G147 PolarHBondContact O-N 2.96Å
144	E	80.2	Confident	72.7	Confident	140 Å²	140	99.1 Å²	99.1	65%	0.654	52%	0.519	S	S	*	.	H	α-helix	trans	-63.3	-43.5	169.3	-78.9	-165.2	157	0	0	112.7	D140 K142 Q146 G147 L148	D140-E144 PolarHBondContact O-N 3.2Å; K142-E144 VanDerWaalsContact C-N 3.33Å; E144-Q146 VanDerWaalsContact C-N 3.33Å; E144-Q146 PolarHBondContact O-N 2.92Å; E144-G147 CarbonylContact O-C 3.55Å; E144-G147 PolarHBondContact O-N 3.4Å; E144-L148 WeakPolarHBondContact O-CB 3.41Å; E144-L148 WeakPolarHBondContact O-CG 3.39Å; E144-L148 PolarHBondContact O-N 3.48Å
145	L	68.8	Low	71.9	Confident	117 Å²	117	99.8 Å²	99.8	61%	0.613	52%	0.522	S	S	*	.	H	α-helix	trans	-62.7	-39.5	175.9	-78.1	171.9	0	0	0	111.9	A141 K142 L148 Q149	A141-L145 WeakPolarHBondContact O-CB 3.35Å; A141-L145 WeakPolarHBondContact O-CG 3.39Å; A141-L145 PolarHBondContact O-N 3.4Å; K142-L145 PolarHBondContact O-N 2.84Å; L145-L148 PolarHBondContact O-N 3.3Å; L145-Q149 WeakPolarHBondContact O-CB 3.37Å; L145-Q149 PolarHBondContact O-N 3.32Å
146	Q	62.3	Low	71.1	Confident	109 Å²	109	102.2 Å²	102.2	51%	0.509	53%	0.525	S	S	.	.	H	α-helix	trans	-65.5	-39.9	173.5	-73.5	-175.3	-13.8	0	0	111.6	K142 D143 E144 Q149 G150	K142-Q146 WeakPolarHBondContact O-CG 3.39Å; K142-Q146 PolarHBondContact O-N 2.94Å; D143-Q146 PolarHBondContact O-N 2.94Å; E144-Q146 VanDerWaalsContact C-N 3.33Å; E144-Q146 PolarHBondContact O-N 2.92Å; Q146-Q149 PolarHBondContact O-N 2.97Å; Q146-G150 PolarHBondContact O-N 3.45Å
147	G	78.1	Confident	69.9	Low	37 Å²	37	104.7 Å²	104.7	38%	0.381	53%	0.533	S	S	.	.	H	α-helix	trans	-63.5	-42.6	173.5	0	0	0	0	0	112.9	D143 E144 G150 R151	D143-G147 PolarHBondContact O-N 2.96Å; E144-G147 CarbonylContact O-C 3.55Å; E144-G147 PolarHBondContact O-N 3.4Å; G147-G150 PolarHBondContact O-N 3.36Å; G147-R151 WeakPolarHBondContact O-CB 3.36Å; G147-R151 WeakPolarHBondContact O-CG 3.14Å; G147-R151 PolarHBondContact O-N 2.05Å
148	L	69.9	Low	68.6	Low	101 Å²	101	103.8 Å²	103.8	53%	0.529	53%	0.533	S	S	.	.	H	α-helix	trans	-67	-38.2	175.5	-74	172.4	0	0	0	111.9	E144 L145 R151 L152	E144-L148 WeakPolarHBondContact O-CB 3.41Å; E144-L148 WeakPolarHBondContact O-CG 3.39Å; E144-L148 PolarHBondContact O-N 3.48Å; L145-L148 PolarHBondContact O-N 3.3Å; L148-R151 PolarHBondContact O-N 3.35Å; L148-L152 WeakPolarHBondContact O-CB 3.32Å; L148-L152 PolarHBondContact O-N 2.9Å
149	Q	64.8	Low	67.7	Low	113 Å²	113	102.2 Å²	102.2	53%	0.528	53%	0.526	S	S	.	.	H	α-helix	trans	-63.5	-45.8	173.7	-172.3	-177.4	-22.1	0	0	111.1	L145 Q146 R151 L152 E153	L145-Q149 WeakPolarHBondContact O-CB 3.37Å; L145-Q149 PolarHBondContact O-N 3.32Å; Q146-Q149 PolarHBondContact O-N 2.97Å; Q149-R151 VanDerWaalsContact C-N 3.31Å; Q149-R151 PolarHBondContact O-N 3.45Å; Q149-L152 PolarHBondContact O-N 3.44Å; Q149-E153 PolarHBondContact NE2-OE1 2.92Å; Q149-E153 VanDerWaalsContact NE2-OE1 3.12Å; Q149-E153 WeakPolarHBondContact O-CG 3.43Å; Q149-E153 PolarHBondContact O-N 2.93Å
150	G	69.1	Low	66.5	Low	28 Å²	28	100.7 Å²	100.7	29%	0.289	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-38	174.7	0	0	0	0	0	112.7	Q146 G147 T154	Q146-G150 PolarHBondContact O-N 3.45Å; G147-G150 PolarHBondContact O-N 3.36Å; G150-T154 WeakPolarHBondContact O-CB 3.5Å; G150-T154 PolarHBondContact O-N 3.26Å; G150-T154 PolarHBondContact O-OG1 3.08Å
151	R	73.4	Confident	65.2	Low	178 Å²	178	100.6 Å²	100.6	67%	0.672	52%	0.521	S	S	*	.	H	α-helix	trans	-65.4	-41.6	172.6	-75.5	176.8	-178.9	-174.1	2.7	111.9	G147 L148 Q149 T154 L155	G147-R151 WeakPolarHBondContact O-CB 3.36Å; G147-R151 WeakPolarHBondContact O-CG 3.14Å; G147-R151 PolarHBondContact O-N 2.05Å; L148-R151 PolarHBondContact O-N 3.35Å; Q149-R151 VanDerWaalsContact C-N 3.31Å; Q149-R151 PolarHBondContact O-N 3.45Å; R151-T154 PolarHBondContact O-N 3.16Å; R151-L155 VanDerWaalsContact O-CB 3.31Å; R151-L155 WeakPolarHBondContact O-CB 3.39Å; R151-L155 PolarHBondContact O-N 2.98Å
152	L	63.3	Low	64.2	Low	124 Å²	124	104 Å²	104	65%	0.649	53%	0.533	S	S	*	.	H	α-helix	trans	-64.9	-41.2	176.8	-177.2	64.8	0	0	0	111.8	L148 Q149 L155 H156	L148-L152 WeakPolarHBondContact O-CB 3.32Å; L148-L152 PolarHBondContact O-N 2.9Å; Q149-L152 PolarHBondContact O-N 3.44Å; L152-L155 PolarHBondContact O-N 3.21Å; L152-H156 VanDerWaalsContact O-CB 3.28Å; L152-H156 WeakPolarHBondContact O-CB 3.07Å; L152-H156 PolarHBondContact O-N 2.86Å
153	E	64.1	Low	63.2	Low	109 Å²	109	104 Å²	104	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-63.7	-42.2	173.6	-73	172.2	-169.5	0	0	111.4	Q149 H156 L157	Q149-E153 PolarHBondContact NE2-OE1 2.92Å; Q149-E153 VanDerWaalsContact NE2-OE1 3.12Å; Q149-E153 WeakPolarHBondContact O-CG 3.43Å; Q149-E153 PolarHBondContact O-N 2.93Å; E153-H156 PolarHBondContact O-N 3.29Å; E153-L157 PolarHBondContact O-N 3.21Å
154	T	65	Low	62.1	Low	88 Å²	88	105.3 Å²	105.3	54%	0.54	54%	0.541	S	S	.	.	H	α-helix	trans	-64.4	-43.6	174.3	-54.6	0	0	0	0	111.3	G150 R151 H156 L157 V158	G150-T154 WeakPolarHBondContact O-CB 3.5Å; G150-T154 PolarHBondContact O-N 3.26Å; G150-T154 PolarHBondContact O-OG1 3.08Å; R151-T154 PolarHBondContact O-N 3.16Å; T154-H156 VanDerWaalsContact C-N 3.32Å; T154-H156 PolarHBondContact O-N 3.32Å; T154-L157 PolarHBondContact O-N 3.06Å; T154-V158 HydrophobicContact CG2-CG2 4.35Å; T154-V158 WeakPolarHBondContact O-CB 3.41Å; T154-V158 VanDerWaalsContact O-CG2 3.26Å; T154-V158 WeakPolarHBondContact O-CG2 3.42Å; T154-V158 PolarHBondContact O-N 3.05Å
155	L	59.3	Low	60.7	Low	122 Å²	122	105.3 Å²	105.3	64%	0.639	54%	0.54	S	S	*	.	H	α-helix	trans	-66.6	-35.3	178.1	-135.7	129.6	0	0	0	111	R151 L152 N159	R151-L155 VanDerWaalsContact O-CB 3.31Å; R151-L155 WeakPolarHBondContact O-CB 3.39Å; R151-L155 PolarHBondContact O-N 2.98Å; L152-L155 PolarHBondContact O-N 3.21Å; L155-N159 WeakPolarHBondContact O-CB 3.47Å; L155-N159 PolarHBondContact O-N 3.37Å
156	H	55.6	Low	59.7	Low	126 Å²	126	106.6 Å²	106.6	58%	0.583	54%	0.538	S	S	*	.	H	α-helix	trans	-68.1	-39	173.8	-169.8	-82.1	0	0	0	111.8	L152 E153 T154 M160	L152-H156 VanDerWaalsContact O-CB 3.28Å; L152-H156 WeakPolarHBondContact O-CB 3.07Å; L152-H156 PolarHBondContact O-N 2.86Å; E153-H156 PolarHBondContact O-N 3.29Å; T154-H156 VanDerWaalsContact C-N 3.32Å; T154-H156 PolarHBondContact O-N 3.32Å; H156-M160 WeakPolarHBondContact O-CB 3.43Å; H156-M160 VanDerWaalsContact O-CG 3.23Å; H156-M160 WeakPolarHBondContact O-CG 3.47Å; H156-M160 PolarHBondContact O-N 3.43Å
157	L	52.4	Low	59.5	Low	116 Å²	116	104.1 Å²	104.1	61%	0.607	53%	0.53	S	S	*	.	H	α-helix	trans	-65	-46.8	172.7	-116.4	106	0	0	0	112.1	E153 T154 M160 N161	E153-L157 PolarHBondContact O-N 3.21Å; T154-L157 PolarHBondContact O-N 3.06Å; L157-M160 PolarHBondContact O-N 2.96Å; L157-N161 VanDerWaalsContact O-CG 3.27Å; L157-N161 PolarHBondContact O-N 3.42Å; L157-N161 VanDerWaalsContact O-N 3.08Å; L157-N161 PolarHBondContact O-OD1 2.95Å
158	V	54.9	Low	58.7	Low	75 Å²	75	106.8 Å²	106.8	46%	0.455	54%	0.536	S	S	.	.	H	α-helix	trans	-69.9	-35.2	-179.5	175.7	0	0	0	0	111.5	T154 N161 N162	T154-V158 HydrophobicContact CG2-CG2 4.35Å; T154-V158 WeakPolarHBondContact O-CB 3.41Å; T154-V158 VanDerWaalsContact O-CG2 3.26Å; T154-V158 WeakPolarHBondContact O-CG2 3.42Å; T154-V158 PolarHBondContact O-N 3.05Å; V158-N161 PolarHBondContact O-N 2.88Å; V158-N162 PolarHBondContact O-N 3.35Å
159	N	54.4	Low	58	Low	96 Å²	96	106 Å²	106	51%	0.513	53%	0.532	S	S	.	.	H	α-helix	trans	-69.6	-36.9	175	-174.2	54.8	0	0	0	112.2	L155 N162 M163	L155-N159 WeakPolarHBondContact O-CB 3.47Å; L155-N159 PolarHBondContact O-N 3.37Å; N159-N162 PolarHBondContact O-N 3.49Å; N159-M163 WeakPolarHBondContact O-CB 3.26Å; N159-M163 PolarHBondContact O-N 3.39Å
160	M	50.2	Low	57.6	Low	102 Å²	102	105 Å²	105	50%	0.502	53%	0.526	S	S	.	.	H	α-helix	trans	-64	-42	171.6	-75.3	-68	-66.3	0	0	111.3	H156 L157 N162 M163 E164	H156-M160 WeakPolarHBondContact O-CB 3.43Å; H156-M160 VanDerWaalsContact O-CG 3.23Å; H156-M160 WeakPolarHBondContact O-CG 3.47Å; H156-M160 PolarHBondContact O-N 3.43Å; L157-M160 PolarHBondContact O-N 2.96Å; M160-N162 PolarHBondContact O-N 2.86Å; M160-M163 PolarHBondContact O-N 3.4Å; M160-E164 WeakPolarHBondContact O-CB 3.42Å; M160-E164 PolarHBondContact O-N 3.47Å
161	N	55.1	Low	57.3	Low	88 Å²	88	107.1 Å²	107.1	47%	0.471	53%	0.533	S	S	.	.	H	α-helix	trans	-64.6	-37.9	176.9	-65.9	-13.1	0	0	0	112.8	L157 V158 H165	L157-N161 VanDerWaalsContact O-CG 3.27Å; L157-N161 PolarHBondContact O-N 3.42Å; L157-N161 VanDerWaalsContact O-N 3.08Å; L157-N161 PolarHBondContact O-OD1 2.95Å; V158-N161 PolarHBondContact O-N 2.88Å; N161-H165 VanDerWaalsContact O-CB 3.29Å; N161-H165 WeakPolarHBondContact O-CB 3.39Å; N161-H165 PolarHBondContact O-N 3.28Å
162	N	55.7	Low	56.6	Low	114 Å²	114	101.4 Å²	101.4	61%	0.61	52%	0.524	S	S	*	.	H	α-helix	trans	-73.4	-34.2	178	-79.7	10.8	0	0	0	112.7	V158 N159 M160 Y166	V158-N162 PolarHBondContact O-N 3.35Å; N159-N162 PolarHBondContact O-N 3.49Å; M160-N162 PolarHBondContact O-N 2.86Å; N162-Y166 WeakPolarHBondContact O-CB 3.38Å; N162-Y166 PolarHBondContact O-N 3.12Å; N162-Y166 VanDerWaalsContact O-N 3.08Å
163	M	53.5	Low	55.9	Low	121 Å²	121	99.4 Å²	99.4	60%	0.596	51%	0.514	S	S	*	.	H	α-helix	trans	-76	-35	174.5	-163.1	171	-171	0	0	111.6	N159 M160 Y166 V167	N159-M163 WeakPolarHBondContact O-CB 3.26Å; N159-M163 PolarHBondContact O-N 3.39Å; M160-M163 PolarHBondContact O-N 3.4Å; M163-Y166 PolarHBondContact O-N 3.25Å; M163-V167 WeakPolarHBondContact O-CB 3.48Å; M163-V167 WeakPolarHBondContact O-CG2 3.45Å; M163-V167 PolarHBondContact O-N 3.02Å
164	E	54.1	Low	55.3	Low	108 Å²	108	99.5 Å²	99.5	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-65	-45.1	172.7	-169.3	166.4	-147.5	0	0	110.7	M160 Y166 V167 D168	M160-E164 WeakPolarHBondContact O-CB 3.42Å; M160-E164 PolarHBondContact O-N 3.47Å; E164-Y166 VanDerWaalsContact C-N 3.35Å; E164-Y166 PolarHBondContact O-N 3.28Å; E164-V167 PolarHBondContact O-N 2.74Å; E164-D168 VanDerWaalsContact O-CB 3.3Å; E164-D168 WeakPolarHBondContact O-CB 3.25Å; E164-D168 VanDerWaalsContact O-CG 3.32Å; E164-D168 PolarHBondContact O-N 3.42Å
165	H	51.3	Low	54.8	Low	140 Å²	140	98.6 Å²	98.6	65%	0.648	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-33.3	174.6	-163.1	-63.7	0	0	0	113	N161 D169	N161-H165 VanDerWaalsContact O-CB 3.29Å; N161-H165 WeakPolarHBondContact O-CB 3.39Å; N161-H165 PolarHBondContact O-N 3.28Å; H165-D169 WeakPolarHBondContact O-CB 3.23Å; H165-D169 PolarHBondContact O-N 3.5Å
166	Y	46.7	Very low	54.6	Low	143 Å²	143	99.8 Å²	99.8	56%	0.561	51%	0.512	S	S	*	.	H	α-helix	trans	-71.5	-39.6	174	-176	-97.1	0	0	0	111.7	N162 M163 E164 K170	N162-Y166 WeakPolarHBondContact O-CB 3.38Å; N162-Y166 PolarHBondContact O-N 3.12Å; N162-Y166 VanDerWaalsContact O-N 3.08Å; M163-Y166 PolarHBondContact O-N 3.25Å; E164-Y166 VanDerWaalsContact C-N 3.35Å; E164-Y166 PolarHBondContact O-N 3.28Å; Y166-K170 HydrophobicContact CD1-CG 4.31Å; Y166-K170 HydrophobicContact CE1-CG 4.04Å; Y166-K170 VanDerWaalsContact CZ-CE 3.46Å; Y166-K170 WeakPolarHBondContact O-CB 3.29Å; Y166-K170 WeakPolarHBondContact O-CG 3.43Å; Y166-K170 PolarHBondContact O-N 3.27Å; Y166-K170 VanDerWaalsContact OH-CE 3.27Å; Y166-K170 WeakPolarHBondContact OH-CE 3.35Å
167	V	58.8	Low	54.6	Low	57 Å²	57	97.1 Å²	97.1	35%	0.345	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-43.2	175.1	170.2	0	0	0	0	110.5	M163 E164 K170 V171	M163-V167 WeakPolarHBondContact O-CB 3.48Å; M163-V167 WeakPolarHBondContact O-CG2 3.45Å; M163-V167 PolarHBondContact O-N 3.02Å; E164-V167 PolarHBondContact O-N 2.74Å; V167-K170 CarbonylContact O-C 3.56Å; V167-K170 PolarHBondContact O-N 2.92Å; V167-V171 HydrophobicContact CG1-CG2 4.13Å; V167-V171 VanDerWaalsContact O-CB 3.3Å; V167-V171 WeakPolarHBondContact O-CB 3.45Å; V167-V171 WeakPolarHBondContact O-CG2 3.11Å; V167-V171 PolarHBondContact O-N 3.44Å
168	D	61.6	Low	54.8	Low	94 Å²	94	95.5 Å²	95.5	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-66.7	-39.4	177.4	-75.7	-13.5	0	0	0	112	E164 V171 A172	E164-D168 VanDerWaalsContact O-CB 3.3Å; E164-D168 WeakPolarHBondContact O-CB 3.25Å; E164-D168 VanDerWaalsContact O-CG 3.32Å; E164-D168 PolarHBondContact O-N 3.42Å; D168-V171 PolarHBondContact O-N 3.08Å; D168-A172 WeakPolarHBondContact O-CB 3.33Å; D168-A172 PolarHBondContact O-N 3.43Å
169	D	55.4	Low	54.8	Low	85 Å²	85	96.8 Å²	96.8	46%	0.455	50%	0.504	S	S	.	.	H	α-helix	trans	-63	-43.3	172.5	-177.1	69.5	0	0	0	111.3	H165 N173	H165-D169 WeakPolarHBondContact O-CB 3.23Å; H165-D169 PolarHBondContact O-N 3.5Å; D169-N173 VanDerWaalsContact O-CB 3.3Å; D169-N173 WeakPolarHBondContact O-CB 3.29Å; D169-N173 PolarHBondContact O-N 3Å
170	K	55.7	Low	54.5	Low	92 Å²	92	94.8 Å²	94.8	40%	0.4	50%	0.497	S	S	.	.	H	α-helix	trans	-68.5	-36.3	175.3	-68.5	-62.5	-179.8	-165.3	0	112.7	Y166 V167 N173 L174	Y166-K170 HydrophobicContact CD1-CG 4.31Å; Y166-K170 HydrophobicContact CE1-CG 4.04Å; Y166-K170 VanDerWaalsContact CZ-CE 3.46Å; Y166-K170 WeakPolarHBondContact O-CB 3.29Å; Y166-K170 WeakPolarHBondContact O-CG 3.43Å; Y166-K170 PolarHBondContact O-N 3.27Å; Y166-K170 VanDerWaalsContact OH-CE 3.27Å; Y166-K170 WeakPolarHBondContact OH-CE 3.35Å; V167-K170 CarbonylContact O-C 3.56Å; V167-K170 PolarHBondContact O-N 2.92Å; K170-N173 PolarHBondContact O-N 2.94Å; K170-L174 WeakPolarHBondContact O-CB 3.37Å; K170-L174 PolarHBondContact O-N 3.06Å
171	V	62.4	Low	54.5	Low	72 Å²	72	95 Å²	95	44%	0.436	50%	0.5	S	S	.	.	H	α-helix	trans	-70.8	-39.6	176.3	168	0	0	0	0	110.9	V167 D168 N173 L174 T175	V167-V171 HydrophobicContact CG1-CG2 4.13Å; V167-V171 VanDerWaalsContact O-CB 3.3Å; V167-V171 WeakPolarHBondContact O-CB 3.45Å; V167-V171 WeakPolarHBondContact O-CG2 3.11Å; V167-V171 PolarHBondContact O-N 3.44Å; D168-V171 PolarHBondContact O-N 3.08Å; V171-N173 VanDerWaalsContact C-N 3.32Å; V171-L174 PolarHBondContact O-N 3.24Å; V171-T175 WeakPolarHBondContact O-CB 3.41Å; V171-T175 PolarHBondContact O-N 2.83Å; V171-T175 PolarHBondContact O-OG1 3.34Å
172	A	59	Low	54.1	Low	58 Å²	58	96.5 Å²	96.5	48%	0.479	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-40.3	172.7	0	0	0	0	0	111	D168 T175 F176	D168-A172 WeakPolarHBondContact O-CB 3.33Å; D168-A172 PolarHBondContact O-N 3.43Å; A172-T175 PolarHBondContact O-N 2.89Å; A172-F176 WeakPolarHBondContact O-CB 3.2Å; A172-F176 PolarHBondContact O-N 3.39Å
173	N	49.7	Very low	53.7	Low	81 Å²	81	93.7 Å²	93.7	43%	0.433	51%	0.506	S	S	.	.	H	α-helix	trans	-68.1	-38.8	175.3	-151	-11.8	0	0	0	111.9	D169 K170 V171 F176 V177	D169-N173 VanDerWaalsContact O-CB 3.3Å; D169-N173 WeakPolarHBondContact O-CB 3.29Å; D169-N173 PolarHBondContact O-N 3Å; K170-N173 PolarHBondContact O-N 2.94Å; V171-N173 VanDerWaalsContact C-N 3.32Å; N173-F176 WeakPolarHBondContact O-CB 3.48Å; N173-F176 PolarHBondContact O-N 3.39Å; N173-V177 VanDerWaalsContact O-CG2 3.27Å; N173-V177 WeakPolarHBondContact O-CG2 3.31Å; N173-V177 PolarHBondContact O-N 3.23Å
174	L	51.2	Low	53.4	Low	111 Å²	111	96 Å²	96	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-63.2	-41.4	170.7	-102.5	139	0	0	0	112.1	K170 V171 F176 V177 V178	K170-L174 WeakPolarHBondContact O-CB 3.37Å; K170-L174 PolarHBondContact O-N 3.06Å; V171-L174 PolarHBondContact O-N 3.24Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 2.81Å; L174-V177 PolarHBondContact O-N 2.95Å; L174-V178 WeakPolarHBondContact O-CB 3.32Å; L174-V178 WeakPolarHBondContact O-CG2 3.38Å; L174-V178 PolarHBondContact O-N 3.28Å
175	T	54.6	Low	52.9	Low	70 Å²	70	95.7 Å²	95.7	43%	0.429	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-39.5	176.1	-54.4	0	0	0	0	110.5	V171 A172 N179	V171-T175 WeakPolarHBondContact O-CB 3.41Å; V171-T175 PolarHBondContact O-N 2.83Å; V171-T175 PolarHBondContact O-OG1 3.34Å; A172-T175 PolarHBondContact O-N 2.89Å; T175-N179 WeakPolarHBondContact O-CB 3.46Å; T175-N179 PolarHBondContact O-N 3.46Å; T175-N179 PolarHBondContact O-ND2 3.44Å
176	F	53.4	Low	52.7	Low	146 Å²	146	93.1 Å²	93.1	64%	0.64	52%	0.519	S	S	*	.	H	α-helix	trans	-65.3	-43.1	173.7	-177.3	-97.2	0	0	0	112.5	A172 N173 L174 N179 S180	A172-F176 WeakPolarHBondContact O-CB 3.2Å; A172-F176 PolarHBondContact O-N 3.39Å; N173-F176 WeakPolarHBondContact O-CB 3.48Å; N173-F176 PolarHBondContact O-N 3.39Å; L174-F176 VanDerWaalsContact C-N 3.31Å; L174-F176 PolarHBondContact O-N 2.81Å; F176-N179 PolarHBondContact O-N 3.26Å; F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.39Å; F176-S180 PolarHBondContact O-N 3.04Å
177	V	56.3	Low	52.4	Low	71 Å²	71	95.8 Å²	95.8	43%	0.43	53%	0.534	S	S	.	.	H	α-helix	trans	-66.2	-41.2	176.3	171.5	0	0	0	0	111.4	N173 L174 S180 L181	N173-V177 VanDerWaalsContact O-CG2 3.27Å; N173-V177 WeakPolarHBondContact O-CG2 3.31Å; N173-V177 PolarHBondContact O-N 3.23Å; L174-V177 PolarHBondContact O-N 2.95Å; V177-S180 CarbonylContact O-C 3.59Å; V177-S180 PolarHBondContact O-N 3.49Å; V177-L181 HydrophobicContact CG1-CD1 3.86Å; V177-L181 HydrophobicContact CG1-CG 4.5Å; V177-L181 WeakPolarHBondContact O-CB 3.49Å; V177-L181 WeakPolarHBondContact O-CD1 3.34Å; V177-L181 VanDerWaalsContact O-CG 3.27Å; V177-L181 WeakPolarHBondContact O-CG 3.27Å; V177-L181 PolarHBondContact O-N 2.86Å
178	V	57.9	Low	51.4	Low	82 Å²	82	98.3 Å²	98.3	50%	0.497	55%	0.553	S	S	.	*	H	α-helix	trans	-63.2	-46.1	175.2	169.2	0	0	0	0	110.8	L174 S180 L181 D182	L174-V178 WeakPolarHBondContact O-CB 3.32Å; L174-V178 WeakPolarHBondContact O-CG2 3.38Å; L174-V178 PolarHBondContact O-N 3.28Å; V178-S180 VanDerWaalsContact C-N 3.29Å; V178-S180 PolarHBondContact O-N 3.3Å; V178-L181 PolarHBondContact O-N 3.46Å; V178-L181 VanDerWaalsContact O-N 3.11Å; V178-D182 WeakPolarHBondContact O-CB 3.49Å; V178-D182 PolarHBondContact O-N 3.1Å
179	N	53.1	Low	50.3	Low	102 Å²	102	100.6 Å²	100.6	55%	0.545	57%	0.573	S	S	.	*	H	α-helix	trans	-65.1	-33.1	175.7	-68.3	-18.8	0	0	0	112.2	T175 F176 L181 G183	T175-N179 WeakPolarHBondContact O-CB 3.46Å; T175-N179 PolarHBondContact O-N 3.46Å; T175-N179 PolarHBondContact O-ND2 3.44Å; F176-N179 PolarHBondContact O-N 3.26Å; N179-L181 VanDerWaalsContact C-N 3.34Å; N179-G183 PolarHBondContact O-N 3.27Å; N179-G183 VanDerWaalsContact O-N 3.17Å
180	S	48.3	Very low	49.6	Very low	53 Å²	53	99.6 Å²	99.6	37%	0.371	58%	0.583	S	S	.	*	H	α-helix	trans	-73	-24.3	173.8	-178.4	0	0	0	0	113.2	F176 V177 V178 K184	F176-S180 VanDerWaalsContact O-CB 3.32Å; F176-S180 WeakPolarHBondContact O-CB 3.39Å; F176-S180 PolarHBondContact O-N 3.04Å; V177-S180 CarbonylContact O-C 3.59Å; V177-S180 PolarHBondContact O-N 3.49Å; V178-S180 VanDerWaalsContact C-N 3.29Å; V178-S180 PolarHBondContact O-N 3.3Å; S180-K184 WeakPolarHBondContact O-CG 3.46Å
181	L	50.7	Low	48.8	Very low	107 Å²	107	104.8 Å²	104.8	56%	0.56	61%	0.608	S	S	*	*	H	α-helix	trans	-82.3	-38.1	174.1	-75.1	163.1	0	0	0	110.9	V177 V178 N179 G183 K184 C185	V177-L181 HydrophobicContact CG1-CD1 3.86Å; V177-L181 HydrophobicContact CG1-CG 4.5Å; V177-L181 WeakPolarHBondContact O-CB 3.49Å; V177-L181 WeakPolarHBondContact O-CD1 3.34Å; V177-L181 VanDerWaalsContact O-CG 3.27Å; V177-L181 WeakPolarHBondContact O-CG 3.27Å; V177-L181 PolarHBondContact O-N 2.86Å; V178-L181 PolarHBondContact O-N 3.46Å; V178-L181 VanDerWaalsContact O-N 3.11Å; N179-L181 VanDerWaalsContact C-N 3.34Å; L181-G183 VanDerWaalsContact C-N 3.34Å; L181-G183 PolarHBondContact O-N 3.01Å; L181-K184 PolarHBondContact O-N 3.34Å; L181-C185 PolarHBondContact O-N 2.68Å
182	D	46.3	Very low	47.4	Very low	119 Å²	119	110.1 Å²	110.1	64%	0.636	63%	0.629	S	S	*	*	H	α-helix	trans	-60.6	-41.2	174.7	-167.8	54.2	0	0	0	112	V178 K184 C185 S186	V178-D182 WeakPolarHBondContact O-CB 3.49Å; V178-D182 PolarHBondContact O-N 3.1Å; D182-K184 VanDerWaalsContact C-N 3.27Å; D182-K184 PolarHBondContact O-N 2.96Å; D182-C185 PolarHBondContact O-N 3.02Å; D182-S186 PolarHBondContact O-OG 3.41Å
183	G	48	Very low	46.3	Very low	56 Å²	56	112.9 Å²	112.9	58%	0.577	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-13.3	173.5	0	0	0	0	0	115.5	N179 L181 S186	N179-G183 PolarHBondContact O-N 3.27Å; N179-G183 VanDerWaalsContact O-N 3.17Å; L181-G183 VanDerWaalsContact C-N 3.34Å; L181-G183 PolarHBondContact O-N 3.01Å; G183-S186 PolarHBondContact O-OG 3.5Å
184	K	46.9	Very low	45.6	Very low	168 Å²	168	115.3 Å²	115.3	73%	0.73	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	-21.5	177.1	-75.7	179.7	179.5	177	0	113	S180 L181 D182 S186	S180-K184 WeakPolarHBondContact O-CG 3.46Å; L181-K184 PolarHBondContact O-N 3.34Å; D182-K184 VanDerWaalsContact C-N 3.27Å; D182-K184 PolarHBondContact O-N 2.96Å; K184-S186 VanDerWaalsContact C-N 3.34Å
185	C	44.6	Very low	45	Very low	102 Å²	102	119.3 Å²	119.3	69%	0.689	68%	0.678	S	S	*	*	S	Bend	trans	-88.4	5.7	178.6	-113.6	0	0	0	0	114.2	L181 D182 K187	L181-C185 PolarHBondContact O-N 2.68Å; D182-C185 PolarHBondContact O-N 3.02Å; C185-K187 VanDerWaalsContact C-N 3.28Å; C185-K187 PolarHBondContact O-N 3.2Å
186	S	46	Very low	44.2	Very low	86 Å²	86	121.2 Å²	121.2	60%	0.601	69%	0.694	S	S	*	*			trans	-83.4	11.2	-172	-4.9	0	0	0	0	115	D182 G183 K184	D182-S186 PolarHBondContact O-OG 3.41Å; G183-S186 PolarHBondContact O-OG 3.5Å; K184-S186 VanDerWaalsContact C-N 3.34Å
187	K	41.1	Very low	43.3	Very low	199 Å²	199	121.9 Å²	121.9	87%	0.865	70%	0.699	S	S	*	*			trans	-128	68.6	175.1	-75.4	-172	179.2	-179.9	0	111.8	C185	C185-K187 VanDerWaalsContact C-N 3.28Å; C185-K187 PolarHBondContact O-N 3.2Å
188	C	37.8	Very low	42.4	Very low	111 Å²	111	124.4 Å²	124.4	75%	0.75	72%	0.717	S	S	*	*			trans	-101.9	117.9	154.7	-69.2	0	0	0	0	107.6	G190	C188-G190 PolarHBondContact O-N 2.77Å
189	P	37.6	Very low	41.4	Very low	141 Å²	141	126.3 Å²	126.3	92%	0.916	73%	0.729	S	S	*	*			trans	-77.9	103.3	177.1	29.7	-29.3	0	0	0	109.2
190	G	40.4	Very low	40.8	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	74%	0.739	S	S	*	*			trans	143.7	80.7	166.1	0	0	0	0	0	114	C188	C188-G190 PolarHBondContact O-N 2.77Å
191	Q	39.2	Very low	40.9	Very low	200 Å²	200	134.4 Å²	134.4	94%	0.935	76%	0.757	S	S	*	*				177.4	142.5	127.8	-99.1	172.3	-25.1	0	0	110.8
192	E	33.4	Very low	41.6	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.864	75%	0.754	S	S	*	*			trans	-63.5	152.2	-169	-67.2	170.7	147.3	0	0	113.8	T194	E192-T194 PolarHBondContact O-N 3.05Å; E192-T194 VanDerWaalsContact O-N 3.15Å
193	S	36.3	Very low	43.4	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	74%	0.74	S	S	*	*			trans	-52.9	108.9	179	53.5	0	0	0	0	113.4
194	T	34.4	Very low	45.6	Very low	131 Å²	131	131.3 Å²	131.3	80%	0.804	72%	0.723	S	S	*	*			trans	-111.2	118	139.9	23.6	0	0	0	0	106.6	E192 S196	E192-T194 PolarHBondContact O-N 3.05Å; E192-T194 VanDerWaalsContact O-N 3.15Å; T194-S196 VanDerWaalsContact C-N 3.25Å; T194-S196 PolarHBondContact O-N 3.3Å
195	Q	39.6	Very low	47.9	Very low	196 Å²	196	126.5 Å²	126.5	92%	0.916	70%	0.702	S	S	*	*			trans	-62.3	88.3	173.8	-74.7	177.8	-9.9	0	0	108.8	Q197	Q195-Q197 PolarHBondContact O-N 2.81Å; Q195-Q197 VanDerWaalsContact O-N 3.15Å
196	S	36.5	Very low	50.3	Low	110 Å²	110	121.8 Å²	121.8	77%	0.769	67%	0.67	S	S	*	*			trans	-73.9	99.7	161.5	54.4	0	0	0	0	106.8	T194	T194-S196 VanDerWaalsContact C-N 3.25Å; T194-S196 PolarHBondContact O-N 3.3Å
197	Q	35.6	Very low	52.8	Low	160 Å²	160	117.7 Å²	117.7	75%	0.748	64%	0.641	S	S	*	*			trans	-49.1	139.1	160.1	-77.7	179.8	-29.1	0	0	108.1	Q195 V199	Q195-Q197 PolarHBondContact O-N 2.81Å; Q195-Q197 VanDerWaalsContact O-N 3.15Å; Q197-V199 VanDerWaalsContact C-N 3.35Å; Q197-V199 PolarHBondContact O-N 2.99Å
198	P	35.9	Very low	55.4	Low	123 Å²	123	108.4 Å²	108.4	80%	0.799	60%	0.602	S	S	*	*			trans	-62.9	104.6	170.7	26.3	-29.8	0	0	0	106.3	Q200	P198-Q200 PolarHBondContact O-N 3.27Å
199	V	36.8	Very low	58.2	Low	123 Å²	123	104.8 Å²	104.8	75%	0.745	58%	0.575	S	S	*	*			trans	-70	85	169.3	-174.2	0	0	0	0	105.1	Q197 H201	Q197-V199 VanDerWaalsContact C-N 3.35Å; Q197-V199 PolarHBondContact O-N 2.99Å; V199-H201 PolarHBondContact O-N 2.84Å
200	Q	41.7	Very low	60.9	Low	165 Å²	165	99.7 Å²	99.7	77%	0.771	54%	0.537	S	S	*	.			trans	-54.4	104.2	154.5	-92.4	179.3	-10.5	0	0	104.6	P198 L202	P198-Q200 PolarHBondContact O-N 3.27Å; Q200-L202 PolarHBondContact O-N 2.87Å
201	H	50.3	Low	63.6	Low	159 Å²	159	97.8 Å²	97.8	74%	0.736	51%	0.51	S	S	*	.			trans	-65	93.7	174.9	-152.3	69.4	0	0	0	105.4	V199 I203	V199-H201 PolarHBondContact O-N 2.84Å; H201-I203 WeakPolarHBondContact O-CG1 3.37Å; H201-I203 PolarHBondContact O-N 3.48Å
202	L	64.8	Low	66.1	Low	94 Å²	94	94.2 Å²	94.2	49%	0.492	50%	0.495	S	S	.	.			trans	-71.6	105.8	-176.7	-151.8	74.8	0	0	0	106.4	Q200 Y204 I213	Q200-L202 PolarHBondContact O-N 2.87Å; L202-Y204 HydrophobicContact CB-CE1 4.4Å; L202-Y204 HydrophobicContact CB-CE2 4.46Å; L202-Y204 HydrophobicContact CD2-CE1 3.71Å; L202-Y204 HydrophobicContact CG-CE1 4.26Å; L202-Y204 WeakPolarHBondContact O-CD2 3.37Å; L202-Y204 VanDerWaalsContact O-CE2 3.25Å; L202-Y204 WeakPolarHBondContact O-CE2 3.29Å; L202-Y204 PolarHBondContact O-N 3.21Å; L202-I213 HydrophobicContact CD2-CG2 4.25Å
203	I	85.3	Confident	68.9	Low	69 Å²	69	89.2 Å²	89.2	35%	0.354	47%	0.473	S	S	.	.			trans	-85.5	104.2	-175.3	-58.2	177.7	0	0	0	108.4	H201 K205 T224 H227	H201-I203 WeakPolarHBondContact O-CG1 3.37Å; H201-I203 PolarHBondContact O-N 3.48Å; I203-K205 PolarHBondContact O-N 2.87Å; I203-T224 HydrophobicContact CG2-CG2 4.02Å; I203-H227 VanDerWaalsContact CD1-CE1 3.42Å; I203-H227 WeakPolarHBondContact CD1-CE1 3.32Å; I203-H227 WeakPolarHBondContact CD1-ND1 3.46Å; I203-H227 WeakPolarHBondContact CG2-CE1 3.33Å
204	Y	93.3	Very high	71.6	Confident	54 Å²	54	85.8 Å²	85.8	21%	0.212	46%	0.457	C	S	.	.			trans	-76.9	119.7	175.3	-50.8	-75.7	0	0	0	109.8	L202 D209 Y210 I213 V223 T224	L202-Y204 HydrophobicContact CB-CE1 4.4Å; L202-Y204 HydrophobicContact CB-CE2 4.46Å; L202-Y204 HydrophobicContact CD2-CE1 3.71Å; L202-Y204 HydrophobicContact CG-CE1 4.26Å; L202-Y204 WeakPolarHBondContact O-CD2 3.37Å; L202-Y204 VanDerWaalsContact O-CE2 3.25Å; L202-Y204 WeakPolarHBondContact O-CE2 3.29Å; L202-Y204 PolarHBondContact O-N 3.21Å; Y204-D209 HydrophobicContact CD1-CB 3.93Å; Y204-Y210 VanDerWaalsContact CB-CE2 3.44Å; Y204-Y210 HydrophobicContact CD1-CD1 4.22Å; Y204-Y210 HydrophobicContact CD1-CE1 4.23Å; Y204-Y210 HydrophobicContact CD1-CG 4.41Å; Y204-Y210 HydrophobicContact CD2-CD1 4.27Å; Y204-Y210 AromaticContact CD2-CE1 3.48Å; Y204-Y210 HydrophobicContact CD2-CE1 3.48Å; Y204-Y210 VanDerWaalsContact CD2-CE1 3.48Å; Y204-Y210 HydrophobicContact CD2-CE2 4.02Å; Y204-Y210 AromaticContact CD2-CZ 3.34Å; Y204-Y210 WeakPolarHBondContact CD2-OH 3.34Å; Y204-Y210 HydrophobicContact CE1-CD1 4.44Å; Y204-Y210 HydrophobicContact CE1-CE1 4.45Å; Y204-Y210 HydrophobicContact CE2-CD1 4.5Å; Y204-Y210 AromaticContact CE2-CE1 3.76Å; Y204-Y210 HydrophobicContact CE2-CE1 3.76Å; Y204-Y210 HydrophobicContact CG-CD1 4.13Å; Y204-Y210 HydrophobicContact CG-CD2 4.16Å; Y204-Y210 AromaticContact CG-CE1 3.75Å; Y204-Y210 HydrophobicContact CG-CE1 3.75Å; Y204-Y210 AromaticContact CG-CE2 3.78Å; Y204-Y210 HydrophobicContact CG-CE2 3.78Å; Y204-Y210 HydrophobicContact CG-CG 4.34Å; Y204-Y210 AromaticContact CG-CZ 3.57Å; Y204-I213 HydrophobicContact CE1-CD1 3.55Å; Y204-I213 HydrophobicContact CE1-CG1 4.14Å; Y204-I213 HydrophobicContact CE1-CG2 4.18Å; Y204-I213 WeakPolarHBondContact OH-CD1 3.34Å; Y204-V223 CarbonylContact O-C 3.43Å; Y204-V223 WeakPolarHBondContact O-CA 3.28Å; Y204-T224 PolarHBondContact O-N 2.67Å
205	K	94.4	Very high	74.5	Confident	68 Å²	68	84.4 Å²	84.4	30%	0.296	44%	0.44	S	S	.	.			trans	-85.6	-30.2	-176	-62.9	-176.6	174.9	-173.3	0	112.5	I203 D209 P225	I203-K205 PolarHBondContact O-N 2.87Å; K205-D209 WeakPolarHBondContact CA-OD2 3.38Å; K205-D209 VanDerWaalsContact CB-OD2 3.31Å; K205-D209 WeakPolarHBondContact CB-OD2 3.37Å; K205-D209 PolarHBondContact N-OD2 3.03Å; K205-P225 WeakPolarHBondContact O-CG 3.12Å
206	D	96.7	Very high	77.1	Confident	2 Å²	2	80.4 Å²	80.4	1%	0.011	42%	0.416	C	S	.	.	S	Bend	trans	-156.6	179.1	-179	61.4	60	0	0	0	111.1	S208 D209 L286 K290	D206-S208 PolarHBondContact O-N 3.5Å; D206-S208 WeakPolarHBondContact OD1-CA 3.41Å; D206-S208 WeakPolarHBondContact OD1-CB 3.45Å; D206-S208 PolarHBondContact OD1-N 2.86Å; D206-S208 PolarHBondContact OD1-OG 2.97Å; D206-D209 PolarHBondContact O-N 3.38Å; D206-D209 PolarHBondContact OD1-N 3.39Å; D206-L286 HydrophobicContact CB-CD2 4.12Å; D206-K290 IonicContact OD1-NZ 3.94Å; D206-K290 IonicContact OD2-NZ 3.42Å; D206-K290 PolarHBondContact OD2-NZ 3.38Å
207	C	97.6	Very high	80	Confident	0 Å²	0	77.8 Å²	77.8	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-63.3	-24.4	-179.7	-63.6	0	0	0	0	114.4	D209 Y210 Y211 C236 M238 W245 T246	C207-D209 VanDerWaalsContact C-N 3.33Å; C207-Y210 PolarHBondContact O-N 3.43Å; C207-Y211 PolarHBondContact O-N 2.78Å; C207-C236 VanDerWaalsContact CA-SG 3.57Å; C207-C236 HydrophobicContact CB-CB 3.6Å; C207-C236 WeakPolarHBondContact CB-SG 3.44Å; C207-C236 WeakPolarHBondContact SG-CA 3.48Å; C207-C236 WeakPolarHBondContact SG-CB 3.29Å; C207-C236 CovalentContact SG-SG 2.02Å; C207-C236 PolarHBondContact SG-SG 3.28Å; C207-M238 HydrophobicContact CB-CE 4.32Å; C207-M238 WeakPolarHBondContact O-CE 3.32Å; C207-W245 PolarHBondContact SG-O 3.1Å; C207-T246 WeakPolarHBondContact CB-OG1 3.43Å; C207-T246 PolarHBondContact N-OG1 3.3Å; C207-T246 VanDerWaalsContact SG-CA 3.53Å; C207-T246 PolarHBondContact SG-OG1 3.45Å
208	S	96.8	Very high	83	Confident	5 Å²	5	71.5 Å²	71.5	4%	0.035	37%	0.372	C	S	.	.	H	α-helix	trans	-70.2	-32.6	179.1	78.2	0	0	0	0	111.8	D206 Y210 Y211 M212 G244 P428	D206-S208 PolarHBondContact O-N 3.5Å; D206-S208 WeakPolarHBondContact OD1-CA 3.41Å; D206-S208 WeakPolarHBondContact OD1-CB 3.45Å; D206-S208 PolarHBondContact OD1-N 2.86Å; D206-S208 PolarHBondContact OD1-OG 2.97Å; S208-Y210 VanDerWaalsContact C-N 3.33Å; S208-Y210 PolarHBondContact O-N 3.29Å; S208-Y211 WeakPolarHBondContact O-CB 3.44Å; S208-Y211 PolarHBondContact O-N 3.27Å; S208-Y211 VanDerWaalsContact O-N 3.13Å; S208-M212 WeakPolarHBondContact O-CG 3.33Å; S208-M212 PolarHBondContact O-N 3.13Å; S208-G244 PolarHBondContact N-O 3.32Å; S208-P428 WeakPolarHBondContact OG-CD 3.33Å; S208-P428 WeakPolarHBondContact OG-CG 3.22Å
209	D	95.3	Very high	85.9	Confident	35 Å²	35	69.9 Å²	69.9	19%	0.187	35%	0.353	C	S	.	.	H	α-helix	trans	-65.6	-38.9	176.1	-61.8	-23.9	0	0	0	110.9	Y204 K205 D206 C207 Y211 M212 I213 K290	Y204-D209 HydrophobicContact CD1-CB 3.93Å; K205-D209 WeakPolarHBondContact CA-OD2 3.38Å; K205-D209 VanDerWaalsContact CB-OD2 3.31Å; K205-D209 WeakPolarHBondContact CB-OD2 3.37Å; K205-D209 PolarHBondContact N-OD2 3.03Å; D206-D209 PolarHBondContact O-N 3.38Å; D206-D209 PolarHBondContact OD1-N 3.39Å; C207-D209 VanDerWaalsContact C-N 3.33Å; D209-Y211 VanDerWaalsContact C-N 3.33Å; D209-M212 PolarHBondContact O-N 3Å; D209-I213 PolarHBondContact O-N 2.9Å; D209-K290 IonicContact OD1-NZ 3.65Å; D209-K290 PolarHBondContact OD1-NZ 3.33Å; D209-K290 IonicContact OD2-NZ 3.03Å; D209-K290 PolarHBondContact OD2-NZ 2.91Å
210	Y	95.5	Very high	88.8	Confident	33 Å²	33	66.3 Å²	66.3	13%	0.129	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-39.3	171.6	-79.8	-70.2	0	0	0	112.2	Y204 C207 S208 I213 K215 Y221 R222 V223	Y204-Y210 VanDerWaalsContact CB-CE2 3.44Å; Y204-Y210 HydrophobicContact CD1-CD1 4.22Å; Y204-Y210 HydrophobicContact CD1-CE1 4.23Å; Y204-Y210 HydrophobicContact CD1-CG 4.41Å; Y204-Y210 HydrophobicContact CD2-CD1 4.27Å; Y204-Y210 AromaticContact CD2-CE1 3.48Å; Y204-Y210 HydrophobicContact CD2-CE1 3.48Å; Y204-Y210 VanDerWaalsContact CD2-CE1 3.48Å; Y204-Y210 HydrophobicContact CD2-CE2 4.02Å; Y204-Y210 AromaticContact CD2-CZ 3.34Å; Y204-Y210 WeakPolarHBondContact CD2-OH 3.34Å; Y204-Y210 HydrophobicContact CE1-CD1 4.44Å; Y204-Y210 HydrophobicContact CE1-CE1 4.45Å; Y204-Y210 HydrophobicContact CE2-CD1 4.5Å; Y204-Y210 AromaticContact CE2-CE1 3.76Å; Y204-Y210 HydrophobicContact CE2-CE1 3.76Å; Y204-Y210 HydrophobicContact CG-CD1 4.13Å; Y204-Y210 HydrophobicContact CG-CD2 4.16Å; Y204-Y210 AromaticContact CG-CE1 3.75Å; Y204-Y210 HydrophobicContact CG-CE1 3.75Å; Y204-Y210 AromaticContact CG-CE2 3.78Å; Y204-Y210 HydrophobicContact CG-CE2 3.78Å; Y204-Y210 HydrophobicContact CG-CG 4.34Å; Y204-Y210 AromaticContact CG-CZ 3.57Å; C207-Y210 PolarHBondContact O-N 3.43Å; S208-Y210 VanDerWaalsContact C-N 3.33Å; S208-Y210 PolarHBondContact O-N 3.29Å; Y210-I213 HydrophobicContact CD1-CD1 4.31Å; Y210-I213 WeakPolarHBondContact O-CG1 3.45Å; Y210-I213 PolarHBondContact O-N 3.4Å; Y210-K215 HydrophobicContact CD1-CG 4.14Å; Y210-K215 VanDerWaalsContact O-CB 3.28Å; Y210-K215 WeakPolarHBondContact O-CB 3.47Å; Y210-K215 PolarHBondContact O-N 2.5Å; Y210-K215 VanDerWaalsContact O-N 3.08Å; Y210-Y221 AromaticContact CD1-CD1 3.6Å; Y210-Y221 HydrophobicContact CD1-CD1 3.6Å; Y210-Y221 AromaticContact CD1-CE1 3.91Å; Y210-Y221 HydrophobicContact CD1-CE1 3.91Å; Y210-Y221 AromaticContact CD2-CD1 3.76Å; Y210-Y221 HydrophobicContact CD2-CD1 3.76Å; Y210-Y221 HydrophobicContact CD2-CG 4.08Å; Y210-Y221 AromaticContact CE1-CD1 3.77Å; Y210-Y221 HydrophobicContact CE1-CD1 3.77Å; Y210-Y221 HydrophobicContact CE1-CE1 4.4Å; Y210-Y221 AromaticContact CE2-CD1 3.92Å; Y210-Y221 HydrophobicContact CE2-CD1 3.92Å; Y210-Y221 HydrophobicContact CE2-CG 4.21Å; Y210-Y221 AromaticContact CG-CD1 3.57Å; Y210-Y221 HydrophobicContact CG-CD1 3.57Å; Y210-Y221 HydrophobicContact CG-CE1 4.01Å; Y210-Y221 HydrophobicContact CG-CG 4.29Å; Y210-Y221 AromaticContact CZ-CD1 3.91Å; Y210-R222 WeakPolarHBondContact CE2-O 3.16Å; Y210-R222 PolarHBondContact OH-O 2.9Å; Y210-V223 HydrophobicContact CE2-CG1 4.15Å
211	Y	95.6	Very high	91.5	Very high	25 Å²	25	59.3 Å²	59.3	10%	0.098	30%	0.298	C	S	.	.	H	α-helix	trans	-64	-40.9	175.6	-161.5	-84.6	0	0	0	111.7	C207 S208 D209 I213 G214 R216 M238 G242 F431 P433	C207-Y211 PolarHBondContact O-N 2.78Å; S208-Y211 WeakPolarHBondContact O-CB 3.44Å; S208-Y211 PolarHBondContact O-N 3.27Å; S208-Y211 VanDerWaalsContact O-N 3.13Å; D209-Y211 VanDerWaalsContact C-N 3.33Å; Y211-I213 PolarHBondContact O-N 3.47Å; Y211-G214 PolarHBondContact O-N 3.48Å; Y211-R216 VanDerWaalsContact CE1-CZ 3.47Å; Y211-R216 PolarHBondContact O-NH1 3.22Å; Y211-R216 PolarHBondContact O-NH2 3.07Å; Y211-M238 HydrophobicContact CD2-CB 4.4Å; Y211-M238 HydrophobicContact CD2-SD 3.81Å; Y211-M238 WeakPolarHBondContact CE2-O 3.34Å; Y211-G242 WeakPolarHBondContact CE2-O 3.2Å; Y211-G242 PolarHBondContact OH-O 3.33Å; Y211-F431 HydrophobicContact CD1-CE2 4.18Å; Y211-F431 AromaticContact CD1-CZ 3.59Å; Y211-F431 HydrophobicContact CD1-CZ 3.59Å; Y211-F431 HydrophobicContact CE1-CZ 4.15Å; Y211-F431 AromaticContact CG-CZ 4Å; Y211-F431 HydrophobicContact CG-CZ 4Å; Y211-P433 WeakPolarHBondContact CE1-OXT 3.17Å
212	M	92.8	Very high	93.7	Very high	126 Å²	126	58.4 Å²	58.4	62%	0.621	29%	0.288	S	S	*	.	H	α-helix	trans	-62.1	-30	179.5	-71.2	-56.8	-59.5	0	0	113.4	S208 D209 G214 F431	S208-M212 WeakPolarHBondContact O-CG 3.33Å; S208-M212 PolarHBondContact O-N 3.13Å; D209-M212 PolarHBondContact O-N 3Å; M212-G214 VanDerWaalsContact C-N 3.29Å; M212-G214 PolarHBondContact O-N 3.08Å; M212-F431 HydrophobicContact CG-CE2 4.41Å; M212-F431 HydrophobicContact SD-CE2 4.13Å
213	I	92.4	Very high	95.3	Very high	79 Å²	79	53.9 Å²	53.9	41%	0.405	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	12.6	176.9	65.7	154.4	0	0	0	113.9	L202 Y204 D209 Y210 Y211 K215	L202-I213 HydrophobicContact CD2-CG2 4.25Å; Y204-I213 HydrophobicContact CE1-CD1 3.55Å; Y204-I213 HydrophobicContact CE1-CG1 4.14Å; Y204-I213 HydrophobicContact CE1-CG2 4.18Å; Y204-I213 WeakPolarHBondContact OH-CD1 3.34Å; D209-I213 PolarHBondContact O-N 2.9Å; Y210-I213 HydrophobicContact CD1-CD1 4.31Å; Y210-I213 WeakPolarHBondContact O-CG1 3.45Å; Y210-I213 PolarHBondContact O-N 3.4Å; Y211-I213 PolarHBondContact O-N 3.47Å; I213-K215 HydrophobicContact CD1-CG 4.17Å; I213-K215 HydrophobicContact CG1-CG 4.21Å
214	G	93.2	Very high	95.7	Very high	45 Å²	45	51.6 Å²	51.6	46%	0.464	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.3	8.9	174.3	0	0	0	0	0	115.8	Y211 M212 R216	Y211-G214 PolarHBondContact O-N 3.48Å; M212-G214 VanDerWaalsContact C-N 3.29Å; M212-G214 PolarHBondContact O-N 3.08Å; G214-R216 VanDerWaalsContact C-NH1 3.28Å; G214-R216 VanDerWaalsContact CA-NH1 3.33Å
215	K	94.6	Very high	95.7	Very high	102 Å²	102	49.3 Å²	49.3	44%	0.443	25%	0.246	S	C	.	.			trans	-74.4	130.8	171.4	-59.5	-63.9	-175.8	176.7	0	110.4	Y210 I213 Y221	Y210-K215 HydrophobicContact CD1-CG 4.14Å; Y210-K215 VanDerWaalsContact O-CB 3.28Å; Y210-K215 WeakPolarHBondContact O-CB 3.47Å; Y210-K215 PolarHBondContact O-N 2.5Å; Y210-K215 VanDerWaalsContact O-N 3.08Å; I213-K215 HydrophobicContact CD1-CG 4.17Å; I213-K215 HydrophobicContact CG1-CG 4.21Å; K215-Y221 HydrophobicContact CB-CE1 4.13Å; K215-Y221 HydrophobicContact CG-CE1 4.25Å
216	R	94.9	Very high	95.4	Very high	111 Å²	111	47.8 Å²	47.8	42%	0.419	24%	0.241	S	C	.	.			trans	-131.1	-6.8	-172.8	-63.5	-67.3	177.1	-84.8	4.7	113.9	Y211 G214 M238	Y211-R216 VanDerWaalsContact CE1-CZ 3.47Å; Y211-R216 PolarHBondContact O-NH1 3.22Å; Y211-R216 PolarHBondContact O-NH2 3.07Å; G214-R216 VanDerWaalsContact C-NH1 3.28Å; G214-R216 VanDerWaalsContact CA-NH1 3.33Å; R216-M238 VanDerWaalsContact O-CB 3.23Å; R216-M238 WeakPolarHBondContact O-CB 3.47Å
217	S	96.9	Very high	94.6	Very high	55 Å²	55	52.9 Å²	52.9	39%	0.385	27%	0.265	S	S	.	.			trans	-78	130	176.5	38.2	0	0	0	0	110.9	E219 Y221 M238	S217-E219 VanDerWaalsContact CB-OE1 3.31Å; S217-E219 WeakPolarHBondContact CB-OE1 3.44Å; S217-E219 PolarHBondContact O-N 2.92Å; S217-E219 PolarHBondContact OG-OE1 2.83Å; S217-Y221 WeakPolarHBondContact O-CE2 3.36Å; S217-Y221 PolarHBondContact O-OH 2.81Å; S217-Y221 PolarHBondContact OG-OH 3.07Å; S217-Y221 VanDerWaalsContact OG-OH 3.08Å; S217-M238 WeakPolarHBondContact O-CG 3.44Å
218	S	98.1	Very high	93.8	Very high	29 Å²	29	63.1 Å²	63.1	20%	0.203	30%	0.303	C	S	.	.			trans	-77.7	107	170.2	-55.6	0	0	0	0	109.6	C236 M238 E239	S218-C236 VanDerWaalsContact CA-O 3.22Å; S218-C236 WeakPolarHBondContact CA-O 3.22Å; S218-M238 PolarHBondContact OG-N 3.36Å; S218-M238 VanDerWaalsContact OG-N 3.16Å; S218-E239 PolarHBondContact OG-OE1 3.34Å
219	E	97.4	Very high	93.2	Very high	89 Å²	89	66.4 Å²	66.4	42%	0.416	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	-172.1	-176.1	64.2	-175.3	129.6	0	0	110.5	S217 Y221 C236	S217-E219 VanDerWaalsContact CB-OE1 3.31Å; S217-E219 WeakPolarHBondContact CB-OE1 3.44Å; S217-E219 PolarHBondContact O-N 2.92Å; S217-E219 PolarHBondContact OG-OE1 2.83Å; E219-Y221 HydrophobicContact CB-CE2 4.38Å; E219-Y221 HydrophobicContact CG-CD2 3.99Å; E219-Y221 HydrophobicContact CG-CE2 3.32Å; E219-Y221 VanDerWaalsContact O-CD2 3.3Å; E219-Y221 WeakPolarHBondContact O-CD2 3.32Å; E219-C236 PolarHBondContact N-O 3.27Å; E219-C236 PolarHBondContact O-N 2.95Å
220	T	98.1	Very high	92.8	Very high	47 Å²	47	69.6 Å²	69.6	29%	0.288	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	131.4	175.5	59.8	0	0	0	0	111.6	V234 Y235 L272 E273	T220-V234 CarbonylContact C-O 3.36Å; T220-V234 VanDerWaalsContact CA-O 3.26Å; T220-V234 WeakPolarHBondContact CA-O 3.4Å; T220-Y235 HydrophobicContact CG2-CD2 4.24Å; T220-L272 HydrophobicContact CG2-CB 3.84Å; T220-L272 HydrophobicContact CG2-CD1 4.19Å; T220-E273 HydrophobicContact CG2-CG 4.28Å
221	Y	97.6	Very high	92.8	Very high	18 Å²	18	70.2 Å²	70.2	7%	0.071	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	154.9	178.4	-67.3	-101.9	0	0	0	110.4	Y210 K215 S217 E219 L233 V234 C236 M238	Y210-Y221 AromaticContact CD1-CD1 3.6Å; Y210-Y221 HydrophobicContact CD1-CD1 3.6Å; Y210-Y221 AromaticContact CD1-CE1 3.91Å; Y210-Y221 HydrophobicContact CD1-CE1 3.91Å; Y210-Y221 AromaticContact CD2-CD1 3.76Å; Y210-Y221 HydrophobicContact CD2-CD1 3.76Å; Y210-Y221 HydrophobicContact CD2-CG 4.08Å; Y210-Y221 AromaticContact CE1-CD1 3.77Å; Y210-Y221 HydrophobicContact CE1-CD1 3.77Å; Y210-Y221 HydrophobicContact CE1-CE1 4.4Å; Y210-Y221 AromaticContact CE2-CD1 3.92Å; Y210-Y221 HydrophobicContact CE2-CD1 3.92Å; Y210-Y221 HydrophobicContact CE2-CG 4.21Å; Y210-Y221 AromaticContact CG-CD1 3.57Å; Y210-Y221 HydrophobicContact CG-CD1 3.57Å; Y210-Y221 HydrophobicContact CG-CE1 4.01Å; Y210-Y221 HydrophobicContact CG-CG 4.29Å; Y210-Y221 AromaticContact CZ-CD1 3.91Å; K215-Y221 HydrophobicContact CB-CE1 4.13Å; K215-Y221 HydrophobicContact CG-CE1 4.25Å; S217-Y221 WeakPolarHBondContact O-CE2 3.36Å; S217-Y221 PolarHBondContact O-OH 2.81Å; S217-Y221 PolarHBondContact OG-OH 3.07Å; S217-Y221 VanDerWaalsContact OG-OH 3.08Å; E219-Y221 HydrophobicContact CB-CE2 4.38Å; E219-Y221 HydrophobicContact CG-CD2 3.99Å; E219-Y221 HydrophobicContact CG-CE2 3.32Å; E219-Y221 VanDerWaalsContact O-CD2 3.3Å; E219-Y221 WeakPolarHBondContact O-CD2 3.32Å; Y221-L233 CarbonylContact O-C 3.5Å; Y221-L233 WeakPolarHBondContact O-CA 3.25Å; Y221-V234 PolarHBondContact N-O 3.34Å; Y221-V234 PolarHBondContact O-N 3.3Å; Y221-C236 HydrophobicContact CD2-CB 3.45Å; Y221-C236 VanDerWaalsContact CD2-CB 3.45Å; Y221-C236 WeakPolarHBondContact CD2-SG 3.45Å; Y221-C236 HydrophobicContact CE2-CB 3.69Å; Y221-C236 HydrophobicContact CG-CB 4.42Å; Y221-M238 HydrophobicContact CD2-CE 4.29Å; Y221-M238 HydrophobicContact CE1-CE 4.34Å; Y221-M238 HydrophobicContact CE2-CE 3.78Å
222	R	97.2	Very high	92.9	Very high	140 Å²	140	69.9 Å²	69.9	53%	0.528	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	119.3	175.5	-179.4	178.2	-64.1	-80.2	-1.9	110	Y210 F232 L233	Y210-R222 WeakPolarHBondContact CE2-O 3.16Å; Y210-R222 PolarHBondContact OH-O 2.9Å; R222-F232 WeakPolarHBondContact CA-O 3.18Å; R222-L233 HydrophobicContact CB-CD2 4.08Å
223	V	96.6	Very high	93.2	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	153.5	-179.6	-62.3	0	0	0	0	111.6	Y204 Y210 P225 S231 F232 V234 L286	Y204-V223 CarbonylContact O-C 3.43Å; Y204-V223 WeakPolarHBondContact O-CA 3.28Å; Y210-V223 HydrophobicContact CE2-CG1 4.15Å; V223-P225 HydrophobicContact CG2-CG 4.46Å; V223-S231 CarbonylContact O-C 3.59Å; V223-S231 WeakPolarHBondContact O-CA 3.43Å; V223-S231 WeakPolarHBondContact O-CB 3.34Å; V223-F232 HydrophobicContact CG2-CD2 3.93Å; V223-F232 HydrophobicContact CG2-CE2 3.64Å; V223-F232 HydrophobicContact CG2-CZ 4.09Å; V223-F232 PolarHBondContact N-O 3.49Å; V223-F232 PolarHBondContact O-N 3.36Å; V223-V234 HydrophobicContact CB-CG2 4.37Å; V223-V234 HydrophobicContact CG1-CG2 3.59Å; V223-V234 HydrophobicContact CG2-CB 4.41Å; V223-V234 HydrophobicContact CG2-CG1 3.64Å; V223-V234 HydrophobicContact CG2-CG2 3.85Å; V223-L286 HydrophobicContact CG2-CD2 4.5Å
224	T	95.4	Very high	93.5	Very high	20 Å²	20	63.9 Å²	63.9	12%	0.123	32%	0.324	C	S	.	.			trans	-135.6	81	177.5	-44.3	0	0	0	0	109.2	I203 Y204 D226 S231	I203-T224 HydrophobicContact CG2-CG2 4.02Å; Y204-T224 PolarHBondContact O-N 2.67Å; T224-D226 VanDerWaalsContact C-N 3.29Å; T224-D226 PolarHBondContact O-N 2.96Å; T224-S231 VanDerWaalsContact OG1-CB 3.29Å; T224-S231 WeakPolarHBondContact OG1-CB 3.38Å; T224-S231 PolarHBondContact OG1-OG 3.48Å
225	P	93.4	Very high	93.7	Very high	7 Å²	7	64.4 Å²	64.4	5%	0.045	31%	0.313	C	S	.	.	S	Bend	trans	-66.4	-29.7	-174.3	-17.6	28.8	0	0	0	114.2	K205 V223 F232 L285 L286 S289	K205-P225 WeakPolarHBondContact O-CG 3.12Å; V223-P225 HydrophobicContact CG2-CG 4.46Å; P225-F232 HydrophobicContact CG-CE1 3.86Å; P225-F232 HydrophobicContact CG-CZ 3.62Å; P225-L285 HydrophobicContact CB-CB 4.36Å; P225-L285 HydrophobicContact CG-CB 4.42Å; P225-L286 HydrophobicContact CB-CD2 4.29Å; P225-L286 HydrophobicContact CG-CD2 3.58Å; P225-L286 HydrophobicContact CG-CG 3.95Å; P225-S289 PolarHBondContact O-OG 3.04Å
226	D	88.1	Confident	93.9	Very high	36 Å²	36	59.5 Å²	59.5	19%	0.193	29%	0.292	C	S	.	.	S	Bend	trans	-130.1	122.2	176.5	-172.7	-23.8	0	0	0	108.4	T224 R228 N229 L285 K288	T224-D226 VanDerWaalsContact C-N 3.29Å; T224-D226 PolarHBondContact O-N 2.96Å; D226-R228 PolarHBondContact O-N 2.68Å; D226-R228 WeakPolarHBondContact OD1-CB 3.25Å; D226-R228 PolarHBondContact OD1-N 3.09Å; D226-N229 HydrophobicContact CB-CB 4.3Å; D226-N229 PolarHBondContact O-N 2.96Å; D226-L285 HydrophobicContact CB-CD2 4.21Å; D226-K288 IonicContact OD2-NZ 3.52Å
227	H	79.3	Confident	94.1	Very high	109 Å²	109	54.6 Å²	54.6	51%	0.505	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-18.8	-177.4	-57	-60.2	0	0	0	113.6	I203 N229	I203-H227 VanDerWaalsContact CD1-CE1 3.42Å; I203-H227 WeakPolarHBondContact CD1-CE1 3.32Å; I203-H227 WeakPolarHBondContact CD1-ND1 3.46Å; I203-H227 WeakPolarHBondContact CG2-CE1 3.33Å; H227-N229 VanDerWaalsContact C-N 3.28Å
228	R	81.1	Confident	94.1	Very high	214 Å²	214	52.2 Å²	52.2	81%	0.808	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-12.6	176.7	-57	-178.8	-173.5	-174.5	4.6	112	D226	D226-R228 PolarHBondContact O-N 2.68Å; D226-R228 WeakPolarHBondContact OD1-CB 3.25Å; D226-R228 PolarHBondContact OD1-N 3.09Å
229	N	84.6	Confident	93.9	Very high	75 Å²	75	57.5 Å²	57.5	40%	0.401	28%	0.278	S	S	.	.	S	Bend	trans	-110.1	159.2	-178.2	-72	66	0	0	0	111.2	D226 H227 L285	D226-N229 HydrophobicContact CB-CB 4.3Å; D226-N229 PolarHBondContact O-N 2.96Å; H227-N229 VanDerWaalsContact C-N 3.28Å; N229-L285 HydrophobicContact CB-CD1 4.11Å
230	S	86.9	Confident	93.6	Very high	101 Å²	101	55.3 Å²	55.3	71%	0.706	27%	0.27	S	S	*	.			trans	-68.3	140.6	177.2	57.9	0	0	0	0	112
231	S	95.2	Very high	93.1	Very high	46 Å²	46	58.4 Å²	58.4	32%	0.322	28%	0.283	S	S	.	.			trans	-62.3	149.2	169.7	-41.4	0	0	0	0	112	V223 T224	V223-S231 CarbonylContact O-C 3.59Å; V223-S231 WeakPolarHBondContact O-CA 3.43Å; V223-S231 WeakPolarHBondContact O-CB 3.34Å; T224-S231 VanDerWaalsContact OG1-CB 3.29Å; T224-S231 WeakPolarHBondContact OG1-CB 3.38Å; T224-S231 PolarHBondContact OG1-OG 3.48Å
232	F	97.3	Very high	92.8	Very high	19 Å²	19	58.8 Å²	58.8	8%	0.083	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	163.7	177.4	54.8	-95	0	0	0	112	R222 V223 P225 V234 K282 L285 L286	R222-F232 WeakPolarHBondContact CA-O 3.18Å; V223-F232 HydrophobicContact CG2-CD2 3.93Å; V223-F232 HydrophobicContact CG2-CE2 3.64Å; V223-F232 HydrophobicContact CG2-CZ 4.09Å; V223-F232 PolarHBondContact N-O 3.49Å; V223-F232 PolarHBondContact O-N 3.36Å; P225-F232 HydrophobicContact CG-CE1 3.86Å; P225-F232 HydrophobicContact CG-CZ 3.62Å; F232-V234 HydrophobicContact CD2-CG1 3.82Å; F232-V234 HydrophobicContact CE2-CG1 3.61Å; F232-K282 HydrophobicContact CB-CD 4.18Å; F232-K282 HydrophobicContact CD1-CD 4.4Å; F232-K282 HydrophobicContact CD1-CG 4.09Å; F232-K282 HydrophobicContact CD2-CB 4.24Å; F232-K282 HydrophobicContact CD2-CD 3.66Å; F232-K282 HydrophobicContact CD2-CG 4.02Å; F232-K282 HydrophobicContact CE1-CB 4.22Å; F232-K282 HydrophobicContact CE1-CG 4.11Å; F232-K282 HydrophobicContact CE2-CB 3.77Å; F232-K282 HydrophobicContact CE2-CD 4.06Å; F232-K282 HydrophobicContact CE2-CG 4.03Å; F232-K282 HydrophobicContact CG-CD 3.83Å; F232-K282 HydrophobicContact CG-CG 4.03Å; F232-K282 HydrophobicContact CZ-CB 3.74Å; F232-K282 HydrophobicContact CZ-CG 4.07Å; F232-L285 HydrophobicContact CE1-CD1 4.17Å; F232-L286 HydrophobicContact CE2-CD1 4.21Å; F232-L286 HydrophobicContact CE2-CG 4.44Å; F232-L286 HydrophobicContact CZ-CD1 4.3Å; F232-L286 HydrophobicContact CZ-CG 4.1Å
233	L	98.2	Very high	92.8	Very high	78 Å²	78	52.1 Å²	52.1	41%	0.408	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	140.9	178.2	-63.7	175	0	0	0	111	Y221 R222 L272	Y221-L233 CarbonylContact O-C 3.5Å; Y221-L233 WeakPolarHBondContact O-CA 3.25Å; R222-L233 HydrophobicContact CB-CD2 4.08Å; L233-L272 HydrophobicContact CB-CD1 3.66Å
234	V	98.5	Very high	92.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.6	172.5	-65.4	0	0	0	0	109.4	T220 Y221 V223 F232 T246 L278	T220-V234 CarbonylContact C-O 3.36Å; T220-V234 VanDerWaalsContact CA-O 3.26Å; T220-V234 WeakPolarHBondContact CA-O 3.4Å; Y221-V234 PolarHBondContact N-O 3.34Å; Y221-V234 PolarHBondContact O-N 3.3Å; V223-V234 HydrophobicContact CB-CG2 4.37Å; V223-V234 HydrophobicContact CG1-CG2 3.59Å; V223-V234 HydrophobicContact CG2-CB 4.41Å; V223-V234 HydrophobicContact CG2-CG1 3.64Å; V223-V234 HydrophobicContact CG2-CG2 3.85Å; F232-V234 HydrophobicContact CD2-CG1 3.82Å; F232-V234 HydrophobicContact CE2-CG1 3.61Å; V234-T246 HydrophobicContact CB-CG2 3.86Å; V234-T246 HydrophobicContact CG1-CG2 3.91Å; V234-T246 HydrophobicContact CG2-CG2 4.08Å; V234-L278 HydrophobicContact CG1-CD1 4Å; V234-L278 HydrophobicContact CG1-CD2 4.11Å
235	Y	98.6	Very high	92.9	Very high	56 Å²	56	51.4 Å²	51.4	22%	0.22	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	125.4	167.2	-173.5	-89.6	0	0	0	109.3	T220 V247 L272	T220-Y235 HydrophobicContact CG2-CD2 4.24Å; Y235-V247 HydrophobicContact CD1-CB 4.26Å; Y235-V247 HydrophobicContact CD1-CG2 3.79Å; Y235-V247 PolarHBondContact O-N 3.49Å; Y235-L272 WeakPolarHBondContact CB-O 3.34Å; Y235-L272 VanDerWaalsContact CD2-O 3.32Å; Y235-L272 WeakPolarHBondContact CD2-O 3.47Å
236	C	98.5	Very high	93.2	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	123.3	177.2	-61.6	0	0	0	0	110.7	C207 S218 E219 Y221 M238 W245	C207-C236 VanDerWaalsContact CA-SG 3.57Å; C207-C236 HydrophobicContact CB-CB 3.6Å; C207-C236 WeakPolarHBondContact CB-SG 3.44Å; C207-C236 WeakPolarHBondContact SG-CA 3.48Å; C207-C236 WeakPolarHBondContact SG-CB 3.29Å; C207-C236 CovalentContact SG-SG 2.02Å; C207-C236 PolarHBondContact SG-SG 3.28Å; S218-C236 VanDerWaalsContact CA-O 3.22Å; S218-C236 WeakPolarHBondContact CA-O 3.22Å; E219-C236 PolarHBondContact N-O 3.27Å; E219-C236 PolarHBondContact O-N 2.95Å; Y221-C236 HydrophobicContact CD2-CB 3.45Å; Y221-C236 VanDerWaalsContact CD2-CB 3.45Å; Y221-C236 WeakPolarHBondContact CD2-SG 3.45Å; Y221-C236 HydrophobicContact CE2-CB 3.69Å; Y221-C236 HydrophobicContact CG-CB 4.42Å; C236-M238 HydrophobicContact CB-CE 3.49Å; C236-M238 VanDerWaalsContact CB-CE 3.49Å; C236-M238 HydrophobicContact CB-CG 4.26Å; C236-M238 HydrophobicContact CB-SD 3.99Å; C236-W245 CarbonylContact C-O 3.58Å; C236-W245 VanDerWaalsContact CA-O 3.32Å; C236-W245 WeakPolarHBondContact CA-O 3.25Å
237	D	98.1	Very high	93.7	Very high	7 Å²	7	49.5 Å²	49.5	4%	0.037	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	103	171.1	-173.6	-33.9	0	0	0	107.8	E239 T240 G243 G244 W245 V247 K423 M425	D237-E239 PolarHBondContact OD1-N 3.02Å; D237-T240 VanDerWaalsContact CG-OG1 3.26Å; D237-T240 VanDerWaalsContact OD1-CB 3.23Å; D237-T240 WeakPolarHBondContact OD1-CB 3.47Å; D237-T240 PolarHBondContact OD1-N 3.4Å; D237-T240 PolarHBondContact OD1-OG1 2.91Å; D237-T240 PolarHBondContact OD2-OG1 3.34Å; D237-G243 CarbonylContact O-C 3.54Å; D237-G243 WeakPolarHBondContact O-CA 3.39Å; D237-G244 PolarHBondContact O-N 2.74Å; D237-W245 HydrophobicContact CB-CB 4.08Å; D237-W245 PolarHBondContact N-O 3.43Å; D237-W245 PolarHBondContact O-N 3.01Å; D237-W245 VanDerWaalsContact O-N 3.08Å; D237-V247 HydrophobicContact CB-CG2 4.01Å; D237-K423 IonicContact OD2-NZ 3.75Å; D237-K423 PolarHBondContact OD2-NZ 2.93Å; D237-M425 HydrophobicContact CB-SD 4.45Å
238	M	97.4	Very high	94.6	Very high	5 Å²	5	44.3 Å²	44.3	3%	0.025	23%	0.228	C	C	.	.			trans	-96.5	2.1	-173.9	-61.4	-55	-162.8	0	0	112.8	C207 Y211 R216 S217 S218 Y221 C236 G243	C207-M238 HydrophobicContact CB-CE 4.32Å; C207-M238 WeakPolarHBondContact O-CE 3.32Å; Y211-M238 HydrophobicContact CD2-CB 4.4Å; Y211-M238 HydrophobicContact CD2-SD 3.81Å; Y211-M238 WeakPolarHBondContact CE2-O 3.34Å; R216-M238 VanDerWaalsContact O-CB 3.23Å; R216-M238 WeakPolarHBondContact O-CB 3.47Å; S217-M238 WeakPolarHBondContact O-CG 3.44Å; S218-M238 PolarHBondContact OG-N 3.36Å; S218-M238 VanDerWaalsContact OG-N 3.16Å; Y221-M238 HydrophobicContact CD2-CE 4.29Å; Y221-M238 HydrophobicContact CE1-CE 4.34Å; Y221-M238 HydrophobicContact CE2-CE 3.78Å; C236-M238 HydrophobicContact CB-CE 3.49Å; C236-M238 VanDerWaalsContact CB-CE 3.49Å; C236-M238 HydrophobicContact CB-CG 4.26Å; C236-M238 HydrophobicContact CB-SD 3.99Å; M238-G243 WeakPolarHBondContact O-CA 3.46Å
239	E	94.8	Very high	95.4	Very high	141 Å²	141	34.1 Å²	34.1	66%	0.659	19%	0.19	S	C	*	.	S	Bend	trans	-112.9	-43.4	-173.1	-70.7	163.1	-135.6	0	0	111.8	S218 D237 M241	S218-E239 PolarHBondContact OG-OE1 3.34Å; D237-E239 PolarHBondContact OD1-N 3.02Å; E239-M241 PolarHBondContact O-N 2.64Å
240	T	90.4	Very high	96.1	Very high	42 Å²	42	31.1 Å²	31.1	26%	0.258	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-65.7	120.1	-172.1	-57.1	0	0	0	0	110.9	D237 G242 G243 W245 M425	D237-T240 VanDerWaalsContact CG-OG1 3.26Å; D237-T240 VanDerWaalsContact OD1-CB 3.23Å; D237-T240 WeakPolarHBondContact OD1-CB 3.47Å; D237-T240 PolarHBondContact OD1-N 3.4Å; D237-T240 PolarHBondContact OD1-OG1 2.91Å; D237-T240 PolarHBondContact OD2-OG1 3.34Å; T240-G242 PolarHBondContact O-N 2.82Å; T240-G243 PolarHBondContact O-N 2.53Å; T240-W245 PolarHBondContact O-NE1 2.96Å; T240-M425 HydrophobicContact CG2-CE 3.8Å
241	M	88.8	Confident	96.6	Very high	112 Å²	112	26.6 Å²	26.6	55%	0.552	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	47.1	52.7	173.9	-66.5	-164	54.8	0	0	114.5	E239 G243 R295 R427	E239-M241 PolarHBondContact O-N 2.64Å; M241-G243 VanDerWaalsContact C-N 3.35Å; M241-R295 PolarHBondContact SD-NH1 2.81Å; M241-R295 PolarHBondContact SD-NH2 2.77Å; M241-R295 VanDerWaalsContact SD-NH2 3.43Å; M241-R427 PolarHBondContact O-NH1 3.09Å
242	G	91.2	Very high	96.7	Very high	27 Å²	27	26.7 Å²	26.7	28%	0.278	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	83.6	7.5	178.5	0	0	0	0	0	114.3	Y211 T240	Y211-G242 WeakPolarHBondContact CE2-O 3.2Å; Y211-G242 PolarHBondContact OH-O 3.33Å; T240-G242 PolarHBondContact O-N 2.82Å
243	G	95.6	Very high	96.5	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	66	-161.8	170.3	0	0	0	0	0	115	D237 M238 T240 M241 W245 R427	D237-G243 CarbonylContact O-C 3.54Å; D237-G243 WeakPolarHBondContact O-CA 3.39Å; M238-G243 WeakPolarHBondContact O-CA 3.46Å; T240-G243 PolarHBondContact O-N 2.53Å; M241-G243 VanDerWaalsContact C-N 3.35Å; G243-W245 PolarHBondContact O-N 3.03Å; G243-R427 VanDerWaalsContact O-CD 3.25Å; G243-R427 WeakPolarHBondContact O-CD 3.4Å; G243-R427 PolarHBondContact O-NH1 3.28Å
244	G	97	Very high	96.4	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.143	C	C	.	.			trans	70.2	17.4	-178.2	0	0	0	0	0	113.7	S208 D237	S208-G244 PolarHBondContact N-O 3.32Å; D237-G244 PolarHBondContact O-N 2.74Å
245	W	98.3	Very high	96.3	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.015	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	132.4	-178.7	-67.5	101.9	0	0	0	111.1	C207 C236 D237 T240 G243 I293 R295 L309 M425 R427	C207-W245 PolarHBondContact SG-O 3.1Å; C236-W245 CarbonylContact C-O 3.58Å; C236-W245 VanDerWaalsContact CA-O 3.32Å; C236-W245 WeakPolarHBondContact CA-O 3.25Å; D237-W245 HydrophobicContact CB-CB 4.08Å; D237-W245 PolarHBondContact N-O 3.43Å; D237-W245 PolarHBondContact O-N 3.01Å; D237-W245 VanDerWaalsContact O-N 3.08Å; T240-W245 PolarHBondContact O-NE1 2.96Å; G243-W245 PolarHBondContact O-N 3.03Å; W245-I293 HydrophobicContact CH2-CD1 3.61Å; W245-I293 HydrophobicContact CH2-CG1 4.07Å; W245-I293 HydrophobicContact CZ3-CD1 4.13Å; W245-I293 HydrophobicContact CZ3-CG1 4.07Å; W245-R295 HydrophobicContact CE3-CB 4.34Å; W245-R295 HydrophobicContact CH2-CB 3.72Å; W245-R295 HydrophobicContact CZ2-CB 4.44Å; W245-R295 HydrophobicContact CZ3-CB 3.66Å; W245-L309 HydrophobicContact CH2-CD1 4.35Å; W245-M425 HydrophobicContact CB-CB 4.17Å; W245-M425 HydrophobicContact CB-CG 4.16Å; W245-M425 HydrophobicContact CB-SD 3.77Å; W245-M425 HydrophobicContact CD2-CE 4.4Å; W245-M425 HydrophobicContact CD2-CG 3.99Å; W245-M425 HydrophobicContact CD2-SD 4.11Å; W245-M425 HydrophobicContact CE3-CB 4.21Å; W245-M425 HydrophobicContact CE3-CG 3.7Å; W245-M425 HydrophobicContact CE3-SD 4.44Å; W245-M425 HydrophobicContact CG-CE 4.4Å; W245-M425 HydrophobicContact CG-CG 4.19Å; W245-M425 HydrophobicContact CG-SD 3.81Å; W245-M425 HydrophobicContact CZ3-CG 4.43Å; W245-R427 HydrophobicContact CD2-CB 4.02Å; W245-R427 HydrophobicContact CE3-CB 3.5Å; W245-R427 VanDerWaalsContact CE3-CB 3.5Å; W245-R427 HydrophobicContact CH2-CB 4.14Å; W245-R427 HydrophobicContact CZ3-CB 3.56Å
246	T	98.7	Very high	96.2	Very high	2 Å²	2	27.7 Å²	27.7	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	115.6	169.1	-50.9	0	0	0	0	108.9	C207 V234 L286 M425 I426	C207-T246 WeakPolarHBondContact CB-OG1 3.43Å; C207-T246 PolarHBondContact N-OG1 3.3Å; C207-T246 VanDerWaalsContact SG-CA 3.53Å; C207-T246 PolarHBondContact SG-OG1 3.45Å; V234-T246 HydrophobicContact CB-CG2 3.86Å; V234-T246 HydrophobicContact CG1-CG2 3.91Å; V234-T246 HydrophobicContact CG2-CG2 4.08Å; T246-L286 HydrophobicContact CG2-CD1 4.04Å; T246-M425 CarbonylContact O-C 3.59Å; T246-M425 VanDerWaalsContact O-CA 3.25Å; T246-M425 WeakPolarHBondContact O-CA 3.32Å; T246-M425 WeakPolarHBondContact O-CB 3.49Å; T246-I426 PolarHBondContact N-O 3.23Å; T246-I426 PolarHBondContact O-N 2.91Å
247	V	98.8	Very high	96.2	Very high	1 Å²	1	32 Å²	32	1%	0.006	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	126.5	-178.8	-175.7	0	0	0	0	110	Y235 D237 Q249 A250 F276 K423 M425	Y235-V247 HydrophobicContact CD1-CB 4.26Å; Y235-V247 HydrophobicContact CD1-CG2 3.79Å; Y235-V247 PolarHBondContact O-N 3.49Å; D237-V247 HydrophobicContact CB-CG2 4.01Å; V247-Q249 WeakPolarHBondContact CG1-O 3.23Å; V247-A250 HydrophobicContact CG1-CB 4.38Å; V247-F276 HydrophobicContact CB-CZ 3.94Å; V247-F276 HydrophobicContact CG1-CE1 4.12Å; V247-F276 HydrophobicContact CG1-CZ 3.62Å; V247-K423 HydrophobicContact CG1-CD 4.41Å; V247-K423 HydrophobicContact CG1-CG 3.87Å; V247-K423 HydrophobicContact CG2-CD 4.25Å; V247-M425 HydrophobicContact CG2-CB 4.16Å
248	L	98.8	Very high	96.2	Very high	1 Å²	1	32 Å²	32	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-32.9	-179.3	-55	-170.9	0	0	0	112.5	L278 I283 L286 F313 M424 I426	L248-L278 HydrophobicContact CD2-CD2 3.8Å; L248-L278 VanDerWaalsContact O-CB 3.27Å; L248-L278 WeakPolarHBondContact O-CB 3.17Å; L248-L278 PolarHBondContact O-N 3.29Å; L248-I283 HydrophobicContact CB-CD1 4.4Å; L248-I283 HydrophobicContact CB-CG1 4.44Å; L248-I283 HydrophobicContact CD1-CG1 4.34Å; L248-I283 HydrophobicContact CD1-CG2 3.95Å; L248-I283 HydrophobicContact CD2-CG1 4.15Å; L248-L286 HydrophobicContact CD2-CD1 4.14Å; L248-F313 HydrophobicContact CD1-CD1 4.47Å; L248-F313 HydrophobicContact CD1-CE1 3.49Å; L248-F313 VanDerWaalsContact CD1-CE1 3.49Å; L248-F313 HydrophobicContact CD1-CZ 3.87Å; L248-M424 HydrophobicContact CB-CB 4.46Å; L248-M424 PolarHBondContact N-O 2.74Å; L248-I426 HydrophobicContact CD1-CB 4.49Å; L248-I426 HydrophobicContact CD1-CD1 4.27Å; L248-I426 HydrophobicContact CD1-CG1 4.24Å; L248-I426 HydrophobicContact CD1-CG2 3.55Å; L248-I426 HydrophobicContact CD2-CD1 3.82Å; L248-I426 HydrophobicContact CD2-CG1 3.83Å; L248-I426 HydrophobicContact CG-CD1 4.42Å; L248-I426 HydrophobicContact CG-CG1 4.13Å; L248-I426 HydrophobicContact CG-CG2 4.15Å
249	Q	98.8	Very high	96.2	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.9	140.4	-176.7	-171.8	-95.6	36.7	0	0	109.3	V247 F258 F276 W277 L383 N384 A422 K423 M424	V247-Q249 WeakPolarHBondContact CG1-O 3.23Å; Q249-F258 HydrophobicContact CG-CE1 4.14Å; Q249-F276 WeakPolarHBondContact CA-O 3.37Å; Q249-W277 HydrophobicContact CB-CE3 3.68Å; Q249-W277 HydrophobicContact CB-CZ3 3.78Å; Q249-W277 HydrophobicContact CG-CE3 3.53Å; Q249-W277 HydrophobicContact CG-CZ3 3.83Å; Q249-L383 PolarHBondContact NE2-O 3.45Å; Q249-N384 PolarHBondContact NE2-OD1 3.08Å; Q249-A422 PolarHBondContact OE1-O 3.31Å; Q249-K423 WeakPolarHBondContact O-CA 3.28Å; Q249-M424 HydrophobicContact CB-CB 4Å; Q249-M424 HydrophobicContact CB-CG 4.1Å; Q249-M424 HydrophobicContact CB-SD 4.12Å; Q249-M424 PolarHBondContact N-O 3.32Å; Q249-M424 PolarHBondContact O-N 3.09Å
250	A	98.4	Very high	96.4	Very high	12 Å²	12	31.7 Å²	31.7	10%	0.099	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	137.2	171.4	0	0	0	0	0	111.3	V247 R274 E275 F276 A422	V247-A250 HydrophobicContact CG1-CB 4.38Å; A250-R274 WeakPolarHBondContact CB-O 3.3Å; A250-E275 VanDerWaalsContact O-CA 3.25Å; A250-E275 WeakPolarHBondContact O-CA 2.98Å; A250-F276 HydrophobicContact CB-CD1 4.1Å; A250-F276 HydrophobicContact CB-CE1 3.91Å; A250-F276 PolarHBondContact N-O 3.43Å; A250-F276 VanDerWaalsContact N-O 3.16Å; A250-F276 PolarHBondContact O-N 3.47Å; A250-A422 CarbonylContact C-O 3.43Å; A250-A422 WeakPolarHBondContact CA-O 3.37Å
251	R	98.3	Very high	96.8	Very high	6 Å²	6	36.4 Å²	36.4	2%	0.023	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	133.9	172.2	-50.9	-60.7	-62.8	-81.7	7.1	108.4	F258 E275 L383 G385 I399 Q421 A422	R251-F258 VanDerWaalsContact NE-CE2 3.29Å; R251-E275 WeakPolarHBondContact CA-OE1 3.27Å; R251-E275 IonicContact NE-OE1 2.64Å; R251-L383 PolarHBondContact NH1-O 3.15Å; R251-G385 VanDerWaalsContact CZ-O 3.31Å; R251-G385 PolarHBondContact NH1-O 2.88Å; R251-G385 PolarHBondContact NH2-O 3.33Å; R251-I399 HydrophobicContact CB-CD1 3.8Å; R251-I399 HydrophobicContact CG-CD1 3.92Å; R251-Q421 VanDerWaalsContact O-CA 3.28Å; R251-Q421 WeakPolarHBondContact O-CA 3.45Å; R251-A422 HydrophobicContact CB-CB 4.14Å; R251-A422 HydrophobicContact CG-CB 4.18Å; R251-A422 PolarHBondContact N-O 3.21Å; R251-A422 PolarHBondContact O-N 3.24Å
252	L	95.5	Very high	97.2	Very high	47 Å²	47	31.7 Å²	31.7	25%	0.246	18%	0.176	C	C	.	.	S	Bend	trans	-150.1	-32.4	-174.7	61.9	118	0	0	0	115.4	R274 E275 Y387	L252-R274 HydrophobicContact CD2-CB 4.07Å; L252-R274 VanDerWaalsContact CD2-O 3.23Å; L252-R274 WeakPolarHBondContact CD2-O 3.32Å; L252-E275 HydrophobicContact CD2-CB 4.42Å; L252-E275 HydrophobicContact CD2-CG 3.54Å; L252-E275 HydrophobicContact CG-CG 3.62Å; L252-E275 PolarHBondContact N-OE1 2.97Å; L252-Y387 PolarHBondContact O-OH 3.31Å
253	D	94.4	Very high	97.6	Very high	47 Å²	47	38.3 Å²	38.3	25%	0.251	20%	0.197	S	C	.	.	S	Bend	trans	-148.8	-5.7	-170.1	61.2	11	0	0	0	114.6	S255 R274 E275 H389	D253-S255 VanDerWaalsContact C-N 3.29Å; D253-S255 PolarHBondContact O-N 2.78Å; D253-S255 WeakPolarHBondContact OD1-CB 3.36Å; D253-S255 PolarHBondContact OD1-N 3.34Å; D253-S255 PolarHBondContact OD1-OG 2.91Å; D253-R274 IonicContact OD2-NE 2.74Å; D253-R274 IonicContact OD2-NH2 3.93Å; D253-E275 PolarHBondContact N-OE1 3Å; D253-H389 PolarHBondContact O-NE2 2.83Å
254	G	95.5	Very high	97.8	Very high	31 Å²	31	41 Å²	41	32%	0.32	21%	0.211	S	C	.	.	S	Bend	trans	73.7	16.1	-176.6	0	0	0	0	0	114.7	T256 E275 Y387	G254-T256 PolarHBondContact O-N 3.08Å; G254-E275 VanDerWaalsContact C-OE2 3.3Å; G254-E275 VanDerWaalsContact CA-OE2 3.25Å; G254-E275 WeakPolarHBondContact CA-OE2 3.3Å; G254-E275 PolarHBondContact N-OE1 3.25Å; G254-E275 PolarHBondContact N-OE2 3.21Å; G254-Y387 VanDerWaalsContact CA-CB 3.5Å; G254-Y387 VanDerWaalsContact CA-CG 3.48Å
255	S	96.3	Very high	97.8	Very high	73 Å²	73	41 Å²	41	51%	0.51	21%	0.211	S	C	.	.			trans	-64.4	-24.1	176	56.2	0	0	0	0	113.6	D253 E275	D253-S255 VanDerWaalsContact C-N 3.29Å; D253-S255 PolarHBondContact O-N 2.78Å; D253-S255 WeakPolarHBondContact OD1-CB 3.36Å; D253-S255 PolarHBondContact OD1-N 3.34Å; D253-S255 PolarHBondContact OD1-OG 2.91Å; S255-E275 PolarHBondContact N-OE2 3.37Å; S255-E275 VanDerWaalsContact N-OE2 3.1Å
256	T	97.8	Very high	97.9	Very high	23 Å²	23	43.2 Å²	43.2	14%	0.141	22%	0.221	C	C	.	.	S	Bend	trans	-110.6	134	-179.5	-65.2	0	0	0	0	111.7	G254 F258 F269 E275	G254-T256 PolarHBondContact O-N 3.08Å; T256-F258 HydrophobicContact CG2-CD2 4.16Å; T256-F258 HydrophobicContact CG2-CE2 3.86Å; T256-F258 WeakPolarHBondContact O-CD2 3.43Å; T256-F258 PolarHBondContact O-N 3.2Å; T256-F269 HydrophobicContact CG2-CD2 3.86Å; T256-F269 HydrophobicContact CG2-CE2 4.17Å; T256-E275 PolarHBondContact N-OE2 2.91Å; T256-E275 PolarHBondContact OG1-O 2.86Å
257	N	97.2	Very high	97.9	Very high	92 Å²	92	45.8 Å²	45.8	49%	0.492	24%	0.242	S	C	.	.			trans	-80.6	117.5	173.5	-172.4	0.5	0	0	0	111	T259 R260	N257-T259 WeakPolarHBondContact OD1-CB 3.3Å; N257-T259 PolarHBondContact OD1-N 2.95Å; N257-R260 WeakPolarHBondContact O-CG 3.47Å; N257-R260 PolarHBondContact O-NE 2.85Å
258	F	98.4	Very high	97.9	Very high	5 Å²	5	46.8 Å²	46.8	2%	0.022	25%	0.252	C	S	.	.			trans	-94	-4.4	175.7	-78.9	-111.1	0	0	0	113.3	Q249 R251 T256 R260 Y265 F269 E275 F276 W277 N384	Q249-F258 HydrophobicContact CG-CE1 4.14Å; R251-F258 VanDerWaalsContact NE-CE2 3.29Å; T256-F258 HydrophobicContact CG2-CD2 4.16Å; T256-F258 HydrophobicContact CG2-CE2 3.86Å; T256-F258 WeakPolarHBondContact O-CD2 3.43Å; T256-F258 PolarHBondContact O-N 3.2Å; F258-R260 PolarHBondContact O-N 2.85Å; F258-Y265 PolarHBondContact O-OH 3.19Å; F258-F269 HydrophobicContact CB-CE2 4.43Å; F258-F269 HydrophobicContact CB-CZ 4.47Å; F258-F269 AromaticContact CD1-CE2 3.74Å; F258-F269 HydrophobicContact CD1-CE2 3.74Å; F258-F269 AromaticContact CD1-CZ 3.77Å; F258-F269 HydrophobicContact CD1-CZ 3.77Å; F258-F269 HydrophobicContact CD2-CE2 4.08Å; F258-F269 AromaticContact CE1-CE2 3.9Å; F258-F269 HydrophobicContact CE1-CE2 3.9Å; F258-F269 HydrophobicContact CE1-CZ 4.16Å; F258-F269 HydrophobicContact CE2-CE2 4.21Å; F258-F269 AromaticContact CG-CE2 3.83Å; F258-F269 HydrophobicContact CG-CE2 3.83Å; F258-F269 HydrophobicContact CG-CZ 4.12Å; F258-F269 HydrophobicContact CZ-CE2 4.13Å; F258-E275 HydrophobicContact CE2-CB 4.28Å; F258-F276 WeakPolarHBondContact CZ-O 3.01Å; F258-W277 HydrophobicContact CE1-CB 4.15Å; F258-N384 VanDerWaalsContact CB-O 3.23Å; F258-N384 WeakPolarHBondContact CB-O 3.29Å; F258-N384 HydrophobicContact CD1-CB 4.08Å
259	T	97.5	Very high	97.9	Very high	55 Å²	55	47.9 Å²	47.9	34%	0.337	26%	0.257	S	S	.	.			trans	-74.1	85.6	167.4	-55.4	0	0	0	0	108.4	N257 S370	N257-T259 WeakPolarHBondContact OD1-CB 3.3Å; N257-T259 PolarHBondContact OD1-N 2.95Å; T259-S370 VanDerWaalsContact CA-O 3.28Å; T259-S370 WeakPolarHBondContact CA-O 3.38Å; T259-S370 VanDerWaalsContact CB-O 3.31Å; T259-S370 WeakPolarHBondContact CB-O 3.36Å; T259-S370 PolarHBondContact OG1-O 2.97Å
260	R	98.3	Very high	97.8	Very high	85 Å²	85	50.3 Å²	50.3	32%	0.321	28%	0.282	S	S	.	.			trans	-132.1	157	-170.7	-65	-64.6	-173.4	159.6	1.6	111.2	N257 F258 D264 Y265 F269 P353	N257-R260 WeakPolarHBondContact O-CG 3.47Å; N257-R260 PolarHBondContact O-NE 2.85Å; F258-R260 PolarHBondContact O-N 2.85Å; R260-D264 HydrophobicContact CB-CB 3.85Å; R260-D264 WeakPolarHBondContact CD-OD2 3.34Å; R260-D264 HydrophobicContact CG-CB 4.38Å; R260-Y265 HydrophobicContact CB-CD2 3.92Å; R260-Y265 HydrophobicContact CB-CE2 3.71Å; R260-Y265 WeakPolarHBondContact O-CE2 3.5Å; R260-F269 HydrophobicContact CB-CD1 4.35Å; R260-F269 HydrophobicContact CB-CE1 3.89Å; R260-F269 HydrophobicContact CB-CZ 4.22Å; R260-F269 HydrophobicContact CG-CD1 4.02Å; R260-F269 HydrophobicContact CG-CD2 4.3Å; R260-F269 HydrophobicContact CG-CE1 3.77Å; R260-F269 HydrophobicContact CG-CE2 4.08Å; R260-F269 HydrophobicContact CG-CG 4.28Å; R260-F269 HydrophobicContact CG-CZ 3.8Å; R260-P353 VanDerWaalsContact O-CD 3.27Å; R260-P353 WeakPolarHBondContact O-CD 3.39Å
261	Y	98.6	Very high	97.8	Very high	141 Å²	141	53.5 Å²	53.5	55%	0.553	30%	0.297	S	S	*	.			trans	-90.7	174.2	-178.2	-66.3	-30.3	0	0	0	112.6	K263 D264 Y265 P353 D354	Y261-K263 VanDerWaalsContact C-N 3.31Å; Y261-K263 PolarHBondContact O-N 2.02Å; Y261-D264 PolarHBondContact O-N 3.08Å; Y261-D264 VanDerWaalsContact O-N 3.11Å; Y261-Y265 PolarHBondContact O-N 3.22Å; Y261-Y265 VanDerWaalsContact O-N 3.08Å; Y261-P353 HydrophobicContact CD1-CB 4.17Å; Y261-P353 HydrophobicContact CD1-CG 4.5Å; Y261-P353 HydrophobicContact CE1-CB 4.06Å; Y261-D354 WeakPolarHBondContact CA-OD1 3.34Å; Y261-D354 VanDerWaalsContact CB-CG 3.5Å; Y261-D354 WeakPolarHBondContact CB-OD1 3.17Å; Y261-D354 WeakPolarHBondContact CB-OD2 3.34Å; Y261-D354 HydrophobicContact CD1-CB 3.78Å; Y261-D354 HydrophobicContact CE1-CB 4.32Å; Y261-D354 HydrophobicContact CG-CB 4.1Å
262	W	98.8	Very high	97.8	Very high	14 Å²	14	55 Å²	55	5%	0.053	31%	0.306	C	S	.	.	H	α-helix	trans	-52.5	-47.3	-175.1	-175.7	-97.5	0	0	0	113	D264 Y265 K266 E318 K321 Y322 F350 T352 D354 R355	W262-D264 VanDerWaalsContact C-N 3.29Å; W262-D264 PolarHBondContact O-N 2.74Å; W262-Y265 PolarHBondContact O-N 3.5Å; W262-K266 VanDerWaalsContact O-CB 3.29Å; W262-K266 WeakPolarHBondContact O-CB 3.4Å; W262-K266 PolarHBondContact O-N 2.9Å; W262-E318 HydrophobicContact CZ2-CG 4.15Å; W262-E318 PolarHBondContact NE1-OE1 3.37Å; W262-K321 HydrophobicContact CH2-CB 4.31Å; W262-Y322 AromaticContact CE2-CE2 3.84Å; W262-Y322 AromaticContact CH2-CD2 3.62Å; W262-Y322 HydrophobicContact CH2-CD2 3.62Å; W262-Y322 AromaticContact CH2-CE2 3.98Å; W262-Y322 HydrophobicContact CH2-CE2 3.98Å; W262-Y322 AromaticContact CZ2-CD2 3.51Å; W262-Y322 HydrophobicContact CZ2-CD2 3.51Å; W262-Y322 AromaticContact CZ2-CE2 3.37Å; W262-Y322 HydrophobicContact CZ2-CE2 3.37Å; W262-F350 HydrophobicContact CH2-CB 4.34Å; W262-F350 HydrophobicContact CZ3-CB 4.17Å; W262-F350 HydrophobicContact CZ3-CD1 4.09Å; W262-F350 VanDerWaalsContact CZ3-O 3.32Å; W262-F350 WeakPolarHBondContact CZ3-O 3.42Å; W262-T352 HydrophobicContact CE3-CG2 3.96Å; W262-T352 PolarHBondContact N-OG1 2.88Å; W262-D354 WeakPolarHBondContact CB-OD2 3.44Å; W262-D354 PolarHBondContact N-OD1 2.86Å; W262-D354 PolarHBondContact N-OD2 2.9Å; W262-R355 HydrophobicContact CB-CB 4.25Å; W262-R355 HydrophobicContact CD2-CB 4.38Å; W262-R355 VanDerWaalsContact CD2-CD 3.46Å; W262-R355 HydrophobicContact CD2-CG 4.46Å; W262-R355 HydrophobicContact CE3-CB 4.01Å; W262-R355 HydrophobicContact CE3-CG 4.2Å; W262-R355 HydrophobicContact CG-CB 4.5Å
263	K	98.8	Very high	97.7	Very high	166 Å²	166	59.3 Å²	59.3	72%	0.722	33%	0.325	S	S	*	.	H	α-helix	trans	-59	-40.6	-179	-175.5	-179.5	177.1	-178	0	112.2	Y261 A267	Y261-K263 VanDerWaalsContact C-N 3.31Å; Y261-K263 PolarHBondContact O-N 2.02Å; K263-A267 PolarHBondContact O-N 3.08Å
264	D	98.8	Very high	97.8	Very high	56 Å²	56	63.6 Å²	63.6	30%	0.299	34%	0.337	S	S	.	.	H	α-helix	trans	-70.2	-44.8	179.5	-64.9	-28.2	0	0	0	110.6	R260 Y261 W262 K266 A267 G268 F269	R260-D264 HydrophobicContact CB-CB 3.85Å; R260-D264 WeakPolarHBondContact CD-OD2 3.34Å; R260-D264 HydrophobicContact CG-CB 4.38Å; Y261-D264 PolarHBondContact O-N 3.08Å; Y261-D264 VanDerWaalsContact O-N 3.11Å; W262-D264 VanDerWaalsContact C-N 3.29Å; W262-D264 PolarHBondContact O-N 2.74Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.35Å; D264-A267 PolarHBondContact O-N 3.31Å; D264-G268 CarbonylContact O-C 3.51Å; D264-G268 WeakPolarHBondContact O-CA 3.12Å; D264-G268 PolarHBondContact O-N 2.8Å; D264-F269 HydrophobicContact CB-CD1 4.07Å
265	Y	98.9	Very high	98	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-33.6	176.1	-89.9	-73.9	0	0	0	113	F258 R260 Y261 W262 F269 W277 G279 N280 F350 T352 G372 N384	F258-Y265 PolarHBondContact O-OH 3.19Å; R260-Y265 HydrophobicContact CB-CD2 3.92Å; R260-Y265 HydrophobicContact CB-CE2 3.71Å; R260-Y265 WeakPolarHBondContact O-CE2 3.5Å; Y261-Y265 PolarHBondContact O-N 3.22Å; Y261-Y265 VanDerWaalsContact O-N 3.08Å; W262-Y265 PolarHBondContact O-N 3.5Å; Y265-F269 AromaticContact CD1-CE1 3.79Å; Y265-F269 HydrophobicContact CD1-CE1 3.79Å; Y265-F269 HydrophobicContact CD1-CZ 4.26Å; Y265-F269 HydrophobicContact CD2-CE1 4.2Å; Y265-F269 AromaticContact CE1-CE1 3.76Å; Y265-F269 HydrophobicContact CE1-CE1 3.76Å; Y265-F269 AromaticContact CE1-CZ 3.75Å; Y265-F269 HydrophobicContact CE1-CZ 3.75Å; Y265-F269 HydrophobicContact CE2-CE1 4.18Å; Y265-F269 HydrophobicContact CE2-CZ 4.34Å; Y265-F269 HydrophobicContact CG-CE1 4.01Å; Y265-F269 AromaticContact CZ-CE1 3.98Å; Y265-F269 AromaticContact CZ-CZ 3.81Å; Y265-W277 AromaticContact CD1-CD1 3.56Å; Y265-W277 HydrophobicContact CD1-CD2 4.14Å; Y265-W277 AromaticContact CD1-CE2 3.96Å; Y265-W277 AromaticContact CD1-CG 3.92Å; Y265-W277 HydrophobicContact CD1-CG 3.92Å; Y265-W277 AromaticContact CD1-NE1 3.59Å; Y265-W277 HydrophobicContact CE1-CD2 4.15Å; Y265-W277 HydrophobicContact CE1-CG 4.05Å; Y265-W277 PolarHBondContact O-NE1 2.96Å; Y265-G279 CarbonylContact O-C 3.55Å; Y265-G279 WeakPolarHBondContact O-CA 3.39Å; Y265-N280 VanDerWaalsContact O-CG 3.31Å; Y265-N280 PolarHBondContact O-N 2.81Å; Y265-N280 PolarHBondContact O-OD1 2.96Å; Y265-F350 AromaticContact CD1-CE1 3.72Å; Y265-F350 HydrophobicContact CD1-CE1 3.72Å; Y265-F350 AromaticContact CD1-CZ 3.56Å; Y265-F350 HydrophobicContact CD1-CZ 3.56Å; Y265-F350 HydrophobicContact CD2-CE1 4.3Å; Y265-F350 HydrophobicContact CE1-CE1 4.37Å; Y265-F350 AromaticContact CE1-CZ 3.96Å; Y265-F350 HydrophobicContact CE1-CZ 3.96Å; Y265-F350 AromaticContact CG-CE1 3.68Å; Y265-F350 HydrophobicContact CG-CE1 3.68Å; Y265-F350 HydrophobicContact CG-CZ 4.04Å; Y265-T352 HydrophobicContact CD2-CG2 3.64Å; Y265-T352 HydrophobicContact CE2-CG2 4.34Å; Y265-T352 HydrophobicContact CG-CG2 4.16Å; Y265-G372 VanDerWaalsContact CZ-CA 3.44Å; Y265-G372 PolarHBondContact OH-N 2.96Å; Y265-N384 WeakPolarHBondContact CE1-ND2 3.37Å
266	K	98.8	Very high	98.1	Very high	51 Å²	51	58.9 Å²	58.9	22%	0.222	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-52.2	172.8	167.4	170.7	176.4	78.7	0	111.9	W262 D264 G279 N280 D281 E318 Y322	W262-K266 VanDerWaalsContact O-CB 3.29Å; W262-K266 WeakPolarHBondContact O-CB 3.4Å; W262-K266 PolarHBondContact O-N 2.9Å; D264-K266 VanDerWaalsContact C-N 3.29Å; D264-K266 PolarHBondContact O-N 3.35Å; K266-G279 CarbonylContact O-C 3.41Å; K266-N280 PolarHBondContact O-N 3.44Å; K266-N280 VanDerWaalsContact O-N 3.12Å; K266-D281 WeakPolarHBondContact CE-OD2 3.41Å; K266-D281 VanDerWaalsContact CG-OD2 3.28Å; K266-D281 WeakPolarHBondContact CG-OD2 3.23Å; K266-D281 VanDerWaalsContact NZ-CG 3.28Å; K266-D281 IonicContact NZ-OD1 3.96Å; K266-D281 PolarHBondContact NZ-OD1 2.84Å; K266-D281 IonicContact NZ-OD2 2.93Å; K266-D281 PolarHBondContact NZ-OD2 2.96Å; K266-D281 PolarHBondContact O-N 3.38Å; K266-E318 VanDerWaalsContact CE-OE2 3.25Å; K266-E318 WeakPolarHBondContact CE-OE2 3.23Å; K266-E318 IonicContact NZ-OE2 2.8Å; K266-E318 PolarHBondContact NZ-OE2 3.32Å; K266-Y322 WeakPolarHBondContact CD-OH 3.39Å; K266-Y322 VanDerWaalsContact CG-OH 3.23Å; K266-Y322 WeakPolarHBondContact CG-OH 3.42Å; K266-Y322 PolarHBondContact NZ-OH 3.42Å
267	A	98.6	Very high	98.1	Very high	56 Å²	56	57.9 Å²	57.9	46%	0.463	29%	0.293	S	S	.	.	H	α-helix	trans	-77.3	-31.9	-176.8	0	0	0	0	0	113.9	K263 D264 K282	K263-A267 PolarHBondContact O-N 3.08Å; D264-A267 PolarHBondContact O-N 3.31Å; A267-K282 PolarHBondContact O-NZ 2.79Å
268	G	98.7	Very high	98.2	Very high	21 Å²	21	53.7 Å²	53.7	22%	0.216	27%	0.27	C	S	.	.			trans	94.1	158.2	-168.7	0	0	0	0	0	112.8	D264 W277 L278 G279	D264-G268 CarbonylContact O-C 3.51Å; D264-G268 WeakPolarHBondContact O-CA 3.12Å; D264-G268 PolarHBondContact O-N 2.8Å; G268-W277 CarbonylContact C-O 3.56Å; G268-W277 WeakPolarHBondContact CA-O 3.17Å; G268-L278 WeakPolarHBondContact CA-O 3.45Å; G268-G279 VanDerWaalsContact CA-CA 3.42Å
269	F	98.8	Very high	98.2	Very high	24 Å²	24	53.5 Å²	53.5	11%	0.105	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	164.7	-177.7	56.9	-97.5	0	0	0	111.5	T256 F258 R260 D264 Y265 F276 W277	T256-F269 HydrophobicContact CG2-CD2 3.86Å; T256-F269 HydrophobicContact CG2-CE2 4.17Å; F258-F269 HydrophobicContact CB-CE2 4.43Å; F258-F269 HydrophobicContact CB-CZ 4.47Å; F258-F269 AromaticContact CD1-CE2 3.74Å; F258-F269 HydrophobicContact CD1-CE2 3.74Å; F258-F269 AromaticContact CD1-CZ 3.77Å; F258-F269 HydrophobicContact CD1-CZ 3.77Å; F258-F269 HydrophobicContact CD2-CE2 4.08Å; F258-F269 AromaticContact CE1-CE2 3.9Å; F258-F269 HydrophobicContact CE1-CE2 3.9Å; F258-F269 HydrophobicContact CE1-CZ 4.16Å; F258-F269 HydrophobicContact CE2-CE2 4.21Å; F258-F269 AromaticContact CG-CE2 3.83Å; F258-F269 HydrophobicContact CG-CE2 3.83Å; F258-F269 HydrophobicContact CG-CZ 4.12Å; F258-F269 HydrophobicContact CZ-CE2 4.13Å; R260-F269 HydrophobicContact CB-CD1 4.35Å; R260-F269 HydrophobicContact CB-CE1 3.89Å; R260-F269 HydrophobicContact CB-CZ 4.22Å; R260-F269 HydrophobicContact CG-CD1 4.02Å; R260-F269 HydrophobicContact CG-CD2 4.3Å; R260-F269 HydrophobicContact CG-CE1 3.77Å; R260-F269 HydrophobicContact CG-CE2 4.08Å; R260-F269 HydrophobicContact CG-CG 4.28Å; R260-F269 HydrophobicContact CG-CZ 3.8Å; D264-F269 HydrophobicContact CB-CD1 4.07Å; Y265-F269 AromaticContact CD1-CE1 3.79Å; Y265-F269 HydrophobicContact CD1-CE1 3.79Å; Y265-F269 HydrophobicContact CD1-CZ 4.26Å; Y265-F269 HydrophobicContact CD2-CE1 4.2Å; Y265-F269 AromaticContact CE1-CE1 3.76Å; Y265-F269 HydrophobicContact CE1-CE1 3.76Å; Y265-F269 AromaticContact CE1-CZ 3.75Å; Y265-F269 HydrophobicContact CE1-CZ 3.75Å; Y265-F269 HydrophobicContact CE2-CE1 4.18Å; Y265-F269 HydrophobicContact CE2-CZ 4.34Å; Y265-F269 HydrophobicContact CG-CE1 4.01Å; Y265-F269 AromaticContact CZ-CE1 3.98Å; Y265-F269 AromaticContact CZ-CZ 3.81Å; F269-F276 CarbonylContact O-C 3.59Å; F269-F276 VanDerWaalsContact O-CA 3.24Å; F269-F276 WeakPolarHBondContact O-CA 3.41Å; F269-F276 VanDerWaalsContact O-CB 3.29Å; F269-F276 WeakPolarHBondContact O-CB 3.26Å; F269-W277 HydrophobicContact CD1-CB 4.19Å; F269-W277 HydrophobicContact CD2-CB 4.36Å; F269-W277 HydrophobicContact CE1-CB 3.74Å; F269-W277 HydrophobicContact CE1-CG 4.21Å; F269-W277 HydrophobicContact CE2-CB 3.92Å; F269-W277 HydrophobicContact CG-CB 4.49Å; F269-W277 HydrophobicContact CZ-CB 3.59Å; F269-W277 HydrophobicContact CZ-CG 4.34Å; F269-W277 PolarHBondContact N-O 2.98Å; F269-W277 PolarHBondContact O-N 3.03Å
270	G	98.2	Very high	98.3	Very high	51 Å²	51	50.9 Å²	50.9	53%	0.526	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	96.8	-164.9	178.9	0	0	0	0	0	113.1	E275	G270-E275 CarbonylContact C-O 3.18Å; G270-E275 VanDerWaalsContact CA-O 3.29Å; G270-E275 WeakPolarHBondContact CA-O 3.44Å
271	N	97.9	Very high	98.3	Very high	79 Å²	79	49.4 Å²	49.4	42%	0.422	25%	0.251	S	S	.	.			trans	-114.8	121.5	179.9	-178.2	-18.9	0	0	0	109.5	E273 R274 E275 F276	N271-E273 PolarHBondContact O-N 2.99Å; N271-E273 VanDerWaalsContact O-N 3.14Å; N271-E273 PolarHBondContact OD1-N 2.82Å; N271-R274 HydrophobicContact CB-CB 4.36Å; N271-R274 CarbonylContact O-C 3.59Å; N271-R274 WeakPolarHBondContact O-CA 3.25Å; N271-R274 PolarHBondContact O-N 2.84Å; N271-E275 PolarHBondContact N-O 2.88Å; N271-E275 CarbonylContact O-C 3.53Å; N271-E275 PolarHBondContact O-N 2.94Å; N271-F276 WeakPolarHBondContact O-CD1 3.41Å
272	L	97.4	Very high	98.3	Very high	37 Å²	37	45.5 Å²	45.5	19%	0.194	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-25.6	-178.7	-71.7	176.8	0	0	0	113.8	T220 L233 Y235 F276 L278	T220-L272 HydrophobicContact CG2-CB 3.84Å; T220-L272 HydrophobicContact CG2-CD1 4.19Å; L233-L272 HydrophobicContact CB-CD1 3.66Å; Y235-L272 WeakPolarHBondContact CB-O 3.34Å; Y235-L272 VanDerWaalsContact CD2-O 3.32Å; Y235-L272 WeakPolarHBondContact CD2-O 3.47Å; L272-F276 HydrophobicContact CD2-CD1 4.3Å; L272-F276 HydrophobicContact CD2-CD2 3.6Å; L272-F276 HydrophobicContact CD2-CE1 4.24Å; L272-F276 HydrophobicContact CD2-CE2 3.55Å; L272-F276 HydrophobicContact CD2-CG 3.97Å; L272-F276 HydrophobicContact CD2-CZ 3.87Å; L272-F276 VanDerWaalsContact O-CE1 3.29Å; L272-F276 WeakPolarHBondContact O-CE1 3.3Å; L272-L278 HydrophobicContact CD2-CD1 4.24Å
273	E	94.6	Very high	98.3	Very high	139 Å²	139	44.9 Å²	44.9	65%	0.65	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-8.4	177.3	-60.9	178.3	173.5	0	0	112.8	T220 N271	T220-E273 HydrophobicContact CG2-CG 4.28Å; N271-E273 PolarHBondContact O-N 2.99Å; N271-E273 VanDerWaalsContact O-N 3.14Å; N271-E273 PolarHBondContact OD1-N 2.82Å
274	R	96.3	Very high	98.3	Very high	137 Å²	137	38 Å²	38	52%	0.517	21%	0.206	S	C	.	.	S	Bend	trans	-130.4	-118.8	177	-55	-159.2	92.8	115.7	9	110.6	A250 L252 D253 N271	A250-R274 WeakPolarHBondContact CB-O 3.3Å; L252-R274 HydrophobicContact CD2-CB 4.07Å; L252-R274 VanDerWaalsContact CD2-O 3.23Å; L252-R274 WeakPolarHBondContact CD2-O 3.32Å; D253-R274 IonicContact OD2-NE 2.74Å; D253-R274 IonicContact OD2-NH2 3.93Å; N271-R274 HydrophobicContact CB-CB 4.36Å; N271-R274 CarbonylContact O-C 3.59Å; N271-R274 WeakPolarHBondContact O-CA 3.25Å; N271-R274 PolarHBondContact O-N 2.84Å
275	E	98.6	Very high	98.2	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	20%	0.197	C	C	.	.	S	Bend	trans	-95.9	130.3	-178.6	-63.6	-162.2	142.6	0	0	111	A250 R251 L252 D253 G254 S255 T256 F258 G270 N271	A250-E275 VanDerWaalsContact O-CA 3.25Å; A250-E275 WeakPolarHBondContact O-CA 2.98Å; R251-E275 WeakPolarHBondContact CA-OE1 3.27Å; R251-E275 IonicContact NE-OE1 2.64Å; L252-E275 HydrophobicContact CD2-CB 4.42Å; L252-E275 HydrophobicContact CD2-CG 3.54Å; L252-E275 HydrophobicContact CG-CG 3.62Å; L252-E275 PolarHBondContact N-OE1 2.97Å; D253-E275 PolarHBondContact N-OE1 3Å; G254-E275 VanDerWaalsContact C-OE2 3.3Å; G254-E275 VanDerWaalsContact CA-OE2 3.25Å; G254-E275 WeakPolarHBondContact CA-OE2 3.3Å; G254-E275 PolarHBondContact N-OE1 3.25Å; G254-E275 PolarHBondContact N-OE2 3.21Å; S255-E275 PolarHBondContact N-OE2 3.37Å; S255-E275 VanDerWaalsContact N-OE2 3.1Å; T256-E275 PolarHBondContact N-OE2 2.91Å; T256-E275 PolarHBondContact OG1-O 2.86Å; F258-E275 HydrophobicContact CE2-CB 4.28Å; G270-E275 CarbonylContact C-O 3.18Å; G270-E275 VanDerWaalsContact CA-O 3.29Å; G270-E275 WeakPolarHBondContact CA-O 3.44Å; N271-E275 PolarHBondContact N-O 2.88Å; N271-E275 CarbonylContact O-C 3.53Å; N271-E275 PolarHBondContact O-N 2.94Å
276	F	98.8	Very high	98.2	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.018	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	162.9	179.9	69.3	-85	0	0	0	113.2	V247 Q249 A250 F258 F269 N271 L272 L278	V247-F276 HydrophobicContact CB-CZ 3.94Å; V247-F276 HydrophobicContact CG1-CE1 4.12Å; V247-F276 HydrophobicContact CG1-CZ 3.62Å; Q249-F276 WeakPolarHBondContact CA-O 3.37Å; A250-F276 HydrophobicContact CB-CD1 4.1Å; A250-F276 HydrophobicContact CB-CE1 3.91Å; A250-F276 PolarHBondContact N-O 3.43Å; A250-F276 VanDerWaalsContact N-O 3.16Å; A250-F276 PolarHBondContact O-N 3.47Å; F258-F276 WeakPolarHBondContact CZ-O 3.01Å; F269-F276 CarbonylContact O-C 3.59Å; F269-F276 VanDerWaalsContact O-CA 3.24Å; F269-F276 WeakPolarHBondContact O-CA 3.41Å; F269-F276 VanDerWaalsContact O-CB 3.29Å; F269-F276 WeakPolarHBondContact O-CB 3.26Å; N271-F276 WeakPolarHBondContact O-CD1 3.41Å; L272-F276 HydrophobicContact CD2-CD1 4.3Å; L272-F276 HydrophobicContact CD2-CD2 3.6Å; L272-F276 HydrophobicContact CD2-CE1 4.24Å; L272-F276 HydrophobicContact CD2-CE2 3.55Å; L272-F276 HydrophobicContact CD2-CG 3.97Å; L272-F276 HydrophobicContact CD2-CZ 3.87Å; L272-F276 VanDerWaalsContact O-CE1 3.29Å; L272-F276 WeakPolarHBondContact O-CE1 3.3Å; F276-L278 HydrophobicContact CD2-CB 4.42Å; F276-L278 HydrophobicContact CE2-CB 4.19Å
277	W	98.9	Very high	98.1	Very high	3 Å²	3	34.3 Å²	34.3	1%	0.011	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	122.9	159.3	-179.7	-103.7	0	0	0	107.9	Q249 F258 Y265 G268 F269 G279 N280 I283 F350 W373 W374 M424	Q249-W277 HydrophobicContact CB-CE3 3.68Å; Q249-W277 HydrophobicContact CB-CZ3 3.78Å; Q249-W277 HydrophobicContact CG-CE3 3.53Å; Q249-W277 HydrophobicContact CG-CZ3 3.83Å; F258-W277 HydrophobicContact CE1-CB 4.15Å; Y265-W277 AromaticContact CD1-CD1 3.56Å; Y265-W277 HydrophobicContact CD1-CD2 4.14Å; Y265-W277 AromaticContact CD1-CE2 3.96Å; Y265-W277 AromaticContact CD1-CG 3.92Å; Y265-W277 HydrophobicContact CD1-CG 3.92Å; Y265-W277 AromaticContact CD1-NE1 3.59Å; Y265-W277 HydrophobicContact CE1-CD2 4.15Å; Y265-W277 HydrophobicContact CE1-CG 4.05Å; Y265-W277 PolarHBondContact O-NE1 2.96Å; G268-W277 CarbonylContact C-O 3.56Å; G268-W277 WeakPolarHBondContact CA-O 3.17Å; F269-W277 HydrophobicContact CD1-CB 4.19Å; F269-W277 HydrophobicContact CD2-CB 4.36Å; F269-W277 HydrophobicContact CE1-CB 3.74Å; F269-W277 HydrophobicContact CE1-CG 4.21Å; F269-W277 HydrophobicContact CE2-CB 3.92Å; F269-W277 HydrophobicContact CG-CB 4.49Å; F269-W277 HydrophobicContact CZ-CB 3.59Å; F269-W277 HydrophobicContact CZ-CG 4.34Å; F269-W277 PolarHBondContact N-O 2.98Å; F269-W277 PolarHBondContact O-N 3.03Å; W277-G279 VanDerWaalsContact C-N 3.25Å; W277-G279 PolarHBondContact O-N 2.92Å; W277-N280 VanDerWaalsContact CE2-OD1 3.25Å; W277-N280 WeakPolarHBondContact CZ2-OD1 3.45Å; W277-N280 PolarHBondContact NE1-OD1 2.83Å; W277-I283 HydrophobicContact CH2-CD1 4.04Å; W277-I283 HydrophobicContact CZ2-CD1 3.5Å; W277-I283 VanDerWaalsContact CZ2-CD1 3.5Å; W277-F350 HydrophobicContact CH2-CE2 4.41Å; W277-F350 HydrophobicContact CZ2-CE2 4.04Å; W277-F350 HydrophobicContact CZ2-CZ 4.17Å; W277-W373 HydrophobicContact CZ3-CZ3 4.4Å; W277-W374 AromaticContact CH2-CH2 3.83Å; W277-W374 HydrophobicContact CH2-CH2 3.83Å; W277-W374 HydrophobicContact CH2-CZ3 4.18Å; W277-W374 HydrophobicContact CZ2-CH2 4.36Å; W277-M424 HydrophobicContact CZ3-SD 4.26Å
278	L	98.8	Very high	98	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	19%	0.191	C	C	.	.			trans	-60.7	-37	-171.6	-178.3	62	0	0	0	112.5	V234 L248 G268 L272 F276 K282 I283 L286	V234-L278 HydrophobicContact CG1-CD1 4Å; V234-L278 HydrophobicContact CG1-CD2 4.11Å; L248-L278 HydrophobicContact CD2-CD2 3.8Å; L248-L278 VanDerWaalsContact O-CB 3.27Å; L248-L278 WeakPolarHBondContact O-CB 3.17Å; L248-L278 PolarHBondContact O-N 3.29Å; G268-L278 WeakPolarHBondContact CA-O 3.45Å; L272-L278 HydrophobicContact CD2-CD1 4.24Å; F276-L278 HydrophobicContact CD2-CB 4.42Å; F276-L278 HydrophobicContact CE2-CB 4.19Å; L278-K282 HydrophobicContact CD1-CD 4.07Å; L278-K282 HydrophobicContact CD2-CB 4.24Å; L278-K282 HydrophobicContact CG-CB 4.01Å; L278-K282 HydrophobicContact CG-CD 4.15Å; L278-K282 WeakPolarHBondContact O-CD 3.39Å; L278-K282 PolarHBondContact O-NZ 3.42Å; L278-I283 HydrophobicContact CB-CG1 4.28Å; L278-I283 HydrophobicContact CD2-CG1 4.28Å; L278-L286 HydrophobicContact CD2-CD1 3.62Å
279	G	98.8	Very high	97.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.193	C	C	.	.			trans	117.6	131.7	-176.9	0	0	0	0	0	111.8	Y265 K266 G268 W277 D281 K282 I283	Y265-G279 CarbonylContact O-C 3.55Å; Y265-G279 WeakPolarHBondContact O-CA 3.39Å; K266-G279 CarbonylContact O-C 3.41Å; G268-G279 VanDerWaalsContact CA-CA 3.42Å; W277-G279 VanDerWaalsContact C-N 3.25Å; W277-G279 PolarHBondContact O-N 2.92Å; G279-D281 VanDerWaalsContact C-N 3.3Å; G279-D281 PolarHBondContact O-N 3.07Å; G279-K282 PolarHBondContact O-N 3.21Å; G279-K282 VanDerWaalsContact O-N 3.09Å; G279-I283 VanDerWaalsContact O-CG1 3.3Å; G279-I283 WeakPolarHBondContact O-CG1 3.46Å; G279-I283 PolarHBondContact O-N 3.12Å
280	N	98.9	Very high	97.4	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.9	-34.9	-173.2	-63.5	-10.6	0	0	0	112.6	Y265 K266 W277 K282 I283 H284 Y322 F350	Y265-N280 VanDerWaalsContact O-CG 3.31Å; Y265-N280 PolarHBondContact O-N 2.81Å; Y265-N280 PolarHBondContact O-OD1 2.96Å; K266-N280 PolarHBondContact O-N 3.44Å; K266-N280 VanDerWaalsContact O-N 3.12Å; W277-N280 VanDerWaalsContact CE2-OD1 3.25Å; W277-N280 WeakPolarHBondContact CZ2-OD1 3.45Å; W277-N280 PolarHBondContact NE1-OD1 2.83Å; N280-K282 VanDerWaalsContact C-N 3.34Å; N280-K282 PolarHBondContact O-N 3.07Å; N280-I283 PolarHBondContact O-N 3.03Å; N280-H284 WeakPolarHBondContact O-CB 3.41Å; N280-H284 PolarHBondContact O-N 3.49Å; N280-Y322 HydrophobicContact CB-CD1 3.48Å; N280-Y322 VanDerWaalsContact CB-CD1 3.48Å; N280-Y322 HydrophobicContact CB-CD2 3.71Å; N280-Y322 HydrophobicContact CB-CE1 3.52Å; N280-Y322 HydrophobicContact CB-CE2 3.75Å; N280-Y322 HydrophobicContact CB-CG 3.57Å; N280-Y322 WeakPolarHBondContact ND2-CD2 3.48Å; N280-F350 WeakPolarHBondContact ND2-CD1 3.19Å; N280-F350 WeakPolarHBondContact ND2-CE1 3.43Å
281	D	98.5	Very high	97.3	Very high	54 Å²	54	43.4 Å²	43.4	29%	0.289	20%	0.203	S	C	.	.	H	α-helix	trans	-62.6	-42.6	175.2	-77.2	-13.8	0	0	0	111.3	K266 G279 H284 L285 Y322	K266-D281 WeakPolarHBondContact CE-OD2 3.41Å; K266-D281 VanDerWaalsContact CG-OD2 3.28Å; K266-D281 WeakPolarHBondContact CG-OD2 3.23Å; K266-D281 VanDerWaalsContact NZ-CG 3.28Å; K266-D281 IonicContact NZ-OD1 3.96Å; K266-D281 PolarHBondContact NZ-OD1 2.84Å; K266-D281 IonicContact NZ-OD2 2.93Å; K266-D281 PolarHBondContact NZ-OD2 2.96Å; K266-D281 PolarHBondContact O-N 3.38Å; G279-D281 VanDerWaalsContact C-N 3.3Å; G279-D281 PolarHBondContact O-N 3.07Å; D281-H284 PolarHBondContact O-N 3.12Å; D281-L285 WeakPolarHBondContact O-CG 3.45Å; D281-L285 PolarHBondContact O-N 2.83Å; D281-Y322 WeakPolarHBondContact OD1-CE1 3.36Å; D281-Y322 PolarHBondContact OD1-OH 3.2Å
282	K	98.6	Very high	97.3	Very high	59 Å²	59	39.9 Å²	39.9	26%	0.257	18%	0.184	S	C	.	.	H	α-helix	trans	-69.9	-40.9	179.7	-63.4	178.1	-163.6	138.3	0	111.6	F232 A267 L278 G279 N280 H284 L285 L286	F232-K282 HydrophobicContact CB-CD 4.18Å; F232-K282 HydrophobicContact CD1-CD 4.4Å; F232-K282 HydrophobicContact CD1-CG 4.09Å; F232-K282 HydrophobicContact CD2-CB 4.24Å; F232-K282 HydrophobicContact CD2-CD 3.66Å; F232-K282 HydrophobicContact CD2-CG 4.02Å; F232-K282 HydrophobicContact CE1-CB 4.22Å; F232-K282 HydrophobicContact CE1-CG 4.11Å; F232-K282 HydrophobicContact CE2-CB 3.77Å; F232-K282 HydrophobicContact CE2-CD 4.06Å; F232-K282 HydrophobicContact CE2-CG 4.03Å; F232-K282 HydrophobicContact CG-CD 3.83Å; F232-K282 HydrophobicContact CG-CG 4.03Å; F232-K282 HydrophobicContact CZ-CB 3.74Å; F232-K282 HydrophobicContact CZ-CG 4.07Å; A267-K282 PolarHBondContact O-NZ 2.79Å; L278-K282 HydrophobicContact CD1-CD 4.07Å; L278-K282 HydrophobicContact CD2-CB 4.24Å; L278-K282 HydrophobicContact CG-CB 4.01Å; L278-K282 HydrophobicContact CG-CD 4.15Å; L278-K282 WeakPolarHBondContact O-CD 3.39Å; L278-K282 PolarHBondContact O-NZ 3.42Å; G279-K282 PolarHBondContact O-N 3.21Å; G279-K282 VanDerWaalsContact O-N 3.09Å; N280-K282 VanDerWaalsContact C-N 3.34Å; N280-K282 PolarHBondContact O-N 3.07Å; K282-H284 VanDerWaalsContact C-N 3.33Å; K282-L285 PolarHBondContact O-N 3.12Å; K282-L286 WeakPolarHBondContact O-CG 3.34Å; K282-L286 PolarHBondContact O-N 2.96Å
283	I	98.8	Very high	97.3	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	18%	0.181	C	C	.	.	H	α-helix	trans	-62.9	-42.3	175.9	-62.4	165.1	0	0	0	110.4	L248 W277 L278 G279 N280 L286 T287 F313 V315	L248-I283 HydrophobicContact CB-CD1 4.4Å; L248-I283 HydrophobicContact CB-CG1 4.44Å; L248-I283 HydrophobicContact CD1-CG1 4.34Å; L248-I283 HydrophobicContact CD1-CG2 3.95Å; L248-I283 HydrophobicContact CD2-CG1 4.15Å; W277-I283 HydrophobicContact CH2-CD1 4.04Å; W277-I283 HydrophobicContact CZ2-CD1 3.5Å; W277-I283 VanDerWaalsContact CZ2-CD1 3.5Å; L278-I283 HydrophobicContact CB-CG1 4.28Å; L278-I283 HydrophobicContact CD2-CG1 4.28Å; G279-I283 VanDerWaalsContact O-CG1 3.3Å; G279-I283 WeakPolarHBondContact O-CG1 3.46Å; G279-I283 PolarHBondContact O-N 3.12Å; N280-I283 PolarHBondContact O-N 3.03Å; I283-L286 PolarHBondContact O-N 3.24Å; I283-T287 HydrophobicContact CG2-CG2 4.32Å; I283-T287 WeakPolarHBondContact O-CB 3.34Å; I283-T287 WeakPolarHBondContact O-CG2 3.33Å; I283-T287 PolarHBondContact O-N 3.05Å; I283-T287 PolarHBondContact O-OG1 2.83Å; I283-F313 HydrophobicContact CG2-CE1 3.95Å; I283-F313 HydrophobicContact CG2-CZ 4.16Å; I283-V315 HydrophobicContact CG2-CB 3.98Å; I283-V315 HydrophobicContact CG2-CG1 4.49Å; I283-V315 HydrophobicContact CG2-CG2 3.61Å
284	H	98.5	Very high	97.5	Very high	23 Å²	23	32.6 Å²	32.6	11%	0.106	15%	0.15	C	C	.	.	H	α-helix	trans	-58.3	-49.3	173.6	171.4	58.8	0	0	0	111.5	N280 D281 K282 L286 T287 K288 V315 A316 N317	N280-H284 WeakPolarHBondContact O-CB 3.41Å; N280-H284 PolarHBondContact O-N 3.49Å; D281-H284 PolarHBondContact O-N 3.12Å; K282-H284 VanDerWaalsContact C-N 3.33Å; H284-L286 VanDerWaalsContact C-N 3.33Å; H284-L286 PolarHBondContact O-N 2.83Å; H284-T287 PolarHBondContact O-N 3Å; H284-T287 PolarHBondContact O-OG1 2.88Å; H284-K288 WeakPolarHBondContact O-CB 3.38Å; H284-K288 PolarHBondContact O-N 2.92Å; H284-V315 PolarHBondContact ND1-O 3.34Å; H284-A316 VanDerWaalsContact ND1-C 3.3Å; H284-A316 PolarHBondContact ND1-O 3.23Å; H284-N317 PolarHBondContact ND1-N 2.87Å
285	L	97.4	Very high	97.6	Very high	22 Å²	22	27 Å²	27	12%	0.115	13%	0.129	C	C	.	.	H	α-helix	trans	-59.7	-42.3	179.3	-69.6	173.2	0	0	0	112.5	P225 D226 N229 F232 D281 K282 S289	P225-L285 HydrophobicContact CB-CB 4.36Å; P225-L285 HydrophobicContact CG-CB 4.42Å; D226-L285 HydrophobicContact CB-CD2 4.21Å; N229-L285 HydrophobicContact CB-CD1 4.11Å; F232-L285 HydrophobicContact CE1-CD1 4.17Å; D281-L285 WeakPolarHBondContact O-CG 3.45Å; D281-L285 PolarHBondContact O-N 2.83Å; K282-L285 PolarHBondContact O-N 3.12Å; L285-S289 WeakPolarHBondContact O-CB 3.32Å; L285-S289 PolarHBondContact O-N 3.29Å
286	L	98	Very high	97.6	Very high	0 Å²	0	27 Å²	27	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.4	-48.9	177.2	-73.9	162.4	0	0	0	111.8	D206 V223 P225 F232 T246 L248 L278 K282 I283 H284 K288 S289 M292 I426	D206-L286 HydrophobicContact CB-CD2 4.12Å; V223-L286 HydrophobicContact CG2-CD2 4.5Å; P225-L286 HydrophobicContact CB-CD2 4.29Å; P225-L286 HydrophobicContact CG-CD2 3.58Å; P225-L286 HydrophobicContact CG-CG 3.95Å; F232-L286 HydrophobicContact CE2-CD1 4.21Å; F232-L286 HydrophobicContact CE2-CG 4.44Å; F232-L286 HydrophobicContact CZ-CD1 4.3Å; F232-L286 HydrophobicContact CZ-CG 4.1Å; T246-L286 HydrophobicContact CG2-CD1 4.04Å; L248-L286 HydrophobicContact CD2-CD1 4.14Å; L278-L286 HydrophobicContact CD2-CD1 3.62Å; K282-L286 WeakPolarHBondContact O-CG 3.34Å; K282-L286 PolarHBondContact O-N 2.96Å; I283-L286 PolarHBondContact O-N 3.24Å; H284-L286 VanDerWaalsContact C-N 3.33Å; H284-L286 PolarHBondContact O-N 2.83Å; L286-K288 VanDerWaalsContact C-N 3.35Å; L286-K288 PolarHBondContact O-N 2.79Å; L286-S289 WeakPolarHBondContact O-CB 3.42Å; L286-S289 PolarHBondContact O-N 2.98Å; L286-M292 WeakPolarHBondContact O-CE 3.29Å; L286-I426 HydrophobicContact CB-CD1 3.89Å; L286-I426 HydrophobicContact CD1-CD1 4.39Å
287	T	97.8	Very high	97.6	Very high	6 Å²	6	28.4 Å²	28.4	4%	0.037	14%	0.137	C	C	.	.	H	α-helix	trans	-76.8	-19.6	-176.1	56.8	0	0	0	0	114.1	I283 H284 M292 F313 V315 I426	I283-T287 HydrophobicContact CG2-CG2 4.32Å; I283-T287 WeakPolarHBondContact O-CB 3.34Å; I283-T287 WeakPolarHBondContact O-CG2 3.33Å; I283-T287 PolarHBondContact O-N 3.05Å; I283-T287 PolarHBondContact O-OG1 2.83Å; H284-T287 PolarHBondContact O-N 3Å; H284-T287 PolarHBondContact O-OG1 2.88Å; T287-M292 HydrophobicContact CG2-CG 4.39Å; T287-F313 HydrophobicContact CG2-CD1 3.43Å; T287-F313 VanDerWaalsContact CG2-CD1 3.43Å; T287-F313 HydrophobicContact CG2-CE1 3.52Å; T287-V315 PolarHBondContact OG1-N 2.87Å; T287-I426 HydrophobicContact CG2-CD1 4.18Å
288	K	95.8	Very high	97.5	Very high	121 Å²	121	28.5 Å²	28.5	53%	0.526	14%	0.137	S	C	.	.	H	α-helix	trans	-75.6	-30.7	169.9	-177.4	-171.6	171.4	-160.2	0	112	D226 H284 L286 Y314	D226-K288 IonicContact OD2-NZ 3.52Å; H284-K288 WeakPolarHBondContact O-CB 3.38Å; H284-K288 PolarHBondContact O-N 2.92Å; L286-K288 VanDerWaalsContact C-N 3.35Å; L286-K288 PolarHBondContact O-N 2.79Å; K288-Y314 HydrophobicContact CB-CE2 4.46Å
289	S	91.6	Very high	97.5	Very high	37 Å²	37	28.7 Å²	28.7	26%	0.259	14%	0.138	S	C	.	.	H	α-helix	trans	-69.6	-37.7	-171.8	-166.8	0	0	0	0	113.3	P225 L285 L286	P225-S289 PolarHBondContact O-OG 3.04Å; L285-S289 WeakPolarHBondContact O-CB 3.32Å; L285-S289 PolarHBondContact O-N 3.29Å; L286-S289 WeakPolarHBondContact O-CB 3.42Å; L286-S289 PolarHBondContact O-N 2.98Å
290	K	92.4	Very high	97.3	Very high	59 Å²	59	29.9 Å²	29.9	26%	0.257	15%	0.145	S	C	.	.	S	Bend	trans	-149.4	161.3	-179.4	-58.3	174.5	-173.2	161	0	109.4	D206 D209 M292 P428	D206-K290 IonicContact OD1-NZ 3.94Å; D206-K290 IonicContact OD2-NZ 3.42Å; D206-K290 PolarHBondContact OD2-NZ 3.38Å; D209-K290 IonicContact OD1-NZ 3.65Å; D209-K290 PolarHBondContact OD1-NZ 3.33Å; D209-K290 IonicContact OD2-NZ 3.03Å; D209-K290 PolarHBondContact OD2-NZ 2.91Å; K290-M292 HydrophobicContact CB-CE 3.91Å; K290-M292 HydrophobicContact CB-SD 4.48Å; K290-M292 HydrophobicContact CD-CE 4.48Å; K290-M292 WeakPolarHBondContact O-CG 3.42Å; K290-M292 PolarHBondContact O-N 2.9Å; K290-P428 HydrophobicContact CD-CB 4.29Å; K290-P428 HydrophobicContact CD-CG 3.9Å
291	E	95.9	Very high	97	Very high	126 Å²	126	34.4 Å²	34.4	59%	0.589	17%	0.165	S	C	*	.			trans	-65.8	117.3	166.8	-65.3	-176.3	158.6	0	0	110	P428 K429	E291-P428 CarbonylContact O-C 3.59Å; E291-P428 WeakPolarHBondContact O-CA 3.39Å; E291-K429 HydrophobicContact CB-CB 4.28Å; E291-K429 PolarHBondContact O-N 2.92Å
292	M	97.9	Very high	96.7	Very high	5 Å²	5	40.9 Å²	40.9	3%	0.025	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	143.3	-176.4	-62.4	-62.7	-177.2	0	0	111.1	L286 T287 K290 E312 F313 I426 R427 P428	L286-M292 WeakPolarHBondContact O-CE 3.29Å; T287-M292 HydrophobicContact CG2-CG 4.39Å; K290-M292 HydrophobicContact CB-CE 3.91Å; K290-M292 HydrophobicContact CB-SD 4.48Å; K290-M292 HydrophobicContact CD-CE 4.48Å; K290-M292 WeakPolarHBondContact O-CG 3.42Å; K290-M292 PolarHBondContact O-N 2.9Å; M292-E312 CarbonylContact O-C 3.6Å; M292-E312 WeakPolarHBondContact O-CA 3.43Å; M292-F313 PolarHBondContact O-N 2.76Å; M292-I426 HydrophobicContact CB-CB 4.31Å; M292-I426 HydrophobicContact CG-CD1 4.14Å; M292-I426 HydrophobicContact SD-CD1 4.45Å; M292-R427 CarbonylContact C-O 3.54Å; M292-R427 WeakPolarHBondContact CA-O 3.49Å; M292-R427 VanDerWaalsContact SD-C 3.59Å; M292-P428 HydrophobicContact CE-CG 4.38Å; M292-P428 HydrophobicContact SD-CB 4.38Å; M292-P428 HydrophobicContact SD-CG 3.97Å
293	I	98.3	Very high	96.5	Very high	23 Å²	23	40 Å²	40	12%	0.118	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	146.8	161.2	61.4	172.4	0	0	0	109.1	W245 L309 Y310 I426 R427 K429	W245-I293 HydrophobicContact CH2-CD1 3.61Å; W245-I293 HydrophobicContact CH2-CG1 4.07Å; W245-I293 HydrophobicContact CZ3-CD1 4.13Å; W245-I293 HydrophobicContact CZ3-CG1 4.07Å; I293-L309 HydrophobicContact CD1-CD1 4.35Å; I293-Y310 WeakPolarHBondContact CA-O 3.35Å; I293-Y310 WeakPolarHBondContact CB-O 3.3Å; I293-I426 WeakPolarHBondContact O-CA 3.36Å; I293-I426 WeakPolarHBondContact O-CB 3.49Å; I293-R427 HydrophobicContact CG1-CB 4.17Å; I293-R427 VanDerWaalsContact CG1-O 3.25Å; I293-R427 WeakPolarHBondContact CG1-O 3.43Å; I293-R427 PolarHBondContact N-O 2.57Å; I293-R427 PolarHBondContact O-N 3.12Å; I293-K429 HydrophobicContact CG2-CB 3.98Å; I293-K429 HydrophobicContact CG2-CG 3.99Å
294	L	98.7	Very high	96.4	Very high	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	133.5	172	170.3	71.7	0	0	0	109.9	I296 L309 Y310 F313 L337 M424 I426	L294-I296 HydrophobicContact CD1-CG1 4.29Å; L294-I296 HydrophobicContact CD2-CD1 4.02Å; L294-I296 HydrophobicContact CD2-CG1 4.13Å; L294-I296 HydrophobicContact CG-CG1 4.09Å; L294-L309 CarbonylContact O-C 3.52Å; L294-L309 WeakPolarHBondContact O-CA 3.31Å; L294-Y310 HydrophobicContact CD2-CD2 3.99Å; L294-Y310 HydrophobicContact CG-CD2 4.38Å; L294-Y310 PolarHBondContact N-O 3.26Å; L294-Y310 PolarHBondContact O-N 3.43Å; L294-F313 HydrophobicContact CB-CB 3.52Å; L294-F313 HydrophobicContact CB-CD1 4.35Å; L294-F313 HydrophobicContact CB-CD2 3.85Å; L294-F313 HydrophobicContact CB-CG 3.65Å; L294-F313 HydrophobicContact CD1-CD2 4.38Å; L294-F313 HydrophobicContact CD1-CE2 4.37Å; L294-F313 HydrophobicContact CD1-CG 4.49Å; L294-F313 HydrophobicContact CD2-CD2 3.59Å; L294-F313 HydrophobicContact CD2-CE2 3.83Å; L294-F313 HydrophobicContact CD2-CG 4.28Å; L294-F313 HydrophobicContact CG-CD2 4.15Å; L294-F313 HydrophobicContact CG-CG 4.36Å; L294-L337 HydrophobicContact CD2-CD1 4.41Å; L294-M424 HydrophobicContact CD1-CB 4.32Å; L294-M424 HydrophobicContact CD1-CE 4.05Å; L294-M424 HydrophobicContact CD2-CE 4.24Å; L294-I426 HydrophobicContact CB-CG2 4.41Å; L294-I426 HydrophobicContact CD1-CG2 4.01Å
295	R	98.3	Very high	96.3	Very high	18 Å²	18	48.8 Å²	48.8	7%	0.068	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	136.6	167.9	-178.7	176.2	173.2	100.7	6.8	110.2	M241 W245 D297 A308 L309 M424 M425	M241-R295 PolarHBondContact SD-NH1 2.81Å; M241-R295 PolarHBondContact SD-NH2 2.77Å; M241-R295 VanDerWaalsContact SD-NH2 3.43Å; W245-R295 HydrophobicContact CE3-CB 4.34Å; W245-R295 HydrophobicContact CH2-CB 3.72Å; W245-R295 HydrophobicContact CZ2-CB 4.44Å; W245-R295 HydrophobicContact CZ3-CB 3.66Å; R295-D297 IonicContact CZ-OD1 3.23Å; R295-D297 IonicContact CZ-OD2 4Å; R295-D297 IonicContact NE-OD1 2.75Å; R295-D297 PolarHBondContact NE-OD1 3.25Å; R295-D297 IonicContact NE-OD2 3.51Å; R295-D297 PolarHBondContact NE-OD2 3.08Å; R295-D297 IonicContact NH2-OD1 3.85Å; R295-D297 PolarHBondContact NH2-OD1 2.87Å; R295-D297 IonicContact NH2-OD2 3.81Å; R295-A308 CarbonylContact C-O 3.57Å; R295-A308 WeakPolarHBondContact CA-O 3.18Å; R295-L309 HydrophobicContact CB-CD1 3.92Å; R295-L309 HydrophobicContact CG-CD1 4.36Å; R295-M424 WeakPolarHBondContact O-CA 3.15Å; R295-M425 HydrophobicContact CB-CG 4.11Å; R295-M425 VanDerWaalsContact CD-CE 3.45Å; R295-M425 HydrophobicContact CG-CE 4.03Å; R295-M425 PolarHBondContact N-O 3.23Å; R295-M425 PolarHBondContact O-N 2.89Å
296	I	98.7	Very high	96.3	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	117.6	174.5	-56	176.1	0	0	0	107.6	L294 L298 Y307 A308 Y310 L337 L383 W401 K423 M424	L294-I296 HydrophobicContact CD1-CG1 4.29Å; L294-I296 HydrophobicContact CD2-CD1 4.02Å; L294-I296 HydrophobicContact CD2-CG1 4.13Å; L294-I296 HydrophobicContact CG-CG1 4.09Å; I296-L298 HydrophobicContact CG2-CD1 4.49Å; I296-L298 HydrophobicContact CG2-CD2 4.14Å; I296-L298 HydrophobicContact CG2-CG 4.05Å; I296-Y307 CarbonylContact O-C 3.56Å; I296-Y307 WeakPolarHBondContact O-CA 3.48Å; I296-Y307 WeakPolarHBondContact O-CB 3.18Å; I296-A308 HydrophobicContact CB-CB 4.37Å; I296-A308 PolarHBondContact N-O 2.88Å; I296-A308 PolarHBondContact O-N 2.81Å; I296-Y310 HydrophobicContact CD1-CE2 4.29Å; I296-L337 HydrophobicContact CD1-CD1 4.25Å; I296-L383 HydrophobicContact CD1-CD1 4.17Å; I296-L383 HydrophobicContact CG2-CD1 3.54Å; I296-W401 HydrophobicContact CD1-CH2 3.6Å; I296-W401 HydrophobicContact CD1-CZ3 3.83Å; I296-K423 CarbonylContact C-O 3.36Å; I296-K423 VanDerWaalsContact CA-O 3.29Å; I296-K423 WeakPolarHBondContact CA-O 3.33Å; I296-M424 HydrophobicContact CD1-CE 4.44Å; I296-M424 HydrophobicContact CG1-CG 4.2Å
297	D	98.4	Very high	96.3	Very high	35 Å²	35	52.3 Å²	52.3	19%	0.187	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	133.6	172.6	-70.5	-30.1	0	0	0	109.7	R295 Y307 A422 K423 M425	R295-D297 IonicContact CZ-OD1 3.23Å; R295-D297 IonicContact CZ-OD2 4Å; R295-D297 IonicContact NE-OD1 2.75Å; R295-D297 PolarHBondContact NE-OD1 3.25Å; R295-D297 IonicContact NE-OD2 3.51Å; R295-D297 PolarHBondContact NE-OD2 3.08Å; R295-D297 IonicContact NH2-OD1 3.85Å; R295-D297 PolarHBondContact NH2-OD1 2.87Å; R295-D297 IonicContact NH2-OD2 3.81Å; D297-Y307 WeakPolarHBondContact OD1-CB 3.26Å; D297-A422 CarbonylContact O-C 3.53Å; D297-A422 WeakPolarHBondContact O-CA 3.27Å; D297-K423 PolarHBondContact N-O 3.34Å; D297-K423 PolarHBondContact O-N 3.05Å; D297-M425 WeakPolarHBondContact OD2-CE 3.39Å
298	L	98.3	Very high	96.4	Very high	4 Å²	4	52 Å²	52	2%	0.021	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	137.7	-176.3	-65.5	171.9	0	0	0	110.4	I296 K305 L306 A333 L383 W401 W404 F419 Q421 A422	I296-L298 HydrophobicContact CG2-CD1 4.49Å; I296-L298 HydrophobicContact CG2-CD2 4.14Å; I296-L298 HydrophobicContact CG2-CG 4.05Å; L298-K305 VanDerWaalsContact O-CA 3.31Å; L298-K305 WeakPolarHBondContact O-CA 3.36Å; L298-L306 PolarHBondContact N-O 3.07Å; L298-L306 PolarHBondContact O-N 2.8Å; L298-L306 VanDerWaalsContact O-N 3.08Å; L298-A333 HydrophobicContact CD1-CB 4.4Å; L298-L383 HydrophobicContact CD2-CD2 3.74Å; L298-W401 HydrophobicContact CD1-CB 3.84Å; L298-W401 HydrophobicContact CD1-CD2 3.7Å; L298-W401 HydrophobicContact CD1-CE3 4.18Å; L298-W401 HydrophobicContact CD1-CG 3.55Å; L298-W404 HydrophobicContact CB-CE3 4.49Å; L298-W404 HydrophobicContact CB-CH2 4.08Å; L298-W404 HydrophobicContact CB-CZ3 3.63Å; L298-W404 HydrophobicContact CD1-CE3 4.22Å; L298-W404 HydrophobicContact CD1-CZ3 4.05Å; L298-W404 HydrophobicContact CG-CZ3 4.5Å; L298-F419 HydrophobicContact CB-CD1 3.97Å; L298-F419 HydrophobicContact CB-CE1 3.9Å; L298-F419 HydrophobicContact CD1-CE1 4.29Å; L298-F419 HydrophobicContact CD1-CZ 4.22Å; L298-F419 HydrophobicContact CD2-CD1 4.35Å; L298-F419 HydrophobicContact CD2-CG 4.33Å; L298-F419 HydrophobicContact CG-CE1 4.5Å; L298-Q421 WeakPolarHBondContact CA-O 3.31Å; L298-A422 HydrophobicContact CD2-CB 3.72Å
299	E	97.3	Very high	96.5	Very high	9 Å²	9	48.1 Å²	48.1	4%	0.042	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	128.2	173.4	-173.6	179	147.6	0	0	110.6	L304 K305 R420 Q421	E299-L304 WeakPolarHBondContact CA-O 3.02Å; E299-K305 HydrophobicContact CB-CG 4.14Å; E299-K305 HydrophobicContact CG-CG 3.84Å; E299-K305 WeakPolarHBondContact OE2-CE 3.44Å; E299-K305 IonicContact OE2-NZ 3.56Å; E299-K305 PolarHBondContact OE2-NZ 2.88Å; E299-R420 WeakPolarHBondContact O-CB 3Å; E299-R420 PolarHBondContact O-N 3.35Å; E299-R420 IonicContact OE1-CZ 3.64Å; E299-R420 IonicContact OE1-NH1 2.68Å; E299-R420 PolarHBondContact OE1-NH1 2.99Å; E299-Q421 HydrophobicContact CB-CB 3.96Å; E299-Q421 HydrophobicContact CB-CG 4.35Å; E299-Q421 PolarHBondContact N-O 2.93Å; E299-Q421 PolarHBondContact O-N 2.87Å; E299-Q421 PolarHBondContact OE2-OE1 3.05Å
300	D	94.6	Very high	96.8	Very high	25 Å²	25	46.4 Å²	46.4	13%	0.134	22%	0.223	C	C	.	.			trans	-87.8	170.5	173.1	78.5	9.6	0	0	0	112.7	K302 G303 L304 W404 F419	D300-K302 PolarHBondContact O-N 3.36Å; D300-K302 VanDerWaalsContact O-N 3.15Å; D300-K302 VanDerWaalsContact OD1-CA 3.31Å; D300-K302 WeakPolarHBondContact OD1-CA 3.04Å; D300-K302 WeakPolarHBondContact OD1-CB 3.31Å; D300-K302 PolarHBondContact OD1-N 3.16Å; D300-G303 PolarHBondContact O-N 2.91Å; D300-G303 PolarHBondContact OD1-N 3.5Å; D300-L304 PolarHBondContact N-O 2.89Å; D300-L304 VanDerWaalsContact N-O 3.1Å; D300-L304 PolarHBondContact OD1-N 2.81Å; D300-W404 HydrophobicContact CB-CZ2 4.13Å; D300-F419 HydrophobicContact CB-CD1 4.44Å
301	F	92.6	Very high	97.1	Very high	95 Å²	95	45.7 Å²	45.7	42%	0.417	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-6	178.7	-75.2	-83.4	0	0	0	114.4	Y387 Y388 S418 R420	F301-Y387 HydrophobicContact CZ-CE1 4.19Å; F301-Y388 WeakPolarHBondContact CE2-O 3.46Å; F301-Y388 WeakPolarHBondContact CZ-O 3.46Å; F301-S418 WeakPolarHBondContact CD2-O 3.35Å; F301-S418 WeakPolarHBondContact CE2-O 3.45Å; F301-R420 HydrophobicContact CD1-CB 3.98Å; F301-R420 HydrophobicContact CD1-CG 4.11Å; F301-R420 HydrophobicContact CD2-CB 4.13Å; F301-R420 HydrophobicContact CE1-CB 3.96Å; F301-R420 HydrophobicContact CE1-CG 3.95Å; F301-R420 HydrophobicContact CE2-CB 4.11Å; F301-R420 HydrophobicContact CG-CB 4.06Å; F301-R420 HydrophobicContact CZ-CB 4.03Å; F301-R420 HydrophobicContact CZ-CG 4.37Å
302	K	92.5	Very high	97.2	Very high	189 Å²	189	43 Å²	43	82%	0.822	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-1.6	171.9	-60.1	178.2	178.6	-180	0	111.8	D300	D300-K302 PolarHBondContact O-N 3.36Å; D300-K302 VanDerWaalsContact O-N 3.15Å; D300-K302 VanDerWaalsContact OD1-CA 3.31Å; D300-K302 WeakPolarHBondContact OD1-CA 3.04Å; D300-K302 WeakPolarHBondContact OD1-CB 3.31Å; D300-K302 PolarHBondContact OD1-N 3.16Å
303	G	94.4	Very high	97.2	Very high	40 Å²	40	43 Å²	43	41%	0.412	21%	0.21	S	C	.	.			trans	84.4	8.8	-179.2	0	0	0	0	0	114.4	D300 K305	D300-G303 PolarHBondContact O-N 2.91Å; D300-G303 PolarHBondContact OD1-N 3.5Å; G303-K305 PolarHBondContact O-N 3.22Å
304	L	96.1	Very high	97.2	Very high	74 Å²	74	45.5 Å²	45.5	39%	0.387	22%	0.219	S	C	.	.			trans	-72.6	123.2	174.4	178.6	63.2	0	0	0	109.3	E299 D300 L306 W404	E299-L304 WeakPolarHBondContact CA-O 3.02Å; D300-L304 PolarHBondContact N-O 2.89Å; D300-L304 VanDerWaalsContact N-O 3.1Å; D300-L304 PolarHBondContact OD1-N 2.81Å; L304-L306 HydrophobicContact CD1-CD2 4.18Å; L304-L306 HydrophobicContact CD1-CG 4.39Å; L304-L306 HydrophobicContact CD2-CD1 4.19Å; L304-L306 HydrophobicContact CD2-CG 4.49Å; L304-L306 HydrophobicContact CG-CD1 4.41Å; L304-L306 HydrophobicContact CG-CG 4.18Å; L304-W404 HydrophobicContact CB-CZ2 4.08Å; L304-W404 HydrophobicContact CD2-CZ2 3.76Å; L304-W404 HydrophobicContact CG-CH2 4.39Å; L304-W404 HydrophobicContact CG-CZ2 3.75Å; L304-W404 WeakPolarHBondContact O-CZ2 3.46Å
305	K	97.5	Very high	97.2	Very high	136 Å²	136	45.5 Å²	45.5	59%	0.591	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-111.7	123.1	178.7	-58.7	-175.9	-168.9	-137.3	0	110.4	L298 E299 G303	L298-K305 VanDerWaalsContact O-CA 3.31Å; L298-K305 WeakPolarHBondContact O-CA 3.36Å; E299-K305 HydrophobicContact CB-CG 4.14Å; E299-K305 HydrophobicContact CG-CG 3.84Å; E299-K305 WeakPolarHBondContact OE2-CE 3.44Å; E299-K305 IonicContact OE2-NZ 3.56Å; E299-K305 PolarHBondContact OE2-NZ 2.88Å; G303-K305 PolarHBondContact O-N 3.22Å
306	L	97.9	Very high	97.2	Very high	28 Å²	28	44.7 Å²	44.7	15%	0.147	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	163.7	173.6	-50.9	170.5	0	0	0	108.9	L298 L304 T332 A333 W404 P405	L298-L306 PolarHBondContact N-O 3.07Å; L298-L306 PolarHBondContact O-N 2.8Å; L298-L306 VanDerWaalsContact O-N 3.08Å; L304-L306 HydrophobicContact CD1-CD2 4.18Å; L304-L306 HydrophobicContact CD1-CG 4.39Å; L304-L306 HydrophobicContact CD2-CD1 4.19Å; L304-L306 HydrophobicContact CD2-CG 4.49Å; L304-L306 HydrophobicContact CG-CD1 4.41Å; L304-L306 HydrophobicContact CG-CG 4.18Å; L306-T332 WeakPolarHBondContact CB-OG1 3.46Å; L306-A333 HydrophobicContact CB-CB 3.86Å; L306-W404 HydrophobicContact CB-CE3 4.39Å; L306-W404 HydrophobicContact CB-CH2 3.65Å; L306-W404 HydrophobicContact CB-CZ3 3.47Å; L306-W404 VanDerWaalsContact CB-CZ3 3.47Å; L306-W404 HydrophobicContact CD1-CD2 4.18Å; L306-W404 HydrophobicContact CD1-CE3 3.84Å; L306-W404 HydrophobicContact CD1-CH2 3.68Å; L306-W404 HydrophobicContact CD1-CZ2 3.99Å; L306-W404 HydrophobicContact CD1-CZ3 3.6Å; L306-W404 HydrophobicContact CG-CE3 4.48Å; L306-W404 HydrophobicContact CG-CH2 3.55Å; L306-W404 HydrophobicContact CG-CZ2 4.17Å; L306-W404 HydrophobicContact CG-CZ3 3.75Å; L306-P405 HydrophobicContact CD1-CG 4.02Å
307	Y	98.2	Very high	97.1	Very high	67 Å²	67	47.6 Å²	47.6	26%	0.263	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	155.4	-179.3	70.8	-84.4	0	0	0	112	I296 D297 G331 T332 A333	I296-Y307 CarbonylContact O-C 3.56Å; I296-Y307 WeakPolarHBondContact O-CA 3.48Å; I296-Y307 WeakPolarHBondContact O-CB 3.18Å; D297-Y307 WeakPolarHBondContact OD1-CB 3.26Å; Y307-G331 CarbonylContact O-C 3.57Å; Y307-T332 HydrophobicContact CE1-CG2 4.03Å; Y307-T332 PolarHBondContact N-OG1 2.95Å; Y307-T332 PolarHBondContact O-N 2.83Å; Y307-A333 WeakPolarHBondContact O-CB 3.22Å; Y307-A333 PolarHBondContact O-N 2.73Å
308	A	98.5	Very high	97.1	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	137.6	168.1	0	0	0	0	0	109.1	R295 I296 Y310 Y329 A333 W401	R295-A308 CarbonylContact C-O 3.57Å; R295-A308 WeakPolarHBondContact CA-O 3.18Å; I296-A308 HydrophobicContact CB-CB 4.37Å; I296-A308 PolarHBondContact N-O 2.88Å; I296-A308 PolarHBondContact O-N 2.81Å; A308-Y310 HydrophobicContact CB-CE2 3.97Å; A308-Y329 HydrophobicContact CB-CD2 4.4Å; A308-Y329 HydrophobicContact CB-CE2 3.76Å; A308-A333 HydrophobicContact CB-CB 4.38Å; A308-W401 HydrophobicContact CB-CH2 4.3Å; A308-W401 HydrophobicContact CB-CZ2 3.73Å
309	L	98.3	Very high	97.1	Very high	40 Å²	40	57.1 Å²	57.1	21%	0.209	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	133.7	180	-170.9	75.9	0	0	0	108.7	W245 I293 L294 R295 Y329 N330	W245-L309 HydrophobicContact CH2-CD1 4.35Å; I293-L309 HydrophobicContact CD1-CD1 4.35Å; L294-L309 CarbonylContact O-C 3.52Å; L294-L309 WeakPolarHBondContact O-CA 3.31Å; R295-L309 HydrophobicContact CB-CD1 3.92Å; R295-L309 HydrophobicContact CG-CD1 4.36Å; L309-Y329 CarbonylContact O-C 3.58Å; L309-Y329 WeakPolarHBondContact O-CA 3.45Å; L309-N330 WeakPolarHBondContact CA-O 3.5Å; L309-N330 HydrophobicContact CB-CB 4.45Å; L309-N330 WeakPolarHBondContact CB-O 3.36Å; L309-N330 PolarHBondContact N-O 2.8Å; L309-N330 PolarHBondContact O-N 2.93Å; L309-N330 VanDerWaalsContact O-O 3.13Å
310	Y	98.6	Very high	97.1	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.9	173.6	-58.6	-93.3	0	0	0	108.5	I293 L294 I296 A308 E312 I326 N328 Y329 D335 L337	I293-Y310 WeakPolarHBondContact CA-O 3.35Å; I293-Y310 WeakPolarHBondContact CB-O 3.3Å; L294-Y310 HydrophobicContact CD2-CD2 3.99Å; L294-Y310 HydrophobicContact CG-CD2 4.38Å; L294-Y310 PolarHBondContact N-O 3.26Å; L294-Y310 PolarHBondContact O-N 3.43Å; I296-Y310 HydrophobicContact CD1-CE2 4.29Å; A308-Y310 HydrophobicContact CB-CE2 3.97Å; Y310-E312 PolarHBondContact O-N 3.23Å; Y310-I326 HydrophobicContact CD1-CB 3.98Å; Y310-I326 HydrophobicContact CD1-CD1 3.83Å; Y310-I326 HydrophobicContact CD1-CG1 4.43Å; Y310-I326 HydrophobicContact CD1-CG2 4.47Å; Y310-I326 HydrophobicContact CE1-CD1 3.65Å; Y310-I326 HydrophobicContact CG-CB 4.26Å; Y310-I326 HydrophobicContact CG-CG2 4.35Å; Y310-N328 WeakPolarHBondContact CA-O 3.28Å; Y310-Y329 AromaticContact CE1-CD2 3.97Å; Y310-Y329 HydrophobicContact CE1-CD2 3.97Å; Y310-Y329 HydrophobicContact CE2-CD2 4.49Å; Y310-Y329 AromaticContact CZ-CD2 3.88Å; Y310-D335 PolarHBondContact OH-OD1 3.33Å; Y310-D335 VanDerWaalsContact OH-OD1 3.07Å; Y310-L337 HydrophobicContact CD2-CD1 4.27Å; Y310-L337 HydrophobicContact CE1-CB 4.22Å; Y310-L337 HydrophobicContact CE1-CD1 4.26Å; Y310-L337 HydrophobicContact CE2-CD1 3.62Å; Y310-L337 HydrophobicContact CE2-CG 4.27Å; Y310-L337 WeakPolarHBondContact OH-CB 3.5Å; Y310-L337 WeakPolarHBondContact OH-CG 3.46Å
311	D	97.5	Very high	97.3	Very high	45 Å²	45	62.1 Å²	62.1	24%	0.241	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	-4.3	-174.2	71.3	-4.7	0	0	0	114.4	G327 N328 K429	D311-G327 VanDerWaalsContact OD1-C 3.3Å; D311-G327 WeakPolarHBondContact OD1-CA 3.24Å; D311-N328 PolarHBondContact N-O 2.9Å; D311-N328 VanDerWaalsContact N-O 3.09Å; D311-N328 PolarHBondContact OD1-N 2.93Å; D311-N328 WeakPolarHBondContact OD2-CB 3.43Å; D311-N328 PolarHBondContact OD2-ND2 2.78Å; D311-K429 WeakPolarHBondContact O-CD 3.34Å; D311-K429 VanDerWaalsContact O-CE 3.29Å; D311-K429 WeakPolarHBondContact O-CE 3.43Å; D311-K429 PolarHBondContact O-NZ 3.44Å
312	E	97.8	Very high	97.6	Very high	70 Å²	70	57.6 Å²	57.6	33%	0.327	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	143.9	167.8	-63	174	-164.7	0	0	109	M292 Y310 H325 I326 G327 K429	M292-E312 CarbonylContact O-C 3.6Å; M292-E312 WeakPolarHBondContact O-CA 3.43Å; Y310-E312 PolarHBondContact O-N 3.23Å; E312-H325 IonicContact OE2-CD2 2.8Å; E312-H325 IonicContact OE2-CE1 3.49Å; E312-H325 IonicContact OE2-NE2 2.99Å; E312-H325 PolarHBondContact OE2-NE2 3.18Å; E312-I326 WeakPolarHBondContact O-CA 3.5Å; E312-G327 PolarHBondContact O-N 3.01Å; E312-K429 IonicContact OE1-NZ 3.19Å
313	F	98.6	Very high	97.9	Very high	5 Å²	5	51.9 Å²	51.9	2%	0.022	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	120.8	173.4	174.5	-105.3	0	0	0	110.3	L248 I283 T287 M292 L294 V315 L324 H325 I326 W374 I426	L248-F313 HydrophobicContact CD1-CD1 4.47Å; L248-F313 HydrophobicContact CD1-CE1 3.49Å; L248-F313 VanDerWaalsContact CD1-CE1 3.49Å; L248-F313 HydrophobicContact CD1-CZ 3.87Å; I283-F313 HydrophobicContact CG2-CE1 3.95Å; I283-F313 HydrophobicContact CG2-CZ 4.16Å; T287-F313 HydrophobicContact CG2-CD1 3.43Å; T287-F313 VanDerWaalsContact CG2-CD1 3.43Å; T287-F313 HydrophobicContact CG2-CE1 3.52Å; M292-F313 PolarHBondContact O-N 2.76Å; L294-F313 HydrophobicContact CB-CB 3.52Å; L294-F313 HydrophobicContact CB-CD1 4.35Å; L294-F313 HydrophobicContact CB-CD2 3.85Å; L294-F313 HydrophobicContact CB-CG 3.65Å; L294-F313 HydrophobicContact CD1-CD2 4.38Å; L294-F313 HydrophobicContact CD1-CE2 4.37Å; L294-F313 HydrophobicContact CD1-CG 4.49Å; L294-F313 HydrophobicContact CD2-CD2 3.59Å; L294-F313 HydrophobicContact CD2-CE2 3.83Å; L294-F313 HydrophobicContact CD2-CG 4.28Å; L294-F313 HydrophobicContact CG-CD2 4.15Å; L294-F313 HydrophobicContact CG-CG 4.36Å; F313-V315 HydrophobicContact CE1-CG2 4.04Å; F313-V315 HydrophobicContact CE2-CG2 4.11Å; F313-V315 HydrophobicContact CZ-CG2 3.59Å; F313-L324 HydrophobicContact CD2-CD1 3.83Å; F313-L324 HydrophobicContact CE2-CD1 3.45Å; F313-L324 VanDerWaalsContact CE2-CD1 3.45Å; F313-L324 HydrophobicContact CZ-CD1 4.48Å; F313-H325 WeakPolarHBondContact CA-O 3.29Å; F313-I326 HydrophobicContact CD2-CG2 4.01Å; F313-W374 HydrophobicContact CE2-CH2 4.49Å; F313-W374 HydrophobicContact CZ-CH2 4.42Å; F313-I426 HydrophobicContact CD1-CG2 3.44Å; F313-I426 VanDerWaalsContact CD1-CG2 3.44Å; F313-I426 HydrophobicContact CE1-CG2 3.72Å; F313-I426 HydrophobicContact CG-CG2 4.29Å
314	Y	98.7	Very high	98.1	Very high	75 Å²	75	50 Å²	50	29%	0.294	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	139	179	175.2	-93.7	0	0	0	111.1	K288 A316 H325	K288-Y314 HydrophobicContact CB-CE2 4.46Å; Y314-A316 HydrophobicContact CE1-CB 3.91Å; Y314-H325 HydrophobicContact CD1-CB 4.46Å; Y314-H325 PolarHBondContact N-O 2.84Å; Y314-H325 PolarHBondContact O-N 2.99Å
315	V	98.8	Very high	98.2	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	121.6	173.4	178	0	0	0	0	107.8	I283 H284 T287 F313 Y322 W374	I283-V315 HydrophobicContact CG2-CB 3.98Å; I283-V315 HydrophobicContact CG2-CG1 4.49Å; I283-V315 HydrophobicContact CG2-CG2 3.61Å; H284-V315 PolarHBondContact ND1-O 3.34Å; T287-V315 PolarHBondContact OG1-N 2.87Å; F313-V315 HydrophobicContact CE1-CG2 4.04Å; F313-V315 HydrophobicContact CE2-CG2 4.11Å; F313-V315 HydrophobicContact CZ-CG2 3.59Å; V315-Y322 HydrophobicContact CG1-CD1 4.32Å; V315-W374 HydrophobicContact CG1-CZ2 4.45Å; V315-W374 HydrophobicContact CG2-CH2 4.43Å; V315-W374 HydrophobicContact CG2-CZ2 3.75Å
316	A	98.4	Very high	98.2	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	20%	0.195	C	C	.	.			trans	-68.8	173.3	180	0	0	0	0	0	112.3	H284 Y314 L320 Y322 R323	H284-A316 VanDerWaalsContact ND1-C 3.3Å; H284-A316 PolarHBondContact ND1-O 3.23Å; Y314-A316 HydrophobicContact CE1-CB 3.91Å; A316-L320 HydrophobicContact CB-CB 3.65Å; A316-L320 HydrophobicContact CB-CD1 4.06Å; A316-Y322 WeakPolarHBondContact O-CA 3.43Å; A316-Y322 VanDerWaalsContact O-CD1 3.3Å; A316-Y322 WeakPolarHBondContact O-CD1 3.49Å; A316-R323 HydrophobicContact CB-CB 4.02Å; A316-R323 PolarHBondContact N-O 2.99Å
317	N	97.2	Very high	98.2	Very high	62 Å²	62	41.8 Å²	41.8	33%	0.332	19%	0.192	S	C	.	.			trans	-72.9	176.8	175.8	66.6	9	0	0	0	112.2	H284 F319 L320 K321 Y322	H284-N317 PolarHBondContact ND1-N 2.87Å; N317-F319 VanDerWaalsContact C-N 3.3Å; N317-F319 PolarHBondContact O-N 3.44Å; N317-F319 PolarHBondContact OD1-N 3.11Å; N317-L320 CarbonylContact O-C 3.57Å; N317-L320 PolarHBondContact O-N 3.06Å; N317-L320 PolarHBondContact OD1-N 3.17Å; N317-K321 PolarHBondContact O-N 3.35Å; N317-Y322 PolarHBondContact O-N 3.27Å
318	E	98	Very high	98.1	Very high	59 Å²	59	43.8 Å²	43.8	28%	0.276	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-34.5	179	-172.1	172.8	-163.6	0	0	113.5	W262 K266 L320 K321 Y322 R355	W262-E318 HydrophobicContact CZ2-CG 4.15Å; W262-E318 PolarHBondContact NE1-OE1 3.37Å; K266-E318 VanDerWaalsContact CE-OE2 3.25Å; K266-E318 WeakPolarHBondContact CE-OE2 3.23Å; K266-E318 IonicContact NZ-OE2 2.8Å; K266-E318 PolarHBondContact NZ-OE2 3.32Å; E318-L320 PolarHBondContact O-N 2.94Å; E318-K321 VanDerWaalsContact O-CA 3.32Å; E318-K321 WeakPolarHBondContact O-CA 3.06Å; E318-K321 PolarHBondContact O-N 3.18Å; E318-Y322 HydrophobicContact CB-CE1 4.09Å; E318-Y322 HydrophobicContact CB-CE2 4.14Å; E318-Y322 WeakPolarHBondContact CB-OH 3.29Å; E318-Y322 HydrophobicContact CG-CE2 4.02Å; E318-R355 IonicContact OE1-NH1 2.95Å; E318-R355 PolarHBondContact OE1-NH1 3.01Å
319	F	97.1	Very high	98.1	Very high	179 Å²	179	46.8 Å²	46.8	79%	0.785	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-39.7	177.3	176.7	-99	0	0	0	111.1	N317 K321	N317-F319 VanDerWaalsContact C-N 3.3Å; N317-F319 PolarHBondContact O-N 3.44Å; N317-F319 PolarHBondContact OD1-N 3.11Å; F319-K321 PolarHBondContact O-N 3.24Å
320	L	97.4	Very high	98.1	Very high	72 Å²	72	49.6 Å²	49.6	38%	0.377	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.8	22.1	171.7	-62.4	177.8	0	0	0	112.9	A316 N317 E318 Y322 R323 F349	A316-L320 HydrophobicContact CB-CB 3.65Å; A316-L320 HydrophobicContact CB-CD1 4.06Å; N317-L320 CarbonylContact O-C 3.57Å; N317-L320 PolarHBondContact O-N 3.06Å; N317-L320 PolarHBondContact OD1-N 3.17Å; E318-L320 PolarHBondContact O-N 2.94Å; L320-Y322 PolarHBondContact O-N 2.86Å; L320-Y322 VanDerWaalsContact O-N 3.1Å; L320-R323 WeakPolarHBondContact O-CB 3.25Å; L320-R323 PolarHBondContact O-N 3.37Å; L320-F349 WeakPolarHBondContact O-CD1 3.4Å
321	K	98.5	Very high	98	Very high	68 Å²	68	50.5 Å²	50.5	30%	0.296	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	36	172.7	-55.6	157.2	175.4	-176	0	113.1	W262 N317 E318 F319 R323 F349 F350 N357	W262-K321 HydrophobicContact CH2-CB 4.31Å; N317-K321 PolarHBondContact O-N 3.35Å; E318-K321 VanDerWaalsContact O-CA 3.32Å; E318-K321 WeakPolarHBondContact O-CA 3.06Å; E318-K321 PolarHBondContact O-N 3.18Å; F319-K321 PolarHBondContact O-N 3.24Å; K321-R323 PolarHBondContact O-N 3.11Å; K321-F349 HydrophobicContact CB-CB 3.93Å; K321-F349 HydrophobicContact CB-CD1 3.85Å; K321-F349 HydrophobicContact CB-CG 4.04Å; K321-F349 HydrophobicContact CD-CB 4.27Å; K321-F349 HydrophobicContact CD-CD1 4.11Å; K321-F349 HydrophobicContact CD-CD2 4.09Å; K321-F349 HydrophobicContact CD-CE2 4.48Å; K321-F349 HydrophobicContact CD-CG 3.9Å; K321-F350 WeakPolarHBondContact O-CB 3.18Å; K321-F350 PolarHBondContact O-N 3.27Å; K321-N357 HydrophobicContact CD-CB 4.16Å; K321-N357 VanDerWaalsContact CD-OD1 3.27Å; K321-N357 WeakPolarHBondContact CD-OD1 3.17Å; K321-N357 VanDerWaalsContact CE-OD1 3.3Å; K321-N357 WeakPolarHBondContact CE-OD1 3.4Å
322	Y	98.8	Very high	98	Very high	0 Å²	0	52 Å²	52	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	38.2	-177.8	-51.3	-70.9	0	0	0	113.8	W262 K266 N280 D281 V315 A316 N317 E318 L320 L324 W374	W262-Y322 AromaticContact CE2-CE2 3.84Å; W262-Y322 AromaticContact CH2-CD2 3.62Å; W262-Y322 HydrophobicContact CH2-CD2 3.62Å; W262-Y322 AromaticContact CH2-CE2 3.98Å; W262-Y322 HydrophobicContact CH2-CE2 3.98Å; W262-Y322 AromaticContact CZ2-CD2 3.51Å; W262-Y322 HydrophobicContact CZ2-CD2 3.51Å; W262-Y322 AromaticContact CZ2-CE2 3.37Å; W262-Y322 HydrophobicContact CZ2-CE2 3.37Å; K266-Y322 WeakPolarHBondContact CD-OH 3.39Å; K266-Y322 VanDerWaalsContact CG-OH 3.23Å; K266-Y322 WeakPolarHBondContact CG-OH 3.42Å; K266-Y322 PolarHBondContact NZ-OH 3.42Å; N280-Y322 HydrophobicContact CB-CD1 3.48Å; N280-Y322 VanDerWaalsContact CB-CD1 3.48Å; N280-Y322 HydrophobicContact CB-CD2 3.71Å; N280-Y322 HydrophobicContact CB-CE1 3.52Å; N280-Y322 HydrophobicContact CB-CE2 3.75Å; N280-Y322 HydrophobicContact CB-CG 3.57Å; N280-Y322 WeakPolarHBondContact ND2-CD2 3.48Å; D281-Y322 WeakPolarHBondContact OD1-CE1 3.36Å; D281-Y322 PolarHBondContact OD1-OH 3.2Å; V315-Y322 HydrophobicContact CG1-CD1 4.32Å; A316-Y322 WeakPolarHBondContact O-CA 3.43Å; A316-Y322 VanDerWaalsContact O-CD1 3.3Å; A316-Y322 WeakPolarHBondContact O-CD1 3.49Å; N317-Y322 PolarHBondContact O-N 3.27Å; E318-Y322 HydrophobicContact CB-CE1 4.09Å; E318-Y322 HydrophobicContact CB-CE2 4.14Å; E318-Y322 WeakPolarHBondContact CB-OH 3.29Å; E318-Y322 HydrophobicContact CG-CE2 4.02Å; L320-Y322 PolarHBondContact O-N 2.86Å; L320-Y322 VanDerWaalsContact O-N 3.1Å; Y322-L324 PolarHBondContact O-N 2.85Å; Y322-W374 PolarHBondContact O-NE1 3.08Å
323	R	98.7	Very high	98	Very high	68 Å²	68	48.7 Å²	48.7	26%	0.257	24%	0.239	S	C	.	.			trans	-48.7	131.2	178.7	-170.4	177.3	56.4	75.9	-8.5	111.6	A316 L320 K321 K348 F349	A316-R323 HydrophobicContact CB-CB 4.02Å; A316-R323 PolarHBondContact N-O 2.99Å; L320-R323 WeakPolarHBondContact O-CB 3.25Å; L320-R323 PolarHBondContact O-N 3.37Å; K321-R323 PolarHBondContact O-N 3.11Å; R323-K348 WeakPolarHBondContact CA-O 3.11Å; R323-F349 HydrophobicContact CB-CD1 3.72Å; R323-F349 HydrophobicContact CB-CE1 3.87Å; R323-F349 HydrophobicContact CG-CD1 3.98Å; R323-F349 HydrophobicContact CG-CE1 3.98Å
324	L	98.8	Very high	97.9	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	143.5	174.1	-176.2	61	0	0	0	111.2	F313 Y322 I326 H345 L347 K348 W374	F313-L324 HydrophobicContact CD2-CD1 3.83Å; F313-L324 HydrophobicContact CE2-CD1 3.45Å; F313-L324 VanDerWaalsContact CE2-CD1 3.45Å; F313-L324 HydrophobicContact CZ-CD1 4.48Å; Y322-L324 PolarHBondContact O-N 2.85Å; L324-I326 HydrophobicContact CD1-CG2 3.96Å; L324-I326 HydrophobicContact CD2-CG2 4.32Å; L324-I326 HydrophobicContact CG-CG2 4.14Å; L324-H345 HydrophobicContact CD2-CB 4.31Å; L324-L347 WeakPolarHBondContact O-CA 3.39Å; L324-L347 PolarHBondContact O-N 2.62Å; L324-K348 PolarHBondContact N-O 2.96Å; L324-W374 HydrophobicContact CB-CB 4.3Å; L324-W374 HydrophobicContact CB-CD2 3.94Å; L324-W374 HydrophobicContact CB-CG 3.68Å; L324-W374 HydrophobicContact CD1-CD2 4.33Å; L324-W374 HydrophobicContact CD1-CH2 4.43Å; L324-W374 HydrophobicContact CD1-CZ2 4.21Å; L324-W374 HydrophobicContact CD2-CB 4.27Å; L324-W374 HydrophobicContact CD2-CD2 3.95Å; L324-W374 HydrophobicContact CD2-CE3 4.04Å; L324-W374 HydrophobicContact CD2-CG 4.08Å; L324-W374 HydrophobicContact CG-CD2 4.31Å; L324-W374 HydrophobicContact CG-CG 4.43Å
325	H	98.4	Very high	97.8	Very high	55 Å²	55	47.3 Å²	47.3	26%	0.255	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	132.3	160.1	173.7	74.7	0	0	0	109	E312 F313 Y314 D346	E312-H325 IonicContact OE2-CD2 2.8Å; E312-H325 IonicContact OE2-CE1 3.49Å; E312-H325 IonicContact OE2-NE2 2.99Å; E312-H325 PolarHBondContact OE2-NE2 3.18Å; F313-H325 WeakPolarHBondContact CA-O 3.29Å; Y314-H325 HydrophobicContact CD1-CB 4.46Å; Y314-H325 PolarHBondContact N-O 2.84Å; Y314-H325 PolarHBondContact O-N 2.99Å; H325-D346 VanDerWaalsContact CA-OD1 3.26Å; H325-D346 WeakPolarHBondContact CA-OD1 3.36Å
326	I	98.3	Very high	97.7	Very high	3 Å²	3	47.2 Å²	47.2	2%	0.015	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	143.2	177.2	48.4	163.3	0	0	0	112.3	Y310 E312 F313 L324 L337 R338 D346	Y310-I326 HydrophobicContact CD1-CB 3.98Å; Y310-I326 HydrophobicContact CD1-CD1 3.83Å; Y310-I326 HydrophobicContact CD1-CG1 4.43Å; Y310-I326 HydrophobicContact CD1-CG2 4.47Å; Y310-I326 HydrophobicContact CE1-CD1 3.65Å; Y310-I326 HydrophobicContact CG-CB 4.26Å; Y310-I326 HydrophobicContact CG-CG2 4.35Å; E312-I326 WeakPolarHBondContact O-CA 3.5Å; F313-I326 HydrophobicContact CD2-CG2 4.01Å; L324-I326 HydrophobicContact CD1-CG2 3.96Å; L324-I326 HydrophobicContact CD2-CG2 4.32Å; L324-I326 HydrophobicContact CG-CG2 4.14Å; I326-L337 HydrophobicContact CD1-CB 3.39Å; I326-L337 HydrophobicContact CD1-CD1 3.86Å; I326-L337 HydrophobicContact CD1-CG 4.26Å; I326-L337 HydrophobicContact CG2-CD1 4.32Å; I326-R338 HydrophobicContact CD1-CG 3.97Å; I326-D346 HydrophobicContact CD1-CB 4.12Å; I326-D346 HydrophobicContact CG1-CB 3.71Å; I326-D346 WeakPolarHBondContact CG1-OD1 3.32Å; I326-D346 PolarHBondContact N-OD1 3.12Å
327	G	96.9	Very high	97.7	Very high	7 Å²	7	47.4 Å²	47.4	7%	0.072	24%	0.242	C	C	.	.			trans	-85.8	-155.6	-179.2	0	0	0	0	0	114.5	D311 E312 R338	D311-G327 VanDerWaalsContact OD1-C 3.3Å; D311-G327 WeakPolarHBondContact OD1-CA 3.24Å; E312-G327 PolarHBondContact O-N 3.01Å; G327-R338 PolarHBondContact O-NH1 3.05Å; G327-R338 PolarHBondContact O-NH2 2.82Å
328	N	97.7	Very high	97.6	Very high	109 Å²	109	48 Å²	48	58%	0.583	24%	0.24	S	C	*	.			trans	-64.4	141.2	177.9	-57.2	-57.1	0	0	0	111.4	Y310 D311	Y310-N328 WeakPolarHBondContact CA-O 3.28Å; D311-N328 PolarHBondContact N-O 2.9Å; D311-N328 VanDerWaalsContact N-O 3.09Å; D311-N328 PolarHBondContact OD1-N 2.93Å; D311-N328 WeakPolarHBondContact OD2-CB 3.43Å; D311-N328 PolarHBondContact OD2-ND2 2.78Å
329	Y	98.3	Very high	97.3	Very high	64 Å²	64	50.3 Å²	50.3	25%	0.251	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.4	142.4	-179.4	166	-90.1	0	0	0	111.6	A308 L309 Y310 G331 G334 D335 R338	A308-Y329 HydrophobicContact CB-CD2 4.4Å; A308-Y329 HydrophobicContact CB-CE2 3.76Å; L309-Y329 CarbonylContact O-C 3.58Å; L309-Y329 WeakPolarHBondContact O-CA 3.45Å; Y310-Y329 AromaticContact CE1-CD2 3.97Å; Y310-Y329 HydrophobicContact CE1-CD2 3.97Å; Y310-Y329 HydrophobicContact CE2-CD2 4.49Å; Y310-Y329 AromaticContact CZ-CD2 3.88Å; Y329-G331 PolarHBondContact OH-O 3.17Å; Y329-G334 VanDerWaalsContact CZ-C 3.45Å; Y329-G334 WeakPolarHBondContact OH-CA 3.12Å; Y329-G334 PolarHBondContact OH-N 2.89Å; Y329-D335 VanDerWaalsContact CB-OD2 3.25Å; Y329-D335 WeakPolarHBondContact CB-OD2 3.27Å; Y329-D335 HydrophobicContact CD1-CB 3.96Å; Y329-D335 HydrophobicContact CD2-CB 3.72Å; Y329-D335 HydrophobicContact CE1-CB 4.43Å; Y329-D335 HydrophobicContact CE2-CB 4.17Å; Y329-D335 HydrophobicContact CG-CB 3.6Å; Y329-R338 VanDerWaalsContact N-NH2 3.13Å
330	N	97.4	Very high	97	Very high	98 Å²	98	43.9 Å²	43.9	52%	0.524	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	155.6	162.6	-175.8	21.8	0	0	0	109.5	L309	L309-N330 WeakPolarHBondContact CA-O 3.5Å; L309-N330 HydrophobicContact CB-CB 4.45Å; L309-N330 WeakPolarHBondContact CB-O 3.36Å; L309-N330 PolarHBondContact N-O 2.8Å; L309-N330 PolarHBondContact O-N 2.93Å; L309-N330 VanDerWaalsContact O-O 3.13Å
331	G	97	Very high	96.5	Very high	19 Å²	19	48.7 Å²	48.7	20%	0.196	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	131.3	-175.4	173.2	0	0	0	0	0	113.8	Y307 Y329	Y307-G331 CarbonylContact O-C 3.57Å; Y329-G331 PolarHBondContact OH-O 3.17Å
332	T	97.8	Very high	95.8	Very high	76 Å²	76	53 Å²	53	47%	0.466	26%	0.26	S	S	.	.	S	Bend	trans	-105.3	-11.2	-170.5	57.1	0	0	0	0	114.1	L306 Y307	L306-T332 WeakPolarHBondContact CB-OG1 3.46Å; Y307-T332 HydrophobicContact CE1-CG2 4.03Å; Y307-T332 PolarHBondContact N-OG1 2.95Å; Y307-T332 PolarHBondContact O-N 2.83Å
333	A	97.1	Very high	95.4	Very high	1 Å²	1	57.7 Å²	57.7	1%	0.008	28%	0.278	C	S	.	.	S	Bend	trans	-83.3	-9.3	-178.9	0	0	0	0	0	114.2	L298 L306 Y307 A308 W401 T403 W404	L298-A333 HydrophobicContact CD1-CB 4.4Å; L306-A333 HydrophobicContact CB-CB 3.86Å; Y307-A333 WeakPolarHBondContact O-CB 3.22Å; Y307-A333 PolarHBondContact O-N 2.73Å; A308-A333 HydrophobicContact CB-CB 4.38Å; A333-W401 PolarHBondContact O-NE1 2.76Å; A333-W401 VanDerWaalsContact O-NE1 3.11Å; A333-T403 PolarHBondContact O-OG1 3.4Å; A333-W404 HydrophobicContact CB-CE3 4.43Å; A333-W404 HydrophobicContact CB-CZ3 4.31Å
334	G	96.9	Very high	95.2	Very high	21 Å²	21	56.3 Å²	56.3	22%	0.216	28%	0.276	C	S	.	.			trans	75.2	156.6	-169.5	0	0	0	0	0	113.3	Y329 A336 W401 T403	Y329-G334 VanDerWaalsContact CZ-C 3.45Å; Y329-G334 WeakPolarHBondContact OH-CA 3.12Å; Y329-G334 PolarHBondContact OH-N 2.89Å; G334-A336 PolarHBondContact O-N 2.74Å; G334-A336 VanDerWaalsContact O-N 3.1Å; G334-W401 PolarHBondContact O-NE1 2.92Å; G334-T403 WeakPolarHBondContact CA-OG1 3.39Å; G334-T403 PolarHBondContact O-OG1 2.92Å; G334-T403 VanDerWaalsContact O-OG1 3.06Å
335	D	97	Very high	95.2	Very high	30 Å²	30	56.2 Å²	56.2	16%	0.16	28%	0.276	C	S	.	.			trans	-81.6	83.4	-179.5	-167.1	-16.7	0	0	0	111.2	Y310 Y329 L337 R338 F339	Y310-D335 PolarHBondContact OH-OD1 3.33Å; Y310-D335 VanDerWaalsContact OH-OD1 3.07Å; Y329-D335 VanDerWaalsContact CB-OD2 3.25Å; Y329-D335 WeakPolarHBondContact CB-OD2 3.27Å; Y329-D335 HydrophobicContact CD1-CB 3.96Å; Y329-D335 HydrophobicContact CD2-CB 3.72Å; Y329-D335 HydrophobicContact CE1-CB 4.43Å; Y329-D335 HydrophobicContact CE2-CB 4.17Å; Y329-D335 HydrophobicContact CG-CB 3.6Å; D335-L337 VanDerWaalsContact C-N 3.35Å; D335-L337 PolarHBondContact OD1-N 3.01Å; D335-R338 CarbonylContact O-C 3.32Å; D335-R338 PolarHBondContact OD1-N 2.87Å; D335-R338 IonicContact OD2-CZ 2.81Å; D335-R338 IonicContact OD2-NE 2.83Å; D335-R338 PolarHBondContact OD2-NE 3.02Å; D335-R338 IonicContact OD2-NH2 3.98Å; D335-R338 PolarHBondContact OD2-NH2 3.16Å; D335-F339 PolarHBondContact O-N 2.95Å
336	A	96.6	Very high	95.1	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.269	C	S	.	.			trans	-80.9	-13.7	174.3	0	0	0	0	0	113.4	G334 S380 A381 W401 T403	G334-A336 PolarHBondContact O-N 2.74Å; G334-A336 VanDerWaalsContact O-N 3.1Å; A336-S380 WeakPolarHBondContact O-CB 3.28Å; A336-S380 PolarHBondContact O-OG 2.76Å; A336-A381 HydrophobicContact CB-CB 3.97Å; A336-W401 HydrophobicContact CB-CD2 3.49Å; A336-W401 VanDerWaalsContact CB-CD2 3.49Å; A336-W401 HydrophobicContact CB-CE3 4.02Å; A336-W401 HydrophobicContact CB-CG 3.81Å; A336-W401 HydrophobicContact CB-CH2 4.24Å; A336-W401 HydrophobicContact CB-CZ2 3.73Å; A336-W401 HydrophobicContact CB-CZ3 4.37Å; A336-T403 HydrophobicContact CB-CG2 4.21Å
337	L	97.4	Very high	95.1	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.016	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-29	175.6	-65.2	-177.8	0	0	0	111.3	L294 I296 Y310 I326 D335 N344 H345 W373 A381 W401	L294-L337 HydrophobicContact CD2-CD1 4.41Å; I296-L337 HydrophobicContact CD1-CD1 4.25Å; Y310-L337 HydrophobicContact CD2-CD1 4.27Å; Y310-L337 HydrophobicContact CE1-CB 4.22Å; Y310-L337 HydrophobicContact CE1-CD1 4.26Å; Y310-L337 HydrophobicContact CE2-CD1 3.62Å; Y310-L337 HydrophobicContact CE2-CG 4.27Å; Y310-L337 WeakPolarHBondContact OH-CB 3.5Å; Y310-L337 WeakPolarHBondContact OH-CG 3.46Å; I326-L337 HydrophobicContact CD1-CB 3.39Å; I326-L337 HydrophobicContact CD1-CD1 3.86Å; I326-L337 HydrophobicContact CD1-CG 4.26Å; I326-L337 HydrophobicContact CG2-CD1 4.32Å; D335-L337 VanDerWaalsContact C-N 3.35Å; D335-L337 PolarHBondContact OD1-N 3.01Å; L337-N344 CarbonylContact O-C 3.53Å; L337-N344 PolarHBondContact O-OD1 3.26Å; L337-H345 HydrophobicContact CB-CB 4.33Å; L337-H345 HydrophobicContact CD2-CB 3.97Å; L337-H345 WeakPolarHBondContact O-CB 3.23Å; L337-H345 PolarHBondContact O-N 2.97Å; L337-W373 HydrophobicContact CD2-CZ2 4.26Å; L337-A381 HydrophobicContact CD2-CB 4.05Å; L337-W401 HydrophobicContact CD1-CH2 4.4Å; L337-W401 HydrophobicContact CD2-CH2 4.19Å; L337-W401 HydrophobicContact CD2-CZ3 4.16Å; L337-W401 HydrophobicContact CG-CH2 3.78Å; L337-W401 HydrophobicContact CG-CZ3 4.27Å
338	R	95.2	Very high	95.1	Very high	75 Å²	75	58.7 Å²	58.7	28%	0.283	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	60.4	170.5	-61.2	-178.9	-63.3	-151.7	-13.8	111.2	I326 G327 Y329 D335 N344 D346	I326-R338 HydrophobicContact CD1-CG 3.97Å; G327-R338 PolarHBondContact O-NH1 3.05Å; G327-R338 PolarHBondContact O-NH2 2.82Å; Y329-R338 VanDerWaalsContact N-NH2 3.13Å; D335-R338 CarbonylContact O-C 3.32Å; D335-R338 PolarHBondContact OD1-N 2.87Å; D335-R338 IonicContact OD2-CZ 2.81Å; D335-R338 IonicContact OD2-NE 2.83Å; D335-R338 PolarHBondContact OD2-NE 3.02Å; D335-R338 IonicContact OD2-NH2 3.98Å; D335-R338 PolarHBondContact OD2-NH2 3.16Å; R338-N344 WeakPolarHBondContact CG-OD1 3.36Å; R338-D346 HydrophobicContact CG-CB 4.12Å
339	F	92.4	Very high	95.1	Very high	107 Å²	107	56.9 Å²	56.9	47%	0.469	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	-43.9	-175.8	-178.3	-107.6	0	0	0	113	D335 Y343 S380 T403	D335-F339 PolarHBondContact O-N 2.95Å; F339-Y343 WeakPolarHBondContact CB-O 3.36Å; F339-Y343 HydrophobicContact CD1-CD2 4.25Å; F339-Y343 PolarHBondContact N-O 2.93Å; F339-S380 WeakPolarHBondContact CB-OG 3.5Å; F339-T403 HydrophobicContact CD2-CG2 3.6Å; F339-T403 HydrophobicContact CE2-CG2 3.99Å
340	S	91.4	Very high	95.2	Very high	44 Å²	44	53.9 Å²	53.9	31%	0.308	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	175.2	177	82.6	0	0	0	0	111.5	Y342 Y343 N344	S340-Y342 PolarHBondContact O-N 3.14Å; S340-Y342 VanDerWaalsContact O-N 3.08Å; S340-Y342 PolarHBondContact OG-N 2.84Å; S340-Y343 PolarHBondContact N-O 3.03Å; S340-Y343 CarbonylContact O-C 3.52Å; S340-Y343 PolarHBondContact O-N 2.71Å; S340-Y343 PolarHBondContact OG-N 3.41Å; S340-N344 WeakPolarHBondContact O-CB 3.29Å
341	K	86.8	Confident	95.2	Very high	174 Å²	174	49.2 Å²	49.2	76%	0.757	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53	-30.3	174.9	-175.9	178.8	177.8	-176.3	0	113.7
342	Y	83.8	Confident	95.3	Very high	159 Å²	159	48.3 Å²	48.3	62%	0.624	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-8.2	-175	-55.4	-70.5	0	0	0	113.8	S340	S340-Y342 PolarHBondContact O-N 3.14Å; S340-Y342 VanDerWaalsContact O-N 3.08Å; S340-Y342 PolarHBondContact OG-N 2.84Å
343	Y	90	Very high	95.3	Very high	97 Å²	97	45.4 Å²	45.4	38%	0.38	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	69.8	175.7	-58.9	-68.7	0	0	0	108	F339 S340 S380	F339-Y343 WeakPolarHBondContact CB-O 3.36Å; F339-Y343 HydrophobicContact CD1-CD2 4.25Å; F339-Y343 PolarHBondContact N-O 2.93Å; S340-Y343 PolarHBondContact N-O 3.03Å; S340-Y343 CarbonylContact O-C 3.52Å; S340-Y343 PolarHBondContact O-N 2.71Å; S340-Y343 PolarHBondContact OG-N 3.41Å; Y343-S380 PolarHBondContact O-OG 2.86Å; Y343-S380 VanDerWaalsContact O-OG 3.12Å
344	N	94.6	Very high	95.4	Very high	39 Å²	39	49.5 Å²	49.5	21%	0.209	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	114.6	-179.7	-176	-7.4	0	0	0	110	L337 R338 S340 D346 K348 D376	L337-N344 CarbonylContact O-C 3.53Å; L337-N344 PolarHBondContact O-OD1 3.26Å; R338-N344 WeakPolarHBondContact CG-OD1 3.36Å; S340-N344 WeakPolarHBondContact O-CB 3.29Å; N344-D346 WeakPolarHBondContact OD1-CA 3.48Å; N344-D346 WeakPolarHBondContact OD1-CB 3.37Å; N344-D346 PolarHBondContact OD1-N 3.17Å; N344-K348 WeakPolarHBondContact O-CE 3.46Å; N344-K348 WeakPolarHBondContact O-CG 3.45Å; N344-K348 PolarHBondContact O-NZ 3.11Å; N344-D376 PolarHBondContact N-OD2 2.99Å; N344-D376 VanDerWaalsContact N-OD2 3.12Å
345	H	97.5	Very high	95.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	24%	0.238	C	C	.	.			trans	-78.9	-20.5	178.8	-64.2	-82.8	0	0	0	113	L324 L337 K348 W373 W374 S380 A381	L324-H345 HydrophobicContact CD2-CB 4.31Å; L337-H345 HydrophobicContact CB-CB 4.33Å; L337-H345 HydrophobicContact CD2-CB 3.97Å; L337-H345 WeakPolarHBondContact O-CB 3.23Å; L337-H345 PolarHBondContact O-N 2.97Å; H345-K348 VanDerWaalsContact O-CB 3.31Å; H345-K348 WeakPolarHBondContact O-CB 3.46Å; H345-K348 WeakPolarHBondContact O-CG 3.4Å; H345-K348 PolarHBondContact O-N 3.02Å; H345-W373 AromaticContact CE1-CD1 3.7Å; H345-W373 AromaticContact CE1-NE1 3.55Å; H345-W373 AromaticContact ND1-CD1 3.62Å; H345-W373 AromaticContact ND1-NE1 3.41Å; H345-W373 PolarHBondContact ND1-NE1 3.4Å; H345-W374 PolarHBondContact ND1-O 3.13Å; H345-S380 PolarHBondContact CD2-OG 2.74Å; H345-S380 VanDerWaalsContact CD2-OG 3.28Å; H345-S380 PolarHBondContact NE2-N 2.77Å; H345-S380 PolarHBondContact NE2-OG 2.87Å; H345-S380 VanDerWaalsContact NE2-OG 3.17Å; H345-A381 PolarHBondContact CE1-O 2.9Å; H345-A381 PolarHBondContact NE2-N 3.3Å; H345-A381 PolarHBondContact NE2-O 3.19Å
346	D	97.6	Very high	95.5	Very high	21 Å²	21	54.5 Å²	54.5	11%	0.112	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	140.8	175.2	-170	34.1	0	0	0	111.3	H325 I326 R338 N344 K348	H325-D346 VanDerWaalsContact CA-OD1 3.26Å; H325-D346 WeakPolarHBondContact CA-OD1 3.36Å; I326-D346 HydrophobicContact CD1-CB 4.12Å; I326-D346 HydrophobicContact CG1-CB 3.71Å; I326-D346 WeakPolarHBondContact CG1-OD1 3.32Å; I326-D346 PolarHBondContact N-OD1 3.12Å; R338-D346 HydrophobicContact CG-CB 4.12Å; N344-D346 WeakPolarHBondContact OD1-CA 3.48Å; N344-D346 WeakPolarHBondContact OD1-CB 3.37Å; N344-D346 PolarHBondContact OD1-N 3.17Å; D346-K348 PolarHBondContact O-N 3.38Å; D346-K348 VanDerWaalsContact O-N 3.08Å; D346-K348 PolarHBondContact O-NZ 3.28Å
347	L	96.9	Very high	95.6	Very high	83 Å²	83	55.6 Å²	55.6	44%	0.435	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.1	13.9	-174.1	-48.3	178.6	0	0	0	114.6	L324	L324-L347 WeakPolarHBondContact O-CA 3.39Å; L324-L347 PolarHBondContact O-N 2.62Å
348	K	97.8	Very high	95.6	Very high	13 Å²	13	56.5 Å²	56.5	6%	0.057	26%	0.259	C	S	.	.	P	Polyproline II helix	trans	-87.8	148.9	176.2	-57.8	-58.2	171.7	-66.8	0	111.9	R323 L324 N344 H345 D346 W374 D376	R323-K348 WeakPolarHBondContact CA-O 3.11Å; L324-K348 PolarHBondContact N-O 2.96Å; N344-K348 WeakPolarHBondContact O-CE 3.46Å; N344-K348 WeakPolarHBondContact O-CG 3.45Å; N344-K348 PolarHBondContact O-NZ 3.11Å; H345-K348 VanDerWaalsContact O-CB 3.31Å; H345-K348 WeakPolarHBondContact O-CB 3.46Å; H345-K348 WeakPolarHBondContact O-CG 3.4Å; H345-K348 PolarHBondContact O-N 3.02Å; D346-K348 PolarHBondContact O-N 3.38Å; D346-K348 VanDerWaalsContact O-N 3.08Å; D346-K348 PolarHBondContact O-NZ 3.28Å; K348-W374 HydrophobicContact CB-CB 4.32Å; K348-D376 HydrophobicContact CD-CB 4.18Å; K348-D376 WeakPolarHBondContact CE-OD1 3.23Å; K348-D376 HydrophobicContact CG-CB 4.17Å
349	F	98.5	Very high	95.6	Very high	71 Å²	71	60.6 Å²	60.6	31%	0.311	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-79.1	151.6	175.4	-60.7	-52	0	0	0	110.1	L320 K321 R323 N357 W374	L320-F349 WeakPolarHBondContact O-CD1 3.4Å; K321-F349 HydrophobicContact CB-CB 3.93Å; K321-F349 HydrophobicContact CB-CD1 3.85Å; K321-F349 HydrophobicContact CB-CG 4.04Å; K321-F349 HydrophobicContact CD-CB 4.27Å; K321-F349 HydrophobicContact CD-CD1 4.11Å; K321-F349 HydrophobicContact CD-CD2 4.09Å; K321-F349 HydrophobicContact CD-CE2 4.48Å; K321-F349 HydrophobicContact CD-CG 3.9Å; R323-F349 HydrophobicContact CB-CD1 3.72Å; R323-F349 HydrophobicContact CB-CE1 3.87Å; R323-F349 HydrophobicContact CG-CD1 3.98Å; R323-F349 HydrophobicContact CG-CE1 3.98Å; F349-N357 HydrophobicContact CB-CB 3.63Å; F349-N357 HydrophobicContact CG-CB 4.45Å; F349-W374 WeakPolarHBondContact O-CA 3.49Å
350	F	98.8	Very high	95.7	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-72.5	139.2	173	-155.3	-96	0	0	0	109.2	W262 Y265 W277 N280 K321 T352 N357 G372 W374	W262-F350 HydrophobicContact CH2-CB 4.34Å; W262-F350 HydrophobicContact CZ3-CB 4.17Å; W262-F350 HydrophobicContact CZ3-CD1 4.09Å; W262-F350 VanDerWaalsContact CZ3-O 3.32Å; W262-F350 WeakPolarHBondContact CZ3-O 3.42Å; Y265-F350 AromaticContact CD1-CE1 3.72Å; Y265-F350 HydrophobicContact CD1-CE1 3.72Å; Y265-F350 AromaticContact CD1-CZ 3.56Å; Y265-F350 HydrophobicContact CD1-CZ 3.56Å; Y265-F350 HydrophobicContact CD2-CE1 4.3Å; Y265-F350 HydrophobicContact CE1-CE1 4.37Å; Y265-F350 AromaticContact CE1-CZ 3.96Å; Y265-F350 HydrophobicContact CE1-CZ 3.96Å; Y265-F350 AromaticContact CG-CE1 3.68Å; Y265-F350 HydrophobicContact CG-CE1 3.68Å; Y265-F350 HydrophobicContact CG-CZ 4.04Å; W277-F350 HydrophobicContact CH2-CE2 4.41Å; W277-F350 HydrophobicContact CZ2-CE2 4.04Å; W277-F350 HydrophobicContact CZ2-CZ 4.17Å; N280-F350 WeakPolarHBondContact ND2-CD1 3.19Å; N280-F350 WeakPolarHBondContact ND2-CE1 3.43Å; K321-F350 WeakPolarHBondContact O-CB 3.18Å; K321-F350 PolarHBondContact O-N 3.27Å; F350-T352 HydrophobicContact CD1-CG2 4.04Å; F350-T352 HydrophobicContact CE1-CG2 3.83Å; F350-N357 PolarHBondContact O-ND2 2.97Å; F350-G372 VanDerWaalsContact CZ-C 3.44Å; F350-W374 AromaticContact CD2-CD1 3.81Å; F350-W374 AromaticContact CD2-CD2 3.89Å; F350-W374 HydrophobicContact CD2-CD2 3.89Å; F350-W374 AromaticContact CD2-CE2 3.65Å; F350-W374 HydrophobicContact CD2-CG 4.03Å; F350-W374 HydrophobicContact CD2-CZ2 4.17Å; F350-W374 AromaticContact CD2-NE1 3.59Å; F350-W374 HydrophobicContact CE2-CD2 4.25Å; F350-W374 HydrophobicContact CE2-CZ2 4.32Å
351	T	98.7	Very high	95.8	Very high	0 Å²	0	63 Å²	63	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-133.5	137.8	-178.5	-70.1	0	0	0	0	109	N357 D358 N364 G372 W373 F375	T351-N357 WeakPolarHBondContact OG1-CA 3.21Å; T351-N357 PolarHBondContact OG1-N 3.06Å; T351-D358 HydrophobicContact CG2-CB 4.25Å; T351-D358 PolarHBondContact OG1-N 3.06Å; T351-N364 WeakPolarHBondContact CG2-OD1 2.96Å; T351-G372 VanDerWaalsContact O-CA 3.23Å; T351-G372 WeakPolarHBondContact O-CA 3.25Å; T351-W373 PolarHBondContact N-O 3.19Å; T351-W373 PolarHBondContact O-N 2.86Å; T351-F375 HydrophobicContact CG2-CD2 4.16Å
352	T	98.7	Very high	96.1	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-126.3	167	177	58.3	0	0	0	0	110.2	W262 Y265 F350 D354 R355 N364	W262-T352 HydrophobicContact CE3-CG2 3.96Å; W262-T352 PolarHBondContact N-OG1 2.88Å; Y265-T352 HydrophobicContact CD2-CG2 3.64Å; Y265-T352 HydrophobicContact CE2-CG2 4.34Å; Y265-T352 HydrophobicContact CG-CG2 4.16Å; F350-T352 HydrophobicContact CD1-CG2 4.04Å; F350-T352 HydrophobicContact CE1-CG2 3.83Å; T352-D354 WeakPolarHBondContact CB-OD1 3.48Å; T352-D354 PolarHBondContact O-N 3.27Å; T352-D354 VanDerWaalsContact O-N 3.1Å; T352-D354 PolarHBondContact OG1-OD1 3.18Å; T352-R355 PolarHBondContact N-O 3.1Å; T352-R355 CarbonylContact O-C 3.59Å; T352-R355 PolarHBondContact O-N 2.9Å; T352-N364 PolarHBondContact O-ND2 3.25Å
353	P	98.3	Very high	96.6	Very high	16 Å²	16	58 Å²	58	10%	0.104	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-31.3	-179.2	-26.5	34.3	0	0	0	114.9	R260 Y261 N364 L367	R260-P353 VanDerWaalsContact O-CD 3.27Å; R260-P353 WeakPolarHBondContact O-CD 3.39Å; Y261-P353 HydrophobicContact CD1-CB 4.17Å; Y261-P353 HydrophobicContact CD1-CG 4.5Å; Y261-P353 HydrophobicContact CE1-CB 4.06Å; P353-N364 PolarHBondContact O-ND2 2.77Å; P353-N364 VanDerWaalsContact O-ND2 3.15Å; P353-L367 HydrophobicContact CB-CB 4.48Å; P353-L367 HydrophobicContact CB-CD1 4.06Å
354	D	98.5	Very high	97	Very high	86 Å²	86	54.5 Å²	54.5	46%	0.46	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-8.5	-179.3	64.1	-46.5	0	0	0	114	Y261 W262 T352	Y261-D354 WeakPolarHBondContact CA-OD1 3.34Å; Y261-D354 VanDerWaalsContact CB-CG 3.5Å; Y261-D354 WeakPolarHBondContact CB-OD1 3.17Å; Y261-D354 WeakPolarHBondContact CB-OD2 3.34Å; Y261-D354 HydrophobicContact CD1-CB 3.78Å; Y261-D354 HydrophobicContact CE1-CB 4.32Å; Y261-D354 HydrophobicContact CG-CB 4.1Å; W262-D354 WeakPolarHBondContact CB-OD2 3.44Å; W262-D354 PolarHBondContact N-OD1 2.86Å; W262-D354 PolarHBondContact N-OD2 2.9Å; T352-D354 WeakPolarHBondContact CB-OD1 3.48Å; T352-D354 PolarHBondContact O-N 3.27Å; T352-D354 VanDerWaalsContact O-N 3.1Å; T352-D354 PolarHBondContact OG1-OD1 3.18Å
355	R	98.3	Very high	97.1	Very high	85 Å²	85	52.6 Å²	52.6	32%	0.321	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-144	101.9	-177.4	-167.8	174.3	177.4	173	-3	111.4	W262 E318 T352	W262-R355 HydrophobicContact CB-CB 4.25Å; W262-R355 HydrophobicContact CD2-CB 4.38Å; W262-R355 VanDerWaalsContact CD2-CD 3.46Å; W262-R355 HydrophobicContact CD2-CG 4.46Å; W262-R355 HydrophobicContact CE3-CB 4.01Å; W262-R355 HydrophobicContact CE3-CG 4.2Å; W262-R355 HydrophobicContact CG-CB 4.5Å; E318-R355 IonicContact OE1-NH1 2.95Å; E318-R355 PolarHBondContact OE1-NH1 3.01Å; T352-R355 PolarHBondContact N-O 3.1Å; T352-R355 CarbonylContact O-C 3.59Å; T352-R355 PolarHBondContact O-N 2.9Å
356	D	98.4	Very high	97.1	Very high	72 Å²	72	52.6 Å²	52.6	39%	0.385	25%	0.252	S	S	.	.			trans	-83.4	120.5	179.7	-166	-10.5	0	0	0	111.8	D358 N364	D356-D358 PolarHBondContact OD1-N 3.11Å; D356-N364 HydrophobicContact CB-CB 4.08Å; D356-N364 WeakPolarHBondContact OD2-CA 3.41Å; D356-N364 WeakPolarHBondContact OD2-CB 3.33Å
357	N	98	Very high	97.1	Very high	23 Å²	23	56.8 Å²	56.8	12%	0.123	27%	0.274	C	S	.	.			trans	-134.2	15.7	170.2	-54.3	-75.1	0	0	0	111.6	K321 F349 F350 T351	K321-N357 HydrophobicContact CD-CB 4.16Å; K321-N357 VanDerWaalsContact CD-OD1 3.27Å; K321-N357 WeakPolarHBondContact CD-OD1 3.17Å; K321-N357 VanDerWaalsContact CE-OD1 3.3Å; K321-N357 WeakPolarHBondContact CE-OD1 3.4Å; F349-N357 HydrophobicContact CB-CB 3.63Å; F349-N357 HydrophobicContact CG-CB 4.45Å; F350-N357 PolarHBondContact O-ND2 2.97Å; T351-N357 WeakPolarHBondContact OG1-CA 3.21Å; T351-N357 PolarHBondContact OG1-N 3.06Å
358	D	97	Very high	97	Very high	21 Å²	21	59.2 Å²	59.2	11%	0.112	28%	0.278	C	S	.	.	S	Bend	trans	-84.1	-178.5	-177.2	71.6	57.3	0	0	0	111.2	T351 D356 Y360 C365 F375 D376	T351-D358 HydrophobicContact CG2-CB 4.25Å; T351-D358 PolarHBondContact OG1-N 3.06Å; D356-D358 PolarHBondContact OD1-N 3.11Å; D358-Y360 VanDerWaalsContact OD1-CB 3.27Å; D358-Y360 WeakPolarHBondContact OD1-CB 3.25Å; D358-Y360 PolarHBondContact OD1-N 2.64Å; D358-C365 HydrophobicContact CB-CB 4.46Å; D358-C365 WeakPolarHBondContact OD2-CA 3.34Å; D358-C365 WeakPolarHBondContact OD2-CB 3.27Å; D358-C365 PolarHBondContact OD2-N 2.68Å; D358-C365 PolarHBondContact OD2-SG 3.29Å; D358-C365 VanDerWaalsContact OD2-SG 3.33Å; D358-F375 HydrophobicContact CB-CB 3.74Å; D358-D376 WeakPolarHBondContact CB-O 3.49Å
359	R	95	Very high	97	Very high	161 Å²	161	60.3 Å²	60.3	61%	0.608	28%	0.282	S	S	*	.	S	Bend	trans	-101.8	5	-176.2	-68.1	-166.3	176.6	175.8	-4.6	112.9	P361 D376 A377	R359-P361 VanDerWaalsContact O-CD 3.28Å; R359-P361 WeakPolarHBondContact O-CD 3.45Å; R359-D376 WeakPolarHBondContact CD-OD1 3.28Å; R359-D376 PolarHBondContact N-O 3.1Å; R359-A377 HydrophobicContact CB-CB 4.35Å
360	Y	95.2	Very high	96.9	Very high	99 Å²	99	58.8 Å²	58.8	39%	0.388	28%	0.281	S	S	.	.			trans	-81.6	111.9	-178.9	-171.9	-122.3	0	0	0	110.1	D358 Y362 G363 C365 A377	D358-Y360 VanDerWaalsContact OD1-CB 3.27Å; D358-Y360 WeakPolarHBondContact OD1-CB 3.25Å; D358-Y360 PolarHBondContact OD1-N 2.64Å; Y360-Y362 HydrophobicContact CE2-CD2 4.04Å; Y360-Y362 PolarHBondContact O-N 3.02Å; Y360-G363 WeakPolarHBondContact CD1-O 3.34Å; Y360-G363 VanDerWaalsContact O-O 3.08Å; Y360-C365 VanDerWaalsContact CB-SG 3.58Å; Y360-A377 HydrophobicContact CD2-CB 4.31Å
361	P	93.2	Very high	96.8	Very high	104 Å²	104	58.8 Å²	58.8	68%	0.675	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-13.4	-170.2	28.8	-34.9	0	0	0	113.8	R359	R359-P361 VanDerWaalsContact O-CD 3.28Å; R359-P361 WeakPolarHBondContact O-CD 3.45Å
362	Y	93.4	Very high	96.8	Very high	196 Å²	196	58.8 Å²	58.8	77%	0.769	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	7.1	-171.5	-54.4	-65.8	0	0	0	113.6	Y360	Y360-Y362 HydrophobicContact CE2-CD2 4.04Å; Y360-Y362 PolarHBondContact O-N 3.02Å
363	G	94.8	Very high	96.8	Very high	31 Å²	31	58.8 Å²	58.8	32%	0.32	28%	0.281	S	S	.	.	S	Bend	trans	162.9	-177.9	175.7	0	0	0	0	0	113	Y360	Y360-G363 WeakPolarHBondContact CD1-O 3.34Å; Y360-G363 VanDerWaalsContact O-O 3.08Å
364	N	97.5	Very high	96.8	Very high	23 Å²	23	58.1 Å²	58.1	12%	0.123	28%	0.276	C	S	.	.			trans	-97.4	116.1	-176.8	177.2	-17.4	0	0	0	110.4	T351 T352 P353 D356 G366 L367 Y368	T351-N364 WeakPolarHBondContact CG2-OD1 2.96Å; T352-N364 PolarHBondContact O-ND2 3.25Å; P353-N364 PolarHBondContact O-ND2 2.77Å; P353-N364 VanDerWaalsContact O-ND2 3.15Å; D356-N364 HydrophobicContact CB-CB 4.08Å; D356-N364 WeakPolarHBondContact OD2-CA 3.41Å; D356-N364 WeakPolarHBondContact OD2-CB 3.33Å; N364-G366 VanDerWaalsContact C-N 3.33Å; N364-G366 PolarHBondContact O-N 2.85Å; N364-G366 VanDerWaalsContact OD1-CA 3.25Å; N364-G366 WeakPolarHBondContact OD1-CA 3.43Å; N364-G366 PolarHBondContact OD1-N 3.15Å; N364-L367 HydrophobicContact CB-CB 3.86Å; N364-L367 WeakPolarHBondContact O-CB 3.25Å; N364-L367 PolarHBondContact O-N 2.03Å; N364-L367 PolarHBondContact OD1-N 3.48Å; N364-Y368 WeakPolarHBondContact O-CB 3.29Å; N364-Y368 PolarHBondContact O-N 3.39Å
365	C	97.1	Very high	96.7	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.7	-39	176.3	-59.6	0	0	0	0	111.7	D358 Y360 L367 Y368 Y369 F375 C378	D358-C365 HydrophobicContact CB-CB 4.46Å; D358-C365 WeakPolarHBondContact OD2-CA 3.34Å; D358-C365 WeakPolarHBondContact OD2-CB 3.27Å; D358-C365 PolarHBondContact OD2-N 2.68Å; D358-C365 PolarHBondContact OD2-SG 3.29Å; D358-C365 VanDerWaalsContact OD2-SG 3.33Å; Y360-C365 VanDerWaalsContact CB-SG 3.58Å; C365-L367 VanDerWaalsContact C-N 3.28Å; C365-L367 PolarHBondContact O-N 2.84Å; C365-Y368 PolarHBondContact O-N 3.03Å; C365-Y369 HydrophobicContact CB-CD2 4.29Å; C365-Y369 WeakPolarHBondContact O-CB 3.28Å; C365-Y369 VanDerWaalsContact O-CD2 3.26Å; C365-Y369 WeakPolarHBondContact O-CD2 3.26Å; C365-Y369 PolarHBondContact O-N 2.89Å; C365-F375 HydrophobicContact CB-CB 3.76Å; C365-F375 HydrophobicContact CB-CD1 4Å; C365-F375 HydrophobicContact CB-CD2 4Å; C365-F375 HydrophobicContact CB-CG 3.65Å; C365-C378 HydrophobicContact CB-CB 3.64Å; C365-C378 WeakPolarHBondContact CB-SG 3.36Å; C365-C378 WeakPolarHBondContact SG-CA 3.46Å; C365-C378 WeakPolarHBondContact SG-CB 3.1Å; C365-C378 CovalentContact SG-SG 2.03Å; C365-C378 PolarHBondContact SG-SG 2.91Å
366	G	97.2	Very high	96.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-38.4	175.4	0	0	0	0	0	112.7	N364 S370 S371 F375	N364-G366 VanDerWaalsContact C-N 3.33Å; N364-G366 PolarHBondContact O-N 2.85Å; N364-G366 VanDerWaalsContact OD1-CA 3.25Å; N364-G366 WeakPolarHBondContact OD1-CA 3.43Å; N364-G366 PolarHBondContact OD1-N 3.15Å; G366-S370 VanDerWaalsContact O-CA 3.31Å; G366-S370 WeakPolarHBondContact O-CA 3.49Å; G366-S370 PolarHBondContact O-N 3.5Å; G366-S371 VanDerWaalsContact CA-O 3.28Å; G366-S371 WeakPolarHBondContact CA-O 3.49Å; G366-S371 PolarHBondContact O-N 2.97Å; G366-F375 VanDerWaalsContact CA-CE2 3.46Å
367	L	97.3	Very high	96.2	Very high	109 Å²	109	48.5 Å²	48.5	57%	0.571	24%	0.236	S	C	*	.	H	α-helix	trans	-68.4	-50.7	173.2	-177	63.3	0	0	0	111.1	P353 N364 C365 Y369 S370	P353-L367 HydrophobicContact CB-CB 4.48Å; P353-L367 HydrophobicContact CB-CD1 4.06Å; N364-L367 HydrophobicContact CB-CB 3.86Å; N364-L367 WeakPolarHBondContact O-CB 3.25Å; N364-L367 PolarHBondContact O-N 2.03Å; N364-L367 PolarHBondContact OD1-N 3.48Å; C365-L367 VanDerWaalsContact C-N 3.28Å; C365-L367 PolarHBondContact O-N 2.84Å; L367-Y369 VanDerWaalsContact C-N 3.34Å; L367-Y369 PolarHBondContact O-N 2.94Å; L367-S370 PolarHBondContact O-N 3.27Å; L367-S370 VanDerWaalsContact O-N 3.11Å
368	Y	96.5	Very high	95.7	Very high	133 Å²	133	48 Å²	48	52%	0.522	23%	0.234	S	C	.	.	H	α-helix	trans	-62.2	-37.4	-176.7	-175.3	-106.6	0	0	0	113.3	N364 C365 V395	N364-Y368 WeakPolarHBondContact O-CB 3.29Å; N364-Y368 PolarHBondContact O-N 3.39Å; C365-Y368 PolarHBondContact O-N 3.03Å; Y368-V395 HydrophobicContact CD1-CG1 3.94Å; Y368-V395 HydrophobicContact CE1-CG1 3.45Å; Y368-V395 VanDerWaalsContact CE1-CG1 3.45Å; Y368-V395 HydrophobicContact CE1-CG2 4.49Å; Y368-V395 HydrophobicContact CE2-CG1 4.32Å; Y368-V395 HydrophobicContact CE2-CG2 4.05Å
369	Y	95.9	Very high	95.5	Very high	36 Å²	36	47.8 Å²	47.8	14%	0.141	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	6.3	176.4	-63.9	-73.2	0	0	0	113.5	C365 L367 S371 F375 C378 L379 V395 R396 N397	C365-Y369 HydrophobicContact CB-CD2 4.29Å; C365-Y369 WeakPolarHBondContact O-CB 3.28Å; C365-Y369 VanDerWaalsContact O-CD2 3.26Å; C365-Y369 WeakPolarHBondContact O-CD2 3.26Å; C365-Y369 PolarHBondContact O-N 2.89Å; L367-Y369 VanDerWaalsContact C-N 3.34Å; L367-Y369 PolarHBondContact O-N 2.94Å; Y369-S371 VanDerWaalsContact C-N 3.27Å; Y369-S371 PolarHBondContact O-N 2.89Å; Y369-S371 PolarHBondContact O-OG 3.07Å; Y369-F375 HydrophobicContact CD2-CE1 4.17Å; Y369-C378 HydrophobicContact CD2-CB 4.23Å; Y369-C378 HydrophobicContact CE2-CB 3.43Å; Y369-C378 VanDerWaalsContact CE2-CB 3.43Å; Y369-L379 HydrophobicContact CD1-CD2 3.66Å; Y369-L379 HydrophobicContact CD2-CD2 3.49Å; Y369-L379 VanDerWaalsContact CD2-CD2 3.49Å; Y369-L379 HydrophobicContact CE1-CD2 3.61Å; Y369-L379 HydrophobicContact CE1-CG 4.47Å; Y369-L379 HydrophobicContact CE2-CD2 3.48Å; Y369-L379 VanDerWaalsContact CE2-CD2 3.48Å; Y369-L379 HydrophobicContact CE2-CG 4.22Å; Y369-L379 HydrophobicContact CG-CD2 3.58Å; Y369-V395 HydrophobicContact CD1-CG1 4.03Å; Y369-V395 HydrophobicContact CE1-CG1 4Å; Y369-R396 WeakPolarHBondContact CD1-O 3.31Å; Y369-R396 HydrophobicContact CE1-CB 4.47Å; Y369-R396 VanDerWaalsContact CE1-O 3.24Å; Y369-R396 WeakPolarHBondContact CE1-O 3.23Å; Y369-N397 HydrophobicContact CD1-CB 4.12Å
370	S	96.3	Very high	95.4	Very high	39 Å²	39	40.3 Å²	40.3	27%	0.273	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	43.1	174	-48.8	0	0	0	0	113.6	T259 G366 L367	T259-S370 VanDerWaalsContact CA-O 3.28Å; T259-S370 WeakPolarHBondContact CA-O 3.38Å; T259-S370 VanDerWaalsContact CB-O 3.31Å; T259-S370 WeakPolarHBondContact CB-O 3.36Å; T259-S370 PolarHBondContact OG1-O 2.97Å; G366-S370 VanDerWaalsContact O-CA 3.31Å; G366-S370 WeakPolarHBondContact O-CA 3.49Å; G366-S370 PolarHBondContact O-N 3.5Å; L367-S370 PolarHBondContact O-N 3.27Å; L367-S370 VanDerWaalsContact O-N 3.11Å
371	S	97.3	Very high	95.5	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	S	Bend	trans	-156.4	161	-175.7	45.1	0	0	0	0	111.4	G366 Y369 F375 N382 N384	G366-S371 VanDerWaalsContact CA-O 3.28Å; G366-S371 WeakPolarHBondContact CA-O 3.49Å; G366-S371 PolarHBondContact O-N 2.97Å; Y369-S371 VanDerWaalsContact C-N 3.27Å; Y369-S371 PolarHBondContact O-N 2.89Å; Y369-S371 PolarHBondContact O-OG 3.07Å; S371-F375 WeakPolarHBondContact O-CE2 3.4Å; S371-N382 PolarHBondContact OG-ND2 3.17Å; S371-N384 VanDerWaalsContact CB-O 3.25Å; S371-N384 WeakPolarHBondContact CB-O 3.39Å
372	G	98.4	Very high	95.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.			trans	-94.2	127.3	168.7	0	0	0	0	0	111.4	Y265 F350 T351 N384	Y265-G372 VanDerWaalsContact CZ-CA 3.44Å; Y265-G372 PolarHBondContact OH-N 2.96Å; F350-G372 VanDerWaalsContact CZ-C 3.44Å; T351-G372 VanDerWaalsContact O-CA 3.23Å; T351-G372 WeakPolarHBondContact O-CA 3.25Å; G372-N384 WeakPolarHBondContact O-CB 3.48Å; G372-N384 PolarHBondContact O-ND2 3.05Å
373	W	98.6	Very high	95.9	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.119	C	C	.	.	B	Isolated β-bridge	trans	-159.6	169.5	178.8	-161.2	-116.7	0	0	0	111.8	W277 L337 H345 T351 F375 A381 L383 N384 M424	W277-W373 HydrophobicContact CZ3-CZ3 4.4Å; L337-W373 HydrophobicContact CD2-CZ2 4.26Å; H345-W373 AromaticContact CE1-CD1 3.7Å; H345-W373 AromaticContact CE1-NE1 3.55Å; H345-W373 AromaticContact ND1-CD1 3.62Å; H345-W373 AromaticContact ND1-NE1 3.41Å; H345-W373 PolarHBondContact ND1-NE1 3.4Å; T351-W373 PolarHBondContact N-O 3.19Å; T351-W373 PolarHBondContact O-N 2.86Å; W373-F375 VanDerWaalsContact C-N 3.26Å; W373-F375 HydrophobicContact CB-CD1 4.19Å; W373-F375 HydrophobicContact CB-CD2 3.92Å; W373-F375 HydrophobicContact CB-CE1 3.81Å; W373-F375 HydrophobicContact CB-CE2 3.5Å; W373-F375 VanDerWaalsContact CB-CE2 3.5Å; W373-F375 HydrophobicContact CB-CG 4.25Å; W373-F375 HydrophobicContact CB-CZ 3.45Å; W373-F375 VanDerWaalsContact CB-CZ 3.45Å; W373-F375 HydrophobicContact CG-CE1 4.37Å; W373-F375 HydrophobicContact CG-CZ 4.42Å; W373-F375 PolarHBondContact O-N 3.15Å; W373-A381 VanDerWaalsContact CD1-O 3.28Å; W373-A381 PolarHBondContact NE1-O 2.89Å; W373-L383 HydrophobicContact CH2-CB 3.8Å; W373-L383 HydrophobicContact CH2-CD1 4.05Å; W373-L383 HydrophobicContact CH2-CG 3.82Å; W373-L383 HydrophobicContact CZ2-CB 4.48Å; W373-L383 HydrophobicContact CZ2-CG 4.21Å; W373-L383 HydrophobicContact CZ3-CB 4.05Å; W373-N384 HydrophobicContact CE3-CB 4.18Å; W373-M424 HydrophobicContact CH2-CE 4.11Å; W373-M424 HydrophobicContact CH2-SD 3.68Å; W373-M424 HydrophobicContact CZ3-SD 3.95Å
374	W	98.3	Very high	96.1	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.008	10%	0.103	C	C	.	.			trans	-78.4	72.2	169.7	-60.7	-77.9	0	0	0	110.6	W277 F313 V315 Y322 L324 H345 K348 F349 F350 M424	W277-W374 AromaticContact CH2-CH2 3.83Å; W277-W374 HydrophobicContact CH2-CH2 3.83Å; W277-W374 HydrophobicContact CH2-CZ3 4.18Å; W277-W374 HydrophobicContact CZ2-CH2 4.36Å; F313-W374 HydrophobicContact CE2-CH2 4.49Å; F313-W374 HydrophobicContact CZ-CH2 4.42Å; V315-W374 HydrophobicContact CG1-CZ2 4.45Å; V315-W374 HydrophobicContact CG2-CH2 4.43Å; V315-W374 HydrophobicContact CG2-CZ2 3.75Å; Y322-W374 PolarHBondContact O-NE1 3.08Å; L324-W374 HydrophobicContact CB-CB 4.3Å; L324-W374 HydrophobicContact CB-CD2 3.94Å; L324-W374 HydrophobicContact CB-CG 3.68Å; L324-W374 HydrophobicContact CD1-CD2 4.33Å; L324-W374 HydrophobicContact CD1-CH2 4.43Å; L324-W374 HydrophobicContact CD1-CZ2 4.21Å; L324-W374 HydrophobicContact CD2-CB 4.27Å; L324-W374 HydrophobicContact CD2-CD2 3.95Å; L324-W374 HydrophobicContact CD2-CE3 4.04Å; L324-W374 HydrophobicContact CD2-CG 4.08Å; L324-W374 HydrophobicContact CG-CD2 4.31Å; L324-W374 HydrophobicContact CG-CG 4.43Å; H345-W374 PolarHBondContact ND1-O 3.13Å; K348-W374 HydrophobicContact CB-CB 4.32Å; F349-W374 WeakPolarHBondContact O-CA 3.49Å; F350-W374 AromaticContact CD2-CD1 3.81Å; F350-W374 AromaticContact CD2-CD2 3.89Å; F350-W374 HydrophobicContact CD2-CD2 3.89Å; F350-W374 AromaticContact CD2-CE2 3.65Å; F350-W374 HydrophobicContact CD2-CG 4.03Å; F350-W374 HydrophobicContact CD2-CZ2 4.17Å; F350-W374 AromaticContact CD2-NE1 3.59Å; F350-W374 HydrophobicContact CE2-CD2 4.25Å; F350-W374 HydrophobicContact CE2-CZ2 4.32Å; W374-M424 HydrophobicContact CZ3-CE 4.2Å
375	F	97.2	Very high	96	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.097	C	C	.	.			trans	-73.5	144.6	-176.7	-67.4	-65.3	0	0	0	112.6	T351 D358 C365 G366 Y369 S371 W373 L379	T351-F375 HydrophobicContact CG2-CD2 4.16Å; D358-F375 HydrophobicContact CB-CB 3.74Å; C365-F375 HydrophobicContact CB-CB 3.76Å; C365-F375 HydrophobicContact CB-CD1 4Å; C365-F375 HydrophobicContact CB-CD2 4Å; C365-F375 HydrophobicContact CB-CG 3.65Å; G366-F375 VanDerWaalsContact CA-CE2 3.46Å; Y369-F375 HydrophobicContact CD2-CE1 4.17Å; S371-F375 WeakPolarHBondContact O-CE2 3.4Å; W373-F375 VanDerWaalsContact C-N 3.26Å; W373-F375 HydrophobicContact CB-CD1 4.19Å; W373-F375 HydrophobicContact CB-CD2 3.92Å; W373-F375 HydrophobicContact CB-CE1 3.81Å; W373-F375 HydrophobicContact CB-CE2 3.5Å; W373-F375 VanDerWaalsContact CB-CE2 3.5Å; W373-F375 HydrophobicContact CB-CG 4.25Å; W373-F375 HydrophobicContact CB-CZ 3.45Å; W373-F375 VanDerWaalsContact CB-CZ 3.45Å; W373-F375 HydrophobicContact CG-CE1 4.37Å; W373-F375 HydrophobicContact CG-CZ 4.42Å; W373-F375 PolarHBondContact O-N 3.15Å; F375-L379 HydrophobicContact CD1-CB 4.02Å; F375-L379 HydrophobicContact CD1-CD2 4.32Å; F375-L379 HydrophobicContact CE1-CB 4.16Å; F375-L379 HydrophobicContact CE1-CD2 3.74Å
376	D	93.5	Very high	96	Very high	7 Å²	7	24 Å²	24	4%	0.037	12%	0.12	C	C	.	.	S	Bend	trans	-100.1	-111.2	167.8	-168.7	13.1	0	0	0	109	N344 K348 D358 R359 C378	N344-D376 PolarHBondContact N-OD2 2.99Å; N344-D376 VanDerWaalsContact N-OD2 3.12Å; K348-D376 HydrophobicContact CD-CB 4.18Å; K348-D376 WeakPolarHBondContact CE-OD1 3.23Å; K348-D376 HydrophobicContact CG-CB 4.17Å; D358-D376 WeakPolarHBondContact CB-O 3.49Å; R359-D376 WeakPolarHBondContact CD-OD1 3.28Å; R359-D376 PolarHBondContact N-O 3.1Å; D376-C378 PolarHBondContact N-O 2.89Å
377	A	91.5	Very high	95.9	Very high	35 Å²	35	25.1 Å²	25.1	29%	0.289	13%	0.125	S	C	.	.	S	Bend	trans	-136	67.5	171.3	0	0	0	0	0	111.7	R359 Y360	R359-A377 HydrophobicContact CB-CB 4.35Å; Y360-A377 HydrophobicContact CD2-CB 4.31Å
378	C	88.8	Confident	95.8	Very high	13 Å²	13	22.3 Å²	22.3	9%	0.088	11%	0.107	C	C	.	.	S	Bend	cis	-113.2	-49.1	0.5	-77.3	0	0	0	0	113.2	C365 Y369 D376	C365-C378 HydrophobicContact CB-CB 3.64Å; C365-C378 WeakPolarHBondContact CB-SG 3.36Å; C365-C378 WeakPolarHBondContact SG-CA 3.46Å; C365-C378 WeakPolarHBondContact SG-CB 3.1Å; C365-C378 CovalentContact SG-SG 2.03Å; C365-C378 PolarHBondContact SG-SG 2.91Å; Y369-C378 HydrophobicContact CD2-CB 4.23Å; Y369-C378 HydrophobicContact CE2-CB 3.43Å; Y369-C378 VanDerWaalsContact CE2-CB 3.43Å; D376-C378 PolarHBondContact N-O 2.89Å
379	L	91.9	Very high	95.6	Very high	15 Å²	15	21.9 Å²	21.9	8%	0.079	11%	0.109	C	C	.	.			trans	-152.9	147.8	-172.8	69.2	92.6	0	0	0	113.8	Y369 F375 N382 F400	Y369-L379 HydrophobicContact CD1-CD2 3.66Å; Y369-L379 HydrophobicContact CD2-CD2 3.49Å; Y369-L379 VanDerWaalsContact CD2-CD2 3.49Å; Y369-L379 HydrophobicContact CE1-CD2 3.61Å; Y369-L379 HydrophobicContact CE1-CG 4.47Å; Y369-L379 HydrophobicContact CE2-CD2 3.48Å; Y369-L379 VanDerWaalsContact CE2-CD2 3.48Å; Y369-L379 HydrophobicContact CE2-CG 4.22Å; Y369-L379 HydrophobicContact CG-CD2 3.58Å; F375-L379 HydrophobicContact CD1-CB 4.02Å; F375-L379 HydrophobicContact CD1-CD2 4.32Å; F375-L379 HydrophobicContact CE1-CB 4.16Å; F375-L379 HydrophobicContact CE1-CD2 3.74Å; L379-N382 HydrophobicContact CD1-CB 4.45Å; L379-N382 HydrophobicContact CD2-CB 4.06Å; L379-F400 HydrophobicContact CD1-CD1 3.41Å; L379-F400 VanDerWaalsContact CD1-CD1 3.41Å; L379-F400 HydrophobicContact CD1-CE1 3.86Å; L379-F400 HydrophobicContact CD1-CG 4.44Å
380	S	94.1	Very high	95.3	Very high	5 Å²	5	27.7 Å²	27.7	4%	0.035	14%	0.138	C	C	.	.	S	Bend	trans	-111.2	-16.1	156.2	42.8	0	0	0	0	112.2	A336 F339 Y343 H345 F400 G402	A336-S380 WeakPolarHBondContact O-CB 3.28Å; A336-S380 PolarHBondContact O-OG 2.76Å; F339-S380 WeakPolarHBondContact CB-OG 3.5Å; Y343-S380 PolarHBondContact O-OG 2.86Å; Y343-S380 VanDerWaalsContact O-OG 3.12Å; H345-S380 PolarHBondContact CD2-OG 2.74Å; H345-S380 VanDerWaalsContact CD2-OG 3.28Å; H345-S380 PolarHBondContact NE2-N 2.77Å; H345-S380 PolarHBondContact NE2-OG 2.87Å; H345-S380 VanDerWaalsContact NE2-OG 3.17Å; S380-F400 VanDerWaalsContact O-CE1 3.28Å; S380-F400 WeakPolarHBondContact O-CE1 3.43Å; S380-G402 VanDerWaalsContact O-CA 3.28Å; S380-G402 WeakPolarHBondContact O-CA 3.38Å; S380-G402 PolarHBondContact O-N 2.75Å
381	A	96.1	Very high	95	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	145.1	173.8	0	0	0	0	0	110.3	A336 L337 H345 W373 F400 W401	A336-A381 HydrophobicContact CB-CB 3.97Å; L337-A381 HydrophobicContact CD2-CB 4.05Å; H345-A381 PolarHBondContact CE1-O 2.9Å; H345-A381 PolarHBondContact NE2-N 3.3Å; H345-A381 PolarHBondContact NE2-O 3.19Å; W373-A381 VanDerWaalsContact CD1-O 3.28Å; W373-A381 PolarHBondContact NE1-O 2.89Å; A381-F400 WeakPolarHBondContact CA-O 3.28Å; A381-W401 HydrophobicContact CB-CD2 4.41Å; A381-W401 HydrophobicContact CB-CE3 3.59Å; A381-W401 HydrophobicContact CB-CZ3 3.71Å
382	N	97	Very high	94.6	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	103.1	169.7	-179.3	3.3	0	0	0	109.6	S371 L379 N384 G385 I399 F400	S371-N382 PolarHBondContact OG-ND2 3.17Å; L379-N382 HydrophobicContact CD1-CB 4.45Å; L379-N382 HydrophobicContact CD2-CB 4.06Å; N382-N384 VanDerWaalsContact C-N 3.33Å; N382-N384 PolarHBondContact OD1-N 3.07Å; N382-G385 PolarHBondContact OD1-N 2.95Å; N382-G385 VanDerWaalsContact OD1-N 3.13Å; N382-I399 CarbonylContact O-C 3.58Å; N382-I399 WeakPolarHBondContact O-CA 3.34Å; N382-F400 PolarHBondContact N-O 2.92Å; N382-F400 PolarHBondContact O-N 3.49Å
383	L	98.3	Very high	94.2	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-11	179.7	-56	-175.3	0	0	0	113.1	Q249 R251 I296 L298 W373 I399 W401 A422 M424	Q249-L383 PolarHBondContact NE2-O 3.45Å; R251-L383 PolarHBondContact NH1-O 3.15Å; I296-L383 HydrophobicContact CD1-CD1 4.17Å; I296-L383 HydrophobicContact CG2-CD1 3.54Å; L298-L383 HydrophobicContact CD2-CD2 3.74Å; W373-L383 HydrophobicContact CH2-CB 3.8Å; W373-L383 HydrophobicContact CH2-CD1 4.05Å; W373-L383 HydrophobicContact CH2-CG 3.82Å; W373-L383 HydrophobicContact CZ2-CB 4.48Å; W373-L383 HydrophobicContact CZ2-CG 4.21Å; W373-L383 HydrophobicContact CZ3-CB 4.05Å; L383-I399 HydrophobicContact CD2-CG2 4.13Å; L383-W401 HydrophobicContact CD1-CZ3 4.38Å; L383-W401 HydrophobicContact CD2-CE3 3.93Å; L383-W401 HydrophobicContact CD2-CZ3 4.39Å; L383-W401 HydrophobicContact CG-CE3 4.49Å; L383-W401 HydrophobicContact CG-CZ3 4.5Å; L383-A422 HydrophobicContact CD2-CB 4.35Å; L383-M424 HydrophobicContact CD1-CG 3.68Å; L383-M424 HydrophobicContact CD1-SD 3.86Å
384	N	98.6	Very high	93.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.7	3.9	-177.7	-71.4	-9.6	0	0	0	112.9	Q249 F258 Y265 S371 G372 W373 N382	Q249-N384 PolarHBondContact NE2-OD1 3.08Å; F258-N384 VanDerWaalsContact CB-O 3.23Å; F258-N384 WeakPolarHBondContact CB-O 3.29Å; F258-N384 HydrophobicContact CD1-CB 4.08Å; Y265-N384 WeakPolarHBondContact CE1-ND2 3.37Å; S371-N384 VanDerWaalsContact CB-O 3.25Å; S371-N384 WeakPolarHBondContact CB-O 3.39Å; G372-N384 WeakPolarHBondContact O-CB 3.48Å; G372-N384 PolarHBondContact O-ND2 3.05Å; W373-N384 HydrophobicContact CE3-CB 4.18Å; N382-N384 VanDerWaalsContact C-N 3.33Å; N382-N384 PolarHBondContact OD1-N 3.07Å
385	G	96.8	Very high	93.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-60.4	168.6	175.7	0	0	0	0	0	113.4	R251 N382 N397	R251-G385 VanDerWaalsContact CZ-O 3.31Å; R251-G385 PolarHBondContact NH1-O 2.88Å; R251-G385 PolarHBondContact NH2-O 3.33Å; N382-G385 PolarHBondContact OD1-N 2.95Å; N382-G385 VanDerWaalsContact OD1-N 3.13Å; G385-N397 CarbonylContact C-O 3.55Å; G385-N397 VanDerWaalsContact CA-O 3.26Å; G385-N397 WeakPolarHBondContact CA-O 3.1Å
386	K	96.1	Very high	92.8	Very high	109 Å²	109	48.2 Å²	48.2	47%	0.474	23%	0.234	S	C	.	.	B	Isolated β-bridge	trans	-59.3	137.9	177.9	-178.4	169.1	176.9	177.1	0	111	Y388 N397 G398 I399	K386-Y388 HydrophobicContact CB-CD2 4.27Å; K386-Y388 HydrophobicContact CB-CE2 3.75Å; K386-Y388 HydrophobicContact CD-CE1 4.38Å; K386-Y388 HydrophobicContact CD-CE2 4Å; K386-Y388 HydrophobicContact CG-CD2 4.27Å; K386-Y388 HydrophobicContact CG-CE2 3.85Å; K386-Y388 WeakPolarHBondContact O-CD2 3.31Å; K386-Y388 PolarHBondContact O-N 2.75Å; K386-N397 PolarHBondContact N-O 2.97Å; K386-G398 VanDerWaalsContact O-CA 3.24Å; K386-G398 WeakPolarHBondContact O-CA 3.2Å; K386-I399 PolarHBondContact O-N 3.21Å
387	Y	96.5	Very high	92.8	Very high	24 Å²	24	49 Å²	49	9%	0.094	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-78.3	118.8	175.9	-163.8	-85.1	0	0	0	109.8	L252 G254 F301 H389 I399 R420	L252-Y387 PolarHBondContact O-OH 3.31Å; G254-Y387 VanDerWaalsContact CA-CB 3.5Å; G254-Y387 VanDerWaalsContact CA-CG 3.48Å; F301-Y387 HydrophobicContact CZ-CE1 4.19Å; Y387-H389 AromaticContact CD1-CE1 3.87Å; Y387-H389 AromaticContact CE1-CD2 3.97Å; Y387-H389 AromaticContact CE1-NE2 3.88Å; Y387-I399 HydrophobicContact CD2-CD1 3.67Å; Y387-I399 HydrophobicContact CE2-CD1 4.23Å; Y387-R420 VanDerWaalsContact CE2-O 3.28Å; Y387-R420 WeakPolarHBondContact CE2-O 2.96Å; Y387-R420 PolarHBondContact OH-O 3.46Å
388	Y	94.9	Very high	92.9	Very high	49 Å²	49	47.3 Å²	47.3	19%	0.192	22%	0.224	C	C	.	.			trans	-112.6	118	175.4	-73.2	-86.9	0	0	0	109.9	F301 K386 Q390 Y392 N397	F301-Y388 WeakPolarHBondContact CE2-O 3.46Å; F301-Y388 WeakPolarHBondContact CZ-O 3.46Å; K386-Y388 HydrophobicContact CB-CD2 4.27Å; K386-Y388 HydrophobicContact CB-CE2 3.75Å; K386-Y388 HydrophobicContact CD-CE1 4.38Å; K386-Y388 HydrophobicContact CD-CE2 4Å; K386-Y388 HydrophobicContact CG-CD2 4.27Å; K386-Y388 HydrophobicContact CG-CE2 3.85Å; K386-Y388 WeakPolarHBondContact O-CD2 3.31Å; K386-Y388 PolarHBondContact O-N 2.75Å; Y388-Q390 WeakPolarHBondContact CB-O 3.49Å; Y388-Q390 PolarHBondContact O-N 3.39Å; Y388-Y392 AromaticContact CD1-CD1 3.94Å; Y388-Y392 HydrophobicContact CD1-CD1 3.94Å; Y388-Y392 AromaticContact CD1-CG 3.77Å; Y388-Y392 HydrophobicContact CD1-CG 3.77Å; Y388-Y392 AromaticContact CD2-CD1 3.62Å; Y388-Y392 HydrophobicContact CD2-CD1 3.62Å; Y388-Y392 HydrophobicContact CD2-CD2 4.29Å; Y388-Y392 AromaticContact CD2-CE1 3.71Å; Y388-Y392 HydrophobicContact CD2-CE1 3.71Å; Y388-Y392 HydrophobicContact CD2-CE2 4.36Å; Y388-Y392 AromaticContact CD2-CG 3.94Å; Y388-Y392 HydrophobicContact CD2-CG 3.94Å; Y388-Y392 HydrophobicContact CE1-CD1 4.43Å; Y388-Y392 HydrophobicContact CE1-CD2 4.2Å; Y388-Y392 AromaticContact CE1-CG 3.87Å; Y388-Y392 HydrophobicContact CE1-CG 3.87Å; Y388-Y392 HydrophobicContact CE2-CD1 4.15Å; Y388-Y392 AromaticContact CE2-CD2 3.97Å; Y388-Y392 HydrophobicContact CE2-CD2 3.97Å; Y388-Y392 HydrophobicContact CE2-CE1 4.22Å; Y388-Y392 HydrophobicContact CE2-CE2 4.03Å; Y388-Y392 HydrophobicContact CE2-CG 4.04Å; Y388-Y392 AromaticContact CG-CD1 3.49Å; Y388-Y392 HydrophobicContact CG-CD1 3.49Å; Y388-Y392 VanDerWaalsContact CG-CD1 3.49Å; Y388-Y392 HydrophobicContact CG-CE1 4.04Å; Y388-Y392 AromaticContact CG-CG 3.8Å; Y388-Y392 HydrophobicContact CG-CG 3.8Å; Y388-Y392 AromaticContact CZ-CD2 3.92Å; Y388-N397 WeakPolarHBondContact CE2-OD1 3.24Å; Y388-N397 PolarHBondContact OH-OD1 3.1Å; Y388-N397 VanDerWaalsContact OH-OD1 3.05Å
389	H	91.9	Very high	93.3	Very high	124 Å²	124	46.7 Å²	46.7	57%	0.574	22%	0.22	S	C	*	.	S	Bend	trans	-67.4	-20.6	177.8	-68.3	85.5	0	0	0	113.6	D253 Y387	D253-H389 PolarHBondContact O-NE2 2.83Å; Y387-H389 AromaticContact CD1-CE1 3.87Å; Y387-H389 AromaticContact CE1-CD2 3.97Å; Y387-H389 AromaticContact CE1-NE2 3.88Å
390	Q	89.1	Confident	93.5	Very high	159 Å²	159	46.7 Å²	46.7	74%	0.743	22%	0.22	S	C	*	.	S	Bend	trans	-139.8	172.6	-177.4	-60.8	-177	17.2	0	0	109.4	Y388	Y388-Q390 WeakPolarHBondContact CB-O 3.49Å; Y388-Q390 PolarHBondContact O-N 3.39Å
391	K	89.4	Confident	93.6	Very high	136 Å²	136	46.5 Å²	46.5	59%	0.591	22%	0.218	S	C	*	.			trans	-59.5	142.3	172.3	-68.5	-178.9	-179.9	177.9	0	110.9	Y415 K416	K391-Y415 HydrophobicContact CB-CD1 3.84Å; K391-Y415 HydrophobicContact CB-CG 4.27Å; K391-K416 CarbonylContact C-O 3.52Å; K391-K416 WeakPolarHBondContact CA-O 3.32Å
392	Y	90.4	Very high	93.5	Very high	13 Å²	13	47.2 Å²	47.2	5%	0.051	23%	0.226	C	C	.	.	B	Isolated β-bridge	trans	-129.5	163.2	-176	65.7	-83.5	0	0	0	112.1	Y388 V395 G398 Y415 K416	Y388-Y392 AromaticContact CD1-CD1 3.94Å; Y388-Y392 HydrophobicContact CD1-CD1 3.94Å; Y388-Y392 AromaticContact CD1-CG 3.77Å; Y388-Y392 HydrophobicContact CD1-CG 3.77Å; Y388-Y392 AromaticContact CD2-CD1 3.62Å; Y388-Y392 HydrophobicContact CD2-CD1 3.62Å; Y388-Y392 HydrophobicContact CD2-CD2 4.29Å; Y388-Y392 AromaticContact CD2-CE1 3.71Å; Y388-Y392 HydrophobicContact CD2-CE1 3.71Å; Y388-Y392 HydrophobicContact CD2-CE2 4.36Å; Y388-Y392 AromaticContact CD2-CG 3.94Å; Y388-Y392 HydrophobicContact CD2-CG 3.94Å; Y388-Y392 HydrophobicContact CE1-CD1 4.43Å; Y388-Y392 HydrophobicContact CE1-CD2 4.2Å; Y388-Y392 AromaticContact CE1-CG 3.87Å; Y388-Y392 HydrophobicContact CE1-CG 3.87Å; Y388-Y392 HydrophobicContact CE2-CD1 4.15Å; Y388-Y392 AromaticContact CE2-CD2 3.97Å; Y388-Y392 HydrophobicContact CE2-CD2 3.97Å; Y388-Y392 HydrophobicContact CE2-CE1 4.22Å; Y388-Y392 HydrophobicContact CE2-CE2 4.03Å; Y388-Y392 HydrophobicContact CE2-CG 4.04Å; Y388-Y392 AromaticContact CG-CD1 3.49Å; Y388-Y392 HydrophobicContact CG-CD1 3.49Å; Y388-Y392 VanDerWaalsContact CG-CD1 3.49Å; Y388-Y392 HydrophobicContact CG-CE1 4.04Å; Y388-Y392 AromaticContact CG-CG 3.8Å; Y388-Y392 HydrophobicContact CG-CG 3.8Å; Y388-Y392 AromaticContact CZ-CD2 3.92Å; Y392-V395 VanDerWaalsContact CE2-O 3.31Å; Y392-V395 WeakPolarHBondContact CE2-O 3.25Å; Y392-G398 WeakPolarHBondContact OH-CA 3.26Å; Y392-G398 PolarHBondContact OH-N 3.36Å; Y392-G398 VanDerWaalsContact OH-N 3.11Å; Y392-Y415 WeakPolarHBondContact O-CA 3.31Å; Y392-K416 HydrophobicContact CD1-CB 4.23Å; Y392-K416 WeakPolarHBondContact CD1-O 3.28Å; Y392-K416 HydrophobicContact CD2-CB 4.26Å; Y392-K416 HydrophobicContact CE1-CB 3.81Å; Y392-K416 HydrophobicContact CE2-CB 3.83Å; Y392-K416 HydrophobicContact CE2-CD 3.91Å; Y392-K416 HydrophobicContact CE2-CG 4.48Å; Y392-K416 HydrophobicContact CG-CB 4.43Å; Y392-K416 PolarHBondContact N-O 3.37Å; Y392-K416 PolarHBondContact O-N 3.11Å
393	R	88.9	Confident	93.3	Very high	162 Å²	162	49.1 Å²	49.1	61%	0.611	24%	0.237	S	C	*	.			trans	-115.5	167.1	175.8	-66.9	-173.3	-178	-170.8	4	110.3	Y415	R393-Y415 HydrophobicContact CG-CD1 3.97Å; R393-Y415 HydrophobicContact CG-CE1 3.98Å; R393-Y415 HydrophobicContact CG-CG 4.47Å; R393-Y415 VanDerWaalsContact NE-CZ 3.3Å; R393-Y415 PolarHBondContact NE-OH 2.69Å; R393-Y415 PolarHBondContact NH2-OH 3.03Å
394	G	87.4	Confident	93.1	Very high	51 Å²	51	49.8 Å²	49.8	53%	0.526	24%	0.24	S	C	.	.	S	Bend	trans	91.8	-146.2	-179.5	0	0	0	0	0	113.5	K416	G394-K416 WeakPolarHBondContact O-CE 3.47Å; G394-K416 PolarHBondContact O-NZ 3.15Å
395	V	87.7	Confident	92.7	Very high	50 Å²	50	53.5 Å²	53.5	30%	0.303	26%	0.264	S	S	.	.	S	Bend	trans	-60.6	139.9	-178.4	-177.9	0	0	0	0	110.6	Y368 Y369 Y392 N397	Y368-V395 HydrophobicContact CD1-CG1 3.94Å; Y368-V395 HydrophobicContact CE1-CG1 3.45Å; Y368-V395 VanDerWaalsContact CE1-CG1 3.45Å; Y368-V395 HydrophobicContact CE1-CG2 4.49Å; Y368-V395 HydrophobicContact CE2-CG1 4.32Å; Y368-V395 HydrophobicContact CE2-CG2 4.05Å; Y369-V395 HydrophobicContact CD1-CG1 4.03Å; Y369-V395 HydrophobicContact CE1-CG1 4Å; Y392-V395 VanDerWaalsContact CE2-O 3.31Å; Y392-V395 WeakPolarHBondContact CE2-O 3.25Å; V395-N397 HydrophobicContact CG1-CB 4.19Å; V395-N397 PolarHBondContact O-N 3.48Å; V395-N397 PolarHBondContact O-OD1 3.3Å
396	R	89.2	Confident	91.8	Very high	60 Å²	60	56 Å²	56	23%	0.226	29%	0.289	C	S	.	.			trans	-78.5	60.3	177.1	-169.6	-177.4	-74.2	-89.4	7.1	111.2	Y369 F400 K416	Y369-R396 WeakPolarHBondContact CD1-O 3.31Å; Y369-R396 HydrophobicContact CE1-CB 4.47Å; Y369-R396 VanDerWaalsContact CE1-O 3.24Å; Y369-R396 WeakPolarHBondContact CE1-O 3.23Å; R396-F400 HydrophobicContact CG-CD2 4.22Å; R396-F400 HydrophobicContact CG-CG 4.29Å; R396-K416 HydrophobicContact CB-CD 3.8Å; R396-K416 HydrophobicContact CG-CD 4.07Å
397	N	93.6	Very high	90.9	Very high	22 Å²	22	52.2 Å²	52.2	12%	0.118	27%	0.274	C	S	.	.			trans	-97.8	11.3	-178.6	68.2	-17.5	0	0	0	113.9	Y369 G385 K386 Y388 V395	Y369-N397 HydrophobicContact CD1-CB 4.12Å; G385-N397 CarbonylContact C-O 3.55Å; G385-N397 VanDerWaalsContact CA-O 3.26Å; G385-N397 WeakPolarHBondContact CA-O 3.1Å; K386-N397 PolarHBondContact N-O 2.97Å; Y388-N397 WeakPolarHBondContact CE2-OD1 3.24Å; Y388-N397 PolarHBondContact OH-OD1 3.1Å; Y388-N397 VanDerWaalsContact OH-OD1 3.05Å; V395-N397 HydrophobicContact CG1-CB 4.19Å; V395-N397 PolarHBondContact O-N 3.48Å; V395-N397 PolarHBondContact O-OD1 3.3Å
398	G	94.9	Very high	89.1	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	31%	0.307	C	S	.	.	B	Isolated β-bridge	trans	-78.1	178.9	171.3	0	0	0	0	0	113.5	K386 Y392 F400	K386-G398 VanDerWaalsContact O-CA 3.24Å; K386-G398 WeakPolarHBondContact O-CA 3.2Å; Y392-G398 WeakPolarHBondContact OH-CA 3.26Å; Y392-G398 PolarHBondContact OH-N 3.36Å; Y392-G398 VanDerWaalsContact OH-N 3.11Å; G398-F400 PolarHBondContact O-N 2.61Å
399	I	96.9	Very high	87	Confident	0 Å²	0	62 Å²	62	0%	0	34%	0.335	C	S	.	.	S	Bend	trans	-66	122.5	171.5	-51.5	176.5	0	0	0	108.3	R251 N382 L383 K386 Y387 S418 F419 A422	R251-I399 HydrophobicContact CB-CD1 3.8Å; R251-I399 HydrophobicContact CG-CD1 3.92Å; N382-I399 CarbonylContact O-C 3.58Å; N382-I399 WeakPolarHBondContact O-CA 3.34Å; L383-I399 HydrophobicContact CD2-CG2 4.13Å; K386-I399 PolarHBondContact O-N 3.21Å; Y387-I399 HydrophobicContact CD2-CD1 3.67Å; Y387-I399 HydrophobicContact CE2-CD1 4.23Å; I399-S418 WeakPolarHBondContact CB-OG 3.31Å; I399-S418 PolarHBondContact N-OG 2.68Å; I399-S418 WeakPolarHBondContact O-CA 3.5Å; I399-F419 HydrophobicContact CB-CB 4.22Å; I399-F419 HydrophobicContact CG2-CB 3.87Å; I399-F419 HydrophobicContact CG2-CD2 4.04Å; I399-F419 HydrophobicContact CG2-CG 4.37Å; I399-F419 WeakPolarHBondContact O-CD2 3.24Å; I399-F419 PolarHBondContact O-N 3.31Å; I399-A422 HydrophobicContact CG2-CB 4.13Å
400	F	95.1	Very high	85.3	Confident	16 Å²	16	58 Å²	58	7%	0.07	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	144.2	-166.1	-179.2	-108.8	0	0	0	113.7	L379 S380 A381 N382 R396 G398 I407	L379-F400 HydrophobicContact CD1-CD1 3.41Å; L379-F400 VanDerWaalsContact CD1-CD1 3.41Å; L379-F400 HydrophobicContact CD1-CE1 3.86Å; L379-F400 HydrophobicContact CD1-CG 4.44Å; S380-F400 VanDerWaalsContact O-CE1 3.28Å; S380-F400 WeakPolarHBondContact O-CE1 3.43Å; A381-F400 WeakPolarHBondContact CA-O 3.28Å; N382-F400 PolarHBondContact N-O 2.92Å; N382-F400 PolarHBondContact O-N 3.49Å; R396-F400 HydrophobicContact CG-CD2 4.22Å; R396-F400 HydrophobicContact CG-CG 4.29Å; G398-F400 PolarHBondContact O-N 2.61Å; F400-I407 HydrophobicContact CD2-CD1 3.97Å; F400-I407 HydrophobicContact CE2-CD1 3.64Å; F400-I407 HydrophobicContact CE2-CG1 4.49Å; F400-I407 HydrophobicContact CE2-CG2 3.44Å; F400-I407 VanDerWaalsContact CE2-CG2 3.44Å; F400-I407 HydrophobicContact CZ-CG2 3.77Å
401	W	96.3	Very high	83.6	Confident	0 Å²	0	58 Å²	58	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	103.5	178.9	-165.5	-97.9	0	0	0	109.9	I296 L298 A308 A333 G334 A336 L337 A381 L383 T403 W404 I407 F419	I296-W401 HydrophobicContact CD1-CH2 3.6Å; I296-W401 HydrophobicContact CD1-CZ3 3.83Å; L298-W401 HydrophobicContact CD1-CB 3.84Å; L298-W401 HydrophobicContact CD1-CD2 3.7Å; L298-W401 HydrophobicContact CD1-CE3 4.18Å; L298-W401 HydrophobicContact CD1-CG 3.55Å; A308-W401 HydrophobicContact CB-CH2 4.3Å; A308-W401 HydrophobicContact CB-CZ2 3.73Å; A333-W401 PolarHBondContact O-NE1 2.76Å; A333-W401 VanDerWaalsContact O-NE1 3.11Å; G334-W401 PolarHBondContact O-NE1 2.92Å; A336-W401 HydrophobicContact CB-CD2 3.49Å; A336-W401 VanDerWaalsContact CB-CD2 3.49Å; A336-W401 HydrophobicContact CB-CE3 4.02Å; A336-W401 HydrophobicContact CB-CG 3.81Å; A336-W401 HydrophobicContact CB-CH2 4.24Å; A336-W401 HydrophobicContact CB-CZ2 3.73Å; A336-W401 HydrophobicContact CB-CZ3 4.37Å; L337-W401 HydrophobicContact CD1-CH2 4.4Å; L337-W401 HydrophobicContact CD2-CH2 4.19Å; L337-W401 HydrophobicContact CD2-CZ3 4.16Å; L337-W401 HydrophobicContact CG-CH2 3.78Å; L337-W401 HydrophobicContact CG-CZ3 4.27Å; A381-W401 HydrophobicContact CB-CD2 4.41Å; A381-W401 HydrophobicContact CB-CE3 3.59Å; A381-W401 HydrophobicContact CB-CZ3 3.71Å; L383-W401 HydrophobicContact CD1-CZ3 4.38Å; L383-W401 HydrophobicContact CD2-CE3 3.93Å; L383-W401 HydrophobicContact CD2-CZ3 4.39Å; L383-W401 HydrophobicContact CG-CE3 4.49Å; L383-W401 HydrophobicContact CG-CZ3 4.5Å; W401-T403 VanDerWaalsContact C-N 3.27Å; W401-T403 VanDerWaalsContact CD1-OG1 3.26Å; W401-T403 PolarHBondContact NE1-OG1 3.31Å; W401-T403 PolarHBondContact O-N 3.48Å; W401-T403 VanDerWaalsContact O-N 3.15Å; W401-W404 VanDerWaalsContact O-CB 3.29Å; W401-W404 WeakPolarHBondContact O-CB 3.4Å; W401-W404 PolarHBondContact O-N 3.11Å; W401-I407 WeakPolarHBondContact O-CD1 3.28Å; W401-F419 HydrophobicContact CB-CE2 3.56Å; W401-F419 HydrophobicContact CB-CZ 3.75Å
402	G	93.8	Very high	82	Confident	16 Å²	16	58.1 Å²	58.1	17%	0.165	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-23	-162.8	0	0	0	0	0	116.3	S380 W404	S380-G402 VanDerWaalsContact O-CA 3.28Å; S380-G402 WeakPolarHBondContact O-CA 3.38Å; S380-G402 PolarHBondContact O-N 2.75Å; G402-W404 VanDerWaalsContact C-N 3.34Å
403	T	94.3	Very high	80.7	Confident	40 Å²	40	60.7 Å²	60.7	25%	0.245	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	2	177.8	53.6	0	0	0	0	113.6	A333 G334 A336 F339 W401	A333-T403 PolarHBondContact O-OG1 3.4Å; G334-T403 WeakPolarHBondContact CA-OG1 3.39Å; G334-T403 PolarHBondContact O-OG1 2.92Å; G334-T403 VanDerWaalsContact O-OG1 3.06Å; A336-T403 HydrophobicContact CB-CG2 4.21Å; F339-T403 HydrophobicContact CD2-CG2 3.6Å; F339-T403 HydrophobicContact CE2-CG2 3.99Å; W401-T403 VanDerWaalsContact C-N 3.27Å; W401-T403 VanDerWaalsContact CD1-OG1 3.26Å; W401-T403 PolarHBondContact NE1-OG1 3.31Å; W401-T403 PolarHBondContact O-N 3.48Å; W401-T403 VanDerWaalsContact O-N 3.15Å
404	W	94.1	Very high	80.1	Confident	14 Å²	14	54.1 Å²	54.1	5%	0.053	35%	0.352	C	S	.	.	S	Bend	trans	-63.8	139.1	-180	-166.4	-98	0	0	0	111.6	L298 D300 L304 L306 A333 W401 G402 G406 I407 F419	L298-W404 HydrophobicContact CB-CE3 4.49Å; L298-W404 HydrophobicContact CB-CH2 4.08Å; L298-W404 HydrophobicContact CB-CZ3 3.63Å; L298-W404 HydrophobicContact CD1-CE3 4.22Å; L298-W404 HydrophobicContact CD1-CZ3 4.05Å; L298-W404 HydrophobicContact CG-CZ3 4.5Å; D300-W404 HydrophobicContact CB-CZ2 4.13Å; L304-W404 HydrophobicContact CB-CZ2 4.08Å; L304-W404 HydrophobicContact CD2-CZ2 3.76Å; L304-W404 HydrophobicContact CG-CH2 4.39Å; L304-W404 HydrophobicContact CG-CZ2 3.75Å; L304-W404 WeakPolarHBondContact O-CZ2 3.46Å; L306-W404 HydrophobicContact CB-CE3 4.39Å; L306-W404 HydrophobicContact CB-CH2 3.65Å; L306-W404 HydrophobicContact CB-CZ3 3.47Å; L306-W404 VanDerWaalsContact CB-CZ3 3.47Å; L306-W404 HydrophobicContact CD1-CD2 4.18Å; L306-W404 HydrophobicContact CD1-CE3 3.84Å; L306-W404 HydrophobicContact CD1-CH2 3.68Å; L306-W404 HydrophobicContact CD1-CZ2 3.99Å; L306-W404 HydrophobicContact CD1-CZ3 3.6Å; L306-W404 HydrophobicContact CG-CE3 4.48Å; L306-W404 HydrophobicContact CG-CH2 3.55Å; L306-W404 HydrophobicContact CG-CZ2 4.17Å; L306-W404 HydrophobicContact CG-CZ3 3.75Å; A333-W404 HydrophobicContact CB-CE3 4.43Å; A333-W404 HydrophobicContact CB-CZ3 4.31Å; W401-W404 VanDerWaalsContact O-CB 3.29Å; W401-W404 WeakPolarHBondContact O-CB 3.4Å; W401-W404 PolarHBondContact O-N 3.11Å; G402-W404 VanDerWaalsContact C-N 3.34Å; W404-G406 PolarHBondContact O-N 2.83Å; W404-I407 HydrophobicContact CB-CD1 3.56Å; W404-I407 HydrophobicContact CB-CG1 3.97Å; W404-I407 HydrophobicContact CG-CD1 4.31Å; W404-I407 WeakPolarHBondContact O-CB 3.43Å; W404-I407 PolarHBondContact O-N 2.99Å; W404-F419 HydrophobicContact CB-CZ 3.97Å; W404-F419 AromaticContact CD2-CE1 3.45Å; W404-F419 HydrophobicContact CD2-CE1 3.45Å; W404-F419 VanDerWaalsContact CD2-CE1 3.45Å; W404-F419 AromaticContact CD2-CZ 3.46Å; W404-F419 HydrophobicContact CD2-CZ 3.46Å; W404-F419 VanDerWaalsContact CD2-CZ 3.46Å; W404-F419 AromaticContact CE2-CE1 3.6Å; W404-F419 AromaticContact CE3-CE1 3.47Å; W404-F419 HydrophobicContact CE3-CE1 3.47Å; W404-F419 VanDerWaalsContact CE3-CE1 3.47Å; W404-F419 AromaticContact CE3-CZ 3.53Å; W404-F419 HydrophobicContact CE3-CZ 3.53Å; W404-F419 HydrophobicContact CG-CE1 4.07Å; W404-F419 AromaticContact CG-CZ 3.66Å; W404-F419 HydrophobicContact CG-CZ 3.66Å; W404-F419 AromaticContact CH2-CE1 3.78Å; W404-F419 HydrophobicContact CH2-CE1 3.78Å; W404-F419 AromaticContact CZ2-CE1 3.79Å; W404-F419 HydrophobicContact CZ2-CE1 3.79Å; W404-F419 AromaticContact CZ3-CE1 3.6Å; W404-F419 HydrophobicContact CZ3-CE1 3.6Å; W404-F419 HydrophobicContact CZ3-CZ 4.12Å
405	P	89.2	Confident	79.9	Confident	79 Å²	79	57.8 Å²	57.8	51%	0.513	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.8	130.3	178.7	-27.6	35.6	0	0	0	112.9	L306 I407	L306-P405 HydrophobicContact CD1-CG 4.02Å; P405-I407 VanDerWaalsContact C-N 3.35Å; P405-I407 PolarHBondContact O-N 3.42Å
406	G	79.1	Confident	79.8	Confident	51 Å²	51	56.8 Å²	56.8	53%	0.526	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	0.3	176.7	0	0	0	0	0	115.9	W404	W404-G406 PolarHBondContact O-N 2.83Å
407	I	76.9	Confident	79.7	Confident	31 Å²	31	56.9 Å²	56.9	16%	0.159	35%	0.352	C	S	.	.	S	Bend	trans	-74.7	-34.1	176.8	-78.9	-168.6	0	0	0	113.2	F400 W401 W404 P405 Q409 A410	F400-I407 HydrophobicContact CD2-CD1 3.97Å; F400-I407 HydrophobicContact CE2-CD1 3.64Å; F400-I407 HydrophobicContact CE2-CG1 4.49Å; F400-I407 HydrophobicContact CE2-CG2 3.44Å; F400-I407 VanDerWaalsContact CE2-CG2 3.44Å; F400-I407 HydrophobicContact CZ-CG2 3.77Å; W401-I407 WeakPolarHBondContact O-CD1 3.28Å; W404-I407 HydrophobicContact CB-CD1 3.56Å; W404-I407 HydrophobicContact CB-CG1 3.97Å; W404-I407 HydrophobicContact CG-CD1 4.31Å; W404-I407 WeakPolarHBondContact O-CB 3.43Å; W404-I407 PolarHBondContact O-N 2.99Å; P405-I407 VanDerWaalsContact C-N 3.35Å; P405-I407 PolarHBondContact O-N 3.42Å; I407-Q409 PolarHBondContact O-N 2.83Å; I407-A410 WeakPolarHBondContact O-CB 3.35Å; I407-A410 PolarHBondContact O-N 3.18Å
408	S	57.9	Low	79.7	Confident	113 Å²	113	56.1 Å²	56.1	79%	0.79	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-18.2	-179.3	55.8	0	0	0	0	114	A410	S408-A410 VanDerWaalsContact C-N 3.31Å
409	Q	51.8	Low	79.7	Confident	164 Å²	164	56.4 Å²	56.4	77%	0.766	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.4	-0.7	179.5	-63.9	-177.8	2.1	0	0	113.5	I407 Q411	I407-Q409 PolarHBondContact O-N 2.83Å; Q409-Q411 PolarHBondContact O-N 3.03Å; Q409-Q411 VanDerWaalsContact O-N 3.09Å
410	A	54.5	Low	79.6	Confident	42 Å²	42	61.5 Å²	61.5	35%	0.347	37%	0.369	S	S	.	.			trans	-71.6	106.4	-179.8	0	0	0	0	0	110.6	I407 S408	I407-A410 WeakPolarHBondContact O-CB 3.35Å; I407-A410 PolarHBondContact O-N 3.18Å; S408-A410 VanDerWaalsContact C-N 3.31Å
411	Q	53.7	Low	79.7	Confident	157 Å²	157	64.2 Å²	64.2	73%	0.734	38%	0.382	S	S	*	.			trans	-54	147.8	176.8	-68.9	-163.4	-21.4	0	0	112.2	Q409 G413 G414	Q409-Q411 PolarHBondContact O-N 3.03Å; Q409-Q411 VanDerWaalsContact O-N 3.09Å; Q411-G413 PolarHBondContact O-N 2.89Å; Q411-G414 PolarHBondContact O-N 3.18Å
412	P	57.1	Low	79.8	Confident	139 Å²	139	64.3 Å²	64.3	90%	0.903	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	126.3	169	-22.9	32.8	0	0	0	110.3	G414	P412-G414 VanDerWaalsContact C-N 3.3Å; P412-G414 PolarHBondContact O-N 3.1Å
413	G	63	Low	80.1	Confident	67 Å²	67	66.4 Å²	66.4	69%	0.691	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	83	-4.8	-176.5	0	0	0	0	0	115.9	Q411	Q411-G413 PolarHBondContact O-N 2.89Å
414	G	75.4	Confident	80.3	Confident	24 Å²	24	64.6 Å²	64.6	25%	0.247	38%	0.376	C	S	.	.			trans	-71.3	165.3	178.2	0	0	0	0	0	114.6	Q411 P412	Q411-G414 PolarHBondContact O-N 3.18Å; P412-G414 VanDerWaalsContact C-N 3.3Å; P412-G414 PolarHBondContact O-N 3.1Å
415	Y	82.6	Confident	80.5	Confident	129 Å²	129	64 Å²	64	51%	0.506	37%	0.373	S	S	.	.			trans	-60.2	135	170.9	-78.1	-81.8	0	0	0	111.1	K391 Y392 R393	K391-Y415 HydrophobicContact CB-CD1 3.84Å; K391-Y415 HydrophobicContact CB-CG 4.27Å; Y392-Y415 WeakPolarHBondContact O-CA 3.31Å; R393-Y415 HydrophobicContact CG-CD1 3.97Å; R393-Y415 HydrophobicContact CG-CE1 3.98Å; R393-Y415 HydrophobicContact CG-CG 4.47Å; R393-Y415 VanDerWaalsContact NE-CZ 3.3Å; R393-Y415 PolarHBondContact NE-OH 2.69Å; R393-Y415 PolarHBondContact NH2-OH 3.03Å
416	K	87.1	Confident	80.9	Confident	28 Å²	28	60.2 Å²	60.2	12%	0.122	35%	0.349	C	S	.	.	B	Isolated β-bridge	trans	-105.5	149.4	176.6	-61.5	173.5	-178.3	69.4	0	109.4	K391 Y392 G394 R396	K391-K416 CarbonylContact C-O 3.52Å; K391-K416 WeakPolarHBondContact CA-O 3.32Å; Y392-K416 HydrophobicContact CD1-CB 4.23Å; Y392-K416 WeakPolarHBondContact CD1-O 3.28Å; Y392-K416 HydrophobicContact CD2-CB 4.26Å; Y392-K416 HydrophobicContact CE1-CB 3.81Å; Y392-K416 HydrophobicContact CE2-CB 3.83Å; Y392-K416 HydrophobicContact CE2-CD 3.91Å; Y392-K416 HydrophobicContact CE2-CG 4.48Å; Y392-K416 HydrophobicContact CG-CB 4.43Å; Y392-K416 PolarHBondContact N-O 3.37Å; Y392-K416 PolarHBondContact O-N 3.11Å; G394-K416 WeakPolarHBondContact O-CE 3.47Å; G394-K416 PolarHBondContact O-NZ 3.15Å; R396-K416 HydrophobicContact CB-CD 3.8Å; R396-K416 HydrophobicContact CG-CD 4.07Å
417	S	87.1	Confident	81.8	Confident	62 Å²	62	59.1 Å²	59.1	43%	0.434	33%	0.329	S	S	.	.			trans	-107	150.6	174	-58.3	0	0	0	0	110.1
418	S	92	Very high	82.8	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.042	33%	0.326	C	S	.	.			trans	-109.7	160.4	167	-176	0	0	0	0	108.7	F301 I399	F301-S418 WeakPolarHBondContact CD2-O 3.35Å; F301-S418 WeakPolarHBondContact CE2-O 3.45Å; I399-S418 WeakPolarHBondContact CB-OG 3.31Å; I399-S418 PolarHBondContact N-OG 2.68Å; I399-S418 WeakPolarHBondContact O-CA 3.5Å
419	F	95.6	Very high	84.6	Confident	7 Å²	7	56.4 Å²	56.4	3%	0.031	30%	0.303	C	S	.	.			trans	-73.4	147.8	168.4	-72.5	-86.4	0	0	0	111.4	L298 D300 I399 W401 W404	L298-F419 HydrophobicContact CB-CD1 3.97Å; L298-F419 HydrophobicContact CB-CE1 3.9Å; L298-F419 HydrophobicContact CD1-CE1 4.29Å; L298-F419 HydrophobicContact CD1-CZ 4.22Å; L298-F419 HydrophobicContact CD2-CD1 4.35Å; L298-F419 HydrophobicContact CD2-CG 4.33Å; L298-F419 HydrophobicContact CG-CE1 4.5Å; D300-F419 HydrophobicContact CB-CD1 4.44Å; I399-F419 HydrophobicContact CB-CB 4.22Å; I399-F419 HydrophobicContact CG2-CB 3.87Å; I399-F419 HydrophobicContact CG2-CD2 4.04Å; I399-F419 HydrophobicContact CG2-CG 4.37Å; I399-F419 WeakPolarHBondContact O-CD2 3.24Å; I399-F419 PolarHBondContact O-N 3.31Å; W401-F419 HydrophobicContact CB-CE2 3.56Å; W401-F419 HydrophobicContact CB-CZ 3.75Å; W404-F419 HydrophobicContact CB-CZ 3.97Å; W404-F419 AromaticContact CD2-CE1 3.45Å; W404-F419 HydrophobicContact CD2-CE1 3.45Å; W404-F419 VanDerWaalsContact CD2-CE1 3.45Å; W404-F419 AromaticContact CD2-CZ 3.46Å; W404-F419 HydrophobicContact CD2-CZ 3.46Å; W404-F419 VanDerWaalsContact CD2-CZ 3.46Å; W404-F419 AromaticContact CE2-CE1 3.6Å; W404-F419 AromaticContact CE3-CE1 3.47Å; W404-F419 HydrophobicContact CE3-CE1 3.47Å; W404-F419 VanDerWaalsContact CE3-CE1 3.47Å; W404-F419 AromaticContact CE3-CZ 3.53Å; W404-F419 HydrophobicContact CE3-CZ 3.53Å; W404-F419 HydrophobicContact CG-CE1 4.07Å; W404-F419 AromaticContact CG-CZ 3.66Å; W404-F419 HydrophobicContact CG-CZ 3.66Å; W404-F419 AromaticContact CH2-CE1 3.78Å; W404-F419 HydrophobicContact CH2-CE1 3.78Å; W404-F419 AromaticContact CZ2-CE1 3.79Å; W404-F419 HydrophobicContact CZ2-CE1 3.79Å; W404-F419 AromaticContact CZ3-CE1 3.6Å; W404-F419 HydrophobicContact CZ3-CE1 3.6Å; W404-F419 HydrophobicContact CZ3-CZ 4.12Å
420	R	96	Very high	86.5	Confident	107 Å²	107	55 Å²	55	40%	0.404	30%	0.301	S	S	.	.	S	Bend	trans	-79.2	-42.7	171.8	-179.2	-166.6	172.3	-162.2	2.7	110.2	E299 F301 Y387	E299-R420 WeakPolarHBondContact O-CB 3Å; E299-R420 PolarHBondContact O-N 3.35Å; E299-R420 IonicContact OE1-CZ 3.64Å; E299-R420 IonicContact OE1-NH1 2.68Å; E299-R420 PolarHBondContact OE1-NH1 2.99Å; F301-R420 HydrophobicContact CD1-CB 3.98Å; F301-R420 HydrophobicContact CD1-CG 4.11Å; F301-R420 HydrophobicContact CD2-CB 4.13Å; F301-R420 HydrophobicContact CE1-CB 3.96Å; F301-R420 HydrophobicContact CE1-CG 3.95Å; F301-R420 HydrophobicContact CE2-CB 4.11Å; F301-R420 HydrophobicContact CG-CB 4.06Å; F301-R420 HydrophobicContact CZ-CB 4.03Å; F301-R420 HydrophobicContact CZ-CG 4.37Å; Y387-R420 VanDerWaalsContact CE2-O 3.28Å; Y387-R420 WeakPolarHBondContact CE2-O 2.96Å; Y387-R420 PolarHBondContact OH-O 3.46Å
421	Q	97.3	Very high	88.2	Confident	73 Å²	73	54.2 Å²	54.2	34%	0.341	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	143.1	174.8	-53	-172.4	-24.1	0	0	110.8	R251 L298 E299	R251-Q421 VanDerWaalsContact O-CA 3.28Å; R251-Q421 WeakPolarHBondContact O-CA 3.45Å; L298-Q421 WeakPolarHBondContact CA-O 3.31Å; E299-Q421 HydrophobicContact CB-CB 3.96Å; E299-Q421 HydrophobicContact CB-CG 4.35Å; E299-Q421 PolarHBondContact N-O 2.93Å; E299-Q421 PolarHBondContact O-N 2.87Å; E299-Q421 PolarHBondContact OE2-OE1 3.05Å
422	A	98.3	Very high	89.5	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.008	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	131.7	168.6	0	0	0	0	0	108.1	Q249 A250 R251 D297 L298 L383 I399	Q249-A422 PolarHBondContact OE1-O 3.31Å; A250-A422 CarbonylContact C-O 3.43Å; A250-A422 WeakPolarHBondContact CA-O 3.37Å; R251-A422 HydrophobicContact CB-CB 4.14Å; R251-A422 HydrophobicContact CG-CB 4.18Å; R251-A422 PolarHBondContact N-O 3.21Å; R251-A422 PolarHBondContact O-N 3.24Å; D297-A422 CarbonylContact O-C 3.53Å; D297-A422 WeakPolarHBondContact O-CA 3.27Å; L298-A422 HydrophobicContact CD2-CB 3.72Å; L383-A422 HydrophobicContact CD2-CB 4.35Å; I399-A422 HydrophobicContact CG2-CB 4.13Å
423	K	98.5	Very high	90.2	Very high	61 Å²	61	53.5 Å²	53.5	27%	0.265	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	124.4	178.1	-173.2	-168.7	-72.2	178.2	0	108.8	D237 V247 Q249 I296 D297 M425	D237-K423 IonicContact OD2-NZ 3.75Å; D237-K423 PolarHBondContact OD2-NZ 2.93Å; V247-K423 HydrophobicContact CG1-CD 4.41Å; V247-K423 HydrophobicContact CG1-CG 3.87Å; V247-K423 HydrophobicContact CG2-CD 4.25Å; Q249-K423 WeakPolarHBondContact O-CA 3.28Å; I296-K423 CarbonylContact C-O 3.36Å; I296-K423 VanDerWaalsContact CA-O 3.29Å; I296-K423 WeakPolarHBondContact CA-O 3.33Å; D297-K423 PolarHBondContact N-O 3.34Å; D297-K423 PolarHBondContact O-N 3.05Å; K423-M425 HydrophobicContact CD-CE 4.48Å; K423-M425 HydrophobicContact CD-SD 3.86Å
424	M	98.8	Very high	91.6	Very high	2 Å²	2	52.9 Å²	52.9	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	129	171	-57.6	179.5	65.9	0	0	109.2	L248 Q249 W277 L294 R295 I296 W373 W374 L383	L248-M424 HydrophobicContact CB-CB 4.46Å; L248-M424 PolarHBondContact N-O 2.74Å; Q249-M424 HydrophobicContact CB-CB 4Å; Q249-M424 HydrophobicContact CB-CG 4.1Å; Q249-M424 HydrophobicContact CB-SD 4.12Å; Q249-M424 PolarHBondContact N-O 3.32Å; Q249-M424 PolarHBondContact O-N 3.09Å; W277-M424 HydrophobicContact CZ3-SD 4.26Å; L294-M424 HydrophobicContact CD1-CB 4.32Å; L294-M424 HydrophobicContact CD1-CE 4.05Å; L294-M424 HydrophobicContact CD2-CE 4.24Å; R295-M424 WeakPolarHBondContact O-CA 3.15Å; I296-M424 HydrophobicContact CD1-CE 4.44Å; I296-M424 HydrophobicContact CG1-CG 4.2Å; W373-M424 HydrophobicContact CH2-CE 4.11Å; W373-M424 HydrophobicContact CH2-SD 3.68Å; W373-M424 HydrophobicContact CZ3-SD 3.95Å; W374-M424 HydrophobicContact CZ3-CE 4.2Å; L383-M424 HydrophobicContact CD1-CG 3.68Å; L383-M424 HydrophobicContact CD1-SD 3.86Å
425	M	98.8	Very high	92.5	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	151.9	-179.9	59.4	-167.5	172.7	0	0	112.4	D237 T240 W245 T246 V247 R295 D297 K423	D237-M425 HydrophobicContact CB-SD 4.45Å; T240-M425 HydrophobicContact CG2-CE 3.8Å; W245-M425 HydrophobicContact CB-CB 4.17Å; W245-M425 HydrophobicContact CB-CG 4.16Å; W245-M425 HydrophobicContact CB-SD 3.77Å; W245-M425 HydrophobicContact CD2-CE 4.4Å; W245-M425 HydrophobicContact CD2-CG 3.99Å; W245-M425 HydrophobicContact CD2-SD 4.11Å; W245-M425 HydrophobicContact CE3-CB 4.21Å; W245-M425 HydrophobicContact CE3-CG 3.7Å; W245-M425 HydrophobicContact CE3-SD 4.44Å; W245-M425 HydrophobicContact CG-CE 4.4Å; W245-M425 HydrophobicContact CG-CG 4.19Å; W245-M425 HydrophobicContact CG-SD 3.81Å; W245-M425 HydrophobicContact CZ3-CG 4.43Å; T246-M425 CarbonylContact O-C 3.59Å; T246-M425 VanDerWaalsContact O-CA 3.25Å; T246-M425 WeakPolarHBondContact O-CA 3.32Å; T246-M425 WeakPolarHBondContact O-CB 3.49Å; V247-M425 HydrophobicContact CG2-CB 4.16Å; R295-M425 HydrophobicContact CB-CG 4.11Å; R295-M425 VanDerWaalsContact CD-CE 3.45Å; R295-M425 HydrophobicContact CG-CE 4.03Å; R295-M425 PolarHBondContact N-O 3.23Å; R295-M425 PolarHBondContact O-N 2.89Å; D297-M425 WeakPolarHBondContact OD2-CE 3.39Å; K423-M425 HydrophobicContact CD-CE 4.48Å; K423-M425 HydrophobicContact CD-SD 3.86Å
426	I	98.7	Very high	93	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	156	-177	60.1	169.5	0	0	0	111.9	T246 L248 L286 T287 M292 I293 L294 F313	T246-I426 PolarHBondContact N-O 3.23Å; T246-I426 PolarHBondContact O-N 2.91Å; L248-I426 HydrophobicContact CD1-CB 4.49Å; L248-I426 HydrophobicContact CD1-CD1 4.27Å; L248-I426 HydrophobicContact CD1-CG1 4.24Å; L248-I426 HydrophobicContact CD1-CG2 3.55Å; L248-I426 HydrophobicContact CD2-CD1 3.82Å; L248-I426 HydrophobicContact CD2-CG1 3.83Å; L248-I426 HydrophobicContact CG-CD1 4.42Å; L248-I426 HydrophobicContact CG-CG1 4.13Å; L248-I426 HydrophobicContact CG-CG2 4.15Å; L286-I426 HydrophobicContact CB-CD1 3.89Å; L286-I426 HydrophobicContact CD1-CD1 4.39Å; T287-I426 HydrophobicContact CG2-CD1 4.18Å; M292-I426 HydrophobicContact CB-CB 4.31Å; M292-I426 HydrophobicContact CG-CD1 4.14Å; M292-I426 HydrophobicContact SD-CD1 4.45Å; I293-I426 WeakPolarHBondContact O-CA 3.36Å; I293-I426 WeakPolarHBondContact O-CB 3.49Å; L294-I426 HydrophobicContact CB-CG2 4.41Å; L294-I426 HydrophobicContact CD1-CG2 4.01Å; F313-I426 HydrophobicContact CD1-CG2 3.44Å; F313-I426 VanDerWaalsContact CD1-CG2 3.44Å; F313-I426 HydrophobicContact CE1-CG2 3.72Å; F313-I426 HydrophobicContact CG-CG2 4.29Å
427	R	97.4	Very high	93.4	Very high	28 Å²	28	51.5 Å²	51.5	11%	0.106	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.7	152.6	176.8	-169.6	165.9	72.4	178.5	-0.1	109.2	M241 G243 W245 M292 I293 F431	M241-R427 PolarHBondContact O-NH1 3.09Å; G243-R427 VanDerWaalsContact O-CD 3.25Å; G243-R427 WeakPolarHBondContact O-CD 3.4Å; G243-R427 PolarHBondContact O-NH1 3.28Å; W245-R427 HydrophobicContact CD2-CB 4.02Å; W245-R427 HydrophobicContact CE3-CB 3.5Å; W245-R427 VanDerWaalsContact CE3-CB 3.5Å; W245-R427 HydrophobicContact CH2-CB 4.14Å; W245-R427 HydrophobicContact CZ3-CB 3.56Å; M292-R427 CarbonylContact C-O 3.54Å; M292-R427 WeakPolarHBondContact CA-O 3.49Å; M292-R427 VanDerWaalsContact SD-C 3.59Å; I293-R427 HydrophobicContact CG1-CB 4.17Å; I293-R427 VanDerWaalsContact CG1-O 3.25Å; I293-R427 WeakPolarHBondContact CG1-O 3.43Å; I293-R427 PolarHBondContact N-O 2.57Å; I293-R427 PolarHBondContact O-N 3.12Å; R427-F431 HydrophobicContact CG-CB 3.92Å; R427-F431 HydrophobicContact CG-CD1 3.86Å; R427-F431 HydrophobicContact CG-CG 3.89Å
428	P	97.6	Very high	93.8	Very high	15 Å²	15	50.9 Å²	50.9	10%	0.097	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	140.8	176.6	-26.5	36.7	0	0	0	112.2	S208 K290 E291 M292 N430 F431	S208-P428 WeakPolarHBondContact OG-CD 3.33Å; S208-P428 WeakPolarHBondContact OG-CG 3.22Å; K290-P428 HydrophobicContact CD-CB 4.29Å; K290-P428 HydrophobicContact CD-CG 3.9Å; E291-P428 CarbonylContact O-C 3.59Å; E291-P428 WeakPolarHBondContact O-CA 3.39Å; M292-P428 HydrophobicContact CE-CG 4.38Å; M292-P428 HydrophobicContact SD-CB 4.38Å; M292-P428 HydrophobicContact SD-CG 3.97Å; P428-N430 VanDerWaalsContact C-N 3.26Å; P428-N430 PolarHBondContact O-N 3.46Å; P428-F431 HydrophobicContact CB-CB 4.29Å; P428-F431 WeakPolarHBondContact O-CB 3.47Å; P428-F431 PolarHBondContact O-N 2.8Å
429	K	95	Very high	93.9	Very high	72 Å²	72	53.9 Å²	53.9	31%	0.313	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-37.2	-178.3	-171.8	173.7	-171.8	161.8	0	113.4	E291 I293 D311 E312 F431	E291-K429 HydrophobicContact CB-CB 4.28Å; E291-K429 PolarHBondContact O-N 2.92Å; I293-K429 HydrophobicContact CG2-CB 3.98Å; I293-K429 HydrophobicContact CG2-CG 3.99Å; D311-K429 WeakPolarHBondContact O-CD 3.34Å; D311-K429 VanDerWaalsContact O-CE 3.29Å; D311-K429 WeakPolarHBondContact O-CE 3.43Å; D311-K429 PolarHBondContact O-NZ 3.44Å; E312-K429 IonicContact OE1-NZ 3.19Å; K429-F431 VanDerWaalsContact C-N 3.33Å
430	N	91.3	Very high	93.8	Very high	135 Å²	135	57.2 Å²	57.2	72%	0.722	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	8.6	-179.3	-60.7	-35.2	0	0	0	113.5	P428 K432	P428-N430 VanDerWaalsContact C-N 3.26Å; P428-N430 PolarHBondContact O-N 3.46Å; N430-K432 PolarHBondContact O-N 3.04Å
431	F	91.1	Very high	93.6	Very high	25 Å²	25	53.4 Å²	53.4	11%	0.11	26%	0.264	C	S	.	.			trans	-66.6	129.5	177.2	178.3	-97.4	0	0	0	111	Y211 M212 R427 P428 K429 P433	Y211-F431 HydrophobicContact CD1-CE2 4.18Å; Y211-F431 AromaticContact CD1-CZ 3.59Å; Y211-F431 HydrophobicContact CD1-CZ 3.59Å; Y211-F431 HydrophobicContact CE1-CZ 4.15Å; Y211-F431 AromaticContact CG-CZ 4Å; Y211-F431 HydrophobicContact CG-CZ 4Å; M212-F431 HydrophobicContact CG-CE2 4.41Å; M212-F431 HydrophobicContact SD-CE2 4.13Å; R427-F431 HydrophobicContact CG-CB 3.92Å; R427-F431 HydrophobicContact CG-CD1 3.86Å; R427-F431 HydrophobicContact CG-CG 3.89Å; P428-F431 HydrophobicContact CB-CB 4.29Å; P428-F431 WeakPolarHBondContact O-CB 3.47Å; P428-F431 PolarHBondContact O-N 2.8Å; K429-F431 VanDerWaalsContact C-N 3.33Å; F431-P433 HydrophobicContact CD1-CG 4.28Å; F431-P433 HydrophobicContact CE1-CB 4.13Å; F431-P433 HydrophobicContact CE1-CG 3.85Å
432	K	81.9	Confident	93.3	Very high	175 Å²	175	51.8 Å²	51.8	76%	0.761	26%	0.257	S	S	*	.			trans	-117.6	116.5	173.1	-65.6	-176.7	-178	179.6	0	107.5	N430	N430-K432 PolarHBondContact O-N 3.04Å
433	P	71.9	Confident	92.8	Very high	106 Å²	106	56.4 Å²	56.4	69%	0.688	28%	0.28	S	S	*	.			trans	-55.6	0	179.2	-22.1	30.5	0	0	0	113.9	Y211 F431	Y211-P433 WeakPolarHBondContact CE1-OXT 3.17Å; F431-P433 HydrophobicContact CD1-CG 4.28Å; F431-P433 HydrophobicContact CE1-CB 4.13Å; F431-P433 HydrophobicContact CE1-CG 3.85Å

Retrieved 433 of 433 residues in 386.8 ms (Link to these results)

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