A0A077Z8T6_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077Z8T6, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 542 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	24.8	Very low	37.5	Very low	197 Å²	197	44.3 Å²	44.3	97%	0.97	23%	0.233	S	C	*	.				0	68.9	0	-68.9	177.9	171.5	0	0	109.6	N3	M1-N3 PolarHBondContact O-N 3.17Å
2	S	26.6	Very low	36.8	Very low	78 Å²	78	48.2 Å²	48.2	55%	0.545	25%	0.246	S	C	.	.			trans	-85.9	90.3	171.2	28.7	0	0	0	0	107.3	F4	S2-F4 PolarHBondContact O-N 3.06Å
3	N	34.6	Very low	36.1	Very low	42 Å²	42	48.5 Å²	48.5	23%	0.225	26%	0.256	C	S	.	.			trans	-75.1	91.9	-175.2	-82.8	-8.8	0	0	0	110.3	M1 G216 Y220	M1-N3 PolarHBondContact O-N 3.17Å; N3-G216 PolarHBondContact ND2-N 3.18Å; N3-Y220 VanDerWaalsContact CG-OH 3.29Å; N3-Y220 PolarHBondContact OD1-OH 2.7Å
4	F	33.6	Very low	35.4	Very low	44 Å²	44	54.8 Å²	54.8	19%	0.193	28%	0.276	C	S	.	.			trans	-60.1	153.4	174.3	-160.5	-94.3	0	0	0	111.4	S2 M6 L185 Q258 I259 I262	S2-F4 PolarHBondContact O-N 3.06Å; F4-M6 HydrophobicContact CD1-CB 4.45Å; F4-M6 HydrophobicContact CD1-CE 4.36Å; F4-M6 HydrophobicContact CE1-CB 4.45Å; F4-M6 HydrophobicContact CE1-CE 4.11Å; F4-L185 HydrophobicContact CE1-CD2 3.44Å; F4-L185 VanDerWaalsContact CE1-CD2 3.44Å; F4-L185 HydrophobicContact CZ-CD1 4.04Å; F4-L185 HydrophobicContact CZ-CD2 3.51Å; F4-L185 HydrophobicContact CZ-CG 4.23Å; F4-Q258 HydrophobicContact CD2-CB 3.93Å; F4-Q258 HydrophobicContact CE2-CB 4.08Å; F4-I259 HydrophobicContact CE2-CG1 4.42Å; F4-I262 HydrophobicContact CD1-CD1 3.69Å; F4-I262 HydrophobicContact CD2-CD1 4.08Å; F4-I262 HydrophobicContact CE1-CD1 3.11Å; F4-I262 HydrophobicContact CE2-CD1 3.55Å; F4-I262 HydrophobicContact CG-CD1 4.15Å; F4-I262 HydrophobicContact CZ-CD1 3.04Å
5	Q	42.9	Very low	34.9	Very low	13 Å²	13	57.9 Å²	57.9	6%	0.061	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	130.1	-173.6	-48.1	-179.8	5.5	0	0	109.3	T188 R189 S192 L213	Q5-T188 VanDerWaalsContact CD-C 3.5Å; Q5-T188 PolarHBondContact OE1-O 3.05Å; Q5-R189 VanDerWaalsContact NE2-N 3.14Å; Q5-S192 WeakPolarHBondContact CB-OG 3.45Å; Q5-S192 PolarHBondContact OE1-OG 3.18Å; Q5-S192 VanDerWaalsContact OE1-OG 3.07Å; Q5-L213 CarbonylContact C-O 3.5Å; Q5-L213 WeakPolarHBondContact CA-O 2.97Å
6	M	46.5	Very low	34.3	Very low	31 Å²	31	61.7 Å²	61.7	15%	0.153	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	121.3	-165.6	-170.2	-179.2	-77	0	0	107.9	F4 T8 L183 L213 I262	F4-M6 HydrophobicContact CD1-CB 4.45Å; F4-M6 HydrophobicContact CD1-CE 4.36Å; F4-M6 HydrophobicContact CE1-CB 4.45Å; F4-M6 HydrophobicContact CE1-CE 4.11Å; M6-T8 HydrophobicContact CG-CG2 3.95Å; M6-T8 HydrophobicContact SD-CG2 3.81Å; M6-L183 HydrophobicContact CE-CD1 4.05Å; M6-L183 HydrophobicContact CG-CD1 3.15Å; M6-L183 HydrophobicContact CG-CG 4.46Å; M6-L183 HydrophobicContact SD-CD1 3.53Å; M6-L183 VanDerWaalsContact SD-CD1 3.53Å; M6-L213 HydrophobicContact CB-CB 4.2Å; M6-L213 HydrophobicContact CB-CD2 4.34Å; M6-L213 PolarHBondContact N-O 2.9Å; M6-L213 WeakPolarHBondContact O-CA 3.44Å; M6-L213 WeakPolarHBondContact O-CB 3.49Å; M6-L213 PolarHBondContact O-N 3.3Å; M6-I262 HydrophobicContact CE-CD1 4.26Å
7	L	42.4	Very low	33.9	Very low	3 Å²	3	62.6 Å²	62.6	2%	0.016	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	124	163	-178.9	119	0	0	0	108	V9 V184 I195 Y196 A211 I212	L7-V9 HydrophobicContact CD2-CG2 3.68Å; L7-V184 HydrophobicContact CB-CB 4.17Å; L7-V184 HydrophobicContact CD2-CB 4.11Å; L7-V184 HydrophobicContact CD2-CG2 3.87Å; L7-V184 PolarHBondContact N-O 3.37Å; L7-V184 PolarHBondContact O-N 3.4Å; L7-I195 HydrophobicContact CD1-CG2 4.39Å; L7-I195 HydrophobicContact CD2-CG2 4.22Å; L7-Y196 VanDerWaalsContact CD1-CB 3.44Å; L7-Y196 HydrophobicContact CD1-CD2 3.65Å; L7-Y196 HydrophobicContact CD1-CG 4.04Å; L7-A211 CarbonylContact C-O 3.51Å; L7-A211 WeakPolarHBondContact CA-O 3.39Å; L7-A211 WeakPolarHBondContact CG-O 3.5Å; L7-I212 HydrophobicContact CD1-CB 4.39Å
8	T	47.1	Very low	33.5	Very low	6 Å²	6	62.6 Å²	62.6	4%	0.037	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138	175.4	49.3	0	0	0	0	109.5	M6 P180 L183 A211	M6-T8 HydrophobicContact CG-CG2 3.95Å; M6-T8 HydrophobicContact SD-CG2 3.81Å; T8-P180 HydrophobicContact CG2-CB 3.86Å; T8-P180 HydrophobicContact CG2-CG 3.91Å; T8-L183 HydrophobicContact CG2-CD1 4.13Å; T8-A211 PolarHBondContact N-O 2.8Å; T8-A211 PolarHBondContact O-N 3.39Å
9	V	41.9	Very low	33.3	Very low	3 Å²	3	68.7 Å²	68.7	2%	0.018	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	128.3	175.7	-172.5	0	0	0	0	109.9	L7 V154 S181 A182 I208 Q209	L7-V9 HydrophobicContact CD2-CG2 3.68Å; V9-V154 HydrophobicContact CB-CG1 3.92Å; V9-V154 HydrophobicContact CG1-CG1 3.59Å; V9-V154 HydrophobicContact CG2-CG1 4.09Å; V9-S181 PolarHBondContact O-N 2.72Å; V9-A182 HydrophobicContact CB-CB 4.31Å; V9-A182 PolarHBondContact N-O 3.09Å; V9-A182 VanDerWaalsContact N-O 3.11Å; V9-I208 HydrophobicContact CG1-CG2 3.11Å; V9-Q209 WeakPolarHBondContact CA-O 3.49Å
10	D	39	Very low	33.4	Very low	19 Å²	19	71.4 Å²	71.4	10%	0.102	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	161.8	-173	-164.5	18.5	0	0	0	113	Q178 Q209	D10-Q178 WeakPolarHBondContact OD2-CB 3.48Å; D10-Q209 PolarHBondContact N-O 3.15Å; D10-Q209 PolarHBondContact O-N 3.39Å
11	Q	32.7	Very low	33.3	Very low	51 Å²	51	78 Å²	78	24%	0.238	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.1	178.2	-172.3	-169.3	13.4	0	0	111.1	L162	Q11-L162 HydrophobicContact CB-CD2 3.67Å; Q11-L162 HydrophobicContact CG-CD2 3.71Å
12	F	29.2	Very low	33.8	Very low	91 Å²	91	76.4 Å²	76.4	40%	0.399	42%	0.417	S	S	.	.			trans	-88.1	121.9	173.2	-135	-90.5	0	0	0	112.1	V229	F12-V229 HydrophobicContact CE2-CG1 4.14Å
13	S	28.7	Very low	34	Very low	53 Å²	53	80.4 Å²	80.4	37%	0.371	42%	0.42	S	S	.	.			trans	-88.1	117.8	163.9	-72.1	0	0	0	0	109.9	S15	S13-S15 PolarHBondContact O-N 3.46Å
14	Y	26.1	Very low	34	Very low	136 Å²	136	80.6 Å²	80.6	53%	0.533	43%	0.428	S	S	.	.			trans	-72.5	107.3	175.1	-103.7	-97.1	0	0	0	110.2
15	S	27.4	Very low	34.1	Very low	102 Å²	102	81.4 Å²	81.4	71%	0.713	43%	0.434	S	S	*	.			trans	-77.5	125.3	155.8	172.9	0	0	0	0	108	S13 G17	S13-S15 PolarHBondContact O-N 3.46Å; S15-G17 PolarHBondContact O-N 3.36Å
16	S	25.9	Very low	33.9	Very low	118 Å²	118	88.8 Å²	88.8	83%	0.825	46%	0.461	S	S	*	.	S	Bend	trans	-60.3	94.3	178.4	48.7	0	0	0	0	111.3
17	G	26.5	Very low	33.4	Very low	78 Å²	78	93.5 Å²	93.5	80%	0.804	49%	0.487	S	S	*	.			trans	160.2	80.8	171.3	0	0	0	0	0	112.5	S15	S15-G17 PolarHBondContact O-N 3.36Å
18	G	27	Very low	33.3	Very low	62 Å²	62	98.7 Å²	98.7	64%	0.639	51%	0.511	S	S	*	.	S	Bend	trans	149	101.4	168.9	0	0	0	0	0	115.2
19	H	30.2	Very low	33.1	Very low	178 Å²	178	104.3 Å²	104.3	82%	0.824	54%	0.541	S	S	*	.			trans	70.6	102.7	161.2	-72.3	131.5	0	0	0	120.1	R21	H19-R21 PolarHBondContact O-N 2.67Å
20	D	34.9	Very low	32.8	Very low	122 Å²	122	115.1 Å²	115.1	65%	0.652	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	17	178.8	-69.7	-56.8	0	0	0	117.9	W22 R23	D20-W22 VanDerWaalsContact C-N 3.33Å; D20-W22 PolarHBondContact O-N 2.82Å; D20-R23 IonicContact OD1-NH1 2.9Å
21	R	32.1	Very low	32.2	Very low	210 Å²	210	122.6 Å²	122.6	79%	0.792	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	-16.7	-169.8	-147	174.1	-179.6	-178.5	-1	114.8	H19	H19-R21 PolarHBondContact O-N 2.67Å
22	W	34.6	Very low	32	Very low	165 Å²	165	125.8 Å²	125.8	63%	0.625	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-3.3	-174.7	-63.6	99	0	0	0	115.1	D20 L25	D20-W22 VanDerWaalsContact C-N 3.33Å; D20-W22 PolarHBondContact O-N 2.82Å; W22-L25 HydrophobicContact CD2-CD1 4.27Å; W22-L25 HydrophobicContact CE3-CD1 3.2Å; W22-L25 HydrophobicContact CZ3-CD1 3.34Å
23	R	31.4	Very low	32.1	Very low	161 Å²	161	129.2 Å²	129.2	61%	0.608	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.3	-36.9	173	-93.2	-178.4	177.2	157.3	-5.4	111.9	D20 L25 R26	D20-R23 IonicContact OD1-NH1 2.9Å; R23-L25 PolarHBondContact O-N 2.98Å; R23-L25 VanDerWaalsContact O-N 3.11Å; R23-R26 PolarHBondContact O-N 3.21Å
24	A	34.2	Very low	32	Very low	47 Å²	47	135.1 Å²	135.1	39%	0.388	69%	0.692	S	S	.	*	H	α-helix	trans	-61.6	-22	179.5	0	0	0	0	0	114	L58	A24-L58 HydrophobicContact CB-CD1 3.85Å
25	L	35.1	Very low	32.2	Very low	60 Å²	60	133 Å²	133	31%	0.314	70%	0.703	S	S	.	*	H	α-helix	trans	-81.6	-13	177.5	-79.3	158.5	0	0	0	114	W22 R23 L58 T62	W22-L25 HydrophobicContact CD2-CD1 4.27Å; W22-L25 HydrophobicContact CE3-CD1 3.2Å; W22-L25 HydrophobicContact CZ3-CD1 3.34Å; R23-L25 PolarHBondContact O-N 2.98Å; R23-L25 VanDerWaalsContact O-N 3.11Å; L25-L58 HydrophobicContact CD1-CD2 4.32Å; L25-L58 HydrophobicContact CD2-CD2 4.05Å; L25-L58 HydrophobicContact CG-CD2 3.91Å; L25-T62 HydrophobicContact CD2-CG2 3.59Å
26	R	39.2	Very low	32.2	Very low	168 Å²	168	133.9 Å²	133.9	63%	0.634	71%	0.708	S	S	*	*	H	α-helix	trans	-91.5	-29	-177.5	-74.9	-172.6	-130.6	-167.8	1.7	114.2	R23	R23-R26 PolarHBondContact O-N 3.21Å
27	D	37	Very low	32.2	Very low	131 Å²	131	139.2 Å²	139.2	70%	0.701	71%	0.71	S	S	*	*	H	α-helix	trans	-98.4	-11.3	-169.6	-67.9	-31.7	0	0	0	114.1	D29	D27-D29 PolarHBondContact O-N 3.31Å
28	H	40.3	Very low	32.4	Very low	112 Å²	112	140 Å²	140	52%	0.519	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.7	-7.6	-164.8	-127.8	-62.3	0	0	0	116.6
29	D	42.9	Very low	32.7	Very low	123 Å²	123	143.2 Å²	143.2	66%	0.658	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.2	4.1	178.7	-73.8	-27.8	0	0	0	114	D27 M31 R205	D27-D29 PolarHBondContact O-N 3.31Å; D29-M31 PolarHBondContact O-N 3.48Å; D29-R205 IonicContact OD2-CZ 3.58Å; D29-R205 IonicContact OD2-NH2 3.31Å; D29-R205 PolarHBondContact OD2-NH2 3.02Å
30	R	35	Very low	32.7	Very low	230 Å²	230	144 Å²	144	87%	0.868	71%	0.714	S	S	*	*			trans	-97.9	67.1	170.6	-72.8	-170.4	-174.1	-173.8	2.6	111.4
31	M	26.8	Very low	32.6	Very low	176 Å²	176	144 Å²	144	87%	0.867	72%	0.721	S	S	*	*			trans	-143.2	115.7	157.9	-73.4	-157.2	166.4	0	0	109.7	D29	D29-M31 PolarHBondContact O-N 3.48Å
32	P	28.6	Very low	32.7	Very low	119 Å²	119	143.1 Å²	143.1	77%	0.773	73%	0.726	S	S	*	*				-138.7	120.4	116.8	34	-20	0	0	0	111.6
33	N	29.4	Very low	32.8	Very low	162 Å²	162	146.9 Å²	146.9	87%	0.866	74%	0.74	S	S	*	*			trans	-175.7	95.1	131.9	-91.5	-17.5	0	0	0	108.3	A35	N33-A35 PolarHBondContact O-N 3.34Å
34	L	27.3	Very low	33.2	Very low	178 Å²	178	144.1 Å²	144.1	93%	0.932	74%	0.737	S	S	*	*			trans	-65.1	103.3	161.7	-80.8	151.9	0	0	0	108.3
35	A	30.8	Very low	33.4	Very low	92 Å²	92	149.9 Å²	149.9	76%	0.76	76%	0.758	S	S	*	*			trans	-159.5	133.2	158.5	0	0	0	0	0	111.2	N33	N33-A35 PolarHBondContact O-N 3.34Å
36	C	27	Very low	33.7	Very low	120 Å²	120	157.2 Å²	157.2	81%	0.811	78%	0.781	S	S	*	*			trans	79.4	78.7	167.5	-136.3	0	0	0	0	117.6
37	W	25.1	Very low	33.7	Very low	230 Å²	230	154.1 Å²	154.1	87%	0.871	78%	0.777	S	S	*	*			trans	-75.5	120.5	148.1	-74.9	67.7	0	0	0	108.7
38	S	31.3	Very low	33.9	Very low	93 Å²	93	152.9 Å²	152.9	65%	0.65	77%	0.767	S	S	*	*			trans	-150.3	132.2	152.1	67.5	0	0	0	0	111.4
39	T	33.3	Very low	34	Very low	131 Å²	131	152.8 Å²	152.8	80%	0.804	77%	0.767	S	S	*	*	S	Bend	trans	71.4	83.5	162.5	59.6	0	0	0	0	119.3
40	Q	31.1	Very low	33.9	Very low	193 Å²	193	155.4 Å²	155.4	90%	0.902	77%	0.769	S	S	*	*				-175.6	121.9	122.1	-101.1	171.7	7.8	0	0	110
41	P	33.4	Very low	34.8	Very low	122 Å²	122	148.1 Å²	148.1	79%	0.792	75%	0.75	S	S	*	*			trans	-99.4	151.1	-171.4	40	-34.5	0	0	0	113.5
42	Q	34.1	Very low	36	Very low	192 Å²	192	145.1 Å²	145.1	90%	0.897	74%	0.737	S	S	*	*	S	Bend	trans	88.2	40.9	151.6	-55.4	-153.1	-39.4	0	0	123.2
43	R	36.6	Very low	37	Very low	245 Å²	245	145.4 Å²	145.4	93%	0.925	73%	0.726	S	S	*	*	S	Bend	trans	-135.3	-0.1	164.6	-110.6	177.8	-179.2	180	-0	120
44	N	39.7	Very low	38	Very low	102 Å²	102	140.4 Å²	140.4	55%	0.545	70%	0.704	S	S	.	*			trans	-117.8	13.8	-164.6	-93.9	10.1	0	0	0	119.3	R46 L47	N44-R46 PolarHBondContact O-N 3.02Å; N44-R46 VanDerWaalsContact O-N 3.07Å; N44-L47 PolarHBondContact O-N 3.46Å; N44-L47 VanDerWaalsContact OD1-CD1 3.29Å; N44-L47 WeakPolarHBondContact OD1-CD1 3.42Å
45	M	37.5	Very low	39.4	Very low	168 Å²	168	133.6 Å²	133.6	83%	0.828	67%	0.669	S	S	*	*	H	α-helix	trans	-62.7	-23.3	-173.6	-140	179.4	-75.8	0	0	115
46	R	42.5	Very low	40.5	Very low	214 Å²	214	134.3 Å²	134.3	81%	0.808	66%	0.66	S	S	*	*	H	α-helix	trans	-80.3	-26	173.9	-78.2	-173.7	-173	175.3	2.9	113.9	N44 Y50	N44-R46 PolarHBondContact O-N 3.02Å; N44-R46 VanDerWaalsContact O-N 3.07Å; R46-Y50 WeakPolarHBondContact O-CD2 3.43Å
47	L	39	Very low	41.5	Very low	104 Å²	104	131 Å²	131	55%	0.545	64%	0.641	S	S	.	*	H	α-helix	trans	-75.6	-32.1	-177.4	-84.6	156.7	0	0	0	112.2	N44 Y50 T51	N44-L47 PolarHBondContact O-N 3.46Å; N44-L47 VanDerWaalsContact OD1-CD1 3.29Å; N44-L47 WeakPolarHBondContact OD1-CD1 3.42Å; L47-Y50 PolarHBondContact O-N 2.92Å; L47-T51 PolarHBondContact O-N 3.49Å; L47-T51 VanDerWaalsContact O-N 3.1Å; L47-T51 PolarHBondContact O-OG1 3.27Å
48	E	40.1	Very low	42.8	Very low	104 Å²	104	121.7 Å²	121.7	49%	0.486	61%	0.608	S	S	.	*	H	α-helix	trans	-64.8	-36.7	176.3	-72.7	-178.6	168.4	0	0	112.5	T51 L52	E48-T51 VanDerWaalsContact CA-OG1 3.26Å; E48-T51 WeakPolarHBondContact CA-OG1 3.35Å; E48-T51 PolarHBondContact O-N 3.11Å; E48-T51 PolarHBondContact O-OG1 3.08Å; E48-T51 VanDerWaalsContact O-OG1 3.05Å; E48-L52 WeakPolarHBondContact O-CB 3.38Å; E48-L52 WeakPolarHBondContact O-CG 3.5Å; E48-L52 PolarHBondContact O-N 3.24Å
49	E	41.9	Very low	43.9	Very low	111 Å²	111	121 Å²	121	52%	0.519	60%	0.597	S	S	.	*	H	α-helix	trans	-72.8	-34.7	-179.6	-137	-163	140	0	0	112.7	K53	E49-K53 WeakPolarHBondContact O-CG 3.44Å; E49-K53 PolarHBondContact O-N 3.13Å; E49-K53 VanDerWaalsContact O-N 3.15Å; E49-K53 IonicContact OE1-NZ 2.67Å; E49-K53 PolarHBondContact OE1-NZ 3.35Å
50	Y	42.1	Very low	44.8	Very low	178 Å²	178	119.5 Å²	119.5	70%	0.698	59%	0.587	S	S	*	*	H	α-helix	trans	-71.6	-37.2	174.3	-86.7	-84.5	0	0	0	112.2	R46 L47 S54	R46-Y50 WeakPolarHBondContact O-CD2 3.43Å; L47-Y50 PolarHBondContact O-N 2.92Å; Y50-S54 WeakPolarHBondContact O-CB 3.37Å; Y50-S54 PolarHBondContact O-N 3.38Å; Y50-S54 PolarHBondContact O-OG 3.46Å; Y50-S54 VanDerWaalsContact O-OG 3.1Å
51	T	53.8	Low	45.7	Very low	76 Å²	76	115.3 Å²	115.3	47%	0.466	57%	0.57	S	S	.	*	H	α-helix	trans	-66.3	-45.6	174.5	27.7	0	0	0	0	110.8	L47 E48 K53 S54 T55	L47-T51 PolarHBondContact O-N 3.49Å; L47-T51 VanDerWaalsContact O-N 3.1Å; L47-T51 PolarHBondContact O-OG1 3.27Å; E48-T51 VanDerWaalsContact CA-OG1 3.26Å; E48-T51 WeakPolarHBondContact CA-OG1 3.35Å; E48-T51 PolarHBondContact O-N 3.11Å; E48-T51 PolarHBondContact O-OG1 3.08Å; E48-T51 VanDerWaalsContact O-OG1 3.05Å; T51-K53 PolarHBondContact O-N 3.41Å; T51-S54 PolarHBondContact O-N 3.39Å; T51-S54 PolarHBondContact O-OG 3.14Å; T51-T55 WeakPolarHBondContact O-CB 3.45Å; T51-T55 PolarHBondContact O-N 3.36Å; T51-T55 PolarHBondContact O-OG1 3.5Å
52	L	51.5	Low	47	Very low	113 Å²	113	111 Å²	111	59%	0.592	54%	0.542	S	S	*	.	H	α-helix	trans	-60.1	-43.2	176.4	-76.5	166.7	0	0	0	113.2	E48 L56	E48-L52 WeakPolarHBondContact O-CB 3.38Å; E48-L52 WeakPolarHBondContact O-CG 3.5Å; E48-L52 PolarHBondContact O-N 3.24Å; L52-L56 WeakPolarHBondContact O-CB 3.14Å; L52-L56 WeakPolarHBondContact O-CG 3.46Å; L52-L56 PolarHBondContact O-N 3Å
53	K	49.5	Very low	48.3	Very low	125 Å²	125	109.7 Å²	109.7	54%	0.543	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-39.3	178	-75.3	174.1	-174.3	158.6	0	112.5	E49 T51 A57	E49-K53 WeakPolarHBondContact O-CG 3.44Å; E49-K53 PolarHBondContact O-N 3.13Å; E49-K53 VanDerWaalsContact O-N 3.15Å; E49-K53 IonicContact OE1-NZ 2.67Å; E49-K53 PolarHBondContact OE1-NZ 3.35Å; T51-K53 PolarHBondContact O-N 3.41Å; K53-A57 WeakPolarHBondContact O-CB 3.46Å; K53-A57 PolarHBondContact O-N 3.1Å
54	S	49.9	Very low	49.7	Very low	58 Å²	58	101.4 Å²	101.4	41%	0.406	51%	0.509	S	S	.	.	H	α-helix	trans	-71.1	-40.8	177.4	64.9	0	0	0	0	111.8	Y50 T51 A57 L58	Y50-S54 WeakPolarHBondContact O-CB 3.37Å; Y50-S54 PolarHBondContact O-N 3.38Å; Y50-S54 PolarHBondContact O-OG 3.46Å; Y50-S54 VanDerWaalsContact O-OG 3.1Å; T51-S54 PolarHBondContact O-N 3.39Å; T51-S54 PolarHBondContact O-OG 3.14Å; S54-A57 PolarHBondContact O-N 3.3Å; S54-L58 WeakPolarHBondContact O-CB 3.48Å; S54-L58 VanDerWaalsContact O-CG 3.3Å; S54-L58 WeakPolarHBondContact O-CG 3.21Å; S54-L58 PolarHBondContact O-N 3.05Å
55	T	57.1	Low	51.2	Low	34 Å²	34	98.9 Å²	98.9	21%	0.209	50%	0.498	C	S	.	.	H	α-helix	trans	-63.5	-42.5	174.6	-50.1	0	0	0	0	111.2	T51 L58 L59	T51-T55 WeakPolarHBondContact O-CB 3.45Å; T51-T55 PolarHBondContact O-N 3.36Å; T51-T55 PolarHBondContact O-OG1 3.5Å; T55-L58 PolarHBondContact O-N 3.4Å; T55-L59 HydrophobicContact CG2-CD1 4.07Å; T55-L59 WeakPolarHBondContact O-CB 3.46Å; T55-L59 WeakPolarHBondContact O-CG 3.46Å; T55-L59 PolarHBondContact O-N 3Å
56	L	53.4	Low	52.9	Low	107 Å²	107	93.3 Å²	93.3	56%	0.56	47%	0.471	S	S	*	.	H	α-helix	trans	-63.7	-44.4	174.5	-84.4	165.2	0	0	0	112.4	L52 L58 L59 V60	L52-L56 WeakPolarHBondContact O-CB 3.14Å; L52-L56 WeakPolarHBondContact O-CG 3.46Å; L52-L56 PolarHBondContact O-N 3Å; L56-L58 VanDerWaalsContact C-N 3.32Å; L56-L58 PolarHBondContact O-N 2.82Å; L56-L59 PolarHBondContact O-N 2.92Å; L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.41Å; L56-V60 PolarHBondContact O-N 2.92Å
57	A	48.8	Very low	54.1	Low	50 Å²	50	92.9 Å²	92.9	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-63	-40.9	177.5	0	0	0	0	0	111.7	K53 S54 V60 L61	K53-A57 WeakPolarHBondContact O-CB 3.46Å; K53-A57 PolarHBondContact O-N 3.1Å; S54-A57 PolarHBondContact O-N 3.3Å; A57-V60 PolarHBondContact O-N 3.5Å; A57-L61 WeakPolarHBondContact O-CB 3.43Å; A57-L61 VanDerWaalsContact O-CG 3.23Å; A57-L61 WeakPolarHBondContact O-CG 3.31Å; A57-L61 PolarHBondContact O-N 3.01Å
58	L	52.1	Low	55.8	Low	36 Å²	36	93.4 Å²	93.4	19%	0.188	47%	0.469	C	S	.	.	H	α-helix	trans	-65.2	-43.6	175	-75.6	166.9	0	0	0	111.7	A24 L25 S54 T55 L56 L61 T62	A24-L58 HydrophobicContact CB-CD1 3.85Å; L25-L58 HydrophobicContact CD1-CD2 4.32Å; L25-L58 HydrophobicContact CD2-CD2 4.05Å; L25-L58 HydrophobicContact CG-CD2 3.91Å; S54-L58 WeakPolarHBondContact O-CB 3.48Å; S54-L58 VanDerWaalsContact O-CG 3.3Å; S54-L58 WeakPolarHBondContact O-CG 3.21Å; S54-L58 PolarHBondContact O-N 3.05Å; T55-L58 PolarHBondContact O-N 3.4Å; L56-L58 VanDerWaalsContact C-N 3.32Å; L56-L58 PolarHBondContact O-N 2.82Å; L58-L61 PolarHBondContact O-N 3.31Å; L58-T62 WeakPolarHBondContact O-CG2 3.36Å; L58-T62 PolarHBondContact O-N 2.91Å; L58-T62 PolarHBondContact O-OG1 3.06Å; L58-T62 VanDerWaalsContact O-OG1 3.14Å
59	L	54	Low	57.4	Low	79 Å²	79	89 Å²	89	41%	0.414	45%	0.449	S	S	.	.	H	α-helix	trans	-59.3	-47.6	173.5	-80.9	162.1	0	0	0	111.2	T55 L56 L61 T62 Y63	T55-L59 HydrophobicContact CG2-CD1 4.07Å; T55-L59 WeakPolarHBondContact O-CB 3.46Å; T55-L59 WeakPolarHBondContact O-CG 3.46Å; T55-L59 PolarHBondContact O-N 3Å; L56-L59 PolarHBondContact O-N 2.92Å; L59-L61 VanDerWaalsContact C-N 3.29Å; L59-L61 PolarHBondContact O-N 2.97Å; L59-T62 WeakPolarHBondContact CA-OG1 3.5Å; L59-T62 PolarHBondContact O-N 2.77Å; L59-T62 PolarHBondContact O-OG1 2.71Å; L59-Y63 HydrophobicContact CD2-CD2 4.49Å; L59-Y63 HydrophobicContact CD2-CE2 4.19Å; L59-Y63 WeakPolarHBondContact O-CB 3.34Å; L59-Y63 VanDerWaalsContact O-CD2 3.25Å; L59-Y63 WeakPolarHBondContact O-CD2 3.46Å; L59-Y63 PolarHBondContact O-N 3.11Å
60	V	52.1	Low	59.1	Low	98 Å²	98	84.5 Å²	84.5	59%	0.594	43%	0.427	S	S	*	.	H	α-helix	trans	-60.9	-40.6	177.8	171.4	0	0	0	0	111.1	L56 A57 S64	L56-V60 VanDerWaalsContact O-CG2 3.28Å; L56-V60 WeakPolarHBondContact O-CG2 3.41Å; L56-V60 PolarHBondContact O-N 2.92Å; A57-V60 PolarHBondContact O-N 3.5Å; V60-S64 VanDerWaalsContact O-CB 3.27Å; V60-S64 WeakPolarHBondContact O-CB 3.28Å; V60-S64 PolarHBondContact O-N 3.45Å
61	L	51.8	Low	60	Low	105 Å²	105	78.6 Å²	78.6	55%	0.55	42%	0.421	S	S	.	.	H	α-helix	trans	-66.8	-44.3	176.4	-72.6	169.8	0	0	0	112.1	A57 L58 L59 S64 V65	A57-L61 WeakPolarHBondContact O-CB 3.43Å; A57-L61 VanDerWaalsContact O-CG 3.23Å; A57-L61 WeakPolarHBondContact O-CG 3.31Å; A57-L61 PolarHBondContact O-N 3.01Å; L58-L61 PolarHBondContact O-N 3.31Å; L59-L61 VanDerWaalsContact C-N 3.29Å; L59-L61 PolarHBondContact O-N 2.97Å; L61-S64 PolarHBondContact O-N 3.31Å; L61-V65 VanDerWaalsContact O-CG2 3.29Å; L61-V65 WeakPolarHBondContact O-CG2 3.36Å; L61-V65 PolarHBondContact O-N 3.47Å
62	T	59.4	Low	60.3	Low	32 Å²	32	80.4 Å²	80.4	20%	0.196	43%	0.432	C	S	.	.	H	α-helix	trans	-65.7	-44	177.2	53.8	0	0	0	0	111.1	L25 L58 L59 S64 V65 I66	L25-T62 HydrophobicContact CD2-CG2 3.59Å; L58-T62 WeakPolarHBondContact O-CG2 3.36Å; L58-T62 PolarHBondContact O-N 2.91Å; L58-T62 PolarHBondContact O-OG1 3.06Å; L58-T62 VanDerWaalsContact O-OG1 3.14Å; L59-T62 WeakPolarHBondContact CA-OG1 3.5Å; L59-T62 PolarHBondContact O-N 2.77Å; L59-T62 PolarHBondContact O-OG1 2.71Å; T62-S64 VanDerWaalsContact C-N 3.33Å; T62-S64 PolarHBondContact O-N 2.91Å; T62-V65 PolarHBondContact O-N 3.09Å; T62-I66 WeakPolarHBondContact O-CB 3.27Å; T62-I66 WeakPolarHBondContact O-CD1 3.4Å; T62-I66 WeakPolarHBondContact O-CG1 3.3Å; T62-I66 PolarHBondContact O-N 3.41Å
63	Y	62.2	Low	60.3	Low	164 Å²	164	77.7 Å²	77.7	64%	0.643	43%	0.431	S	S	*	.	H	α-helix	trans	-60.2	-41.5	174.1	-91.9	-85.3	0	0	0	112.1	L59 I66 R67	L59-Y63 HydrophobicContact CD2-CD2 4.49Å; L59-Y63 HydrophobicContact CD2-CE2 4.19Å; L59-Y63 WeakPolarHBondContact O-CB 3.34Å; L59-Y63 VanDerWaalsContact O-CD2 3.25Å; L59-Y63 WeakPolarHBondContact O-CD2 3.46Å; L59-Y63 PolarHBondContact O-N 3.11Å; Y63-I66 PolarHBondContact O-N 2.77Å; Y63-R67 VanDerWaalsContact O-CB 3.31Å; Y63-R67 WeakPolarHBondContact O-CB 3.41Å; Y63-R67 PolarHBondContact O-N 3.41Å
64	S	64.8	Low	60.3	Low	71 Å²	71	75 Å²	75	50%	0.497	43%	0.429	S	S	.	.	H	α-helix	trans	-64	-44.5	176.9	-172.4	0	0	0	0	111.8	V60 L61 T62 R67 E68	V60-S64 VanDerWaalsContact O-CB 3.27Å; V60-S64 WeakPolarHBondContact O-CB 3.28Å; V60-S64 PolarHBondContact O-N 3.45Å; L61-S64 PolarHBondContact O-N 3.31Å; T62-S64 VanDerWaalsContact C-N 3.33Å; T62-S64 PolarHBondContact O-N 2.91Å; S64-R67 PolarHBondContact O-N 3.29Å; S64-E68 WeakPolarHBondContact O-CB 3.39Å; S64-E68 PolarHBondContact O-N 3.42Å
65	V	71	Confident	60.3	Low	49 Å²	49	77.8 Å²	77.8	30%	0.297	44%	0.443	S	S	.	.	H	α-helix	trans	-68.2	-40.5	178.1	172.6	0	0	0	0	111	L61 T62 R67 E68 L69 Y204	L61-V65 VanDerWaalsContact O-CG2 3.29Å; L61-V65 WeakPolarHBondContact O-CG2 3.36Å; L61-V65 PolarHBondContact O-N 3.47Å; T62-V65 PolarHBondContact O-N 3.09Å; V65-R67 VanDerWaalsContact C-N 3.34Å; V65-R67 PolarHBondContact O-N 3.14Å; V65-E68 PolarHBondContact O-N 3.07Å; V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 HydrophobicContact CG1-CG 4.22Å; V65-L69 WeakPolarHBondContact O-CB 3.49Å; V65-L69 WeakPolarHBondContact O-CG 3.19Å; V65-L69 PolarHBondContact O-N 3.41Å; V65-Y204 HydrophobicContact CG1-CD2 4.22Å; V65-Y204 HydrophobicContact CG1-CE2 3.76Å
66	I	73.2	Confident	60	Low	52 Å²	52	76.8 Å²	76.8	27%	0.267	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-44.9	176.1	-72.4	164.7	0	0	0	110	T62 Y63 E68 L69 F70 Y204	T62-I66 WeakPolarHBondContact O-CB 3.27Å; T62-I66 WeakPolarHBondContact O-CD1 3.4Å; T62-I66 WeakPolarHBondContact O-CG1 3.3Å; T62-I66 PolarHBondContact O-N 3.41Å; Y63-I66 PolarHBondContact O-N 2.77Å; I66-E68 PolarHBondContact O-N 2.92Å; I66-L69 PolarHBondContact O-N 3.33Å; I66-F70 HydrophobicContact CB-CD2 4.38Å; I66-F70 HydrophobicContact CG2-CD2 4.05Å; I66-F70 WeakPolarHBondContact O-CA 3.37Å; I66-F70 WeakPolarHBondContact O-CB 3.37Å; I66-F70 WeakPolarHBondContact O-CD2 3.49Å; I66-F70 PolarHBondContact O-N 2.96Å; I66-Y204 HydrophobicContact CG1-CE1 4.06Å; I66-Y204 WeakPolarHBondContact CG1-OH 3.32Å
67	R	69.5	Low	59.9	Low	205 Å²	205	78.6 Å²	78.6	77%	0.774	45%	0.448	S	S	*	.	H	α-helix	trans	-66.7	-37.7	178.1	-168.7	178.7	175.5	-163.7	-1.8	112.3	Y63 S64 V65 G71	Y63-R67 VanDerWaalsContact O-CB 3.31Å; Y63-R67 WeakPolarHBondContact O-CB 3.41Å; Y63-R67 PolarHBondContact O-N 3.41Å; S64-R67 PolarHBondContact O-N 3.29Å; V65-R67 VanDerWaalsContact C-N 3.34Å; V65-R67 PolarHBondContact O-N 3.14Å; R67-G71 WeakPolarHBondContact O-CA 3.37Å; R67-G71 PolarHBondContact O-N 3.16Å; R67-G71 VanDerWaalsContact O-N 3.11Å
68	E	74.9	Confident	60.3	Low	115 Å²	115	78.8 Å²	78.8	54%	0.537	44%	0.442	S	S	.	.	H	α-helix	trans	-62.2	-45	173.9	-176.9	-165.8	140.8	0	0	111.6	S64 V65 I66 R200	S64-E68 WeakPolarHBondContact O-CB 3.39Å; S64-E68 PolarHBondContact O-N 3.42Å; V65-E68 PolarHBondContact O-N 3.07Å; I66-E68 PolarHBondContact O-N 2.92Å; E68-R200 IonicContact OE1-CZ 3.87Å; E68-R200 IonicContact OE1-NH1 2.74Å; E68-R200 PolarHBondContact OE1-NH1 3.02Å; E68-R200 IonicContact OE1-NH2 3.56Å; E68-R200 PolarHBondContact OE1-NH2 2.83Å
69	L	73.6	Confident	60.7	Low	11 Å²	11	80 Å²	80	6%	0.058	45%	0.446	C	S	.	.	H	α-helix	trans	-83.2	-40.6	-174.2	-69	178.3	0	0	0	113.1	V65 I66 R200 K201 Y204	V65-L69 HydrophobicContact CG1-CD1 3.7Å; V65-L69 HydrophobicContact CG1-CG 4.22Å; V65-L69 WeakPolarHBondContact O-CB 3.49Å; V65-L69 WeakPolarHBondContact O-CG 3.19Å; V65-L69 PolarHBondContact O-N 3.41Å; I66-L69 PolarHBondContact O-N 3.33Å; L69-R200 HydrophobicContact CD2-CB 3.85Å; L69-K201 HydrophobicContact CB-CG 4.29Å; L69-K201 VanDerWaalsContact O-CD 3.3Å; L69-K201 WeakPolarHBondContact O-CD 3.23Å; L69-K201 WeakPolarHBondContact O-CE 3.42Å; L69-K201 WeakPolarHBondContact O-CG 3.29Å; L69-Y204 HydrophobicContact CD1-CD2 3.86Å; L69-Y204 HydrophobicContact CD1-CG 4.32Å
70	F	76.9	Confident	61.3	Low	16 Å²	16	81.3 Å²	81.3	7%	0.07	45%	0.453	C	S	.	.	H	α-helix	trans	-113.6	-0.3	-168.1	-55.9	-81.3	0	0	0	113.7	I66 T72 L116 C117 K201 Y204	I66-F70 HydrophobicContact CB-CD2 4.38Å; I66-F70 HydrophobicContact CG2-CD2 4.05Å; I66-F70 WeakPolarHBondContact O-CA 3.37Å; I66-F70 WeakPolarHBondContact O-CB 3.37Å; I66-F70 WeakPolarHBondContact O-CD2 3.49Å; I66-F70 PolarHBondContact O-N 2.96Å; F70-T72 PolarHBondContact O-N 2.97Å; F70-T72 VanDerWaalsContact O-N 3.13Å; F70-L116 HydrophobicContact CD1-CB 3.7Å; F70-L116 HydrophobicContact CD2-CB 4.28Å; F70-L116 HydrophobicContact CE1-CB 3.64Å; F70-L116 HydrophobicContact CE2-CB 4.25Å; F70-L116 HydrophobicContact CE2-CD1 4.06Å; F70-L116 HydrophobicContact CG-CB 4.03Å; F70-L116 HydrophobicContact CZ-CB 3.93Å; F70-L116 HydrophobicContact CZ-CD1 4.04Å; F70-C117 HydrophobicContact CD1-CB 4.4Å; F70-C117 VanDerWaalsContact CD1-SG 3.54Å; F70-C117 WeakPolarHBondContact CE1-SG 3.35Å; F70-K201 HydrophobicContact CD1-CB 4.4Å; F70-K201 HydrophobicContact CE1-CB 3.81Å; F70-K201 HydrophobicContact CE1-CG 4.35Å; F70-K201 HydrophobicContact CZ-CB 4.26Å; F70-K201 WeakPolarHBondContact CZ-O 3.44Å; F70-Y204 AromaticContact CE2-CD1 3.89Å; F70-Y204 HydrophobicContact CE2-CD1 3.89Å; F70-Y204 HydrophobicContact CE2-CE1 4.35Å; F70-Y204 HydrophobicContact CE2-CG 4.15Å; F70-Y204 HydrophobicContact CZ-CD1 4.08Å; F70-Y204 HydrophobicContact CZ-CG 4.28Å
71	G	60.8	Low	61.8	Low	55 Å²	55	81.5 Å²	81.5	57%	0.567	45%	0.446	S	S	*	.	S	Bend	trans	-69.4	-7.7	-174	0	0	0	0	0	116.4	R67	R67-G71 WeakPolarHBondContact O-CA 3.37Å; R67-G71 PolarHBondContact O-N 3.16Å; R67-G71 VanDerWaalsContact O-N 3.11Å
72	T	59.2	Low	62.4	Low	113 Å²	113	77.1 Å²	77.1	69%	0.693	42%	0.422	S	S	*	.			trans	-112.5	72.5	-178	61.3	0	0	0	0	110.6	F70	F70-T72 PolarHBondContact O-N 2.97Å; F70-T72 VanDerWaalsContact O-N 3.13Å
73	G	52.7	Low	62.7	Low	56 Å²	56	79.9 Å²	79.9	58%	0.577	43%	0.433	S	S	*	.			trans	-92	119.7	169.3	0	0	0	0	0	110.2
74	S	49.9	Very low	63	Low	70 Å²	70	79.9 Å²	79.9	49%	0.49	44%	0.439	S	S	.	.			trans	-123.5	98.9	169.4	58.8	0	0	0	0	109.1
75	T	50.2	Low	63.3	Low	116 Å²	116	78.7 Å²	78.7	71%	0.712	43%	0.427	S	S	*	.			trans	-84.5	135.2	164.9	53.1	0	0	0	0	107.9
76	G	49.4	Very low	63.7	Low	13 Å²	13	80.5 Å²	80.5	13%	0.134	44%	0.44	C	S	.	.			trans	-102.9	160.1	179.3	0	0	0	0	0	112.5	N78 V434	G76-N78 VanDerWaalsContact C-N 3.31Å; G76-N78 PolarHBondContact O-N 3.13Å; G76-V434 CarbonylContact C-O 3.37Å; G76-V434 WeakPolarHBondContact CA-O 3.29Å
77	I	51.3	Low	64.2	Low	145 Å²	145	79.7 Å²	79.7	74%	0.744	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	-28.7	-160.7	-59.4	167.5	0	0	0	112.7
78	N	56.8	Low	65	Low	54 Å²	54	76.4 Å²	76.4	29%	0.289	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	49.7	-176.6	-78.6	-44.1	0	0	0	112.1	G76 D80 K81 G435	G76-N78 VanDerWaalsContact C-N 3.31Å; G76-N78 PolarHBondContact O-N 3.13Å; N78-D80 PolarHBondContact O-N 3.12Å; N78-K81 HydrophobicContact CB-CB 4.4Å; N78-K81 HydrophobicContact CB-CD 3.99Å; N78-K81 HydrophobicContact CB-CG 4.03Å; N78-K81 PolarHBondContact O-N 3.43Å; N78-G435 PolarHBondContact ND2-O 3.19Å
79	F	61.3	Low	65.7	Low	61 Å²	61	72.4 Å²	72.4	27%	0.268	42%	0.417	S	S	.	.	G	3₁₀ helix	trans	-62.5	-31.9	175.9	-159.3	-93.8	0	0	0	112.1	K81 Y82 K121 T123 V434	F79-K81 VanDerWaalsContact C-N 3.27Å; F79-K81 PolarHBondContact O-N 3.42Å; F79-Y82 HydrophobicContact CD2-CD2 4.46Å; F79-Y82 WeakPolarHBondContact O-CB 3.37Å; F79-Y82 WeakPolarHBondContact O-CD2 3.47Å; F79-Y82 PolarHBondContact O-N 3.2Å; F79-Y82 VanDerWaalsContact O-N 3.11Å; F79-K121 HydrophobicContact CE1-CB 4.35Å; F79-T123 HydrophobicContact CE2-CG2 4.24Å; F79-T123 HydrophobicContact CZ-CG2 3.81Å; F79-V434 HydrophobicContact CD2-CG1 4.29Å
80	D	65.6	Low	66.5	Low	106 Å²	106	74.3 Å²	74.3	57%	0.567	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-64.8	-28.3	-179.4	-62.9	-41.4	0	0	0	113.2	N78 Y82 E83 K121	N78-D80 PolarHBondContact O-N 3.12Å; D80-Y82 PolarHBondContact O-N 3.45Å; D80-E83 WeakPolarHBondContact O-CB 3.26Å; D80-E83 PolarHBondContact O-N 2.8Å; D80-K121 IonicContact OD1-NZ 2.67Å
81	K	63.7	Low	67	Low	102 Å²	102	75.4 Å²	75.4	44%	0.443	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-63.4	-25.7	175.2	-70.1	-168	179.2	-170	0	112.9	N78 F79 E83 E84	N78-K81 HydrophobicContact CB-CB 4.4Å; N78-K81 HydrophobicContact CB-CD 3.99Å; N78-K81 HydrophobicContact CB-CG 4.03Å; N78-K81 PolarHBondContact O-N 3.43Å; F79-K81 VanDerWaalsContact C-N 3.27Å; F79-K81 PolarHBondContact O-N 3.42Å; K81-E83 PolarHBondContact O-N 2.93Å; K81-E84 PolarHBondContact O-N 3.19Å
82	Y	63.5	Low	68.2	Low	13 Å²	13	77.9 Å²	77.9	5%	0.051	44%	0.442	C	S	.	.	G	3₁₀ helix	trans	-67.6	-26.1	176.1	-70.5	-82.9	0	0	0	111.8	F79 D80 E84 I85 P124 E145 V434 G435	F79-Y82 HydrophobicContact CD2-CD2 4.46Å; F79-Y82 WeakPolarHBondContact O-CB 3.37Å; F79-Y82 WeakPolarHBondContact O-CD2 3.47Å; F79-Y82 PolarHBondContact O-N 3.2Å; F79-Y82 VanDerWaalsContact O-N 3.11Å; D80-Y82 PolarHBondContact O-N 3.45Å; Y82-E84 PolarHBondContact O-N 2.87Å; Y82-I85 HydrophobicContact CD1-CD1 3.57Å; Y82-I85 HydrophobicContact CE1-CD1 4.32Å; Y82-I85 HydrophobicContact CG-CD1 4.35Å; Y82-I85 PolarHBondContact O-N 3.12Å; Y82-P124 WeakPolarHBondContact O-CG 3.33Å; Y82-E145 VanDerWaalsContact CD1-CD 3.47Å; Y82-E145 WeakPolarHBondContact CD1-OE1 3.5Å; Y82-E145 VanDerWaalsContact CD1-OE2 3.28Å; Y82-E145 WeakPolarHBondContact CD1-OE2 3.19Å; Y82-E145 HydrophobicContact CE1-CG 4.31Å; Y82-E145 WeakPolarHBondContact CE1-OE1 3.34Å; Y82-E145 VanDerWaalsContact CE1-OE2 3.25Å; Y82-E145 WeakPolarHBondContact CE1-OE2 3.45Å; Y82-V434 WeakPolarHBondContact OH-CA 3.35Å; Y82-V434 PolarHBondContact OH-N 3.03Å; Y82-G435 VanDerWaalsContact CE2-N 3.31Å; Y82-G435 PolarHBondContact OH-N 3.34Å
83	E	66.9	Low	69.6	Low	90 Å²	90	79.3 Å²	79.3	42%	0.421	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-66.1	-20.4	177.5	-64.6	-170.8	177.4	0	0	112.7	D80 K81 K121	D80-E83 WeakPolarHBondContact O-CB 3.26Å; D80-E83 PolarHBondContact O-N 2.8Å; K81-E83 PolarHBondContact O-N 2.93Å; E83-K121 WeakPolarHBondContact OE1-CD 3.49Å; E83-K121 IonicContact OE1-NZ 3.32Å; E83-K121 PolarHBondContact OE1-NZ 3.38Å
84	E	67.9	Low	71.3	Confident	164 Å²	164	78.9 Å²	78.9	77%	0.766	43%	0.431	S	S	*	.	G	3₁₀ helix	trans	-83	-11	179.3	-60.5	-179.9	172.6	0	0	113.3	K81 Y82 P86	K81-E84 PolarHBondContact O-N 3.19Å; Y82-E84 PolarHBondContact O-N 2.87Å; E84-P86 WeakPolarHBondContact O-CD 3.33Å
85	I	72	Confident	73.1	Confident	46 Å²	46	76.6 Å²	76.6	24%	0.236	42%	0.415	C	S	.	.	S	Bend	trans	-68.8	122.1	-178.8	-59.4	174.8	0	0	0	108.9	Y82 V87 V304	Y82-I85 HydrophobicContact CD1-CD1 3.57Å; Y82-I85 HydrophobicContact CE1-CD1 4.32Å; Y82-I85 HydrophobicContact CG-CD1 4.35Å; Y82-I85 PolarHBondContact O-N 3.12Å; I85-V87 PolarHBondContact O-N 3.16Å; I85-V304 HydrophobicContact CG2-CG1 3.84Å
86	P	79.4	Confident	75	Confident	88 Å²	88	76.5 Å²	76.5	57%	0.571	42%	0.416	S	S	*	.			trans	-65.1	135.3	-180	26.5	-33.5	0	0	0	110.1	E84 G305	E84-P86 WeakPolarHBondContact O-CD 3.33Å; P86-G305 WeakPolarHBondContact O-CA 3.45Å; P86-G305 PolarHBondContact O-N 2.62Å
87	V	83.1	Confident	76.8	Confident	34 Å²	34	78.2 Å²	78.2	21%	0.206	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	123.3	176	-178.7	0	0	0	0	109	I85 P124 F128 L302 A303 V304	I85-V87 PolarHBondContact O-N 3.16Å; V87-P124 HydrophobicContact CG2-CB 3.75Å; V87-F128 HydrophobicContact CB-CD2 4.1Å; V87-F128 HydrophobicContact CB-CE2 3.58Å; V87-F128 HydrophobicContact CB-CZ 4.01Å; V87-F128 HydrophobicContact CG1-CD1 4.39Å; V87-F128 HydrophobicContact CG1-CD2 3.45Å; V87-F128 VanDerWaalsContact CG1-CD2 3.45Å; V87-F128 HydrophobicContact CG1-CE1 4.34Å; V87-F128 HydrophobicContact CG1-CE2 3.41Å; V87-F128 VanDerWaalsContact CG1-CE2 3.41Å; V87-F128 HydrophobicContact CG1-CG 3.96Å; V87-F128 HydrophobicContact CG1-CZ 3.88Å; V87-F128 HydrophobicContact CG2-CD2 4.49Å; V87-F128 HydrophobicContact CG2-CE2 4.1Å; V87-L302 HydrophobicContact CG1-CD1 3.37Å; V87-L302 HydrophobicContact CG1-CG 4.24Å; V87-A303 WeakPolarHBondContact CA-O 3.24Å; V87-V304 HydrophobicContact CG1-CG2 3.97Å; V87-V304 HydrophobicContact CG2-CB 4.42Å; V87-V304 HydrophobicContact CG2-CG1 4.11Å; V87-V304 HydrophobicContact CG2-CG2 3.97Å
88	E	86.6	Confident	78.6	Confident	136 Å²	136	71.8 Å²	71.8	64%	0.636	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.5	175.7	-65	-175.7	177.7	0	0	109	L302 A303	E88-L302 WeakPolarHBondContact O-CA 3.32Å; E88-A303 PolarHBondContact N-O 3.02Å; E88-A303 PolarHBondContact O-N 3.4Å
89	A	88.9	Confident	80	Confident	32 Å²	32	73.8 Å²	73.8	26%	0.264	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	116.2	174.3	0	0	0	0	0	109.2	V94 F128 V300 F301 L302	A89-V94 HydrophobicContact CB-CG1 3.79Å; A89-F128 HydrophobicContact CB-CD1 3.84Å; A89-F128 HydrophobicContact CB-CE1 4.24Å; A89-V300 HydrophobicContact CB-CG1 4.48Å; A89-F301 CarbonylContact C-O 3.6Å; A89-F301 WeakPolarHBondContact CA-O 3.05Å; A89-L302 HydrophobicContact CB-CD1 3.84Å
90	T	90.6	Very high	81.2	Confident	51 Å²	51	77 Å²	77	31%	0.313	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.7	-179.6	63.5	0	0	0	0	110.8	V300 F301	T90-V300 CarbonylContact O-C 3.59Å; T90-V300 WeakPolarHBondContact O-CA 3.28Å; T90-F301 PolarHBondContact N-O 3.16Å; T90-F301 PolarHBondContact O-N 2.79Å; T90-F301 WeakPolarHBondContact OG1-CB 3.26Å
91	G	87.6	Confident	82.1	Confident	39 Å²	39	72.2 Å²	72.2	40%	0.402	39%	0.388	S	S	.	.	S	Bend	trans	153	174	-177.4	0	0	0	0	0	112
92	Q	86.7	Confident	83.1	Confident	106 Å²	106	72.8 Å²	72.8	50%	0.495	40%	0.396	S	S	.	.	S	Bend	trans	-80.1	137.9	169.8	-64.1	-178.5	9.9	0	0	109	V94 R137	Q92-V94 VanDerWaalsContact C-N 3.33Å; Q92-V94 PolarHBondContact O-N 3.28Å; Q92-R137 VanDerWaalsContact O-CZ 3.26Å; Q92-R137 PolarHBondContact O-NH1 3.36Å; Q92-R137 PolarHBondContact O-NH2 2.97Å
93	D	87.9	Confident	84.2	Confident	143 Å²	143	77 Å²	77	77%	0.765	42%	0.417	S	S	*	.	S	Bend	trans	47.4	50.3	174.7	-56.5	-36.1	0	0	0	113.9	P95 R137	D93-P95 WeakPolarHBondContact O-CD 3.29Å; D93-R137 PolarHBondContact O-NH1 2.87Å
94	V	89	Confident	84.6	Confident	47 Å²	47	73.2 Å²	73.2	29%	0.285	40%	0.399	S	S	.	.	P	Polyproline II helix	trans	-64.6	122.7	178.4	-178.1	0	0	0	0	109.3	A89 Q92 V300	A89-V94 HydrophobicContact CB-CG1 3.79Å; Q92-V94 VanDerWaalsContact C-N 3.33Å; Q92-V94 PolarHBondContact O-N 3.28Å; V94-V300 HydrophobicContact CG1-CG1 4.05Å; V94-V300 HydrophobicContact CG2-CG1 4.28Å; V94-V300 HydrophobicContact CG2-CG2 4.28Å
95	P	87.5	Confident	85.2	Confident	23 Å²	23	74.6 Å²	74.6	15%	0.149	41%	0.405	C	S	.	.	P	Polyproline II helix	trans	-61.5	147.3	177.7	-28.6	40.6	0	0	0	112.3	D93 P131 A135	D93-P95 WeakPolarHBondContact O-CD 3.29Å; P95-P131 HydrophobicContact CB-CB 4.28Å; P95-A135 HydrophobicContact CG-CB 3.6Å
96	P	89.2	Confident	85.5	Confident	114 Å²	114	73.5 Å²	73.5	74%	0.74	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-63.5	144.2	178.1	27.7	-34.4	0	0	0	110.8	P131	P96-P131 WeakPolarHBondContact O-CG 3.48Å
97	C	87.6	Confident	85.4	Confident	48 Å²	48	71 Å²	71	32%	0.324	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-69.3	150.1	174.7	65.4	0	0	0	0	111.4	K127 F128	C97-K127 VanDerWaalsContact CA-O 3.24Å; C97-K127 WeakPolarHBondContact CA-O 3.37Å; C97-K127 HydrophobicContact CB-CB 4.4Å; C97-F128 HydrophobicContact CB-CD1 3.82Å; C97-F128 HydrophobicContact CB-CD2 4.11Å; C97-F128 HydrophobicContact CB-CE1 3.66Å; C97-F128 HydrophobicContact CB-CE2 3.95Å; C97-F128 HydrophobicContact CB-CG 4.05Å; C97-F128 HydrophobicContact CB-CZ 3.73Å
98	I	87.9	Confident	85.4	Confident	11 Å²	11	73.4 Å²	73.4	6%	0.056	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-93.3	158.5	171.7	62.2	170.3	0	0	0	111.3	E103 L104 P122 K127 P131	I98-E103 VanDerWaalsContact CA-OE2 3.29Å; I98-E103 WeakPolarHBondContact CA-OE2 3.12Å; I98-E103 HydrophobicContact CB-CB 4.32Å; I98-E103 HydrophobicContact CG2-CB 4.13Å; I98-L104 HydrophobicContact CD1-CD1 3.44Å; I98-L104 VanDerWaalsContact CD1-CD1 3.44Å; I98-L104 HydrophobicContact CD1-CD2 3.8Å; I98-L104 HydrophobicContact CD1-CG 3.52Å; I98-L104 HydrophobicContact CG2-CD2 3.8Å; I98-L104 HydrophobicContact CG2-CG 4.23Å; I98-P122 HydrophobicContact CD1-CB 4.46Å; I98-P122 HydrophobicContact CD1-CG 4.26Å; I98-P122 HydrophobicContact CG1-CG 4.4Å; I98-K127 HydrophobicContact CG1-CB 4.46Å; I98-K127 PolarHBondContact N-O 2.82Å; I98-K127 WeakPolarHBondContact O-CB 3.27Å; I98-K127 WeakPolarHBondContact O-CD 3.31Å; I98-K127 WeakPolarHBondContact O-CG 3.25Å; I98-P131 HydrophobicContact CG2-CB 4.49Å; I98-P131 HydrophobicContact CG2-CG 4.34Å
99	Q	86.8	Confident	85.1	Confident	96 Å²	96	71.5 Å²	71.5	45%	0.449	38%	0.384	S	S	.	.	S	Bend	trans	-106.7	-32.5	169	-62.4	-58.2	-32.2	0	0	113.1	E103 P122	Q99-E103 WeakPolarHBondContact CB-OE1 3.46Å; Q99-E103 PolarHBondContact N-OE1 2.89Å; Q99-E103 PolarHBondContact N-OE2 3.4Å; Q99-P122 VanDerWaalsContact O-CD 3.27Å; Q99-P122 WeakPolarHBondContact O-CD 3.37Å; Q99-P122 WeakPolarHBondContact O-CG 3.32Å
100	K	87.2	Confident	84.7	Confident	127 Å²	127	70.1 Å²	70.1	55%	0.552	37%	0.372	S	S	*	.	S	Bend	trans	-125.5	154.8	177.7	-63.1	-177.3	-178.7	-179.1	0	111.3	D102 E103	K100-D102 PolarHBondContact O-N 2.88Å; K100-E103 PolarHBondContact N-OE1 3.34Å; K100-E103 PolarHBondContact O-N 2.82Å
101	F	83.4	Confident	84.3	Confident	7 Å²	7	68.9 Å²	68.9	3%	0.031	36%	0.363	C	S	.	.	G	3₁₀ helix	trans	-61.3	-31.7	173.3	-67.8	-66.9	0	0	0	112.3	E103 L104 M111 I114 K121 P122 I130 L152	F101-E103 PolarHBondContact O-N 3.04Å; F101-E103 VanDerWaalsContact O-N 3.16Å; F101-L104 HydrophobicContact CD1-CD1 4.2Å; F101-L104 VanDerWaalsContact O-CB 3.25Å; F101-L104 WeakPolarHBondContact O-CB 3.42Å; F101-L104 PolarHBondContact O-N 2.83Å; F101-M111 HydrophobicContact CB-CE 4.39Å; F101-M111 HydrophobicContact CB-SD 4.35Å; F101-M111 WeakPolarHBondContact O-CE 3.48Å; F101-I114 HydrophobicContact CB-CD1 4.35Å; F101-I114 HydrophobicContact CD1-CD1 4.2Å; F101-I114 HydrophobicContact CD2-CG2 3.88Å; F101-I114 HydrophobicContact CE2-CG2 4.24Å; F101-I114 HydrophobicContact CG-CD1 4.3Å; F101-I114 HydrophobicContact CG-CG2 4.14Å; F101-K121 VanDerWaalsContact CE2-C 3.44Å; F101-P122 HydrophobicContact CD1-CB 4.4Å; F101-P122 HydrophobicContact CE1-CB 3.82Å; F101-P122 HydrophobicContact CE2-CB 4.36Å; F101-P122 VanDerWaalsContact CZ-CA 3.5Å; F101-P122 HydrophobicContact CZ-CB 3.8Å; F101-I130 HydrophobicContact CE1-CD1 4.09Å; F101-L152 HydrophobicContact CD1-CD1 4.37Å; F101-L152 HydrophobicContact CE1-CD1 3.79Å; F101-L152 HydrophobicContact CZ-CD1 4.48Å
102	D	85.7	Confident	84.2	Confident	114 Å²	114	70 Å²	70	61%	0.61	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-62.5	-19.5	179.9	-64.8	-25.3	0	0	0	114.2	K100 L104	K100-D102 PolarHBondContact O-N 2.88Å; D102-L104 PolarHBondContact O-N 2.86Å
103	E	85.5	Confident	84	Confident	102 Å²	102	65 Å²	65	48%	0.477	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-74.4	-18.5	174.8	-66.3	164.3	-138.8	0	0	112.1	I98 Q99 K100 F101	I98-E103 VanDerWaalsContact CA-OE2 3.29Å; I98-E103 WeakPolarHBondContact CA-OE2 3.12Å; I98-E103 HydrophobicContact CB-CB 4.32Å; I98-E103 HydrophobicContact CG2-CB 4.13Å; Q99-E103 WeakPolarHBondContact CB-OE1 3.46Å; Q99-E103 PolarHBondContact N-OE1 2.89Å; Q99-E103 PolarHBondContact N-OE2 3.4Å; K100-E103 PolarHBondContact N-OE1 3.34Å; K100-E103 PolarHBondContact O-N 2.82Å; F101-E103 PolarHBondContact O-N 3.04Å; F101-E103 VanDerWaalsContact O-N 3.16Å
104	L	76.8	Confident	83.8	Confident	9 Å²	9	58.3 Å²	58.3	5%	0.047	30%	0.3	C	S	.	.	S	Bend	trans	-83.8	118.2	173.2	-57.9	167.6	0	0	0	107.8	I98 F101 D102 L106 I130 L134	I98-L104 HydrophobicContact CD1-CD1 3.44Å; I98-L104 VanDerWaalsContact CD1-CD1 3.44Å; I98-L104 HydrophobicContact CD1-CD2 3.8Å; I98-L104 HydrophobicContact CD1-CG 3.52Å; I98-L104 HydrophobicContact CG2-CD2 3.8Å; I98-L104 HydrophobicContact CG2-CG 4.23Å; F101-L104 HydrophobicContact CD1-CD1 4.2Å; F101-L104 VanDerWaalsContact O-CB 3.25Å; F101-L104 WeakPolarHBondContact O-CB 3.42Å; F101-L104 PolarHBondContact O-N 2.83Å; D102-L104 PolarHBondContact O-N 2.86Å; L104-L106 HydrophobicContact CB-CD1 4.07Å; L104-L106 HydrophobicContact CB-CD2 3.84Å; L104-L106 HydrophobicContact CB-CG 3.56Å; L104-L106 HydrophobicContact CD1-CD1 4.08Å; L104-L106 HydrophobicContact CD1-CG 4.43Å; L104-L106 PolarHBondContact O-N 3.3Å; L104-I130 HydrophobicContact CD1-CB 4.26Å; L104-I130 HydrophobicContact CD1-CD1 4.19Å; L104-I130 HydrophobicContact CD1-CG2 3.53Å; L104-I130 HydrophobicContact CD2-CB 4.48Å; L104-I130 HydrophobicContact CD2-CG2 3.78Å; L104-I130 HydrophobicContact CG-CG2 4.3Å; L104-L134 HydrophobicContact CD2-CD1 3.64Å
105	E	79.6	Confident	83.6	Confident	194 Å²	194	62 Å²	62	91%	0.907	31%	0.312	S	S	*	.			trans	-69.6	56.3	173.9	-62.1	-178.3	163.4	0	0	111.7
106	L	78.1	Confident	83.5	Confident	23 Å²	23	63.4 Å²	63.4	12%	0.12	32%	0.319	C	S	.	.			trans	-76.5	156.8	-178.2	-57	-172.9	0	0	0	111.3	L104 I110 I114 L134 S156	L104-L106 HydrophobicContact CB-CD1 4.07Å; L104-L106 HydrophobicContact CB-CD2 3.84Å; L104-L106 HydrophobicContact CB-CG 3.56Å; L104-L106 HydrophobicContact CD1-CD1 4.08Å; L104-L106 HydrophobicContact CD1-CG 4.43Å; L104-L106 PolarHBondContact O-N 3.3Å; L106-I110 HydrophobicContact CD1-CG2 4.12Å; L106-I114 HydrophobicContact CD1-CD1 3.88Å; L106-L134 HydrophobicContact CD2-CD1 4.14Å; L106-L134 HydrophobicContact CD2-CD2 4.39Å; L106-S156 VanDerWaalsContact CD2-OG 3.29Å; L106-S156 WeakPolarHBondContact CD2-OG 3.39Å
107	H	77.5	Confident	83	Confident	35 Å²	35	58.5 Å²	58.5	16%	0.162	29%	0.287	C	S	.	.			trans	-60.4	139.6	173.5	-172.1	-90.1	0	0	0	110.8	W109 I110 M111 W159	H107-W109 VanDerWaalsContact C-N 3.27Å; H107-W109 AromaticContact CE1-CD2 3.41Å; H107-W109 VanDerWaalsContact CE1-CD2 3.41Å; H107-W109 AromaticContact CE1-CE2 3.94Å; H107-W109 AromaticContact CE1-CE3 3.56Å; H107-W109 AromaticContact CE1-CG 3.59Å; H107-W109 AromaticContact ND1-CD2 3.83Å; H107-W109 AromaticContact ND1-CE3 3.94Å; H107-W109 AromaticContact ND1-CG 3.66Å; H107-W109 PolarHBondContact ND1-N 3.29Å; H107-W109 PolarHBondContact O-N 2.99Å; H107-W109 VanDerWaalsContact O-N 3.11Å; H107-I110 HydrophobicContact CB-CD1 3.92Å; H107-I110 HydrophobicContact CB-CG1 4.31Å; H107-I110 WeakPolarHBondContact O-CB 3.23Å; H107-I110 PolarHBondContact O-N 3.2Å; H107-M111 PolarHBondContact O-N 3.49Å; H107-W159 HydrophobicContact CB-CG 4.32Å; H107-W159 AromaticContact CD2-CD2 3.67Å; H107-W159 AromaticContact CD2-CE2 3.39Å; H107-W159 AromaticContact CD2-CZ2 3.62Å; H107-W159 AromaticContact CD2-NE1 3.71Å; H107-W159 AromaticContact NE2-CE2 3.98Å; H107-W159 AromaticContact NE2-CH2 3.82Å; H107-W159 AromaticContact NE2-CZ2 3.71Å
108	P	82.5	Confident	82.7	Confident	84 Å²	84	62 Å²	62	55%	0.545	30%	0.298	S	S	.	.	H	α-helix	trans	-51.6	-40.4	-176.4	-30.9	35.7	0	0	0	114.5	I110 M111 D112	P108-I110 VanDerWaalsContact C-N 3.29Å; P108-I110 PolarHBondContact O-N 3.32Å; P108-M111 PolarHBondContact O-N 2.86Å; P108-D112 VanDerWaalsContact O-CG 3.29Å; P108-D112 PolarHBondContact O-N 2.81Å
109	W	81	Confident	82.2	Confident	97 Å²	97	64.4 Å²	64.4	37%	0.367	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-35.4	177.1	-62.8	-20.8	0	0	0	113.7	H107 N113 T206	H107-W109 VanDerWaalsContact C-N 3.27Å; H107-W109 AromaticContact CE1-CD2 3.41Å; H107-W109 VanDerWaalsContact CE1-CD2 3.41Å; H107-W109 AromaticContact CE1-CE2 3.94Å; H107-W109 AromaticContact CE1-CE3 3.56Å; H107-W109 AromaticContact CE1-CG 3.59Å; H107-W109 AromaticContact ND1-CD2 3.83Å; H107-W109 AromaticContact ND1-CE3 3.94Å; H107-W109 AromaticContact ND1-CG 3.66Å; H107-W109 PolarHBondContact ND1-N 3.29Å; H107-W109 PolarHBondContact O-N 2.99Å; H107-W109 VanDerWaalsContact O-N 3.11Å; W109-N113 WeakPolarHBondContact O-CB 3.44Å; W109-N113 PolarHBondContact O-N 3.21Å; W109-N113 PolarHBondContact O-ND2 3.32Å; W109-N113 PolarHBondContact O-OD1 3Å; W109-T206 HydrophobicContact CB-CG2 4.39Å; W109-T206 HydrophobicContact CE3-CG2 4.22Å
110	I	79.8	Confident	81.8	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.015	32%	0.319	C	S	.	.	H	α-helix	trans	-72.3	-42.3	178.5	-58.7	165.9	0	0	0	109.1	L106 H107 P108 D112 N113 I114 L152 G155	L106-I110 HydrophobicContact CD1-CG2 4.12Å; H107-I110 HydrophobicContact CB-CD1 3.92Å; H107-I110 HydrophobicContact CB-CG1 4.31Å; H107-I110 WeakPolarHBondContact O-CB 3.23Å; H107-I110 PolarHBondContact O-N 3.2Å; P108-I110 VanDerWaalsContact C-N 3.29Å; P108-I110 PolarHBondContact O-N 3.32Å; I110-D112 VanDerWaalsContact C-N 3.32Å; I110-D112 PolarHBondContact O-N 3.35Å; I110-N113 CarbonylContact O-C 3.59Å; I110-N113 PolarHBondContact O-N 3Å; I110-N113 VanDerWaalsContact O-N 3.13Å; I110-I114 HydrophobicContact CG2-CD1 4.4Å; I110-I114 WeakPolarHBondContact O-CG1 3.35Å; I110-I114 PolarHBondContact O-N 3.1Å; I110-L152 HydrophobicContact CG2-CD2 3.77Å; I110-G155 VanDerWaalsContact CD1-O 3.24Å; I110-G155 WeakPolarHBondContact CD1-O 3.44Å
111	M	82.8	Confident	81.4	Confident	24 Å²	24	64 Å²	64	12%	0.118	31%	0.31	C	S	.	.	H	α-helix	trans	-61.8	-40.9	175.7	-170.9	60.3	83.2	0	0	111.8	F101 H107 P108 N113 I114 K115	F101-M111 HydrophobicContact CB-CE 4.39Å; F101-M111 HydrophobicContact CB-SD 4.35Å; F101-M111 WeakPolarHBondContact O-CE 3.48Å; H107-M111 PolarHBondContact O-N 3.49Å; P108-M111 PolarHBondContact O-N 2.86Å; M111-N113 VanDerWaalsContact C-N 3.33Å; M111-N113 PolarHBondContact O-N 3.4Å; M111-I114 WeakPolarHBondContact O-CB 3.41Å; M111-I114 PolarHBondContact O-N 2.9Å; M111-I114 HydrophobicContact SD-CD1 4.2Å; M111-K115 WeakPolarHBondContact O-CG 3.34Å; M111-K115 PolarHBondContact O-N 2.78Å; M111-K115 VanDerWaalsContact O-N 3.08Å
112	D	85.6	Confident	81.3	Confident	62 Å²	62	63.8 Å²	63.8	33%	0.332	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-41.7	172.9	-70.2	-16.9	0	0	0	111.1	P108 I110 K115 L116	P108-D112 VanDerWaalsContact O-CG 3.29Å; P108-D112 PolarHBondContact O-N 2.81Å; I110-D112 VanDerWaalsContact C-N 3.32Å; I110-D112 PolarHBondContact O-N 3.35Å; D112-K115 WeakPolarHBondContact O-CB 3.49Å; D112-K115 PolarHBondContact O-N 3.35Å; D112-L116 VanDerWaalsContact O-CG 3.32Å; D112-L116 WeakPolarHBondContact O-CG 3.41Å; D112-L116 PolarHBondContact O-N 3.22Å
113	N	83.2	Confident	80.9	Confident	1 Å²	1	59.4 Å²	59.4	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-66.7	-36.3	177.1	-66.9	-19.7	0	0	0	112.6	W109 I110 M111 K115 L116 C117 K201 F202 Y204	W109-N113 WeakPolarHBondContact O-CB 3.44Å; W109-N113 PolarHBondContact O-N 3.21Å; W109-N113 PolarHBondContact O-ND2 3.32Å; W109-N113 PolarHBondContact O-OD1 3Å; I110-N113 CarbonylContact O-C 3.59Å; I110-N113 PolarHBondContact O-N 3Å; I110-N113 VanDerWaalsContact O-N 3.13Å; M111-N113 VanDerWaalsContact C-N 3.33Å; M111-N113 PolarHBondContact O-N 3.4Å; N113-K115 VanDerWaalsContact C-N 3.32Å; N113-L116 PolarHBondContact O-N 3.13Å; N113-C117 PolarHBondContact O-N 3.07Å; N113-C117 PolarHBondContact O-SG 3.07Å; N113-C117 VanDerWaalsContact O-SG 3.35Å; N113-K201 PolarHBondContact ND2-O 2.82Å; N113-F202 HydrophobicContact CB-CD1 4.48Å; N113-F202 PolarHBondContact ND2-O 3.27Å; N113-Y204 PolarHBondContact ND2-O 2.96Å
114	I	82.7	Confident	80.7	Confident	3 Å²	3	55.1 Å²	55.1	2%	0.015	27%	0.268	C	S	.	.	H	α-helix	trans	-58.3	-46.8	171.1	-70.6	168.2	0	0	0	110.1	F101 L106 I110 M111 L116 C117 H118 Y119 L152 F202	F101-I114 HydrophobicContact CB-CD1 4.35Å; F101-I114 HydrophobicContact CD1-CD1 4.2Å; F101-I114 HydrophobicContact CD2-CG2 3.88Å; F101-I114 HydrophobicContact CE2-CG2 4.24Å; F101-I114 HydrophobicContact CG-CD1 4.3Å; F101-I114 HydrophobicContact CG-CG2 4.14Å; L106-I114 HydrophobicContact CD1-CD1 3.88Å; I110-I114 HydrophobicContact CG2-CD1 4.4Å; I110-I114 WeakPolarHBondContact O-CG1 3.35Å; I110-I114 PolarHBondContact O-N 3.1Å; M111-I114 WeakPolarHBondContact O-CB 3.41Å; M111-I114 PolarHBondContact O-N 2.9Å; M111-I114 HydrophobicContact SD-CD1 4.2Å; I114-L116 PolarHBondContact O-N 3.48Å; I114-C117 WeakPolarHBondContact O-CB 3.26Å; I114-C117 PolarHBondContact O-N 2.81Å; I114-C117 VanDerWaalsContact O-N 3.17Å; I114-H118 PolarHBondContact O-N 3.15Å; I114-Y119 PolarHBondContact O-N 3.49Å; I114-L152 HydrophobicContact CD1-CD1 4.19Å; I114-L152 HydrophobicContact CD1-CD2 3.59Å; I114-L152 HydrophobicContact CG1-CD1 4.29Å; I114-L152 HydrophobicContact CG1-CD2 3.46Å; I114-L152 VanDerWaalsContact CG1-CD2 3.46Å; I114-L152 HydrophobicContact CG1-CG 4.49Å; I114-F202 HydrophobicContact CG1-CD1 4.48Å; I114-F202 HydrophobicContact CG1-CE1 4.04Å
115	K	84.9	Confident	81	Confident	124 Å²	124	54.8 Å²	54.8	54%	0.539	27%	0.266	S	S	.	.	H	α-helix	trans	-64.2	-39.6	178.1	-69.4	172.1	-177.8	175	0	111.9	M111 D112 N113 C117 H118	M111-K115 WeakPolarHBondContact O-CG 3.34Å; M111-K115 PolarHBondContact O-N 2.78Å; M111-K115 VanDerWaalsContact O-N 3.08Å; D112-K115 WeakPolarHBondContact O-CB 3.49Å; D112-K115 PolarHBondContact O-N 3.35Å; N113-K115 VanDerWaalsContact C-N 3.32Å; K115-C117 VanDerWaalsContact C-N 3.28Å; K115-C117 PolarHBondContact O-N 2.98Å; K115-H118 PolarHBondContact O-N 3.05Å
116	L	85.1	Confident	81.1	Confident	54 Å²	54	46.3 Å²	46.3	28%	0.283	23%	0.227	S	C	.	.	H	α-helix	trans	-65.1	-30.2	174.5	-71.4	173	0	0	0	112.6	F70 D112 N113 I114 H118 Y204	F70-L116 HydrophobicContact CD1-CB 3.7Å; F70-L116 HydrophobicContact CD2-CB 4.28Å; F70-L116 HydrophobicContact CE1-CB 3.64Å; F70-L116 HydrophobicContact CE2-CB 4.25Å; F70-L116 HydrophobicContact CE2-CD1 4.06Å; F70-L116 HydrophobicContact CG-CB 4.03Å; F70-L116 HydrophobicContact CZ-CB 3.93Å; F70-L116 HydrophobicContact CZ-CD1 4.04Å; D112-L116 VanDerWaalsContact O-CG 3.32Å; D112-L116 WeakPolarHBondContact O-CG 3.41Å; D112-L116 PolarHBondContact O-N 3.22Å; N113-L116 PolarHBondContact O-N 3.13Å; I114-L116 PolarHBondContact O-N 3.48Å; L116-H118 PolarHBondContact O-N 3.22Å; L116-Y204 HydrophobicContact CD1-CD1 4.21Å; L116-Y204 HydrophobicContact CD1-CE1 4.27Å
117	C	79.3	Confident	81.5	Confident	10 Å²	10	46 Å²	46	7%	0.068	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-7.7	172.3	-71.5	0	0	0	0	113.8	F70 N113 I114 K115 Y119	F70-C117 HydrophobicContact CD1-CB 4.4Å; F70-C117 VanDerWaalsContact CD1-SG 3.54Å; F70-C117 WeakPolarHBondContact CE1-SG 3.35Å; N113-C117 PolarHBondContact O-N 3.07Å; N113-C117 PolarHBondContact O-SG 3.07Å; N113-C117 VanDerWaalsContact O-SG 3.35Å; I114-C117 WeakPolarHBondContact O-CB 3.26Å; I114-C117 PolarHBondContact O-N 2.81Å; I114-C117 VanDerWaalsContact O-N 3.17Å; K115-C117 VanDerWaalsContact C-N 3.28Å; K115-C117 PolarHBondContact O-N 2.98Å; C117-Y119 VanDerWaalsContact C-N 3.3Å; C117-Y119 HydrophobicContact CB-CD1 4.18Å; C117-Y119 HydrophobicContact CB-CD2 3.5Å; C117-Y119 HydrophobicContact CB-CE1 4.12Å; C117-Y119 HydrophobicContact CB-CE2 3.4Å; C117-Y119 VanDerWaalsContact CB-CE2 3.4Å; C117-Y119 HydrophobicContact CB-CG 3.9Å; C117-Y119 PolarHBondContact O-N 2.98Å
118	H	81.2	Confident	82	Confident	121 Å²	121	46.2 Å²	46.2	56%	0.56	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.9	38.4	-173.3	-55	-72.4	0	0	0	113.4	I114 K115 L116	I114-H118 PolarHBondContact O-N 3.15Å; K115-H118 PolarHBondContact O-N 3.05Å; L116-H118 PolarHBondContact O-N 3.22Å
119	Y	77.6	Confident	82.1	Confident	62 Å²	62	42.6 Å²	42.6	24%	0.243	20%	0.202	C	C	.	.			trans	-90.2	105.1	173.2	-61.8	-28.7	0	0	0	110.4	I114 C117 E198 F202	I114-Y119 PolarHBondContact O-N 3.49Å; C117-Y119 VanDerWaalsContact C-N 3.3Å; C117-Y119 HydrophobicContact CB-CD1 4.18Å; C117-Y119 HydrophobicContact CB-CD2 3.5Å; C117-Y119 HydrophobicContact CB-CE1 4.12Å; C117-Y119 HydrophobicContact CB-CE2 3.4Å; C117-Y119 VanDerWaalsContact CB-CE2 3.4Å; C117-Y119 HydrophobicContact CB-CG 3.9Å; C117-Y119 PolarHBondContact O-N 2.98Å; Y119-E198 PolarHBondContact OH-OE2 3.1Å; Y119-F202 HydrophobicContact CD2-CE1 4.31Å; Y119-F202 HydrophobicContact CD2-CZ 4.07Å; Y119-F202 HydrophobicContact CE2-CE1 4.14Å; Y119-F202 HydrophobicContact CE2-CE2 4.48Å; Y119-F202 AromaticContact CE2-CZ 3.56Å; Y119-F202 HydrophobicContact CE2-CZ 3.56Å
120	D	78.4	Confident	82.3	Confident	132 Å²	132	38.5 Å²	38.5	71%	0.706	19%	0.187	S	C	*	.			trans	-80.8	-45.4	-176.5	-63.8	-37.6	0	0	0	112.9
121	K	79.5	Confident	82.6	Confident	84 Å²	84	39.1 Å²	39.1	37%	0.365	19%	0.191	S	C	.	.	S	Bend	trans	-133.4	145.6	-177.4	-66	-179.3	179.7	178.8	0	111.4	F79 D80 E83 F101	F79-K121 HydrophobicContact CE1-CB 4.35Å; D80-K121 IonicContact OD1-NZ 2.67Å; E83-K121 WeakPolarHBondContact OE1-CD 3.49Å; E83-K121 IonicContact OE1-NZ 3.32Å; E83-K121 PolarHBondContact OE1-NZ 3.38Å; F101-K121 VanDerWaalsContact CE2-C 3.44Å
122	P	80.8	Confident	82.9	Confident	2 Å²	2	38 Å²	38	1%	0.013	19%	0.186	C	C	.	.			trans	-67.7	141.9	172.7	27.3	-33.9	0	0	0	112	I98 Q99 F101 Q126 K127	I98-P122 HydrophobicContact CD1-CB 4.46Å; I98-P122 HydrophobicContact CD1-CG 4.26Å; I98-P122 HydrophobicContact CG1-CG 4.4Å; Q99-P122 VanDerWaalsContact O-CD 3.27Å; Q99-P122 WeakPolarHBondContact O-CD 3.37Å; Q99-P122 WeakPolarHBondContact O-CG 3.32Å; F101-P122 HydrophobicContact CD1-CB 4.4Å; F101-P122 HydrophobicContact CE1-CB 3.82Å; F101-P122 HydrophobicContact CE2-CB 4.36Å; F101-P122 VanDerWaalsContact CZ-CA 3.5Å; F101-P122 HydrophobicContact CZ-CB 3.8Å; P122-Q126 VanDerWaalsContact CA-OE1 3.3Å; P122-Q126 HydrophobicContact CB-CB 3.86Å; P122-K127 HydrophobicContact CB-CG 4Å; P122-K127 HydrophobicContact CG-CG 3.76Å; P122-K127 WeakPolarHBondContact O-CE 3.4Å
123	T	77.7	Confident	82.8	Confident	22 Å²	22	35.2 Å²	35.2	14%	0.135	17%	0.171	C	C	.	.			trans	-68.3	161.2	170.9	72.1	0	0	0	0	111	F79 V125 Q126 K127	F79-T123 HydrophobicContact CE2-CG2 4.24Å; F79-T123 HydrophobicContact CZ-CG2 3.81Å; T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 2.9Å; T123-Q126 VanDerWaalsContact CG2-NE2 3.25Å; T123-Q126 VanDerWaalsContact N-OE1 3.09Å; T123-Q126 WeakPolarHBondContact O-CA 3.28Å; T123-Q126 WeakPolarHBondContact O-CB 3.35Å; T123-Q126 PolarHBondContact O-N 3.36Å; T123-Q126 VanDerWaalsContact OG1-CG 3.26Å; T123-Q126 WeakPolarHBondContact OG1-CG 3.38Å; T123-Q126 PolarHBondContact OG1-NE2 3.31Å; T123-K127 WeakPolarHBondContact O-CG 3.34Å; T123-K127 PolarHBondContact O-N 3.46Å
124	P	80.8	Confident	82.8	Confident	12 Å²	12	37.5 Å²	37.5	8%	0.078	18%	0.183	C	C	.	.	H	α-helix	trans	-51.6	-43.8	-179.1	-28.1	35	0	0	0	113.6	Y82 V87 Q126 K127 F128 V304	Y82-P124 WeakPolarHBondContact O-CG 3.33Å; V87-P124 HydrophobicContact CG2-CB 3.75Å; P124-Q126 VanDerWaalsContact C-N 3.33Å; P124-Q126 PolarHBondContact O-N 2.84Å; P124-K127 PolarHBondContact O-N 2.9Å; P124-F128 WeakPolarHBondContact O-CD2 3.44Å; P124-V304 HydrophobicContact CB-CG1 4.34Å
125	V	82.3	Confident	82.9	Confident	2 Å²	2	40 Å²	40	1%	0.012	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-43.9	175.3	-177.2	0	0	0	0	111.2	T123 K127 F128 A129 A143 P147 L302 V304	T123-V125 VanDerWaalsContact C-N 3.28Å; T123-V125 PolarHBondContact O-N 2.9Å; V125-K127 VanDerWaalsContact C-N 3.35Å; V125-K127 PolarHBondContact O-N 2.93Å; V125-F128 PolarHBondContact O-N 3.38Å; V125-A129 HydrophobicContact CG1-CB 4.33Å; V125-A129 WeakPolarHBondContact O-CB 3.35Å; V125-A129 PolarHBondContact O-N 2.84Å; V125-A143 HydrophobicContact CG2-CB 3.5Å; V125-P147 HydrophobicContact CB-CB 4.42Å; V125-P147 HydrophobicContact CG1-CB 3.9Å; V125-P147 HydrophobicContact CG1-CG 4.2Å; V125-L302 HydrophobicContact CG1-CD2 4.19Å; V125-V304 HydrophobicContact CB-CG2 4.37Å; V125-V304 HydrophobicContact CG2-CB 4.11Å; V125-V304 HydrophobicContact CG2-CG1 4.1Å; V125-V304 HydrophobicContact CG2-CG2 3.63Å
126	Q	82.8	Confident	82.9	Confident	16 Å²	16	36 Å²	36	8%	0.075	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-35.4	-177	-64.8	164	25.2	0	0	112.5	P122 T123 P124 F128 I130 P149	P122-Q126 VanDerWaalsContact CA-OE1 3.3Å; P122-Q126 HydrophobicContact CB-CB 3.86Å; T123-Q126 VanDerWaalsContact CG2-NE2 3.25Å; T123-Q126 VanDerWaalsContact N-OE1 3.09Å; T123-Q126 WeakPolarHBondContact O-CA 3.28Å; T123-Q126 WeakPolarHBondContact O-CB 3.35Å; T123-Q126 PolarHBondContact O-N 3.36Å; T123-Q126 VanDerWaalsContact OG1-CG 3.26Å; T123-Q126 WeakPolarHBondContact OG1-CG 3.38Å; T123-Q126 PolarHBondContact OG1-NE2 3.31Å; P124-Q126 VanDerWaalsContact C-N 3.33Å; P124-Q126 PolarHBondContact O-N 2.84Å; Q126-F128 PolarHBondContact O-N 3.44Å; Q126-I130 HydrophobicContact CB-CD1 3.87Å; Q126-I130 HydrophobicContact CB-CG1 4.32Å; Q126-I130 HydrophobicContact CG-CD1 4.45Å; Q126-I130 WeakPolarHBondContact O-CB 3.47Å; Q126-I130 WeakPolarHBondContact O-CG1 3.31Å; Q126-I130 PolarHBondContact O-N 3.35Å; Q126-I130 VanDerWaalsContact O-N 3.1Å; Q126-P149 HydrophobicContact CG-CG 3.59Å
127	K	86	Confident	83.1	Confident	16 Å²	16	35.1 Å²	35.1	7%	0.07	19%	0.191	C	C	.	.	H	α-helix	trans	-55.7	-33.4	178.5	-70.1	-173.8	-178.6	-174.2	0	112.5	C97 I98 P122 T123 P124 V125 P131	C97-K127 VanDerWaalsContact CA-O 3.24Å; C97-K127 WeakPolarHBondContact CA-O 3.37Å; C97-K127 HydrophobicContact CB-CB 4.4Å; I98-K127 HydrophobicContact CG1-CB 4.46Å; I98-K127 PolarHBondContact N-O 2.82Å; I98-K127 WeakPolarHBondContact O-CB 3.27Å; I98-K127 WeakPolarHBondContact O-CD 3.31Å; I98-K127 WeakPolarHBondContact O-CG 3.25Å; P122-K127 HydrophobicContact CB-CG 4Å; P122-K127 HydrophobicContact CG-CG 3.76Å; P122-K127 WeakPolarHBondContact O-CE 3.4Å; T123-K127 WeakPolarHBondContact O-CG 3.34Å; T123-K127 PolarHBondContact O-N 3.46Å; P124-K127 PolarHBondContact O-N 2.9Å; V125-K127 VanDerWaalsContact C-N 3.35Å; V125-K127 PolarHBondContact O-N 2.93Å; K127-P131 WeakPolarHBondContact O-CD 3.34Å; K127-P131 WeakPolarHBondContact O-CG 3.24Å
128	F	87.5	Confident	83.7	Confident	39 Å²	39	35 Å²	35	17%	0.171	19%	0.19	C	C	.	.	H	α-helix	trans	-101.6	-43.4	178.7	-66.2	-98	0	0	0	112.1	V87 A89 C97 P124 V125 Q126 I130 P131 T132 L302	V87-F128 HydrophobicContact CB-CD2 4.1Å; V87-F128 HydrophobicContact CB-CE2 3.58Å; V87-F128 HydrophobicContact CB-CZ 4.01Å; V87-F128 HydrophobicContact CG1-CD1 4.39Å; V87-F128 HydrophobicContact CG1-CD2 3.45Å; V87-F128 VanDerWaalsContact CG1-CD2 3.45Å; V87-F128 HydrophobicContact CG1-CE1 4.34Å; V87-F128 HydrophobicContact CG1-CE2 3.41Å; V87-F128 VanDerWaalsContact CG1-CE2 3.41Å; V87-F128 HydrophobicContact CG1-CG 3.96Å; V87-F128 HydrophobicContact CG1-CZ 3.88Å; V87-F128 HydrophobicContact CG2-CD2 4.49Å; V87-F128 HydrophobicContact CG2-CE2 4.1Å; A89-F128 HydrophobicContact CB-CD1 3.84Å; A89-F128 HydrophobicContact CB-CE1 4.24Å; C97-F128 HydrophobicContact CB-CD1 3.82Å; C97-F128 HydrophobicContact CB-CD2 4.11Å; C97-F128 HydrophobicContact CB-CE1 3.66Å; C97-F128 HydrophobicContact CB-CE2 3.95Å; C97-F128 HydrophobicContact CB-CG 4.05Å; C97-F128 HydrophobicContact CB-CZ 3.73Å; P124-F128 WeakPolarHBondContact O-CD2 3.44Å; V125-F128 PolarHBondContact O-N 3.38Å; Q126-F128 PolarHBondContact O-N 3.44Å; F128-I130 PolarHBondContact O-N 3.42Å; F128-P131 VanDerWaalsContact O-CD 3.26Å; F128-P131 WeakPolarHBondContact O-CD 3.16Å; F128-P131 VanDerWaalsContact O-CG 3.3Å; F128-P131 WeakPolarHBondContact O-CG 3.45Å; F128-T132 WeakPolarHBondContact O-CB 3.39Å; F128-T132 PolarHBondContact O-N 2.76Å; F128-T132 VanDerWaalsContact O-N 3.15Å; F128-T132 PolarHBondContact O-OG1 3.27Å; F128-L302 HydrophobicContact CB-CD1 3.47Å; F128-L302 VanDerWaalsContact CB-CD1 3.47Å; F128-L302 HydrophobicContact CB-CD2 3.9Å; F128-L302 HydrophobicContact CB-CG 4.36Å; F128-L302 HydrophobicContact CD1-CD1 4.17Å; F128-L302 HydrophobicContact CD2-CD1 4.32Å; F128-L302 HydrophobicContact CG-CD1 3.75Å
129	A	85.8	Confident	84.2	Confident	8 Å²	8	29.3 Å²	29.3	7%	0.066	16%	0.163	C	C	.	.	H	α-helix	trans	-62.8	-46	-175.1	0	0	0	0	0	112.2	V125 T132 A133 L139 L302	V125-A129 HydrophobicContact CG1-CB 4.33Å; V125-A129 WeakPolarHBondContact O-CB 3.35Å; V125-A129 PolarHBondContact O-N 2.84Å; A129-T132 PolarHBondContact O-N 2.82Å; A129-A133 WeakPolarHBondContact O-CB 3.38Å; A129-A133 PolarHBondContact O-N 3.44Å; A129-L139 HydrophobicContact CB-CD2 3.64Å; A129-L302 HydrophobicContact CB-CD2 4.41Å
130	I	84.2	Confident	84.9	Confident	12 Å²	12	26.3 Å²	26.3	6%	0.062	15%	0.151	C	C	.	.	H	α-helix	trans	-62.1	-50.2	-177	-57.2	171.7	0	0	0	112.3	F101 L104 Q126 F128 A133 L134 L152	F101-I130 HydrophobicContact CE1-CD1 4.09Å; L104-I130 HydrophobicContact CD1-CB 4.26Å; L104-I130 HydrophobicContact CD1-CD1 4.19Å; L104-I130 HydrophobicContact CD1-CG2 3.53Å; L104-I130 HydrophobicContact CD2-CB 4.48Å; L104-I130 HydrophobicContact CD2-CG2 3.78Å; L104-I130 HydrophobicContact CG-CG2 4.3Å; Q126-I130 HydrophobicContact CB-CD1 3.87Å; Q126-I130 HydrophobicContact CB-CG1 4.32Å; Q126-I130 HydrophobicContact CG-CD1 4.45Å; Q126-I130 WeakPolarHBondContact O-CB 3.47Å; Q126-I130 WeakPolarHBondContact O-CG1 3.31Å; Q126-I130 PolarHBondContact O-N 3.35Å; Q126-I130 VanDerWaalsContact O-N 3.1Å; F128-I130 PolarHBondContact O-N 3.42Å; I130-A133 PolarHBondContact O-N 2.9Å; I130-L134 HydrophobicContact CG2-CD1 4.29Å; I130-L134 HydrophobicContact CG2-CG 4.38Å; I130-L134 WeakPolarHBondContact O-CG 3.39Å; I130-L134 PolarHBondContact O-N 3.32Å; I130-L152 HydrophobicContact CD1-CD1 4.13Å
131	P	86.7	Confident	85.4	Confident	15 Å²	15	20.1 Å²	20.1	10%	0.097	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-39	177.7	23	-32.3	0	0	0	113.3	P95 P96 I98 K127 F128 A133 L134 A135	P95-P131 HydrophobicContact CB-CB 4.28Å; P96-P131 WeakPolarHBondContact O-CG 3.48Å; I98-P131 HydrophobicContact CG2-CB 4.49Å; I98-P131 HydrophobicContact CG2-CG 4.34Å; K127-P131 WeakPolarHBondContact O-CD 3.34Å; K127-P131 WeakPolarHBondContact O-CG 3.24Å; F128-P131 VanDerWaalsContact O-CD 3.26Å; F128-P131 WeakPolarHBondContact O-CD 3.16Å; F128-P131 VanDerWaalsContact O-CG 3.3Å; F128-P131 WeakPolarHBondContact O-CG 3.45Å; P131-A133 PolarHBondContact O-N 3.49Å; P131-L134 PolarHBondContact O-N 3.5Å; P131-A135 WeakPolarHBondContact O-CB 3.43Å; P131-A135 PolarHBondContact O-N 3.43Å
132	T	88	Confident	85.7	Confident	2 Å²	2	16.1 Å²	16.1	1%	0.012	10%	0.101	C	C	.	.	H	α-helix	trans	-54.2	-43.8	171.9	-63.5	0	0	0	0	111.3	F128 A129 A135 R137 L139 V300	F128-T132 WeakPolarHBondContact O-CB 3.39Å; F128-T132 PolarHBondContact O-N 2.76Å; F128-T132 VanDerWaalsContact O-N 3.15Å; F128-T132 PolarHBondContact O-OG1 3.27Å; A129-T132 PolarHBondContact O-N 2.82Å; T132-A135 PolarHBondContact O-N 3.27Å; T132-R137 HydrophobicContact CG2-CB 4Å; T132-R137 PolarHBondContact O-N 2.93Å; T132-L139 HydrophobicContact CG2-CB 4.28Å; T132-L139 HydrophobicContact CG2-CD1 4.27Å; T132-V300 HydrophobicContact CG2-CB 3.76Å; T132-V300 HydrophobicContact CG2-CG1 4.29Å; T132-V300 HydrophobicContact CG2-CG2 3.68Å
133	A	84.1	Confident	85.3	Confident	2 Å²	2	16.6 Å²	16.6	2%	0.017	11%	0.105	C	C	.	.	H	α-helix	trans	-72.8	-41.3	-175.1	0	0	0	0	0	111	A129 I130 P131 A135 G136 F153 Q275 M277	A129-A133 WeakPolarHBondContact O-CB 3.38Å; A129-A133 PolarHBondContact O-N 3.44Å; I130-A133 PolarHBondContact O-N 2.9Å; P131-A133 PolarHBondContact O-N 3.49Å; A133-A135 PolarHBondContact O-N 2.94Å; A133-G136 PolarHBondContact O-N 3.48Å; A133-F153 VanDerWaalsContact CA-CE2 3.48Å; A133-F153 HydrophobicContact CB-CD2 3.3Å; A133-F153 HydrophobicContact CB-CE1 4.23Å; A133-F153 HydrophobicContact CB-CE2 2.9Å; A133-F153 HydrophobicContact CB-CG 4.17Å; A133-F153 HydrophobicContact CB-CZ 3.42Å; A133-F153 VanDerWaalsContact CB-CZ 3.42Å; A133-F153 WeakPolarHBondContact O-CE2 3.45Å; A133-F153 WeakPolarHBondContact O-CZ 3.18Å; A133-Q275 PolarHBondContact O-NE2 3.4Å; A133-M277 VanDerWaalsContact CA-CE 3.45Å; A133-M277 HydrophobicContact CB-CE 3.19Å; A133-M277 HydrophobicContact CB-SD 3.81Å
134	L	83	Confident	84.6	Confident	49 Å²	49	18.9 Å²	18.9	26%	0.257	12%	0.116	S	C	.	.	H	α-helix	trans	-63.1	-28.9	172.9	-73.2	179.5	0	0	0	113.3	L104 L106 I130 P131 G136 V157	L104-L134 HydrophobicContact CD2-CD1 3.64Å; L106-L134 HydrophobicContact CD2-CD1 4.14Å; L106-L134 HydrophobicContact CD2-CD2 4.39Å; I130-L134 HydrophobicContact CG2-CD1 4.29Å; I130-L134 HydrophobicContact CG2-CG 4.38Å; I130-L134 WeakPolarHBondContact O-CG 3.39Å; I130-L134 PolarHBondContact O-N 3.32Å; P131-L134 PolarHBondContact O-N 3.5Å; L134-G136 PolarHBondContact O-N 3.11Å; L134-V157 HydrophobicContact CD2-CG2 3.84Å
135	A	85.6	Confident	83.6	Confident	57 Å²	57	21.1 Å²	21.1	47%	0.471	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-2.8	174.2	0	0	0	0	0	113.4	P95 P131 T132 A133 R137	P95-A135 HydrophobicContact CG-CB 3.6Å; P131-A135 WeakPolarHBondContact O-CB 3.43Å; P131-A135 PolarHBondContact O-N 3.43Å; T132-A135 PolarHBondContact O-N 3.27Å; A133-A135 PolarHBondContact O-N 2.94Å; A135-R137 VanDerWaalsContact C-N 3.32Å; A135-R137 HydrophobicContact CB-CG 4.15Å
136	G	84.7	Confident	82.3	Confident	38 Å²	38	23 Å²	23	39%	0.392	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	18.5	179.6	0	0	0	0	0	114.1	A133 L134 Q275	A133-G136 PolarHBondContact O-N 3.48Å; L134-G136 PolarHBondContact O-N 3.11Å; G136-Q275 VanDerWaalsContact C-NE2 3.25Å
137	R	89.2	Confident	80.9	Confident	37 Å²	37	23.1 Å²	23.1	14%	0.14	14%	0.136	C	C	.	.			trans	-92.1	146.4	-178.9	-58	-66.9	-65.4	-65.2	-0.9	111.5	Q92 D93 T132 A135 Q275 M277 D298 V300	Q92-R137 VanDerWaalsContact O-CZ 3.26Å; Q92-R137 PolarHBondContact O-NH1 3.36Å; Q92-R137 PolarHBondContact O-NH2 2.97Å; D93-R137 PolarHBondContact O-NH1 2.87Å; T132-R137 HydrophobicContact CG2-CB 4Å; T132-R137 PolarHBondContact O-N 2.93Å; A135-R137 VanDerWaalsContact C-N 3.32Å; A135-R137 HydrophobicContact CB-CG 4.15Å; R137-Q275 PolarHBondContact O-NE2 3.25Å; R137-M277 WeakPolarHBondContact O-CE 3.18Å; R137-D298 IonicContact CZ-OD2 2.79Å; R137-D298 IonicContact NE-OD2 3.48Å; R137-D298 PolarHBondContact NE-OD2 3.39Å; R137-D298 VanDerWaalsContact NE-OD2 3.17Å; R137-D298 PolarHBondContact NH2-O 3.33Å; R137-D298 IonicContact NH2-OD2 3.95Å; R137-D298 PolarHBondContact NH2-OD2 2.88Å; R137-V300 HydrophobicContact CB-CG2 4.48Å
138	D	92.4	Very high	79.3	Confident	8 Å²	8	26 Å²	26	4%	0.043	15%	0.149	C	C	.	.			trans	-68.4	146.9	170.1	-82.1	10.8	0	0	0	110.6	Q275 T276 L295 V296 Y299 V300	D138-Q275 WeakPolarHBondContact OD1-CA 3.34Å; D138-T276 VanDerWaalsContact CA-O 3.31Å; D138-T276 WeakPolarHBondContact CA-O 3.43Å; D138-T276 WeakPolarHBondContact CB-O 3.35Å; D138-T276 PolarHBondContact OD1-N 3.04Å; D138-L295 HydrophobicContact CB-CB 4.29Å; D138-L295 HydrophobicContact CB-CD2 4.2Å; D138-L295 VanDerWaalsContact OD2-CA 3.3Å; D138-L295 WeakPolarHBondContact OD2-CA 3.3Å; D138-V296 PolarHBondContact OD2-N 2.99Å; D138-Y299 CarbonylContact O-C 3.55Å; D138-Y299 WeakPolarHBondContact O-CA 3.39Å; D138-V300 PolarHBondContact O-N 3.41Å
139	L	90.8	Very high	77.5	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	129.8	-174.4	175.3	66.7	0	0	0	111	A129 T132 A141 T276 M277 M278 F279 V300 L302	A129-L139 HydrophobicContact CB-CD2 3.64Å; T132-L139 HydrophobicContact CG2-CB 4.28Å; T132-L139 HydrophobicContact CG2-CD1 4.27Å; L139-A141 HydrophobicContact CD1-CB 4.43Å; L139-A141 HydrophobicContact CD2-CB 4.33Å; L139-A141 HydrophobicContact CG-CB 4.23Å; L139-T276 PolarHBondContact N-O 3.22Å; L139-M277 HydrophobicContact CB-CB 4.44Å; L139-M277 HydrophobicContact CB-CE 4.38Å; L139-M277 HydrophobicContact CB-CG 4.02Å; L139-M277 HydrophobicContact CB-SD 4.17Å; L139-M277 HydrophobicContact CD2-SD 4.24Å; L139-M277 CarbonylContact O-C 3.52Å; L139-M277 VanDerWaalsContact O-CA 3.3Å; L139-M277 WeakPolarHBondContact O-CA 3.49Å; L139-M278 PolarHBondContact O-N 2.93Å; L139-F279 HydrophobicContact CD2-CE1 4.3Å; L139-F279 HydrophobicContact CD2-CZ 3.95Å; L139-V300 WeakPolarHBondContact CA-O 3.47Å; L139-V300 HydrophobicContact CD1-CB 4.31Å; L139-V300 HydrophobicContact CD1-CG1 4.3Å; L139-L302 HydrophobicContact CD1-CB 3.89Å
140	M	92.1	Very high	75.8	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	114.1	161.3	178.2	65.9	-148.4	0	0	108	M278 F283 I287 A291 L295 Y299 V300 F301 L302	M140-M278 HydrophobicContact SD-CB 3.47Å; M140-M278 WeakPolarHBondContact SD-CB 3.49Å; M140-M278 HydrophobicContact SD-CE 4.17Å; M140-F283 HydrophobicContact CE-CD2 3.57Å; M140-F283 HydrophobicContact CE-CE2 3.56Å; M140-F283 HydrophobicContact CG-CD2 4.42Å; M140-F283 HydrophobicContact CG-CE2 3.63Å; M140-F283 HydrophobicContact CG-CZ 4.15Å; M140-F283 HydrophobicContact SD-CD2 4.47Å; M140-F283 HydrophobicContact SD-CE2 3.85Å; M140-I287 HydrophobicContact CE-CG2 3.79Å; M140-I287 HydrophobicContact SD-CG2 4.49Å; M140-A291 HydrophobicContact SD-CB 4.2Å; M140-L295 HydrophobicContact CB-CD1 3.8Å; M140-Y299 HydrophobicContact CB-CD2 3.78Å; M140-Y299 HydrophobicContact CB-CE2 3.66Å; M140-Y299 HydrophobicContact CG-CE2 4.49Å; M140-V300 PolarHBondContact N-O 2.86Å; M140-F301 HydrophobicContact CB-CD2 4.03Å; M140-F301 HydrophobicContact CG-CD2 3.73Å; M140-F301 HydrophobicContact CG-CE2 4.04Å; M140-F301 CarbonylContact O-C 3.48Å; M140-F301 WeakPolarHBondContact O-CA 3.33Å; M140-L302 PolarHBondContact O-N 2.75Å
141	A	88.7	Confident	74.1	Confident	1 Å²	1	25.4 Å²	25.4	1%	0.008	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	121.9	-180	0	0	0	0	0	111.2	L139 M278 F279 S280 L302	L139-A141 HydrophobicContact CD1-CB 4.43Å; L139-A141 HydrophobicContact CD2-CB 4.33Å; L139-A141 HydrophobicContact CG-CB 4.23Å; A141-M278 PolarHBondContact N-O 3.46Å; A141-F279 HydrophobicContact CB-CD1 3.6Å; A141-F279 HydrophobicContact CB-CE1 3.56Å; A141-F279 HydrophobicContact CB-CZ 4.46Å; A141-F279 WeakPolarHBondContact O-CA 3.41Å; A141-S280 PolarHBondContact O-N 3.29Å; A141-L302 CarbonylContact C-O 3.58Å; A141-L302 WeakPolarHBondContact CA-O 3.35Å; A141-L302 HydrophobicContact CB-CB 4.26Å; A141-L302 HydrophobicContact CB-CD2 4.27Å
142	C	86.1	Confident	72.3	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	106.2	174.8	-66.9	0	0	0	0	109.3	S280 F283 F301 L302 V304 V307	C142-S280 CarbonylContact C-O 3.59Å; C142-S280 VanDerWaalsContact CA-O 3.24Å; C142-S280 WeakPolarHBondContact CA-O 3.45Å; C142-F283 VanDerWaalsContact SG-CD2 3.52Å; C142-F301 HydrophobicContact CB-CZ 4.5Å; C142-F301 VanDerWaalsContact SG-CE2 3.6Å; C142-L302 PolarHBondContact N-O 3.07Å; C142-V304 PolarHBondContact O-N 2.87Å; C142-V307 HydrophobicContact CB-CG1 4.17Å; C142-V307 HydrophobicContact CB-CG2 3.9Å
143	A	73.8	Confident	70.3	Confident	13 Å²	13	25.1 Å²	25.1	11%	0.107	14%	0.144	C	C	.	.			trans	-148.9	137.1	-178.5	0	0	0	0	0	111.2	V125 E145 S280 A281 V304	V125-A143 HydrophobicContact CG2-CB 3.5Å; A143-E145 VanDerWaalsContact C-N 3.26Å; A143-E145 PolarHBondContact O-N 3.2Å; A143-S280 PolarHBondContact N-O 3.2Å; A143-A281 WeakPolarHBondContact O-CA 3.26Å; A143-V304 HydrophobicContact CB-CB 3.95Å; A143-V304 HydrophobicContact CB-CG2 4.32Å
144	L	61.9	Low	68.8	Low	69 Å²	69	25.8 Å²	25.8	36%	0.361	15%	0.148	S	C	.	.	S	Bend	trans	-68.2	-31	175	-67.2	162.5	0	0	0	112.1	S309 V425	L144-S309 WeakPolarHBondContact CD1-O 3.44Å; L144-S309 WeakPolarHBondContact CD2-O 3.28Å; L144-V425 HydrophobicContact CD2-CG1 3.93Å
145	E	60.5	Low	66.9	Low	59 Å²	59	23.7 Å²	23.7	28%	0.276	14%	0.139	S	C	.	.	S	Bend	trans	-86.7	134.8	177.7	-73.3	164.3	-126.9	0	0	110.7	Y82 A143 P147	Y82-E145 VanDerWaalsContact CD1-CD 3.47Å; Y82-E145 WeakPolarHBondContact CD1-OE1 3.5Å; Y82-E145 VanDerWaalsContact CD1-OE2 3.28Å; Y82-E145 WeakPolarHBondContact CD1-OE2 3.19Å; Y82-E145 HydrophobicContact CE1-CG 4.31Å; Y82-E145 WeakPolarHBondContact CE1-OE1 3.34Å; Y82-E145 VanDerWaalsContact CE1-OE2 3.25Å; Y82-E145 WeakPolarHBondContact CE1-OE2 3.45Å; A143-E145 VanDerWaalsContact C-N 3.26Å; A143-E145 PolarHBondContact O-N 3.2Å; E145-P147 VanDerWaalsContact O-CD 3.27Å; E145-P147 WeakPolarHBondContact O-CD 3.36Å
146	K	55.2	Low	65	Low	41 Å²	41	21.5 Å²	21.5	18%	0.178	12%	0.119	C	C	.	.			trans	-65.2	121.1	171.6	-61.9	-178.8	173.7	-129.1	0	108.5	Q148 E246	K146-Q148 HydrophobicContact CB-CG 4.41Å; K146-Q148 PolarHBondContact O-N 2.87Å; K146-E246 WeakPolarHBondContact CE-OE1 3.35Å; K146-E246 IonicContact NZ-OE1 2.68Å; K146-E246 PolarHBondContact NZ-OE1 3.23Å
147	P	52.7	Low	63.3	Low	20 Å²	20	20 Å²	20	13%	0.13	10%	0.103	C	C	.	.			trans	-71.3	82.8	164.8	28.3	-27.8	0	0	0	107.8	V125 E145 P149 F150 F279	V125-P147 HydrophobicContact CB-CB 4.42Å; V125-P147 HydrophobicContact CG1-CB 3.9Å; V125-P147 HydrophobicContact CG1-CG 4.2Å; E145-P147 VanDerWaalsContact O-CD 3.27Å; E145-P147 WeakPolarHBondContact O-CD 3.36Å; P147-P149 WeakPolarHBondContact O-CD 3.46Å; P147-F150 PolarHBondContact O-N 2.9Å; P147-F150 VanDerWaalsContact O-N 3.16Å; P147-F279 HydrophobicContact CG-CD1 3.46Å; P147-F279 VanDerWaalsContact CG-CD1 3.46Å; P147-F279 HydrophobicContact CG-CE1 3.69Å; P147-F279 HydrophobicContact CG-CG 4.23Å
148	Q	52	Low	61.4	Low	75 Å²	75	18.5 Å²	18.5	35%	0.35	10%	0.098	S	C	.	.	G	3₁₀ helix	trans	-49.9	-24.7	175.8	-71.5	178	-21.5	0	0	114.2	K146 D405	K146-Q148 HydrophobicContact CB-CG 4.41Å; K146-Q148 PolarHBondContact O-N 2.87Å; Q148-D405 PolarHBondContact NE2-OD2 3.43Å
149	P	50.3	Low	59.1	Low	9 Å²	9	23.1 Å²	23.1	6%	0.058	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-103.8	35.6	178.2	37.5	-29.6	0	0	0	114.7	Q126 P147 C151 L152 F202	Q126-P149 HydrophobicContact CG-CG 3.59Å; P147-P149 WeakPolarHBondContact O-CD 3.46Å; P149-C151 PolarHBondContact O-N 3.22Å; P149-L152 HydrophobicContact CB-CB 4.39Å; P149-L152 HydrophobicContact CB-CD1 3.72Å; P149-L152 HydrophobicContact CB-CG 3.88Å; P149-L152 HydrophobicContact CG-CD1 4.4Å; P149-L152 VanDerWaalsContact O-CB 3.28Å; P149-L152 WeakPolarHBondContact O-CB 3.26Å; P149-L152 PolarHBondContact O-N 2.78Å; P149-F202 HydrophobicContact CB-CE2 4.21Å; P149-F202 HydrophobicContact CB-CZ 3.99Å
150	F	49.8	Very low	57.1	Low	30 Å²	30	32.1 Å²	32.1	13%	0.132	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-54.8	-21.3	157.4	-156.4	-85.3	0	0	0	111.5	P147 L152 F153 V243 M277 F279	P147-F150 PolarHBondContact O-N 2.9Å; P147-F150 VanDerWaalsContact O-N 3.16Å; F150-L152 VanDerWaalsContact C-N 3.26Å; F150-L152 PolarHBondContact O-N 3.36Å; F150-F153 HydrophobicContact CD1-CB 4.23Å; F150-F153 HydrophobicContact CE1-CB 3.94Å; F150-F153 AromaticContact CE1-CD1 3.62Å; F150-F153 HydrophobicContact CE1-CD1 3.62Å; F150-F153 HydrophobicContact CE1-CG 4.13Å; F150-F153 HydrophobicContact CE2-CD1 4.35Å; F150-F153 HydrophobicContact CE2-CG 4.49Å; F150-F153 HydrophobicContact CZ-CB 4.15Å; F150-F153 AromaticContact CZ-CD1 3.48Å; F150-F153 HydrophobicContact CZ-CD1 3.48Å; F150-F153 VanDerWaalsContact CZ-CD1 3.48Å; F150-F153 HydrophobicContact CZ-CE1 4.24Å; F150-F153 AromaticContact CZ-CG 3.99Å; F150-F153 HydrophobicContact CZ-CG 3.99Å; F150-F153 WeakPolarHBondContact O-CB 3.4Å; F150-F153 PolarHBondContact O-N 2.78Å; F150-V243 HydrophobicContact CD1-CB 4.38Å; F150-V243 HydrophobicContact CD1-CG1 3.74Å; F150-V243 HydrophobicContact CD1-CG2 3.86Å; F150-V243 HydrophobicContact CD2-CG1 4.42Å; F150-V243 HydrophobicContact CE1-CB 3.94Å; F150-V243 HydrophobicContact CE1-CG1 3.6Å; F150-V243 HydrophobicContact CE1-CG2 3.07Å; F150-V243 HydrophobicContact CE2-CG1 4.26Å; F150-V243 HydrophobicContact CG-CG1 4.17Å; F150-V243 HydrophobicContact CZ-CB 4.33Å; F150-V243 HydrophobicContact CZ-CG1 3.82Å; F150-V243 HydrophobicContact CZ-CG2 3.55Å; F150-M277 HydrophobicContact CE2-CB 3.97Å; F150-M277 HydrophobicContact CE2-CG 4.23Å; F150-M277 HydrophobicContact CE2-SD 3.36Å; F150-M277 WeakPolarHBondContact CE2-SD 3.25Å; F150-M277 HydrophobicContact CZ-CB 3.85Å; F150-M277 HydrophobicContact CZ-CG 3.98Å; F150-M277 HydrophobicContact CZ-SD 3.33Å; F150-M277 WeakPolarHBondContact CZ-SD 3.47Å; F150-F279 HydrophobicContact CD2-CD2 4.14Å; F150-F279 HydrophobicContact CD2-CE1 4.21Å; F150-F279 AromaticContact CD2-CE2 3.15Å; F150-F279 HydrophobicContact CD2-CE2 3.15Å; F150-F279 AromaticContact CD2-CZ 3.2Å; F150-F279 HydrophobicContact CD2-CZ 3.2Å; F150-F279 HydrophobicContact CE2-CD2 4.32Å; F150-F279 AromaticContact CE2-CE2 3.09Å; F150-F279 HydrophobicContact CE2-CE2 3.09Å; F150-F279 AromaticContact CE2-CZ 3.24Å; F150-F279 HydrophobicContact CE2-CZ 3.24Å; F150-F279 HydrophobicContact CG-CE2 4.11Å; F150-F279 HydrophobicContact CG-CZ 4.42Å; F150-F279 HydrophobicContact CZ-CE2 4.02Å; F150-F279 HydrophobicContact CZ-CZ 4.47Å
151	C	49	Very low	55	Low	9 Å²	9	37.1 Å²	37.1	6%	0.061	17%	0.169	C	C	.	.	H	α-helix	trans	-65.5	-19.8	170.6	-56.6	0	0	0	0	114.8	P149 F153 I195 E198 S199 F202	P149-C151 PolarHBondContact O-N 3.22Å; C151-F153 PolarHBondContact O-N 2.81Å; C151-I195 PolarHBondContact SG-O 3.36Å; C151-I195 VanDerWaalsContact SG-O 3.32Å; C151-E198 HydrophobicContact CB-CB 4.02Å; C151-E198 WeakPolarHBondContact SG-CB 3.3Å; C151-S199 PolarHBondContact SG-N 2.81Å; C151-S199 VanDerWaalsContact SG-N 3.36Å; C151-F202 HydrophobicContact CB-CD2 3.35Å; C151-F202 HydrophobicContact CB-CE2 3.7Å; C151-F202 HydrophobicContact CB-CG 4.45Å
152	L	47.7	Very low	52.9	Low	1 Å²	1	38.3 Å²	38.3	1%	0.005	17%	0.174	C	C	.	.	H	α-helix	trans	-66	-25.4	167	-78.8	174.6	0	0	0	112.3	F101 I110 I114 I130 P149 F150 S156 F202	F101-L152 HydrophobicContact CD1-CD1 4.37Å; F101-L152 HydrophobicContact CE1-CD1 3.79Å; F101-L152 HydrophobicContact CZ-CD1 4.48Å; I110-L152 HydrophobicContact CG2-CD2 3.77Å; I114-L152 HydrophobicContact CD1-CD1 4.19Å; I114-L152 HydrophobicContact CD1-CD2 3.59Å; I114-L152 HydrophobicContact CG1-CD1 4.29Å; I114-L152 HydrophobicContact CG1-CD2 3.46Å; I114-L152 VanDerWaalsContact CG1-CD2 3.46Å; I114-L152 HydrophobicContact CG1-CG 4.49Å; I130-L152 HydrophobicContact CD1-CD1 4.13Å; P149-L152 HydrophobicContact CB-CB 4.39Å; P149-L152 HydrophobicContact CB-CD1 3.72Å; P149-L152 HydrophobicContact CB-CG 3.88Å; P149-L152 HydrophobicContact CG-CD1 4.4Å; P149-L152 VanDerWaalsContact O-CB 3.28Å; P149-L152 WeakPolarHBondContact O-CB 3.26Å; P149-L152 PolarHBondContact O-N 2.78Å; F150-L152 VanDerWaalsContact C-N 3.26Å; F150-L152 PolarHBondContact O-N 3.36Å; L152-S156 WeakPolarHBondContact O-CB 3.32Å; L152-S156 PolarHBondContact O-N 3.13Å; L152-S156 PolarHBondContact O-OG 2.78Å; L152-F202 HydrophobicContact CD1-CE1 4.22Å; L152-F202 HydrophobicContact CD1-CZ 4.2Å; L152-F202 HydrophobicContact CD2-CD1 3.26Å; L152-F202 HydrophobicContact CD2-CE1 3.16Å; L152-F202 HydrophobicContact CD2-CG 3.98Å; L152-F202 HydrophobicContact CD2-CZ 3.79Å; L152-F202 HydrophobicContact CG-CD1 3.94Å; L152-F202 HydrophobicContact CG-CE1 3.5Å; L152-F202 HydrophobicContact CG-CE2 4.15Å; L152-F202 HydrophobicContact CG-CG 4.39Å; L152-F202 HydrophobicContact CG-CZ 3.54Å
153	F	47.8	Very low	50.7	Low	10 Å²	10	46.7 Å²	46.7	4%	0.044	21%	0.211	C	C	.	.	H	α-helix	trans	-73.6	-38.8	-174.9	-165	-116.3	0	0	0	112.7	A133 F150 C151 S156 V157 F241 M277	A133-F153 VanDerWaalsContact CA-CE2 3.48Å; A133-F153 HydrophobicContact CB-CD2 3.3Å; A133-F153 HydrophobicContact CB-CE1 4.23Å; A133-F153 HydrophobicContact CB-CE2 2.9Å; A133-F153 HydrophobicContact CB-CG 4.17Å; A133-F153 HydrophobicContact CB-CZ 3.42Å; A133-F153 VanDerWaalsContact CB-CZ 3.42Å; A133-F153 WeakPolarHBondContact O-CE2 3.45Å; A133-F153 WeakPolarHBondContact O-CZ 3.18Å; F150-F153 HydrophobicContact CD1-CB 4.23Å; F150-F153 HydrophobicContact CE1-CB 3.94Å; F150-F153 AromaticContact CE1-CD1 3.62Å; F150-F153 HydrophobicContact CE1-CD1 3.62Å; F150-F153 HydrophobicContact CE1-CG 4.13Å; F150-F153 HydrophobicContact CE2-CD1 4.35Å; F150-F153 HydrophobicContact CE2-CG 4.49Å; F150-F153 HydrophobicContact CZ-CB 4.15Å; F150-F153 AromaticContact CZ-CD1 3.48Å; F150-F153 HydrophobicContact CZ-CD1 3.48Å; F150-F153 VanDerWaalsContact CZ-CD1 3.48Å; F150-F153 HydrophobicContact CZ-CE1 4.24Å; F150-F153 AromaticContact CZ-CG 3.99Å; F150-F153 HydrophobicContact CZ-CG 3.99Å; F150-F153 WeakPolarHBondContact O-CB 3.4Å; F150-F153 PolarHBondContact O-N 2.78Å; C151-F153 PolarHBondContact O-N 2.81Å; F153-S156 PolarHBondContact O-N 2.95Å; F153-V157 HydrophobicContact CD2-CG2 3.81Å; F153-V157 HydrophobicContact CE1-CB 4.47Å; F153-V157 HydrophobicContact CE1-CG2 4.32Å; F153-V157 HydrophobicContact CE2-CB 3.98Å; F153-V157 HydrophobicContact CE2-CG2 3.05Å; F153-V157 HydrophobicContact CZ-CB 3.95Å; F153-V157 HydrophobicContact CZ-CG1 4.24Å; F153-V157 HydrophobicContact CZ-CG2 3.39Å; F153-V157 WeakPolarHBondContact O-CB 3.41Å; F153-V157 PolarHBondContact O-N 3.21Å; F153-F241 AromaticContact CE1-CD1 4Å; F153-F241 HydrophobicContact CE1-CD1 4Å; F153-M277 HydrophobicContact CD1-SD 4.26Å; F153-M277 HydrophobicContact CE1-CE 3.75Å; F153-M277 HydrophobicContact CE1-SD 4.03Å; F153-M277 HydrophobicContact CE2-CE 4.34Å; F153-M277 HydrophobicContact CZ-CE 3.66Å; F153-M277 HydrophobicContact CZ-SD 4.4Å
154	V	50.7	Low	48.9	Very low	15 Å²	15	48.6 Å²	48.6	9%	0.091	23%	0.232	C	C	.	.	H	α-helix	trans	-71.1	-35.3	179.6	-170.3	0	0	0	0	111.3	V9 C158 A182	V9-V154 HydrophobicContact CB-CG1 3.92Å; V9-V154 HydrophobicContact CG1-CG1 3.59Å; V9-V154 HydrophobicContact CG2-CG1 4.09Å; V154-C158 WeakPolarHBondContact O-CB 3.22Å; V154-C158 PolarHBondContact O-N 3.43Å; V154-C158 PolarHBondContact O-SG 3.19Å; V154-A182 HydrophobicContact CG1-CB 4.17Å; V154-A182 HydrophobicContact CG2-CB 4.41Å
155	G	43.3	Very low	48	Very low	6 Å²	6	50.9 Å²	50.9	6%	0.062	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-47.9	173	0	0	0	0	0	112.3	I110 W159	I110-G155 VanDerWaalsContact CD1-O 3.24Å; I110-G155 WeakPolarHBondContact CD1-O 3.44Å; G155-W159 PolarHBondContact O-N 2.71Å
156	S	46.5	Very low	47.1	Very low	10 Å²	10	52.6 Å²	52.6	7%	0.07	26%	0.258	C	S	.	.	H	α-helix	trans	-77.4	-38.3	-167.1	-53.3	0	0	0	0	112.8	L106 L152 F153	L106-S156 VanDerWaalsContact CD2-OG 3.29Å; L106-S156 WeakPolarHBondContact CD2-OG 3.39Å; L152-S156 WeakPolarHBondContact O-CB 3.32Å; L152-S156 PolarHBondContact O-N 3.13Å; L152-S156 PolarHBondContact O-OG 2.78Å; F153-S156 PolarHBondContact O-N 2.95Å
157	V	49.4	Very low	46.5	Very low	6 Å²	6	54.9 Å²	54.9	4%	0.036	28%	0.275	C	S	.	.	H	α-helix	trans	-89	-27.9	-179.7	178.1	0	0	0	0	112.6	L134 F153 W159 R160 Y161 F241	L134-V157 HydrophobicContact CD2-CG2 3.84Å; F153-V157 HydrophobicContact CD2-CG2 3.81Å; F153-V157 HydrophobicContact CE1-CB 4.47Å; F153-V157 HydrophobicContact CE1-CG2 4.32Å; F153-V157 HydrophobicContact CE2-CB 3.98Å; F153-V157 HydrophobicContact CE2-CG2 3.05Å; F153-V157 HydrophobicContact CZ-CB 3.95Å; F153-V157 HydrophobicContact CZ-CG1 4.24Å; F153-V157 HydrophobicContact CZ-CG2 3.39Å; F153-V157 WeakPolarHBondContact O-CB 3.41Å; F153-V157 PolarHBondContact O-N 3.21Å; V157-W159 VanDerWaalsContact C-N 3.26Å; V157-W159 PolarHBondContact O-N 3.28Å; V157-R160 PolarHBondContact O-N 2.83Å; V157-Y161 HydrophobicContact CG1-CD2 3.98Å; V157-Y161 HydrophobicContact CG1-CE2 3.95Å; V157-Y161 WeakPolarHBondContact O-CD2 3.36Å; V157-F241 HydrophobicContact CB-CE1 4.37Å; V157-F241 HydrophobicContact CB-CZ 4.37Å; V157-F241 HydrophobicContact CG1-CD1 4.18Å; V157-F241 HydrophobicContact CG1-CE1 3.26Å; V157-F241 HydrophobicContact CG1-CE2 4Å; V157-F241 HydrophobicContact CG1-CZ 3.16Å
158	C	48.7	Very low	46.2	Very low	7 Å²	7	56.9 Å²	56.9	5%	0.047	29%	0.29	C	S	.	.	H	α-helix	trans	-60.6	-39.9	169.5	-69.9	0	0	0	0	110.2	V154 R160 Y161 L162 I208	V154-C158 WeakPolarHBondContact O-CB 3.22Å; V154-C158 PolarHBondContact O-N 3.43Å; V154-C158 PolarHBondContact O-SG 3.19Å; C158-R160 PolarHBondContact O-N 3.16Å; C158-R160 VanDerWaalsContact O-N 3.1Å; C158-Y161 CarbonylContact O-C 3.45Å; C158-Y161 PolarHBondContact O-N 2.82Å; C158-L162 VanDerWaalsContact C-CD1 3.43Å; C158-L162 VanDerWaalsContact C-CG 3.48Å; C158-L162 HydrophobicContact CB-CD1 3.47Å; C158-L162 VanDerWaalsContact CB-CD1 3.47Å; C158-L162 HydrophobicContact CB-CD2 4.29Å; C158-L162 HydrophobicContact CB-CG 3.76Å; C158-L162 VanDerWaalsContact O-CB 3.23Å; C158-L162 WeakPolarHBondContact O-CB 3.47Å; C158-L162 WeakPolarHBondContact O-CD1 3.37Å; C158-L162 WeakPolarHBondContact O-CG 3.36Å; C158-L162 PolarHBondContact O-N 3.33Å; C158-I208 HydrophobicContact CB-CD1 3.85Å
159	W	45.2	Very low	45.9	Very low	104 Å²	104	59 Å²	59	39%	0.394	30%	0.298	S	S	.	.	H	α-helix	trans	-57.6	-33.5	178.5	-170.8	-104.7	0	0	0	114.2	H107 G155 V157 Y161 F163	H107-W159 HydrophobicContact CB-CG 4.32Å; H107-W159 AromaticContact CD2-CD2 3.67Å; H107-W159 AromaticContact CD2-CE2 3.39Å; H107-W159 AromaticContact CD2-CZ2 3.62Å; H107-W159 AromaticContact CD2-NE1 3.71Å; H107-W159 AromaticContact NE2-CE2 3.98Å; H107-W159 AromaticContact NE2-CH2 3.82Å; H107-W159 AromaticContact NE2-CZ2 3.71Å; G155-W159 PolarHBondContact O-N 2.71Å; V157-W159 VanDerWaalsContact C-N 3.26Å; V157-W159 PolarHBondContact O-N 3.28Å; W159-Y161 VanDerWaalsContact C-N 3.28Å; W159-Y161 PolarHBondContact O-N 2.82Å; W159-F163 AromaticContact CH2-CE2 3.97Å; W159-F163 HydrophobicContact CH2-CE2 3.97Å; W159-F163 AromaticContact CZ2-CE2 3.82Å; W159-F163 HydrophobicContact CZ2-CE2 3.82Å
160	R	47.1	Very low	45.6	Very low	189 Å²	189	64.2 Å²	64.2	71%	0.713	32%	0.324	S	S	*	.	H	α-helix	trans	-74	-15.4	-179.9	-147.4	165	179.3	113.2	-4.5	113.7	V157 C158	V157-R160 PolarHBondContact O-N 2.83Å; C158-R160 PolarHBondContact O-N 3.16Å; C158-R160 VanDerWaalsContact O-N 3.1Å
161	Y	48.6	Very low	45.7	Very low	106 Å²	106	65 Å²	65	42%	0.416	33%	0.33	S	S	.	.	H	α-helix	trans	-122.6	-11.5	179.5	-66.4	-78.9	0	0	0	115.2	V157 C158 W159 F163 F241	V157-Y161 HydrophobicContact CG1-CD2 3.98Å; V157-Y161 HydrophobicContact CG1-CE2 3.95Å; V157-Y161 WeakPolarHBondContact O-CD2 3.36Å; C158-Y161 CarbonylContact O-C 3.45Å; C158-Y161 PolarHBondContact O-N 2.82Å; W159-Y161 VanDerWaalsContact C-N 3.28Å; W159-Y161 PolarHBondContact O-N 2.82Å; Y161-F163 PolarHBondContact O-N 3.06Å; Y161-F241 HydrophobicContact CD2-CE2 4.43Å; Y161-F241 AromaticContact CD2-CZ 3.8Å; Y161-F241 HydrophobicContact CD2-CZ 3.8Å; Y161-F241 AromaticContact CE2-CZ 3.94Å; Y161-F241 HydrophobicContact CE2-CZ 3.94Å
162	L	44.8	Very low	45.7	Very low	25 Å²	25	75.8 Å²	75.8	13%	0.131	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-4.1	-175.9	-75.9	167.6	0	0	0	114.4	Q11 C158 G164 I208	Q11-L162 HydrophobicContact CB-CD2 3.67Å; Q11-L162 HydrophobicContact CG-CD2 3.71Å; C158-L162 VanDerWaalsContact C-CD1 3.43Å; C158-L162 VanDerWaalsContact C-CG 3.48Å; C158-L162 HydrophobicContact CB-CD1 3.47Å; C158-L162 VanDerWaalsContact CB-CD1 3.47Å; C158-L162 HydrophobicContact CB-CD2 4.29Å; C158-L162 HydrophobicContact CB-CG 3.76Å; C158-L162 VanDerWaalsContact O-CB 3.23Å; C158-L162 WeakPolarHBondContact O-CB 3.47Å; C158-L162 WeakPolarHBondContact O-CD1 3.37Å; C158-L162 WeakPolarHBondContact O-CG 3.36Å; C158-L162 PolarHBondContact O-N 3.33Å; L162-G164 VanDerWaalsContact C-N 3.32Å; L162-G164 PolarHBondContact O-N 3.47Å; L162-I208 HydrophobicContact CD1-CD1 4.23Å; L162-I208 HydrophobicContact CD1-CG1 4.12Å
163	F	38.8	Very low	45.8	Very low	176 Å²	176	82.9 Å²	82.9	77%	0.772	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	12.5	178.8	-104.7	-77.5	0	0	0	115.1	W159 Y161	W159-F163 AromaticContact CH2-CE2 3.97Å; W159-F163 HydrophobicContact CH2-CE2 3.97Å; W159-F163 AromaticContact CZ2-CE2 3.82Å; W159-F163 HydrophobicContact CZ2-CE2 3.82Å; Y161-F163 PolarHBondContact O-N 3.06Å
164	G	37.8	Very low	45.8	Very low	53 Å²	53	84.8 Å²	84.8	55%	0.546	42%	0.423	S	S	.	.	S	Bend	trans	-143	0.3	-172.1	0	0	0	0	0	118.4	L162	L162-G164 VanDerWaalsContact C-N 3.32Å; L162-G164 PolarHBondContact O-N 3.47Å
165	F	41.4	Very low	45.8	Very low	118 Å²	118	92.5 Å²	92.5	52%	0.518	45%	0.45	S	S	.	.			trans	-122.8	137.6	-171.1	-63.3	-72.4	0	0	0	114.2	R240	F165-R240 VanDerWaalsContact CE1-NH2 3.33Å; F165-R240 VanDerWaalsContact CE2-NH2 3.31Å
166	S	41.6	Very low	46.1	Very low	94 Å²	94	101.3 Å²	101.3	66%	0.657	48%	0.482	S	S	*	.			trans	-122.9	122.3	-155.1	-177.1	0	0	0	0	109
167	V	44.2	Very low	46.4	Very low	89 Å²	89	101.3 Å²	101.3	54%	0.539	48%	0.482	S	S	.	.			trans	42.5	127	155	-77.2	0	0	0	0	120.3	K169	V167-K169 PolarHBondContact O-N 3.34Å
168	S	45.6	Very low	46.7	Very low	63 Å²	63	101.9 Å²	101.9	44%	0.441	48%	0.484	S	S	.	.			trans	-22	105.7	156.9	-45.4	0	0	0	0	112	Q178	S168-Q178 PolarHBondContact OG-OE1 2.97Å
169	K	44.9	Very low	47.5	Very low	120 Å²	120	103 Å²	103	52%	0.522	49%	0.488	S	S	.	.			trans	-78.8	133.3	172.8	-63.6	172.4	-176.3	157.2	0	107.8	V167 D171 C177 F179	V167-K169 PolarHBondContact O-N 3.34Å; K169-D171 PolarHBondContact O-N 2.98Å; K169-C177 PolarHBondContact O-N 3.09Å; K169-F179 HydrophobicContact CB-CE2 3.82Å; K169-F179 HydrophobicContact CB-CZ 4.24Å; K169-F179 HydrophobicContact CD-CE2 4.48Å; K169-F179 HydrophobicContact CG-CE2 4.37Å
170	L	44.7	Very low	48.7	Very low	118 Å²	118	98.1 Å²	98.1	62%	0.618	47%	0.47	S	S	*	.	B	Isolated β-bridge	trans	-63.5	131.3	162.6	-69	166.3	0	0	0	107.2	G174 R175	L170-G174 WeakPolarHBondContact CD2-O 3.38Å; L170-R175 WeakPolarHBondContact CA-O 3.49Å
171	D	51.7	Low	50	Low	46 Å²	46	90.7 Å²	90.7	25%	0.246	45%	0.447	C	S	.	.			trans	-64.8	174.4	168.4	80.7	-5.2	0	0	0	110.3	K169 F173 G174 R175 C177	K169-D171 PolarHBondContact O-N 2.98Å; D171-F173 PolarHBondContact O-N 2.92Å; D171-F173 VanDerWaalsContact OD1-C 3.24Å; D171-F173 VanDerWaalsContact OD1-CA 3.25Å; D171-F173 WeakPolarHBondContact OD1-CA 3.3Å; D171-F173 WeakPolarHBondContact OD1-CB 3.49Å; D171-F173 PolarHBondContact OD1-N 3.17Å; D171-G174 PolarHBondContact O-N 3.44Å; D171-G174 PolarHBondContact OD1-N 2.98Å; D171-G174 VanDerWaalsContact OD1-N 3.08Å; D171-R175 PolarHBondContact N-O 3.22Å; D171-R175 WeakPolarHBondContact OD1-CB 3.37Å; D171-R175 PolarHBondContact OD1-N 2.96Å; D171-C177 HydrophobicContact CB-CB 4.44Å
172	R	48.2	Very low	51.4	Low	235 Å²	235	85.7 Å²	85.7	89%	0.887	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-13	178	-74.6	-173.7	-80.4	-143.2	-4.5	114.2
173	F	50.9	Low	53.2	Low	151 Å²	151	84.5 Å²	84.5	66%	0.662	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.6	10.8	-179.4	-59	-77.8	0	0	0	113	D171 R175	D171-F173 PolarHBondContact O-N 2.92Å; D171-F173 VanDerWaalsContact OD1-C 3.24Å; D171-F173 VanDerWaalsContact OD1-CA 3.25Å; D171-F173 WeakPolarHBondContact OD1-CA 3.3Å; D171-F173 WeakPolarHBondContact OD1-CB 3.49Å; D171-F173 PolarHBondContact OD1-N 3.17Å; F173-R175 HydrophobicContact CB-CG 4.26Å; F173-R175 PolarHBondContact O-N 2.86Å
174	G	47.1	Very low	55.4	Low	50 Å²	50	76.4 Å²	76.4	52%	0.515	39%	0.386	S	S	.	.	S	Bend	trans	71.6	17.4	-179.1	0	0	0	0	0	113.6	L170 D171	L170-G174 WeakPolarHBondContact CD2-O 3.38Å; D171-G174 PolarHBondContact O-N 3.44Å; D171-G174 PolarHBondContact OD1-N 2.98Å; D171-G174 VanDerWaalsContact OD1-N 3.08Å
175	R	50.5	Low	57.8	Low	177 Å²	177	73.9 Å²	73.9	67%	0.668	36%	0.36	S	S	*	.			trans	-90.4	140.5	176.3	-55.2	-177.8	-177.7	-159.6	2.4	109.3	L170 D171 F173 C177	L170-R175 WeakPolarHBondContact CA-O 3.49Å; D171-R175 PolarHBondContact N-O 3.22Å; D171-R175 WeakPolarHBondContact OD1-CB 3.37Å; D171-R175 PolarHBondContact OD1-N 2.96Å; F173-R175 HydrophobicContact CB-CG 4.26Å; F173-R175 PolarHBondContact O-N 2.86Å; R175-C177 PolarHBondContact O-N 2.86Å; R175-C177 VanDerWaalsContact O-N 3.13Å
176	R	51.2	Low	59.8	Low	190 Å²	190	68.5 Å²	68.5	72%	0.717	34%	0.338	S	S	*	.	B	Isolated β-bridge	trans	-66.1	112	175.6	-68.1	-178.1	178.3	-178.3	-1.3	108.6
177	C	51.5	Low	61.6	Low	11 Å²	11	64.1 Å²	64.1	7%	0.074	31%	0.307	C	S	.	.			trans	-103	135.3	170.2	-156.2	0	0	0	0	107.5	K169 D171 R175 F179 W232 C233	K169-C177 PolarHBondContact O-N 3.09Å; D171-C177 HydrophobicContact CB-CB 4.44Å; R175-C177 PolarHBondContact O-N 2.86Å; R175-C177 VanDerWaalsContact O-N 3.13Å; C177-F179 HydrophobicContact CB-CE2 3.96Å; C177-F179 HydrophobicContact CB-CZ 3.94Å; C177-W232 VanDerWaalsContact CA-O 3.25Å; C177-W232 WeakPolarHBondContact CA-O 3.49Å; C177-W232 PolarHBondContact SG-O 3.08Å; C177-C233 WeakPolarHBondContact CA-SG 3.42Å; C177-C233 WeakPolarHBondContact CB-SG 3.41Å; C177-C233 WeakPolarHBondContact SG-CA 3.3Å; C177-C233 WeakPolarHBondContact SG-CB 3.47Å; C177-C233 CovalentContact SG-SG 2.04Å; C177-C233 PolarHBondContact SG-SG 2.9Å
178	Q	55.8	Low	63	Low	17 Å²	17	60.2 Å²	60.2	8%	0.079	28%	0.283	C	S	.	.			trans	-118.9	131.6	172.6	-50.8	-93.8	40.5	0	0	110	D10 S168 P180 V229 T230 C233	D10-Q178 WeakPolarHBondContact OD2-CB 3.48Å; S168-Q178 PolarHBondContact OG-OE1 2.97Å; Q178-P180 WeakPolarHBondContact O-CD 2.93Å; Q178-V229 PolarHBondContact NE2-O 2.99Å; Q178-T230 VanDerWaalsContact CB-C 3.41Å; Q178-T230 WeakPolarHBondContact CB-O 3.3Å; Q178-T230 WeakPolarHBondContact CG-O 3.28Å; Q178-C233 PolarHBondContact N-SG 3.26Å; Q178-C233 WeakPolarHBondContact O-CB 3.28Å; Q178-C233 PolarHBondContact O-SG 2.97Å
179	F	66	Low	64.4	Low	31 Å²	31	59.5 Å²	59.5	14%	0.136	27%	0.271	C	S	.	.			trans	-104	100.9	-168.2	-59.3	-94.4	0	0	0	108	K169 C177 S181 A235 L237 D238	K169-F179 HydrophobicContact CB-CE2 3.82Å; K169-F179 HydrophobicContact CB-CZ 4.24Å; K169-F179 HydrophobicContact CD-CE2 4.48Å; K169-F179 HydrophobicContact CG-CE2 4.37Å; C177-F179 HydrophobicContact CB-CE2 3.96Å; C177-F179 HydrophobicContact CB-CZ 3.94Å; F179-S181 PolarHBondContact O-N 3.29Å; F179-A235 HydrophobicContact CE1-CB 4.42Å; F179-L237 HydrophobicContact CD1-CB 4.34Å; F179-L237 HydrophobicContact CE1-CD1 4.29Å; F179-D238 HydrophobicContact CB-CB 3.82Å; F179-D238 WeakPolarHBondContact CB-OD2 3.43Å
180	P	71.5	Confident	65.8	Low	2 Å²	2	54.6 Å²	54.6	1%	0.013	25%	0.25	C	C	.	.			trans	-62.3	130.9	-176.1	27.2	-34.9	0	0	0	109.8	T8 Q178 A182 L236 C239	T8-P180 HydrophobicContact CG2-CB 3.86Å; T8-P180 HydrophobicContact CG2-CG 3.91Å; Q178-P180 WeakPolarHBondContact O-CD 2.93Å; P180-A182 VanDerWaalsContact C-N 3.32Å; P180-L236 HydrophobicContact CG-CD2 3.78Å; P180-C239 VanDerWaalsContact O-CA 3.29Å; P180-C239 WeakPolarHBondContact O-CA 3.46Å; P180-C239 PolarHBondContact O-N 3.39Å
181	S	72.8	Confident	67.3	Low	32 Å²	32	49 Å²	49	22%	0.224	22%	0.221	C	C	.	.	S	Bend	trans	-75	-28.8	177.4	-65.8	0	0	0	0	111.5	V9 F179 R240 F241	V9-S181 PolarHBondContact O-N 2.72Å; F179-S181 PolarHBondContact O-N 3.29Å; S181-R240 PolarHBondContact O-N 3.11Å; S181-F241 PolarHBondContact O-N 3.23Å; S181-F241 VanDerWaalsContact O-N 3.16Å
182	A	78.3	Confident	68.6	Low	1 Å²	1	47 Å²	47	1%	0.008	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	142.8	177.2	0	0	0	0	0	111.6	V9 V154 P180 F241	V9-A182 HydrophobicContact CB-CB 4.31Å; V9-A182 PolarHBondContact N-O 3.09Å; V9-A182 VanDerWaalsContact N-O 3.11Å; V154-A182 HydrophobicContact CG1-CB 4.17Å; V154-A182 HydrophobicContact CG2-CB 4.41Å; P180-A182 VanDerWaalsContact C-N 3.32Å; A182-F241 CarbonylContact C-O 3.55Å; A182-F241 WeakPolarHBondContact CA-O 3.36Å; A182-F241 HydrophobicContact CB-CB 3.8Å; A182-F241 HydrophobicContact CB-CD2 4.33Å
183	L	83.9	Confident	70	Confident	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	122.7	180	-176.1	65	0	0	0	110.1	M6 T8 L185 L236 C239 F241 L242 V243 I262 M268	M6-L183 HydrophobicContact CE-CD1 4.05Å; M6-L183 HydrophobicContact CG-CD1 3.15Å; M6-L183 HydrophobicContact CG-CG 4.46Å; M6-L183 HydrophobicContact SD-CD1 3.53Å; M6-L183 VanDerWaalsContact SD-CD1 3.53Å; T8-L183 HydrophobicContact CG2-CD1 4.13Å; L183-L185 HydrophobicContact CD1-CD2 4.26Å; L183-L185 HydrophobicContact CD2-CD2 4.07Å; L183-L185 HydrophobicContact CG-CD2 3.95Å; L183-L185 HydrophobicContact CG-CG 4.43Å; L183-L236 HydrophobicContact CD2-CD1 3.81Å; L183-L236 HydrophobicContact CD2-CD2 4.32Å; L183-C239 VanDerWaalsContact CB-SG 3.55Å; L183-F241 PolarHBondContact N-O 3.29Å; L183-L242 HydrophobicContact CB-CD1 4.37Å; L183-L242 HydrophobicContact CD2-CD1 4Å; L183-L242 HydrophobicContact CG-CD1 4.3Å; L183-V243 PolarHBondContact O-N 3.42Å; L183-I262 HydrophobicContact CD2-CG2 3.95Å; L183-M268 HydrophobicContact CD2-CE 3.63Å
184	V	84.2	Confident	71.2	Confident	6 Å²	6	32.4 Å²	32.4	4%	0.036	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	123.3	172.3	-172.1	0	0	0	0	109.7	L7 I195 V243	L7-V184 HydrophobicContact CB-CB 4.17Å; L7-V184 HydrophobicContact CD2-CB 4.11Å; L7-V184 HydrophobicContact CD2-CG2 3.87Å; L7-V184 PolarHBondContact N-O 3.37Å; L7-V184 PolarHBondContact O-N 3.4Å; V184-I195 HydrophobicContact CG1-CD1 4.03Å; V184-I195 HydrophobicContact CG1-CG2 4.11Å; V184-V243 HydrophobicContact CB-CB 4.27Å; V184-V243 HydrophobicContact CG1-CB 4.02Å; V184-V243 HydrophobicContact CG1-CG1 4.15Å; V184-V243 HydrophobicContact CG2-CB 4.02Å; V184-V243 HydrophobicContact CG2-CG2 4.03Å
185	L	87.3	Confident	72.7	Confident	0 Å²	0	31 Å²	31	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	134.4	176.9	-56.4	-174.4	0	0	0	109.2	F4 L183 L242 V243 L244 D245 M250 I259	F4-L185 HydrophobicContact CE1-CD2 3.44Å; F4-L185 VanDerWaalsContact CE1-CD2 3.44Å; F4-L185 HydrophobicContact CZ-CD1 4.04Å; F4-L185 HydrophobicContact CZ-CD2 3.51Å; F4-L185 HydrophobicContact CZ-CG 4.23Å; L183-L185 HydrophobicContact CD1-CD2 4.26Å; L183-L185 HydrophobicContact CD2-CD2 4.07Å; L183-L185 HydrophobicContact CG-CD2 3.95Å; L183-L185 HydrophobicContact CG-CG 4.43Å; L185-L242 HydrophobicContact CD1-CD1 4.14Å; L185-L242 HydrophobicContact CG-CD1 4.3Å; L185-V243 PolarHBondContact N-O 3.5Å; L185-L244 HydrophobicContact CD1-CG 4.38Å; L185-D245 PolarHBondContact O-N 3.16Å; L185-M250 HydrophobicContact CB-CE 4.42Å; L185-M250 HydrophobicContact CB-SD 4.13Å; L185-I259 HydrophobicContact CD1-CG2 4.38Å
186	A	83.5	Confident	74.1	Confident	6 Å²	6	24.9 Å²	24.9	5%	0.05	11%	0.113	C	C	.	.			trans	-143.3	150	176.9	0	0	0	0	0	110.8	T188 L191 I195	A186-T188 PolarHBondContact O-N 3.44Å; A186-L191 HydrophobicContact CB-CB 4.42Å; A186-L191 HydrophobicContact CB-CD2 4.03Å; A186-L191 HydrophobicContact CB-CG 3.98Å; A186-I195 HydrophobicContact CB-CD1 3.93Å
187	P	79	Confident	75.4	Confident	1 Å²	1	18.7 Å²	18.7	1%	0.006	9%	0.094	C	C	.	.	S	Bend	trans	-72.4	-23.3	-174.6	24	-35.1	0	0	0	115	L191 D245 E246 R249 M250 M253	P187-L191 HydrophobicContact CG-CD2 4.25Å; P187-D245 WeakPolarHBondContact CD-O 3.46Å; P187-E246 HydrophobicContact CG-CB 3.73Å; P187-R249 HydrophobicContact CB-CG 4.31Å; P187-R249 HydrophobicContact CG-CB 4.32Å; P187-R249 HydrophobicContact CG-CG 4.27Å; P187-M250 HydrophobicContact CB-CG 3.77Å; P187-M250 HydrophobicContact CG-CG 4.15Å; P187-M253 HydrophobicContact CB-SD 3.76Å
188	T	75	Confident	76.6	Confident	7 Å²	7	19 Å²	19	4%	0.043	10%	0.095	C	C	.	.	S	Bend	trans	-141.6	148.9	-169.2	44.8	0	0	0	0	115	Q5 A186 E190 L191 S192 R249 M253 R402	Q5-T188 VanDerWaalsContact CD-C 3.5Å; Q5-T188 PolarHBondContact OE1-O 3.05Å; A186-T188 PolarHBondContact O-N 3.44Å; T188-E190 PolarHBondContact O-N 2.82Å; T188-L191 WeakPolarHBondContact O-CA 3.33Å; T188-L191 WeakPolarHBondContact O-CB 3.37Å; T188-L191 PolarHBondContact O-N 3.05Å; T188-S192 PolarHBondContact O-N 3.28Å; T188-S192 PolarHBondContact O-OG 3.23Å; T188-R249 PolarHBondContact OG1-NH1 2.9Å; T188-M253 HydrophobicContact CG2-CE 4.36Å; T188-M253 HydrophobicContact CG2-SD 4.29Å; T188-R402 PolarHBondContact OG1-O 3.15Å
189	R	75.2	Confident	77.7	Confident	48 Å²	48	18.6 Å²	18.6	18%	0.181	9%	0.094	C	C	.	.	H	α-helix	trans	-61.2	-38.9	-167	-61.1	178.2	175.3	145.8	4.7	110	Q5 L191 S192 L193 Y214 G215 Q376	Q5-R189 VanDerWaalsContact NE2-N 3.14Å; R189-L191 VanDerWaalsContact C-N 3.35Å; R189-S192 PolarHBondContact O-N 3.25Å; R189-L193 VanDerWaalsContact O-CB 3.29Å; R189-L193 WeakPolarHBondContact O-CB 3.36Å; R189-L193 PolarHBondContact O-N 3.48Å; R189-Y214 HydrophobicContact CB-CD2 3.84Å; R189-Y214 HydrophobicContact CB-CE2 4.27Å; R189-Y214 HydrophobicContact CB-CG 4.17Å; R189-Y214 HydrophobicContact CG-CD2 3.61Å; R189-Y214 HydrophobicContact CG-CE2 4.36Å; R189-Y214 HydrophobicContact CG-CG 4.09Å; R189-G215 PolarHBondContact NE-O 3.01Å; R189-G215 PolarHBondContact NH2-O 3.01Å; R189-Q376 VanDerWaalsContact CD-CD 3.41Å
190	E	72.8	Confident	78.3	Confident	17 Å²	17	20.7 Å²	20.7	8%	0.079	10%	0.1	C	C	.	.	H	α-helix	trans	-70.3	-35.9	-176.7	-59.1	81.9	-165.2	0	0	110.9	T188 Q194 Q376 R379 L383 L404	T188-E190 PolarHBondContact O-N 2.82Å; E190-Q194 WeakPolarHBondContact O-CB 3.42Å; E190-Q194 PolarHBondContact O-N 3.34Å; E190-Q376 PolarHBondContact OE1-NE2 2.91Å; E190-Q376 VanDerWaalsContact OE1-NE2 3.11Å; E190-R379 IonicContact OE1-CZ 3.7Å; E190-R379 IonicContact OE1-NE 3.22Å; E190-R379 IonicContact OE1-NH1 2.65Å; E190-R379 PolarHBondContact OE1-NH1 3.05Å; E190-R379 IonicContact OE1-NH2 2.7Å; E190-R379 PolarHBondContact OE1-NH2 3.44Å; E190-R379 IonicContact OE2-NH1 2.83Å; E190-R379 IonicContact OE2-NH2 3.73Å; E190-R379 PolarHBondContact OE2-NH2 3.03Å; E190-L383 HydrophobicContact CG-CD1 4.1Å; E190-L404 HydrophobicContact CB-CD2 3.51Å; E190-L404 HydrophobicContact CG-CD2 3.4Å; E190-L404 VanDerWaalsContact CG-CD2 3.4Å
191	L	76.9	Confident	78.7	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.01	10%	0.104	C	C	.	.	H	α-helix	trans	-70.7	-45.3	171.4	-178.7	54.2	0	0	0	111.5	A186 P187 T188 R189 L193 Q194 I195 E246	A186-L191 HydrophobicContact CB-CB 4.42Å; A186-L191 HydrophobicContact CB-CD2 4.03Å; A186-L191 HydrophobicContact CB-CG 3.98Å; P187-L191 HydrophobicContact CG-CD2 4.25Å; T188-L191 WeakPolarHBondContact O-CA 3.33Å; T188-L191 WeakPolarHBondContact O-CB 3.37Å; T188-L191 PolarHBondContact O-N 3.05Å; R189-L191 VanDerWaalsContact C-N 3.35Å; L191-L193 VanDerWaalsContact C-N 3.27Å; L191-L193 PolarHBondContact O-N 2.88Å; L191-Q194 WeakPolarHBondContact O-CB 3.33Å; L191-Q194 PolarHBondContact O-N 3Å; L191-Q194 VanDerWaalsContact O-N 3.14Å; L191-I195 HydrophobicContact CD1-CD1 4.13Å; L191-I195 HydrophobicContact CD1-CG1 4.17Å; L191-I195 HydrophobicContact CG-CD1 3.96Å; L191-I195 HydrophobicContact CG-CG1 4.48Å; L191-I195 VanDerWaalsContact O-CG1 3.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.38Å; L191-I195 PolarHBondContact O-N 3.39Å; L191-E246 HydrophobicContact CD2-CB 4.24Å; L191-E246 VanDerWaalsContact CD2-CD 3.41Å; L191-E246 HydrophobicContact CD2-CG 3.74Å
192	S	80.1	Confident	78.9	Confident	2 Å²	2	20 Å²	20	1%	0.014	9%	0.094	C	C	.	.	H	α-helix	trans	-58	-41.1	174.5	-60.2	0	0	0	0	111.8	Q5 T188 R189 I195 Y196 I212	Q5-S192 WeakPolarHBondContact CB-OG 3.45Å; Q5-S192 PolarHBondContact OE1-OG 3.18Å; Q5-S192 VanDerWaalsContact OE1-OG 3.07Å; T188-S192 PolarHBondContact O-N 3.28Å; T188-S192 PolarHBondContact O-OG 3.23Å; R189-S192 PolarHBondContact O-N 3.25Å; S192-I195 PolarHBondContact O-N 3.25Å; S192-Y196 VanDerWaalsContact O-CB 3.26Å; S192-Y196 WeakPolarHBondContact O-CB 3.43Å; S192-Y196 PolarHBondContact O-N 3.39Å; S192-I212 VanDerWaalsContact O-CD1 3.3Å; S192-I212 WeakPolarHBondContact O-CD1 3.48Å
193	L	77	Confident	78.9	Confident	56 Å²	56	20.7 Å²	20.7	29%	0.293	10%	0.099	S	C	.	.	H	α-helix	trans	-66.4	-38.8	177	-175.3	64.4	0	0	0	112	R189 L191 Y196 N197 I212	R189-L193 VanDerWaalsContact O-CB 3.29Å; R189-L193 WeakPolarHBondContact O-CB 3.36Å; R189-L193 PolarHBondContact O-N 3.48Å; L191-L193 VanDerWaalsContact C-N 3.27Å; L191-L193 PolarHBondContact O-N 2.88Å; L193-Y196 HydrophobicContact CD1-CD1 4.25Å; L193-Y196 PolarHBondContact O-N 3.36Å; L193-N197 WeakPolarHBondContact O-CB 3.33Å; L193-N197 VanDerWaalsContact O-CG 3.25Å; L193-N197 PolarHBondContact O-N 3.44Å; L193-N197 PolarHBondContact O-ND2 3.01Å; L193-I212 HydrophobicContact CB-CD1 4.19Å; L193-I212 HydrophobicContact CD1-CD1 4.37Å
194	Q	75.4	Confident	78.6	Confident	25 Å²	25	22.4 Å²	22.4	12%	0.117	11%	0.105	C	C	.	.	H	α-helix	trans	-61.3	-52.6	173.6	-179.2	-175.7	-0.9	0	0	111.1	E190 L191 Y196 N197 E198 D405	E190-Q194 WeakPolarHBondContact O-CB 3.42Å; E190-Q194 PolarHBondContact O-N 3.34Å; L191-Q194 WeakPolarHBondContact O-CB 3.33Å; L191-Q194 PolarHBondContact O-N 3Å; L191-Q194 VanDerWaalsContact O-N 3.14Å; Q194-Y196 VanDerWaalsContact C-N 3.25Å; Q194-Y196 PolarHBondContact O-N 3.09Å; Q194-N197 PolarHBondContact O-N 2.89Å; Q194-E198 PolarHBondContact O-N 3.49Å; Q194-D405 VanDerWaalsContact CD-CB 3.44Å; Q194-D405 HydrophobicContact CG-CB 4.48Å; Q194-D405 PolarHBondContact NE2-OD2 3.36Å
195	I	78	Confident	78.2	Confident	19 Å²	19	27.4 Å²	27.4	10%	0.097	12%	0.124	C	C	.	.	H	α-helix	trans	-57.1	-42.7	176.4	-64.5	165.4	0	0	0	110.1	L7 C151 V184 A186 L191 S192 E198 S199 D245	L7-I195 HydrophobicContact CD1-CG2 4.39Å; L7-I195 HydrophobicContact CD2-CG2 4.22Å; C151-I195 PolarHBondContact SG-O 3.36Å; C151-I195 VanDerWaalsContact SG-O 3.32Å; V184-I195 HydrophobicContact CG1-CD1 4.03Å; V184-I195 HydrophobicContact CG1-CG2 4.11Å; A186-I195 HydrophobicContact CB-CD1 3.93Å; L191-I195 HydrophobicContact CD1-CD1 4.13Å; L191-I195 HydrophobicContact CD1-CG1 4.17Å; L191-I195 HydrophobicContact CG-CD1 3.96Å; L191-I195 HydrophobicContact CG-CG1 4.48Å; L191-I195 VanDerWaalsContact O-CG1 3.32Å; L191-I195 WeakPolarHBondContact O-CG1 3.38Å; L191-I195 PolarHBondContact O-N 3.39Å; S192-I195 PolarHBondContact O-N 3.25Å; I195-E198 PolarHBondContact O-N 2.7Å; I195-S199 VanDerWaalsContact O-CB 3.28Å; I195-S199 WeakPolarHBondContact O-CB 3.38Å; I195-S199 PolarHBondContact O-N 2.87Å; I195-S199 PolarHBondContact O-OG 3.1Å; I195-D245 HydrophobicContact CD1-CB 4.18Å; I195-D245 WeakPolarHBondContact CD1-OD2 3.39Å
196	Y	80.2	Confident	77.5	Confident	49 Å²	49	28.7 Å²	28.7	19%	0.192	13%	0.131	C	C	.	.	H	α-helix	trans	-60.5	-49	177	175.4	-107.1	0	0	0	112.8	L7 S192 L193 Q194 S199 R200 S210 I212	L7-Y196 VanDerWaalsContact CD1-CB 3.44Å; L7-Y196 HydrophobicContact CD1-CD2 3.65Å; L7-Y196 HydrophobicContact CD1-CG 4.04Å; S192-Y196 VanDerWaalsContact O-CB 3.26Å; S192-Y196 WeakPolarHBondContact O-CB 3.43Å; S192-Y196 PolarHBondContact O-N 3.39Å; L193-Y196 HydrophobicContact CD1-CD1 4.25Å; L193-Y196 PolarHBondContact O-N 3.36Å; Q194-Y196 VanDerWaalsContact C-N 3.25Å; Q194-Y196 PolarHBondContact O-N 3.09Å; Y196-S199 PolarHBondContact O-N 3.19Å; Y196-S199 PolarHBondContact O-OG 3.04Å; Y196-R200 HydrophobicContact CE1-CG 4.37Å; Y196-R200 HydrophobicContact CE2-CG 4.34Å; Y196-R200 WeakPolarHBondContact O-CG 3.23Å; Y196-R200 PolarHBondContact O-N 2.85Å; Y196-S210 WeakPolarHBondContact CE2-O 3.44Å; Y196-I212 HydrophobicContact CD1-CB 4.41Å; Y196-I212 HydrophobicContact CD1-CG2 3.93Å; Y196-I212 HydrophobicContact CD2-CB 3.65Å; Y196-I212 HydrophobicContact CD2-CG2 3.86Å; Y196-I212 HydrophobicContact CE1-CG2 4.13Å; Y196-I212 HydrophobicContact CE2-CB 4.23Å; Y196-I212 HydrophobicContact CE2-CG2 4.07Å; Y196-I212 HydrophobicContact CG-CB 3.75Å; Y196-I212 HydrophobicContact CG-CD1 4.32Å; Y196-I212 HydrophobicContact CG-CG2 3.78Å
197	N	79.1	Confident	76.8	Confident	60 Å²	60	30.9 Å²	30.9	32%	0.321	15%	0.145	S	C	.	.	H	α-helix	trans	-64.1	-43.2	179.6	-71.3	-24.8	0	0	0	111.4	L193 Q194 S199 R200 K201	L193-N197 WeakPolarHBondContact O-CB 3.33Å; L193-N197 VanDerWaalsContact O-CG 3.25Å; L193-N197 PolarHBondContact O-N 3.44Å; L193-N197 PolarHBondContact O-ND2 3.01Å; Q194-N197 PolarHBondContact O-N 2.89Å; N197-S199 PolarHBondContact O-N 3.22Å; N197-R200 WeakPolarHBondContact O-CB 3.38Å; N197-R200 PolarHBondContact O-N 2.65Å; N197-K201 WeakPolarHBondContact O-CG 3.42Å; N197-K201 PolarHBondContact O-N 2.93Å
198	E	76.8	Confident	76.4	Confident	19 Å²	19	31.6 Å²	31.6	9%	0.089	15%	0.149	C	C	.	.	H	α-helix	trans	-61.5	-42.6	173.7	-71.6	-54.9	127.6	0	0	111.6	Y119 C151 Q194 I195 R200 K201 F202	Y119-E198 PolarHBondContact OH-OE2 3.1Å; C151-E198 HydrophobicContact CB-CB 4.02Å; C151-E198 WeakPolarHBondContact SG-CB 3.3Å; Q194-E198 PolarHBondContact O-N 3.49Å; I195-E198 PolarHBondContact O-N 2.7Å; E198-R200 PolarHBondContact O-N 3.41Å; E198-K201 WeakPolarHBondContact O-CB 3.44Å; E198-K201 PolarHBondContact O-N 3.14Å; E198-K201 WeakPolarHBondContact OE1-CE 3.48Å; E198-K201 IonicContact OE1-NZ 2.82Å; E198-K201 PolarHBondContact OE1-NZ 3.28Å; E198-K201 IonicContact OE2-NZ 3.16Å; E198-F202 WeakPolarHBondContact O-CD2 3.16Å; E198-F202 PolarHBondContact O-N 2.97Å
199	S	78.2	Confident	76.2	Confident	8 Å²	8	34.8 Å²	34.8	6%	0.056	16%	0.163	C	C	.	.	H	α-helix	trans	-59.3	-36.4	176.5	80.2	0	0	0	0	112.3	C151 I195 Y196 N197 F202 A203 S210	C151-S199 PolarHBondContact SG-N 2.81Å; C151-S199 VanDerWaalsContact SG-N 3.36Å; I195-S199 VanDerWaalsContact O-CB 3.28Å; I195-S199 WeakPolarHBondContact O-CB 3.38Å; I195-S199 PolarHBondContact O-N 2.87Å; I195-S199 PolarHBondContact O-OG 3.1Å; Y196-S199 PolarHBondContact O-N 3.19Å; Y196-S199 PolarHBondContact O-OG 3.04Å; N197-S199 PolarHBondContact O-N 3.22Å; S199-F202 PolarHBondContact O-N 2.93Å; S199-A203 WeakPolarHBondContact O-CB 3.44Å; S199-A203 PolarHBondContact O-N 3.29Å; S199-S210 WeakPolarHBondContact CB-OG 3.4Å; S199-S210 WeakPolarHBondContact OG-CB 3.27Å; S199-S210 PolarHBondContact OG-OG 3.45Å
200	R	80	Confident	76.1	Confident	74 Å²	74	33.5 Å²	33.5	28%	0.279	16%	0.162	S	C	.	.	H	α-helix	trans	-66.6	-35.7	175.6	-71.9	178.2	65.9	-152.3	-0.8	112.4	E68 L69 Y196 N197 E198 Y204	E68-R200 IonicContact OE1-CZ 3.87Å; E68-R200 IonicContact OE1-NH1 2.74Å; E68-R200 PolarHBondContact OE1-NH1 3.02Å; E68-R200 IonicContact OE1-NH2 3.56Å; E68-R200 PolarHBondContact OE1-NH2 2.83Å; L69-R200 HydrophobicContact CD2-CB 3.85Å; Y196-R200 HydrophobicContact CE1-CG 4.37Å; Y196-R200 HydrophobicContact CE2-CG 4.34Å; Y196-R200 WeakPolarHBondContact O-CG 3.23Å; Y196-R200 PolarHBondContact O-N 2.85Å; N197-R200 WeakPolarHBondContact O-CB 3.38Å; N197-R200 PolarHBondContact O-N 2.65Å; E198-R200 PolarHBondContact O-N 3.41Å; R200-Y204 PolarHBondContact O-N 3.35Å; R200-Y204 VanDerWaalsContact O-N 3.09Å
201	K	80.1	Confident	76.2	Confident	20 Å²	20	33.1 Å²	33.1	9%	0.087	16%	0.161	C	C	.	.	H	α-helix	trans	-61.3	-47.4	176.8	-60.5	-177.9	-165.4	-177	0	110.6	L69 F70 N113 N197 E198 Y204	L69-K201 HydrophobicContact CB-CG 4.29Å; L69-K201 VanDerWaalsContact O-CD 3.3Å; L69-K201 WeakPolarHBondContact O-CD 3.23Å; L69-K201 WeakPolarHBondContact O-CE 3.42Å; L69-K201 WeakPolarHBondContact O-CG 3.29Å; F70-K201 HydrophobicContact CD1-CB 4.4Å; F70-K201 HydrophobicContact CE1-CB 3.81Å; F70-K201 HydrophobicContact CE1-CG 4.35Å; F70-K201 HydrophobicContact CZ-CB 4.26Å; F70-K201 WeakPolarHBondContact CZ-O 3.44Å; N113-K201 PolarHBondContact ND2-O 2.82Å; N197-K201 WeakPolarHBondContact O-CG 3.42Å; N197-K201 PolarHBondContact O-N 2.93Å; E198-K201 WeakPolarHBondContact O-CB 3.44Å; E198-K201 PolarHBondContact O-N 3.14Å; E198-K201 WeakPolarHBondContact OE1-CE 3.48Å; E198-K201 IonicContact OE1-NZ 2.82Å; E198-K201 PolarHBondContact OE1-NZ 3.28Å; E198-K201 IonicContact OE2-NZ 3.16Å; K201-Y204 WeakPolarHBondContact O-CB 3.32Å; K201-Y204 PolarHBondContact O-N 2.95Å
202	F	76.7	Confident	76.2	Confident	1 Å²	1	34.1 Å²	34.1	0%	0.004	17%	0.167	C	C	.	.	H	α-helix	trans	-79.5	-27.5	-178.7	-61.8	-67.9	0	0	0	114.2	N113 I114 Y119 P149 C151 L152 E198 S199 Y204	N113-F202 HydrophobicContact CB-CD1 4.48Å; N113-F202 PolarHBondContact ND2-O 3.27Å; I114-F202 HydrophobicContact CG1-CD1 4.48Å; I114-F202 HydrophobicContact CG1-CE1 4.04Å; Y119-F202 HydrophobicContact CD2-CE1 4.31Å; Y119-F202 HydrophobicContact CD2-CZ 4.07Å; Y119-F202 HydrophobicContact CE2-CE1 4.14Å; Y119-F202 HydrophobicContact CE2-CE2 4.48Å; Y119-F202 AromaticContact CE2-CZ 3.56Å; Y119-F202 HydrophobicContact CE2-CZ 3.56Å; P149-F202 HydrophobicContact CB-CE2 4.21Å; P149-F202 HydrophobicContact CB-CZ 3.99Å; C151-F202 HydrophobicContact CB-CD2 3.35Å; C151-F202 HydrophobicContact CB-CE2 3.7Å; C151-F202 HydrophobicContact CB-CG 4.45Å; L152-F202 HydrophobicContact CD1-CE1 4.22Å; L152-F202 HydrophobicContact CD1-CZ 4.2Å; L152-F202 HydrophobicContact CD2-CD1 3.26Å; L152-F202 HydrophobicContact CD2-CE1 3.16Å; L152-F202 HydrophobicContact CD2-CG 3.98Å; L152-F202 HydrophobicContact CD2-CZ 3.79Å; L152-F202 HydrophobicContact CG-CD1 3.94Å; L152-F202 HydrophobicContact CG-CE1 3.5Å; L152-F202 HydrophobicContact CG-CE2 4.15Å; L152-F202 HydrophobicContact CG-CG 4.39Å; L152-F202 HydrophobicContact CG-CZ 3.54Å; E198-F202 WeakPolarHBondContact O-CD2 3.16Å; E198-F202 PolarHBondContact O-N 2.97Å; S199-F202 PolarHBondContact O-N 2.93Å; F202-Y204 PolarHBondContact O-N 3.35Å
203	A	76.9	Confident	76	Confident	14 Å²	14	35.6 Å²	35.6	12%	0.116	17%	0.174	C	C	.	.	H	α-helix	trans	-78.7	-5.1	172.4	0	0	0	0	0	113	S199 R205 T206 I208	S199-A203 WeakPolarHBondContact O-CB 3.44Å; S199-A203 PolarHBondContact O-N 3.29Å; A203-R205 PolarHBondContact O-N 3.3Å; A203-T206 WeakPolarHBondContact CA-OG1 3.37Å; A203-T206 WeakPolarHBondContact O-CB 3.16Å; A203-T206 PolarHBondContact O-N 2.95Å; A203-T206 PolarHBondContact O-OG1 3.32Å; A203-I208 HydrophobicContact CB-CB 4.25Å; A203-I208 HydrophobicContact CB-CG2 4.35Å
204	Y	79.4	Confident	75.8	Confident	36 Å²	36	33.3 Å²	33.3	14%	0.141	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	131	179.1	-177.5	-116.9	0	0	0	110.9	V65 I66 L69 F70 N113 L116 R200 K201 F202 T206	V65-Y204 HydrophobicContact CG1-CD2 4.22Å; V65-Y204 HydrophobicContact CG1-CE2 3.76Å; I66-Y204 HydrophobicContact CG1-CE1 4.06Å; I66-Y204 WeakPolarHBondContact CG1-OH 3.32Å; L69-Y204 HydrophobicContact CD1-CD2 3.86Å; L69-Y204 HydrophobicContact CD1-CG 4.32Å; F70-Y204 AromaticContact CE2-CD1 3.89Å; F70-Y204 HydrophobicContact CE2-CD1 3.89Å; F70-Y204 HydrophobicContact CE2-CE1 4.35Å; F70-Y204 HydrophobicContact CE2-CG 4.15Å; F70-Y204 HydrophobicContact CZ-CD1 4.08Å; F70-Y204 HydrophobicContact CZ-CG 4.28Å; N113-Y204 PolarHBondContact ND2-O 2.96Å; L116-Y204 HydrophobicContact CD1-CD1 4.21Å; L116-Y204 HydrophobicContact CD1-CE1 4.27Å; R200-Y204 PolarHBondContact O-N 3.35Å; R200-Y204 VanDerWaalsContact O-N 3.09Å; K201-Y204 WeakPolarHBondContact O-CB 3.32Å; K201-Y204 PolarHBondContact O-N 2.95Å; F202-Y204 PolarHBondContact O-N 3.35Å; Y204-T206 PolarHBondContact O-N 3.48Å; Y204-T206 VanDerWaalsContact O-N 3.15Å
205	R	75.1	Confident	75.4	Confident	111 Å²	111	32.1 Å²	32.1	42%	0.419	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	8.9	-175.3	-55.3	170.6	75.3	-168.2	8.6	116	D29 A203	D29-R205 IonicContact OD2-CZ 3.58Å; D29-R205 IonicContact OD2-NH2 3.31Å; D29-R205 PolarHBondContact OD2-NH2 3.02Å; A203-R205 PolarHBondContact O-N 3.3Å
206	T	72.3	Confident	74.8	Confident	27 Å²	27	32.8 Å²	32.8	17%	0.166	17%	0.167	C	C	.	.	S	Bend	trans	-98.6	162.4	173.2	78.5	0	0	0	0	111	W109 A203 Y204 I208	W109-T206 HydrophobicContact CB-CG2 4.39Å; W109-T206 HydrophobicContact CE3-CG2 4.22Å; A203-T206 WeakPolarHBondContact CA-OG1 3.37Å; A203-T206 WeakPolarHBondContact O-CB 3.16Å; A203-T206 PolarHBondContact O-N 2.95Å; A203-T206 PolarHBondContact O-OG1 3.32Å; Y204-T206 PolarHBondContact O-N 3.48Å; Y204-T206 VanDerWaalsContact O-N 3.15Å; T206-I208 PolarHBondContact O-N 2.98Å; T206-I208 WeakPolarHBondContact OG1-CB 3.24Å; T206-I208 PolarHBondContact OG1-N 3.02Å
207	P	68.9	Low	73.6	Confident	52 Å²	52	35.4 Å²	35.4	34%	0.338	18%	0.177	S	C	.	.	S	Bend	trans	-74.6	2.7	171.8	32	-37.1	0	0	0	113.6
208	I	70.9	Confident	72.4	Confident	17 Å²	17	40.9 Å²	40.9	9%	0.087	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	131.1	-177	-58.2	174.2	0	0	0	109.1	V9 C158 L162 A203 T206	V9-I208 HydrophobicContact CG1-CG2 3.11Å; C158-I208 HydrophobicContact CB-CD1 3.85Å; L162-I208 HydrophobicContact CD1-CD1 4.23Å; L162-I208 HydrophobicContact CD1-CG1 4.12Å; A203-I208 HydrophobicContact CB-CB 4.25Å; A203-I208 HydrophobicContact CB-CG2 4.35Å; T206-I208 PolarHBondContact O-N 2.98Å; T206-I208 WeakPolarHBondContact OG1-CB 3.24Å; T206-I208 PolarHBondContact OG1-N 3.02Å
209	Q	70.5	Confident	71.4	Confident	74 Å²	74	44.3 Å²	44.3	35%	0.346	22%	0.219	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	117.1	175.9	-66.5	-171.7	-38.2	0	0	110	V9 D10 T230	V9-Q209 WeakPolarHBondContact CA-O 3.49Å; D10-Q209 PolarHBondContact N-O 3.15Å; D10-Q209 PolarHBondContact O-N 3.39Å; Q209-T230 HydrophobicContact CB-CG2 4.28Å
210	S	73.3	Confident	70.5	Confident	20 Å²	20	47.9 Å²	47.9	14%	0.14	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	142.6	168.2	-51	0	0	0	0	110.3	Y196 S199	Y196-S210 WeakPolarHBondContact CE2-O 3.44Å; S199-S210 WeakPolarHBondContact CB-OG 3.4Å; S199-S210 WeakPolarHBondContact OG-CB 3.27Å; S199-S210 PolarHBondContact OG-OG 3.45Å
211	A	74.9	Confident	69.1	Low	9 Å²	9	52.2 Å²	52.2	7%	0.074	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	151.8	168.9	0	0	0	0	0	109.8	L7 T8 L227	L7-A211 CarbonylContact C-O 3.51Å; L7-A211 WeakPolarHBondContact CA-O 3.39Å; L7-A211 WeakPolarHBondContact CG-O 3.5Å; T8-A211 PolarHBondContact N-O 2.8Å; T8-A211 PolarHBondContact O-N 3.39Å; A211-L227 HydrophobicContact CB-CD2 3.36Å; A211-L227 HydrophobicContact CB-CG 4.18Å
212	I	76.2	Confident	68	Low	24 Å²	24	55 Å²	55	12%	0.123	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	135.3	-179.5	-169.4	-174.1	0	0	0	109.4	L7 S192 L193 Y196 Y214	L7-I212 HydrophobicContact CD1-CB 4.39Å; S192-I212 VanDerWaalsContact O-CD1 3.3Å; S192-I212 WeakPolarHBondContact O-CD1 3.48Å; L193-I212 HydrophobicContact CB-CD1 4.19Å; L193-I212 HydrophobicContact CD1-CD1 4.37Å; Y196-I212 HydrophobicContact CD1-CB 4.41Å; Y196-I212 HydrophobicContact CD1-CG2 3.93Å; Y196-I212 HydrophobicContact CD2-CB 3.65Å; Y196-I212 HydrophobicContact CD2-CG2 3.86Å; Y196-I212 HydrophobicContact CE1-CG2 4.13Å; Y196-I212 HydrophobicContact CE2-CB 4.23Å; Y196-I212 HydrophobicContact CE2-CG2 4.07Å; Y196-I212 HydrophobicContact CG-CB 3.75Å; Y196-I212 HydrophobicContact CG-CD1 4.32Å; Y196-I212 HydrophobicContact CG-CG2 3.78Å; I212-Y214 HydrophobicContact CD1-CD1 3.59Å; I212-Y214 HydrophobicContact CD1-CE1 3.82Å; I212-Y214 HydrophobicContact CG1-CD1 3.89Å; I212-Y214 HydrophobicContact CG1-CE1 4.39Å
213	L	75.6	Confident	67	Low	32 Å²	32	56 Å²	56	17%	0.168	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	128.2	172.8	-178.2	70.7	0	0	0	107.5	Q5 M6 L227	Q5-L213 CarbonylContact C-O 3.5Å; Q5-L213 WeakPolarHBondContact CA-O 2.97Å; M6-L213 HydrophobicContact CB-CB 4.2Å; M6-L213 HydrophobicContact CB-CD2 4.34Å; M6-L213 PolarHBondContact N-O 2.9Å; M6-L213 WeakPolarHBondContact O-CA 3.44Å; M6-L213 WeakPolarHBondContact O-CB 3.49Å; M6-L213 PolarHBondContact O-N 3.3Å; L213-L227 HydrophobicContact CB-CD1 4.19Å; L213-L227 HydrophobicContact CD1-CD1 3.94Å
214	Y	73.5	Confident	65.7	Low	9 Å²	9	56.2 Å²	56.2	4%	0.035	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.6	138.9	167.7	60.3	-92.6	0	0	0	108.2	R189 I212 R217 Q223 Q376 E380	R189-Y214 HydrophobicContact CB-CD2 3.84Å; R189-Y214 HydrophobicContact CB-CE2 4.27Å; R189-Y214 HydrophobicContact CB-CG 4.17Å; R189-Y214 HydrophobicContact CG-CD2 3.61Å; R189-Y214 HydrophobicContact CG-CE2 4.36Å; R189-Y214 HydrophobicContact CG-CG 4.09Å; I212-Y214 HydrophobicContact CD1-CD1 3.59Å; I212-Y214 HydrophobicContact CD1-CE1 3.82Å; I212-Y214 HydrophobicContact CG1-CD1 3.89Å; I212-Y214 HydrophobicContact CG1-CE1 4.39Å; Y214-R217 HydrophobicContact CE2-CG 4.36Å; Y214-R217 PolarHBondContact OH-NE 3.23Å; Y214-Q223 PolarHBondContact O-NE2 2.87Å; Y214-Q223 VanDerWaalsContact O-NE2 3.15Å; Y214-Q223 PolarHBondContact O-OE1 2.96Å; Y214-Q223 VanDerWaalsContact O-OE1 3.1Å; Y214-Q376 HydrophobicContact CE2-CG 4.5Å; Y214-E380 PolarHBondContact OH-OE1 3.26Å
215	G	67.9	Low	64.1	Low	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.287	C	S	.	.	S	Bend	trans	-73.1	178	-176.2	0	0	0	0	0	114.3	R189 Y220	R189-G215 PolarHBondContact NE-O 3.01Å; R189-G215 PolarHBondContact NH2-O 3.01Å; G215-Y220 WeakPolarHBondContact CA-OH 3.34Å
216	G	63.6	Low	62.8	Low	32 Å²	32	60.9 Å²	60.9	33%	0.33	30%	0.301	S	S	.	.			trans	88.2	10	174.5	0	0	0	0	0	116.4	N3	N3-G216 PolarHBondContact ND2-N 3.18Å
217	R	56.6	Low	61.4	Low	105 Å²	105	60 Å²	60	40%	0.396	30%	0.295	S	S	.	.			trans	-103	136.9	157.7	-73.7	-168.9	172	-166.4	2.8	108.8	Y214 N219 Y220 E380	Y214-R217 HydrophobicContact CE2-CG 4.36Å; Y214-R217 PolarHBondContact OH-NE 3.23Å; R217-N219 PolarHBondContact O-N 3.2Å; R217-N219 VanDerWaalsContact O-N 3.12Å; R217-Y220 WeakPolarHBondContact O-CD2 3.4Å; R217-Y220 PolarHBondContact O-N 2.98Å; R217-E380 IonicContact CZ-OE1 3.89Å; R217-E380 IonicContact CZ-OE2 3.58Å; R217-E380 IonicContact NE-OE1 3.01Å; R217-E380 IonicContact NH2-OE1 3.01Å; R217-E380 PolarHBondContact NH2-OE1 3.32Å; R217-E380 IonicContact NH2-OE2 3.51Å; R217-E380 PolarHBondContact NH2-OE2 3Å
218	E	53.3	Low	59.9	Low	175 Å²	175	60.3 Å²	60.3	82%	0.818	30%	0.296	S	S	*	.	S	Bend	trans	-61.1	-20.5	178.6	-57.2	-177.2	-165.5	0	0	111.7	Y220	E218-Y220 PolarHBondContact O-N 3.42Å
219	N	56.2	Low	58.1	Low	91 Å²	91	63.4 Å²	63.4	49%	0.487	32%	0.315	S	S	.	.			trans	-99	58	177.3	-61.6	1.8	0	0	0	112.4	R217 K221 D222 Q223	R217-N219 PolarHBondContact O-N 3.2Å; R217-N219 VanDerWaalsContact O-N 3.12Å; N219-K221 PolarHBondContact O-N 2.84Å; N219-D222 HydrophobicContact CB-CB 3.83Å; N219-D222 WeakPolarHBondContact CB-OD2 3.32Å; N219-D222 PolarHBondContact ND2-OD2 2.98Å; N219-D222 PolarHBondContact O-N 3Å; N219-Q223 PolarHBondContact O-N 3.01Å
220	Y	57.9	Low	56.3	Low	82 Å²	82	60.5 Å²	60.5	32%	0.322	30%	0.302	S	S	.	.	H	α-helix	trans	-49.9	-39.2	163.8	-92.9	-88.1	0	0	0	110.5	N3 G215 R217 E218 D222 Q223 I224	N3-Y220 VanDerWaalsContact CG-OH 3.29Å; N3-Y220 PolarHBondContact OD1-OH 2.7Å; G215-Y220 WeakPolarHBondContact CA-OH 3.34Å; R217-Y220 WeakPolarHBondContact O-CD2 3.4Å; R217-Y220 PolarHBondContact O-N 2.98Å; E218-Y220 PolarHBondContact O-N 3.42Å; Y220-D222 VanDerWaalsContact C-N 3.3Å; Y220-D222 PolarHBondContact O-N 3.24Å; Y220-Q223 PolarHBondContact O-N 3.23Å; Y220-I224 WeakPolarHBondContact O-CA 3.3Å; Y220-I224 WeakPolarHBondContact O-CB 3.44Å; Y220-I224 WeakPolarHBondContact O-CD1 3.48Å; Y220-I224 WeakPolarHBondContact O-CG1 3.45Å; Y220-I224 PolarHBondContact O-N 3.5Å
221	K	51.3	Low	54.3	Low	165 Å²	165	60.5 Å²	60.5	72%	0.717	30%	0.303	S	S	*	.	H	α-helix	trans	-59.5	-32.3	175.5	-71.5	-176.2	-179.9	176.2	0	113.9	N219 I224 N225	N219-K221 PolarHBondContact O-N 2.84Å; K221-I224 CarbonylContact O-C 3.41Å; K221-N225 WeakPolarHBondContact O-CA 3.47Å; K221-N225 WeakPolarHBondContact O-CB 3.45Å; K221-N225 PolarHBondContact O-N 3.17Å; K221-N225 PolarHBondContact O-ND2 2.65Å; K221-N225 PolarHBondContact O-OD1 3.06Å
222	D	57.7	Low	52.2	Low	78 Å²	78	66 Å²	66	42%	0.417	32%	0.321	S	S	.	.	H	α-helix	trans	-80.8	-37.8	178.9	-72	-20.9	0	0	0	112.6	N219 Y220 I224 N225 K226	N219-D222 HydrophobicContact CB-CB 3.83Å; N219-D222 WeakPolarHBondContact CB-OD2 3.32Å; N219-D222 PolarHBondContact ND2-OD2 2.98Å; N219-D222 PolarHBondContact O-N 3Å; Y220-D222 VanDerWaalsContact C-N 3.3Å; Y220-D222 PolarHBondContact O-N 3.24Å; D222-I224 VanDerWaalsContact C-N 3.31Å; D222-N225 PolarHBondContact O-N 3.44Å; D222-K226 WeakPolarHBondContact O-CG 3.48Å; D222-K226 PolarHBondContact O-N 2.86Å
223	Q	54.9	Low	50.6	Low	22 Å²	22	66.2 Å²	66.2	10%	0.103	33%	0.325	C	S	.	.	H	α-helix	trans	-62.3	-47.7	170.8	-64.6	-172.5	18	0	0	109.4	Y214 N219 Y220 N225 K226 L227	Y214-Q223 PolarHBondContact O-NE2 2.87Å; Y214-Q223 VanDerWaalsContact O-NE2 3.15Å; Y214-Q223 PolarHBondContact O-OE1 2.96Å; Y214-Q223 VanDerWaalsContact O-OE1 3.1Å; N219-Q223 PolarHBondContact O-N 3.01Å; Y220-Q223 PolarHBondContact O-N 3.23Å; Q223-N225 VanDerWaalsContact C-N 3.31Å; Q223-N225 PolarHBondContact O-N 3.31Å; Q223-K226 PolarHBondContact O-N 2.96Å; Q223-L227 WeakPolarHBondContact O-CD1 3.26Å; Q223-L227 WeakPolarHBondContact O-CG 3.48Å; Q223-L227 PolarHBondContact O-N 3.23Å
224	I	50.5	Low	49	Very low	19 Å²	19	71 Å²	71	10%	0.097	34%	0.341	C	S	.	.	H	α-helix	trans	-61	-38.8	173.3	-67.2	167.6	0	0	0	109.8	Y220 K221 D222 K226 L227 V228 W232	Y220-I224 WeakPolarHBondContact O-CA 3.3Å; Y220-I224 WeakPolarHBondContact O-CB 3.44Å; Y220-I224 WeakPolarHBondContact O-CD1 3.48Å; Y220-I224 WeakPolarHBondContact O-CG1 3.45Å; Y220-I224 PolarHBondContact O-N 3.5Å; K221-I224 CarbonylContact O-C 3.41Å; D222-I224 VanDerWaalsContact C-N 3.31Å; I224-K226 PolarHBondContact O-N 2.83Å; I224-L227 CarbonylContact O-C 3.51Å; I224-L227 WeakPolarHBondContact O-CA 3.09Å; I224-L227 VanDerWaalsContact O-CB 3.28Å; I224-L227 WeakPolarHBondContact O-CB 3.43Å; I224-L227 PolarHBondContact O-N 2.85Å; I224-V228 HydrophobicContact CG2-CG2 3.88Å; I224-V228 WeakPolarHBondContact O-CA 3.41Å; I224-V228 WeakPolarHBondContact O-CG2 3.49Å; I224-V228 PolarHBondContact O-N 2.68Å; I224-W232 HydrophobicContact CB-CZ2 4.5Å; I224-W232 HydrophobicContact CG2-CD2 4.08Å; I224-W232 HydrophobicContact CG2-CE3 4.4Å; I224-W232 HydrophobicContact CG2-CH2 3.47Å; I224-W232 VanDerWaalsContact CG2-CH2 3.47Å; I224-W232 HydrophobicContact CG2-CZ2 3.04Å; I224-W232 HydrophobicContact CG2-CZ3 4.12Å
225	N	44.8	Very low	48	Very low	85 Å²	85	71.6 Å²	71.6	46%	0.455	35%	0.347	S	S	.	.	H	α-helix	trans	-67.1	-35.2	177.1	-75.6	-27.5	0	0	0	113.6	K221 D222 Q223 L227 V228 V229	K221-N225 WeakPolarHBondContact O-CA 3.47Å; K221-N225 WeakPolarHBondContact O-CB 3.45Å; K221-N225 PolarHBondContact O-N 3.17Å; K221-N225 PolarHBondContact O-ND2 2.65Å; K221-N225 PolarHBondContact O-OD1 3.06Å; D222-N225 PolarHBondContact O-N 3.44Å; Q223-N225 VanDerWaalsContact C-N 3.31Å; Q223-N225 PolarHBondContact O-N 3.31Å; N225-L227 VanDerWaalsContact C-N 3.28Å; N225-V228 HydrophobicContact CB-CG2 4.45Å; N225-V228 WeakPolarHBondContact O-CB 3.48Å; N225-V228 PolarHBondContact O-N 3.5Å; N225-V228 WeakPolarHBondContact OD1-CG2 3.48Å; N225-V229 PolarHBondContact O-N 3.35Å
226	K	48.4	Very low	47.8	Very low	161 Å²	161	72.1 Å²	72.1	70%	0.7	35%	0.35	S	S	*	.	H	α-helix	trans	-66.3	-35.3	168.3	-70.6	176.5	-179.2	-179.5	0	111.1	D222 Q223 I224 T230	D222-K226 WeakPolarHBondContact O-CG 3.48Å; D222-K226 PolarHBondContact O-N 2.86Å; Q223-K226 PolarHBondContact O-N 2.96Å; I224-K226 PolarHBondContact O-N 2.83Å; K226-T230 PolarHBondContact O-OG1 3.49Å
227	L	43.4	Very low	47.7	Very low	8 Å²	8	75.2 Å²	75.2	4%	0.042	36%	0.359	C	S	.	.	H	α-helix	trans	-76.8	-14.7	165.8	-63.5	150.4	0	0	0	112.7	A211 L213 Q223 I224 N225 V229 T230 C231	A211-L227 HydrophobicContact CB-CD2 3.36Å; A211-L227 HydrophobicContact CB-CG 4.18Å; L213-L227 HydrophobicContact CB-CD1 4.19Å; L213-L227 HydrophobicContact CD1-CD1 3.94Å; Q223-L227 WeakPolarHBondContact O-CD1 3.26Å; Q223-L227 WeakPolarHBondContact O-CG 3.48Å; Q223-L227 PolarHBondContact O-N 3.23Å; I224-L227 CarbonylContact O-C 3.51Å; I224-L227 WeakPolarHBondContact O-CA 3.09Å; I224-L227 VanDerWaalsContact O-CB 3.28Å; I224-L227 WeakPolarHBondContact O-CB 3.43Å; I224-L227 PolarHBondContact O-N 2.85Å; N225-L227 VanDerWaalsContact C-N 3.28Å; L227-V229 PolarHBondContact O-N 2.75Å; L227-T230 CarbonylContact O-C 3.55Å; L227-T230 WeakPolarHBondContact O-CA 3.18Å; L227-T230 PolarHBondContact O-N 3.33Å; L227-C231 HydrophobicContact CB-CB 4.35Å; L227-C231 WeakPolarHBondContact CB-O 3.25Å; L227-C231 HydrophobicContact CD2-CB 3.67Å; L227-C231 CarbonylContact O-C 3.58Å; L227-C231 WeakPolarHBondContact O-CA 3.39Å; L227-C231 PolarHBondContact O-N 3.44Å
228	V	36.4	Very low	48.3	Very low	58 Å²	58	73 Å²	73	35%	0.352	36%	0.355	S	S	.	.	H	α-helix	trans	-74.9	-21.9	179.9	173.7	0	0	0	0	107.5	I224 N225 W232	I224-V228 HydrophobicContact CG2-CG2 3.88Å; I224-V228 WeakPolarHBondContact O-CA 3.41Å; I224-V228 WeakPolarHBondContact O-CG2 3.49Å; I224-V228 PolarHBondContact O-N 2.68Å; N225-V228 HydrophobicContact CB-CG2 4.45Å; N225-V228 WeakPolarHBondContact O-CB 3.48Å; N225-V228 PolarHBondContact O-N 3.5Å; N225-V228 WeakPolarHBondContact OD1-CG2 3.48Å; V228-W232 HydrophobicContact CG2-CZ2 3.7Å
229	V	33.9	Very low	49.4	Very low	83 Å²	83	64.7 Å²	64.7	50%	0.503	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-24.9	164.8	-170.8	0	0	0	0	111.6	F12 Q178 N225 L227	F12-V229 HydrophobicContact CE2-CG1 4.14Å; Q178-V229 PolarHBondContact NE2-O 2.99Å; N225-V229 PolarHBondContact O-N 3.35Å; L227-V229 PolarHBondContact O-N 2.75Å
230	T	32.5	Very low	50.5	Low	12 Å²	12	64 Å²	64	7%	0.074	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-144.9	-2.6	-164.2	49.4	0	0	0	0	120.9	Q178 Q209 K226 L227	Q178-T230 VanDerWaalsContact CB-C 3.41Å; Q178-T230 WeakPolarHBondContact CB-O 3.3Å; Q178-T230 WeakPolarHBondContact CG-O 3.28Å; Q209-T230 HydrophobicContact CB-CG2 4.28Å; K226-T230 PolarHBondContact O-OG1 3.49Å; L227-T230 CarbonylContact O-C 3.55Å; L227-T230 WeakPolarHBondContact O-CA 3.18Å; L227-T230 PolarHBondContact O-N 3.33Å
231	C	31.2	Very low	51.6	Low	21 Å²	21	60.7 Å²	60.7	14%	0.142	29%	0.294	C	S	.	.			trans	-179.2	95.4	-178.1	-172.7	0	0	0	0	113.8	L227	L227-C231 HydrophobicContact CB-CB 4.35Å; L227-C231 WeakPolarHBondContact CB-O 3.25Å; L227-C231 HydrophobicContact CD2-CB 3.67Å; L227-C231 CarbonylContact O-C 3.58Å; L227-C231 WeakPolarHBondContact O-CA 3.39Å; L227-C231 PolarHBondContact O-N 3.44Å
232	W	30.2	Very low	53.3	Low	123 Å²	123	52.9 Å²	52.9	47%	0.466	26%	0.26	S	S	.	.			trans	-113.9	88.4	144.9	-72	81.5	0	0	0	107.8	C177 I224 V228	C177-W232 VanDerWaalsContact CA-O 3.25Å; C177-W232 WeakPolarHBondContact CA-O 3.49Å; C177-W232 PolarHBondContact SG-O 3.08Å; I224-W232 HydrophobicContact CB-CZ2 4.5Å; I224-W232 HydrophobicContact CG2-CD2 4.08Å; I224-W232 HydrophobicContact CG2-CE3 4.4Å; I224-W232 HydrophobicContact CG2-CH2 3.47Å; I224-W232 VanDerWaalsContact CG2-CH2 3.47Å; I224-W232 HydrophobicContact CG2-CZ2 3.04Å; I224-W232 HydrophobicContact CG2-CZ3 4.12Å; V228-W232 HydrophobicContact CG2-CZ2 3.7Å
233	C	42.1	Very low	54.7	Low	29 Å²	29	49.3 Å²	49.3	20%	0.196	24%	0.241	C	C	.	.			trans	-126.5	120.2	171.9	-85.7	0	0	0	0	113.7	C177 Q178 A235	C177-C233 WeakPolarHBondContact CA-SG 3.42Å; C177-C233 WeakPolarHBondContact CB-SG 3.41Å; C177-C233 WeakPolarHBondContact SG-CA 3.3Å; C177-C233 WeakPolarHBondContact SG-CB 3.47Å; C177-C233 CovalentContact SG-SG 2.04Å; C177-C233 PolarHBondContact SG-SG 2.9Å; Q178-C233 PolarHBondContact N-SG 3.26Å; Q178-C233 WeakPolarHBondContact O-CB 3.28Å; Q178-C233 PolarHBondContact O-SG 2.97Å; C233-A235 WeakPolarHBondContact CB-O 3.18Å; C233-A235 PolarHBondContact O-N 3.03Å; C233-A235 VanDerWaalsContact O-N 3.16Å
234	R	42.8	Very low	56.3	Low	133 Å²	133	48.3 Å²	48.3	50%	0.502	24%	0.236	S	C	.	.	S	Bend	trans	-70.5	11.2	163.6	-54	177.4	82.9	-170.4	14.1	111.9
235	A	53.3	Low	58	Low	21 Å²	21	48.5 Å²	48.5	17%	0.174	24%	0.237	C	C	.	.			trans	-155	118.2	-168.7	0	0	0	0	0	110.8	F179 C233 L237 S266	F179-A235 HydrophobicContact CE1-CB 4.42Å; C233-A235 WeakPolarHBondContact CB-O 3.18Å; C233-A235 PolarHBondContact O-N 3.03Å; C233-A235 VanDerWaalsContact O-N 3.16Å; A235-L237 HydrophobicContact CB-CD1 3.63Å; A235-L237 HydrophobicContact CB-CG 3.85Å; A235-L237 PolarHBondContact O-N 2.94Å; A235-S266 WeakPolarHBondContact CA-O 3.27Å
236	L	62.8	Low	59.8	Low	12 Å²	12	45.5 Å²	45.5	6%	0.063	22%	0.22	C	C	.	.			trans	-88	30.9	175.5	-66.2	171.4	0	0	0	111.6	P180 L183 D238 C239 I262 S266 M268 P269	P180-L236 HydrophobicContact CG-CD2 3.78Å; L183-L236 HydrophobicContact CD2-CD1 3.81Å; L183-L236 HydrophobicContact CD2-CD2 4.32Å; L236-D238 VanDerWaalsContact C-N 3.27Å; L236-D238 PolarHBondContact O-N 3.03Å; L236-C239 HydrophobicContact CB-CB 4.06Å; L236-C239 WeakPolarHBondContact O-CB 3.11Å; L236-C239 PolarHBondContact O-N 2.97Å; L236-I262 HydrophobicContact CD1-CG2 3.63Å; L236-S266 PolarHBondContact N-O 3.04Å; L236-M268 HydrophobicContact CB-CB 4.14Å; L236-M268 HydrophobicContact CB-CE 4.45Å; L236-M268 HydrophobicContact CD1-CE 3.64Å; L236-P269 VanDerWaalsContact O-CD 3.32Å; L236-P269 WeakPolarHBondContact O-CD 2.97Å
237	L	60.7	Low	61.6	Low	97 Å²	97	37.8 Å²	37.8	51%	0.508	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-31.9	-168.2	-72.4	162.1	0	0	0	114.2	F179 A235 G267 P269	F179-L237 HydrophobicContact CD1-CB 4.34Å; F179-L237 HydrophobicContact CE1-CD1 4.29Å; A235-L237 HydrophobicContact CB-CD1 3.63Å; A235-L237 HydrophobicContact CB-CG 3.85Å; A235-L237 PolarHBondContact O-N 2.94Å; L237-G267 VanDerWaalsContact CA-O 3.25Å; L237-G267 WeakPolarHBondContact CA-O 3.41Å; L237-G267 WeakPolarHBondContact CD2-O 3Å; L237-G267 PolarHBondContact N-O 3.48Å; L237-P269 WeakPolarHBondContact O-CG 3.37Å
238	D	70	Confident	63.6	Low	59 Å²	59	37.6 Å²	37.6	32%	0.316	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	13.6	178.9	-60.4	-43.7	0	0	0	112.7	F179 L236 R240	F179-D238 HydrophobicContact CB-CB 3.82Å; F179-D238 WeakPolarHBondContact CB-OD2 3.43Å; L236-D238 VanDerWaalsContact C-N 3.27Å; L236-D238 PolarHBondContact O-N 3.03Å; D238-R240 PolarHBondContact O-N 3.4Å; D238-R240 VanDerWaalsContact O-N 3.07Å
239	C	76.8	Confident	65.7	Low	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.			trans	-71.8	102.8	178	-175.8	0	0	0	0	110.5	P180 L183 L236 F241 M268 P269	P180-C239 VanDerWaalsContact O-CA 3.29Å; P180-C239 WeakPolarHBondContact O-CA 3.46Å; P180-C239 PolarHBondContact O-N 3.39Å; L183-C239 VanDerWaalsContact CB-SG 3.55Å; L236-C239 HydrophobicContact CB-CB 4.06Å; L236-C239 WeakPolarHBondContact O-CB 3.11Å; L236-C239 PolarHBondContact O-N 2.97Å; C239-F241 PolarHBondContact SG-O 3.48Å; C239-M268 HydrophobicContact CB-CG 4.4Å; C239-P269 WeakPolarHBondContact O-CD 3.14Å; C239-P269 WeakPolarHBondContact O-CG 2.99Å
240	R	78.8	Confident	68.1	Low	77 Å²	77	31.1 Å²	31.1	29%	0.291	15%	0.146	S	C	.	.			trans	-93.1	-20.9	-179.4	-65.6	-175.7	-173.9	-116.3	-8.6	113.4	F165 S181 D238 R274 Q275	F165-R240 VanDerWaalsContact CE1-NH2 3.33Å; F165-R240 VanDerWaalsContact CE2-NH2 3.31Å; S181-R240 PolarHBondContact O-N 3.11Å; D238-R240 PolarHBondContact O-N 3.4Å; D238-R240 VanDerWaalsContact O-N 3.07Å; R240-R274 CarbonylContact O-C 3.56Å; R240-R274 WeakPolarHBondContact O-CA 3.14Å; R240-R274 WeakPolarHBondContact O-CB 3.41Å; R240-Q275 PolarHBondContact O-N 3.12Å
241	F	81.5	Confident	70.7	Confident	12 Å²	12	31.9 Å²	31.9	5%	0.053	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	118.7	-178.8	-56.3	-74.6	0	0	0	109.6	F153 V157 Y161 S181 A182 L183 C239 Q275	F153-F241 AromaticContact CE1-CD1 4Å; F153-F241 HydrophobicContact CE1-CD1 4Å; V157-F241 HydrophobicContact CB-CE1 4.37Å; V157-F241 HydrophobicContact CB-CZ 4.37Å; V157-F241 HydrophobicContact CG1-CD1 4.18Å; V157-F241 HydrophobicContact CG1-CE1 3.26Å; V157-F241 HydrophobicContact CG1-CE2 4Å; V157-F241 HydrophobicContact CG1-CZ 3.16Å; Y161-F241 HydrophobicContact CD2-CE2 4.43Å; Y161-F241 AromaticContact CD2-CZ 3.8Å; Y161-F241 HydrophobicContact CD2-CZ 3.8Å; Y161-F241 AromaticContact CE2-CZ 3.94Å; Y161-F241 HydrophobicContact CE2-CZ 3.94Å; S181-F241 PolarHBondContact O-N 3.23Å; S181-F241 VanDerWaalsContact O-N 3.16Å; A182-F241 CarbonylContact C-O 3.55Å; A182-F241 WeakPolarHBondContact CA-O 3.36Å; A182-F241 HydrophobicContact CB-CB 3.8Å; A182-F241 HydrophobicContact CB-CD2 4.33Å; L183-F241 PolarHBondContact N-O 3.29Å; C239-F241 PolarHBondContact SG-O 3.48Å; F241-Q275 WeakPolarHBondContact CA-O 3.27Å; F241-Q275 HydrophobicContact CD1-CB 3.89Å; F241-Q275 HydrophobicContact CE1-CB 3.99Å
242	L	87	Confident	73.1	Confident	0 Å²	0	35.3 Å²	35.3	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	130.9	174.6	173.4	63.7	0	0	0	109.2	L183 L185 L244 V263 M268 Q275 T276 M277	L183-L242 HydrophobicContact CB-CD1 4.37Å; L183-L242 HydrophobicContact CD2-CD1 4Å; L183-L242 HydrophobicContact CG-CD1 4.3Å; L185-L242 HydrophobicContact CD1-CD1 4.14Å; L185-L242 HydrophobicContact CG-CD1 4.3Å; L242-L244 HydrophobicContact CD1-CD1 4Å; L242-L244 HydrophobicContact CD2-CD1 3.9Å; L242-L244 HydrophobicContact CG-CD1 3.69Å; L242-V263 HydrophobicContact CD2-CG2 3.74Å; L242-M268 HydrophobicContact CB-SD 4.39Å; L242-M268 HydrophobicContact CD1-CE 4.04Å; L242-M268 HydrophobicContact CD1-SD 4.47Å; L242-M268 HydrophobicContact CD2-CE 4.36Å; L242-M268 HydrophobicContact CD2-SD 3.8Å; L242-M268 HydrophobicContact CG-SD 4.44Å; L242-Q275 PolarHBondContact N-O 3.47Å; L242-T276 HydrophobicContact CB-CG2 4.16Å; L242-T276 HydrophobicContact CD2-CG2 3.83Å; L242-T276 HydrophobicContact CG-CG2 4.02Å; L242-T276 CarbonylContact O-C 3.58Å; L242-T276 VanDerWaalsContact O-CA 3.3Å; L242-T276 WeakPolarHBondContact O-CA 3.39Å; L242-M277 PolarHBondContact O-N 3Å
243	V	86.5	Confident	75.3	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.024	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	129.4	-179.8	-170	0	0	0	0	109	F150 L183 V184 L185 M277 F279	F150-V243 HydrophobicContact CD1-CB 4.38Å; F150-V243 HydrophobicContact CD1-CG1 3.74Å; F150-V243 HydrophobicContact CD1-CG2 3.86Å; F150-V243 HydrophobicContact CD2-CG1 4.42Å; F150-V243 HydrophobicContact CE1-CB 3.94Å; F150-V243 HydrophobicContact CE1-CG1 3.6Å; F150-V243 HydrophobicContact CE1-CG2 3.07Å; F150-V243 HydrophobicContact CE2-CG1 4.26Å; F150-V243 HydrophobicContact CG-CG1 4.17Å; F150-V243 HydrophobicContact CZ-CB 4.33Å; F150-V243 HydrophobicContact CZ-CG1 3.82Å; F150-V243 HydrophobicContact CZ-CG2 3.55Å; L183-V243 PolarHBondContact O-N 3.42Å; V184-V243 HydrophobicContact CB-CB 4.27Å; V184-V243 HydrophobicContact CG1-CB 4.02Å; V184-V243 HydrophobicContact CG1-CG1 4.15Å; V184-V243 HydrophobicContact CG2-CB 4.02Å; V184-V243 HydrophobicContact CG2-CG2 4.03Å; L185-V243 PolarHBondContact N-O 3.5Å; V243-M277 CarbonylContact C-O 3.57Å; V243-M277 VanDerWaalsContact CA-O 3.3Å; V243-M277 WeakPolarHBondContact CA-O 3.17Å; V243-F279 HydrophobicContact CG1-CD2 4.14Å; V243-F279 HydrophobicContact CG1-CE2 4.13Å
244	L	89.1	Confident	77.3	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113	107.2	172.4	-75.1	79.5	0	0	0	107.5	L185 L242 A247 M250 I259 T276 M277 M278 F279 L290 F294	L185-L244 HydrophobicContact CD1-CG 4.38Å; L242-L244 HydrophobicContact CD1-CD1 4Å; L242-L244 HydrophobicContact CD2-CD1 3.9Å; L242-L244 HydrophobicContact CG-CD1 3.69Å; L244-A247 HydrophobicContact CB-CB 4.27Å; L244-M250 HydrophobicContact CB-CE 3.52Å; L244-M250 HydrophobicContact CD2-CE 3.89Å; L244-M250 HydrophobicContact CG-CE 3.81Å; L244-I259 HydrophobicContact CD2-CD1 4.49Å; L244-I259 HydrophobicContact CD2-CG2 3.98Å; L244-T276 HydrophobicContact CD1-CG2 4.48Å; L244-M277 PolarHBondContact N-O 3.48Å; L244-M278 HydrophobicContact CB-CG 4.12Å; L244-M278 HydrophobicContact CD1-CG 4.37Å; L244-F279 PolarHBondContact O-N 3.48Å; L244-L290 HydrophobicContact CD2-CD2 4.2Å; L244-F294 HydrophobicContact CD2-CD2 4.25Å; L244-F294 HydrophobicContact CD2-CE2 4.36Å
245	D	85.7	Confident	79.3	Confident	23 Å²	23	27.9 Å²	27.9	12%	0.123	15%	0.152	C	C	.	.	S	Bend	trans	-96.4	139.3	175.4	-167.7	21.3	0	0	0	110.8	L185 P187 I195	L185-D245 PolarHBondContact O-N 3.16Å; P187-D245 WeakPolarHBondContact CD-O 3.46Å; I195-D245 HydrophobicContact CD1-CB 4.18Å; I195-D245 WeakPolarHBondContact CD1-OD2 3.39Å
246	E	81.8	Confident	80.9	Confident	22 Å²	22	30.2 Å²	30.2	10%	0.103	16%	0.159	C	C	.	.	S	Bend	trans	47.7	56.7	-169.4	-63.7	-175.1	-175.5	0	0	111.9	K146 P187 L191 D248 R249 M250 F279	K146-E246 WeakPolarHBondContact CE-OE1 3.35Å; K146-E246 IonicContact NZ-OE1 2.68Å; K146-E246 PolarHBondContact NZ-OE1 3.23Å; P187-E246 HydrophobicContact CG-CB 3.73Å; L191-E246 HydrophobicContact CD2-CB 4.24Å; L191-E246 VanDerWaalsContact CD2-CD 3.41Å; L191-E246 HydrophobicContact CD2-CG 3.74Å; E246-D248 VanDerWaalsContact C-OD1 3.3Å; E246-R249 HydrophobicContact CB-CB 4.06Å; E246-R249 WeakPolarHBondContact O-CB 3.26Å; E246-R249 PolarHBondContact O-N 3.43Å; E246-R249 WeakPolarHBondContact OE2-CD 3.49Å; E246-R249 IonicContact OE2-CZ 3.18Å; E246-R249 IonicContact OE2-NE 3.43Å; E246-R249 IonicContact OE2-NH1 2.99Å; E246-R249 PolarHBondContact OE2-NH1 2.97Å; E246-M250 PolarHBondContact O-N 3.46Å; E246-F279 WeakPolarHBondContact CA-O 3.17Å; E246-F279 PolarHBondContact N-O 3.06Å; E246-F279 VanDerWaalsContact N-O 3.13Å
247	A	87.2	Confident	82.2	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.6	-43.2	-174.2	0	0	0	0	0	113.4	L244 R249 M250 L251 M278 F279 I287	L244-A247 HydrophobicContact CB-CB 4.27Å; A247-R249 PolarHBondContact O-N 3.16Å; A247-M250 HydrophobicContact CB-CE 4.24Å; A247-M250 WeakPolarHBondContact O-CB 3.42Å; A247-M250 PolarHBondContact O-N 2.97Å; A247-M250 VanDerWaalsContact O-N 3.13Å; A247-L251 PolarHBondContact O-N 3.33Å; A247-L251 VanDerWaalsContact O-N 3.15Å; A247-M278 HydrophobicContact CB-CE 4.17Å; A247-F279 PolarHBondContact N-O 3.35Å; A247-I287 HydrophobicContact CB-CD1 3.91Å; A247-I287 WeakPolarHBondContact O-CD1 3.49Å
248	D	84.8	Confident	83.4	Confident	3 Å²	3	31.3 Å²	31.3	2%	0.016	17%	0.168	C	C	.	.	H	α-helix	trans	-45.1	-51.8	169.4	43.4	7	0	0	0	110.7	E246 M250 L251 D252 S280 A281 T282 I287	E246-D248 VanDerWaalsContact C-OD1 3.3Å; D248-M250 PolarHBondContact O-N 3.06Å; D248-L251 WeakPolarHBondContact O-CB 3.29Å; D248-L251 PolarHBondContact O-N 3.27Å; D248-L251 VanDerWaalsContact O-N 3.09Å; D248-D252 PolarHBondContact O-N 3.36Å; D248-S280 WeakPolarHBondContact CB-OG 3.26Å; D248-S280 PolarHBondContact N-OG 3.06Å; D248-S280 PolarHBondContact OD1-OG 3.4Å; D248-S280 PolarHBondContact OD2-OG 3Å; D248-S280 VanDerWaalsContact OD2-OG 3.11Å; D248-A281 PolarHBondContact OD2-N 2.9Å; D248-T282 WeakPolarHBondContact CB-OG1 3.25Å; D248-T282 PolarHBondContact OD2-N 3.33Å; D248-T282 PolarHBondContact OD2-OG1 3.18Å; D248-I287 HydrophobicContact CB-CD1 4.29Å; D248-I287 HydrophobicContact CB-CG1 4.1Å
249	R	80.7	Confident	84.2	Confident	4 Å²	4	28.5 Å²	28.5	2%	0.015	15%	0.154	C	C	.	.	H	α-helix	trans	-71.7	-32	-175.7	-169.2	-177.8	163.6	-163.2	1.4	113.4	P187 T188 E246 A247 L251 D252 M253 R402	P187-R249 HydrophobicContact CB-CG 4.31Å; P187-R249 HydrophobicContact CG-CB 4.32Å; P187-R249 HydrophobicContact CG-CG 4.27Å; T188-R249 PolarHBondContact OG1-NH1 2.9Å; E246-R249 HydrophobicContact CB-CB 4.06Å; E246-R249 WeakPolarHBondContact O-CB 3.26Å; E246-R249 PolarHBondContact O-N 3.43Å; E246-R249 WeakPolarHBondContact OE2-CD 3.49Å; E246-R249 IonicContact OE2-CZ 3.18Å; E246-R249 IonicContact OE2-NE 3.43Å; E246-R249 IonicContact OE2-NH1 2.99Å; E246-R249 PolarHBondContact OE2-NH1 2.97Å; A247-R249 PolarHBondContact O-N 3.16Å; R249-L251 PolarHBondContact O-N 3.47Å; R249-D252 PolarHBondContact O-N 3.15Å; R249-M253 HydrophobicContact CG-SD 4.43Å; R249-M253 WeakPolarHBondContact O-CB 3.33Å; R249-M253 WeakPolarHBondContact O-CG 3.15Å; R249-M253 PolarHBondContact O-N 3.45Å; R249-R402 PolarHBondContact NH1-O 2.88Å; R249-R402 VanDerWaalsContact NH1-O 3.14Å; R249-R402 VanDerWaalsContact NH2-CA 3.35Å; R249-R402 VanDerWaalsContact NH2-CG 3.27Å; R249-R402 PolarHBondContact NH2-O 2.83Å
250	M	84.8	Confident	84.8	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.01	16%	0.162	C	C	.	.	H	α-helix	trans	-61.2	-38.9	171.6	-71.2	-167.2	-74.4	0	0	111	L185 P187 L244 E246 A247 D248 M253 G254 F255 I259	L185-M250 HydrophobicContact CB-CE 4.42Å; L185-M250 HydrophobicContact CB-SD 4.13Å; P187-M250 HydrophobicContact CB-CG 3.77Å; P187-M250 HydrophobicContact CG-CG 4.15Å; L244-M250 HydrophobicContact CB-CE 3.52Å; L244-M250 HydrophobicContact CD2-CE 3.89Å; L244-M250 HydrophobicContact CG-CE 3.81Å; E246-M250 PolarHBondContact O-N 3.46Å; A247-M250 HydrophobicContact CB-CE 4.24Å; A247-M250 WeakPolarHBondContact O-CB 3.42Å; A247-M250 PolarHBondContact O-N 2.97Å; A247-M250 VanDerWaalsContact O-N 3.13Å; D248-M250 PolarHBondContact O-N 3.06Å; M250-M253 PolarHBondContact O-N 3.03Å; M250-G254 PolarHBondContact O-N 3.11Å; M250-F255 HydrophobicContact CB-CB 4.3Å; M250-F255 HydrophobicContact CB-CD2 4.41Å; M250-F255 HydrophobicContact CG-CD2 4.5Å; M250-F255 VanDerWaalsContact O-CB 3.31Å; M250-F255 WeakPolarHBondContact O-CB 3.48Å; M250-F255 PolarHBondContact O-N 2.92Å; M250-I259 HydrophobicContact CB-CD1 3.77Å; M250-I259 HydrophobicContact CE-CD1 4.09Å; M250-I259 HydrophobicContact CG-CD1 4.39Å; M250-I259 HydrophobicContact SD-CD1 3.82Å
251	L	86.5	Confident	85.2	Confident	28 Å²	28	30.4 Å²	30.4	15%	0.147	16%	0.163	C	C	.	.	H	α-helix	trans	-67.5	-44	174.3	-60.8	-171.1	0	0	0	111.8	A247 D248 R249 M253 G254 E256 E286 I287 L290	A247-L251 PolarHBondContact O-N 3.33Å; A247-L251 VanDerWaalsContact O-N 3.15Å; D248-L251 WeakPolarHBondContact O-CB 3.29Å; D248-L251 PolarHBondContact O-N 3.27Å; D248-L251 VanDerWaalsContact O-N 3.09Å; R249-L251 PolarHBondContact O-N 3.47Å; L251-M253 PolarHBondContact O-N 3.49Å; L251-G254 WeakPolarHBondContact O-CA 3.39Å; L251-G254 PolarHBondContact O-N 3.34Å; L251-E256 HydrophobicContact CD2-CB 3.59Å; L251-E256 HydrophobicContact CD2-CG 3.71Å; L251-E286 HydrophobicContact CD1-CB 3.85Å; L251-I287 HydrophobicContact CD1-CD1 3.37Å; L251-I287 HydrophobicContact CD1-CG1 3.91Å; L251-I287 HydrophobicContact CG-CD1 3.86Å; L251-L290 HydrophobicContact CD1-CD2 4.23Å; L251-L290 HydrophobicContact CD2-CD2 4.05Å; L251-L290 HydrophobicContact CG-CD2 4.3Å
252	D	81.9	Confident	85.3	Confident	92 Å²	92	30.6 Å²	30.6	49%	0.492	17%	0.165	S	C	.	.	H	α-helix	trans	-57.5	-35.4	176.2	-66.1	-19	0	0	0	112.7	D248 R249 G254	D248-D252 PolarHBondContact O-N 3.36Å; R249-D252 PolarHBondContact O-N 3.15Å; D252-G254 PolarHBondContact O-N 3.37Å
253	M	77.4	Confident	85.2	Confident	64 Å²	64	31 Å²	31	32%	0.315	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-0.9	177	-69.4	-177.8	63.4	0	0	113.2	P187 T188 R249 M250 L251 F255	P187-M253 HydrophobicContact CB-SD 3.76Å; T188-M253 HydrophobicContact CG2-CE 4.36Å; T188-M253 HydrophobicContact CG2-SD 4.29Å; R249-M253 HydrophobicContact CG-SD 4.43Å; R249-M253 WeakPolarHBondContact O-CB 3.33Å; R249-M253 WeakPolarHBondContact O-CG 3.15Å; R249-M253 PolarHBondContact O-N 3.45Å; M250-M253 PolarHBondContact O-N 3.03Å; L251-M253 PolarHBondContact O-N 3.49Å; M253-F255 HydrophobicContact CB-CD2 3.81Å; M253-F255 HydrophobicContact CB-CE2 3.85Å; M253-F255 HydrophobicContact CE-CE2 3.64Å; M253-F255 HydrophobicContact CE-CZ 4.03Å; M253-F255 HydrophobicContact SD-CE2 4.13Å
254	G	82.9	Confident	85	Confident	42 Å²	42	36.1 Å²	36.1	43%	0.433	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.4	25.1	180	0	0	0	0	0	113.8	M250 L251 D252 E256 P257 Q258	M250-G254 PolarHBondContact O-N 3.11Å; L251-G254 WeakPolarHBondContact O-CA 3.39Å; L251-G254 PolarHBondContact O-N 3.34Å; D252-G254 PolarHBondContact O-N 3.37Å; G254-E256 VanDerWaalsContact C-N 3.27Å; G254-E256 PolarHBondContact O-N 2.65Å; G254-P257 WeakPolarHBondContact O-CD 3.3Å; G254-Q258 PolarHBondContact O-OE1 3.48Å
255	F	84.5	Confident	84.4	Confident	23 Å²	23	42.3 Å²	42.3	10%	0.101	22%	0.223	C	C	.	.			trans	-80.5	-1.8	178.6	-69.6	-50.3	0	0	0	114.3	M250 M253 P257 Q258 I259	M250-F255 HydrophobicContact CB-CB 4.3Å; M250-F255 HydrophobicContact CB-CD2 4.41Å; M250-F255 HydrophobicContact CG-CD2 4.5Å; M250-F255 VanDerWaalsContact O-CB 3.31Å; M250-F255 WeakPolarHBondContact O-CB 3.48Å; M250-F255 PolarHBondContact O-N 2.92Å; M253-F255 HydrophobicContact CB-CD2 3.81Å; M253-F255 HydrophobicContact CB-CE2 3.85Å; M253-F255 HydrophobicContact CE-CE2 3.64Å; M253-F255 HydrophobicContact CE-CZ 4.03Å; M253-F255 HydrophobicContact SD-CE2 4.13Å; F255-P257 VanDerWaalsContact C-CD 3.49Å; F255-Q258 VanDerWaalsContact CA-OE1 3.25Å; F255-Q258 PolarHBondContact O-N 3.43Å; F255-Q258 VanDerWaalsContact O-N 3.1Å; F255-Q258 PolarHBondContact O-OE1 3Å; F255-I259 HydrophobicContact CB-CD1 4.2Å; F255-I259 HydrophobicContact CB-CG1 4.4Å; F255-I259 WeakPolarHBondContact O-CG1 3.2Å; F255-I259 PolarHBondContact O-N 3.24Å
256	E	88.1	Confident	83.7	Confident	70 Å²	70	42.7 Å²	42.7	33%	0.327	23%	0.228	S	C	.	.	H	α-helix	trans	-49.8	-49.5	179.8	-164.1	-170.2	158.6	0	0	113	L251 G254 Q258 I259 R260	L251-E256 HydrophobicContact CD2-CB 3.59Å; L251-E256 HydrophobicContact CD2-CG 3.71Å; G254-E256 VanDerWaalsContact C-N 3.27Å; G254-E256 PolarHBondContact O-N 2.65Å; E256-Q258 VanDerWaalsContact C-N 3.3Å; E256-Q258 PolarHBondContact O-N 3.43Å; E256-I259 PolarHBondContact O-N 3.2Å; E256-R260 WeakPolarHBondContact O-CG 3.29Å; E256-R260 PolarHBondContact O-N 3.01Å; E256-R260 IonicContact OE1-CZ 2.97Å; E256-R260 VanDerWaalsContact OE1-CZ 3.28Å; E256-R260 IonicContact OE1-NE 3.49Å; E256-R260 PolarHBondContact OE1-NE 3.38Å; E256-R260 IonicContact OE1-NH2 2.7Å; E256-R260 PolarHBondContact OE1-NH2 2.97Å
257	P	88.6	Confident	83.4	Confident	84 Å²	84	43.4 Å²	43.4	55%	0.545	24%	0.241	S	C	.	.	H	α-helix	trans	-62.1	-37.8	-179	-21.9	35.3	0	0	0	112.6	G254 F255 Q261	G254-P257 WeakPolarHBondContact O-CD 3.3Å; F255-P257 VanDerWaalsContact C-CD 3.49Å; P257-Q261 VanDerWaalsContact O-CB 3.28Å; P257-Q261 WeakPolarHBondContact O-CB 3.44Å; P257-Q261 PolarHBondContact O-N 3.45Å
258	Q	86.5	Confident	83.3	Confident	48 Å²	48	44.1 Å²	44.1	22%	0.224	25%	0.245	C	C	.	.	H	α-helix	trans	-71.4	-39.6	179.2	-65.6	80.6	4.6	0	0	111.5	F4 G254 F255 E256 Q261 I262	F4-Q258 HydrophobicContact CD2-CB 3.93Å; F4-Q258 HydrophobicContact CE2-CB 4.08Å; G254-Q258 PolarHBondContact O-OE1 3.48Å; F255-Q258 VanDerWaalsContact CA-OE1 3.25Å; F255-Q258 PolarHBondContact O-N 3.43Å; F255-Q258 VanDerWaalsContact O-N 3.1Å; F255-Q258 PolarHBondContact O-OE1 3Å; E256-Q258 VanDerWaalsContact C-N 3.3Å; E256-Q258 PolarHBondContact O-N 3.43Å; Q258-Q261 PolarHBondContact O-N 2.79Å; Q258-I262 WeakPolarHBondContact O-CG1 3.39Å; Q258-I262 PolarHBondContact O-N 3.11Å
259	I	87.5	Confident	83.2	Confident	1 Å²	1	45.4 Å²	45.4	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-63	-48.1	176.2	-65.2	167.2	0	0	0	109.8	F4 L185 L244 M250 F255 E256 Q261 I262 V263 F294	F4-I259 HydrophobicContact CE2-CG1 4.42Å; L185-I259 HydrophobicContact CD1-CG2 4.38Å; L244-I259 HydrophobicContact CD2-CD1 4.49Å; L244-I259 HydrophobicContact CD2-CG2 3.98Å; M250-I259 HydrophobicContact CB-CD1 3.77Å; M250-I259 HydrophobicContact CE-CD1 4.09Å; M250-I259 HydrophobicContact CG-CD1 4.39Å; M250-I259 HydrophobicContact SD-CD1 3.82Å; F255-I259 HydrophobicContact CB-CD1 4.2Å; F255-I259 HydrophobicContact CB-CG1 4.4Å; F255-I259 WeakPolarHBondContact O-CG1 3.2Å; F255-I259 PolarHBondContact O-N 3.24Å; E256-I259 PolarHBondContact O-N 3.2Å; I259-Q261 VanDerWaalsContact C-N 3.3Å; I259-Q261 PolarHBondContact O-N 3.42Å; I259-I262 PolarHBondContact O-N 3.24Å; I259-I262 VanDerWaalsContact O-N 3.1Å; I259-V263 HydrophobicContact CG2-CG2 4.26Å; I259-V263 WeakPolarHBondContact O-CG2 3.49Å; I259-V263 PolarHBondContact O-N 2.7Å; I259-F294 HydrophobicContact CG2-CD2 4.49Å; I259-F294 HydrophobicContact CG2-CE2 3.45Å; I259-F294 VanDerWaalsContact CG2-CE2 3.45Å; I259-F294 HydrophobicContact CG2-CZ 3.95Å
260	R	89.5	Confident	83.6	Confident	48 Å²	48	51.9 Å²	51.9	18%	0.181	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-44.8	175.6	-71.3	-177.9	-178.2	-68.5	-4.6	111.7	E256 I262 V263 E264 E293 F294	E256-R260 WeakPolarHBondContact O-CG 3.29Å; E256-R260 PolarHBondContact O-N 3.01Å; E256-R260 IonicContact OE1-CZ 2.97Å; E256-R260 VanDerWaalsContact OE1-CZ 3.28Å; E256-R260 IonicContact OE1-NE 3.49Å; E256-R260 PolarHBondContact OE1-NE 3.38Å; E256-R260 IonicContact OE1-NH2 2.7Å; E256-R260 PolarHBondContact OE1-NH2 2.97Å; R260-I262 VanDerWaalsContact C-N 3.27Å; R260-I262 PolarHBondContact O-N 3.1Å; R260-V263 PolarHBondContact O-N 3.49Å; R260-E264 IonicContact NH1-OE1 3.06Å; R260-E264 WeakPolarHBondContact O-CA 3.45Å; R260-E264 WeakPolarHBondContact O-CB 3.19Å; R260-E264 WeakPolarHBondContact O-CG 3.46Å; R260-E264 PolarHBondContact O-N 3.11Å; R260-E293 IonicContact CZ-OE2 2.71Å; R260-E293 IonicContact NH1-OE2 3Å; R260-E293 PolarHBondContact NH1-OE2 2.71Å; R260-E293 IonicContact NH2-OE1 3.57Å; R260-E293 IonicContact NH2-OE2 3.96Å; R260-E293 PolarHBondContact NH2-OE2 3.23Å; R260-F294 HydrophobicContact CG-CZ 4.07Å
261	Q	85.6	Confident	83.8	Confident	68 Å²	68	56 Å²	56	32%	0.318	30%	0.299	S	S	.	.	H	α-helix	trans	-61.6	-34.7	177.5	-178.1	163.1	36.1	0	0	113.3	P257 Q258 I259 L265 S266 W539	P257-Q261 VanDerWaalsContact O-CB 3.28Å; P257-Q261 WeakPolarHBondContact O-CB 3.44Å; P257-Q261 PolarHBondContact O-N 3.45Å; Q258-Q261 PolarHBondContact O-N 2.79Å; I259-Q261 VanDerWaalsContact C-N 3.3Å; I259-Q261 PolarHBondContact O-N 3.42Å; Q261-L265 HydrophobicContact CB-CD1 4.38Å; Q261-L265 HydrophobicContact CG-CB 4.34Å; Q261-L265 HydrophobicContact CG-CD1 4.05Å; Q261-L265 CarbonylContact O-C 3.56Å; Q261-L265 WeakPolarHBondContact O-CA 3.37Å; Q261-L265 VanDerWaalsContact O-CB 3.26Å; Q261-L265 WeakPolarHBondContact O-CB 3.42Å; Q261-L265 PolarHBondContact O-N 3.28Å; Q261-S266 PolarHBondContact O-N 3.11Å; Q261-S266 PolarHBondContact O-OG 3.29Å; Q261-S266 VanDerWaalsContact O-OG 3.13Å; Q261-W539 HydrophobicContact CG-CH2 3.78Å; Q261-W539 HydrophobicContact CG-CZ2 4.38Å
262	I	84.8	Confident	83.8	Confident	16 Å²	16	58.5 Å²	58.5	8%	0.082	32%	0.318	C	S	.	.	H	α-helix	trans	-71.8	-48	175.8	-72.9	165.8	0	0	0	111.2	F4 M6 L183 L236 Q258 I259 R260 S266 M268	F4-I262 HydrophobicContact CD1-CD1 3.69Å; F4-I262 HydrophobicContact CD2-CD1 4.08Å; F4-I262 HydrophobicContact CE1-CD1 3.11Å; F4-I262 HydrophobicContact CE2-CD1 3.55Å; F4-I262 HydrophobicContact CG-CD1 4.15Å; F4-I262 HydrophobicContact CZ-CD1 3.04Å; M6-I262 HydrophobicContact CE-CD1 4.26Å; L183-I262 HydrophobicContact CD2-CG2 3.95Å; L236-I262 HydrophobicContact CD1-CG2 3.63Å; Q258-I262 WeakPolarHBondContact O-CG1 3.39Å; Q258-I262 PolarHBondContact O-N 3.11Å; I259-I262 PolarHBondContact O-N 3.24Å; I259-I262 VanDerWaalsContact O-N 3.1Å; R260-I262 VanDerWaalsContact C-N 3.27Å; R260-I262 PolarHBondContact O-N 3.1Å; I262-S266 VanDerWaalsContact O-CB 3.27Å; I262-S266 WeakPolarHBondContact O-CB 3.01Å; I262-M268 HydrophobicContact CG2-CE 4.12Å
263	V	85.2	Confident	84	Confident	8 Å²	8	59.5 Å²	59.5	5%	0.048	32%	0.324	C	S	.	.	H	α-helix	trans	-73	-38.2	-175.3	178.1	0	0	0	0	111.9	L242 I259 R260 M268 F294	L242-V263 HydrophobicContact CD2-CG2 3.74Å; I259-V263 HydrophobicContact CG2-CG2 4.26Å; I259-V263 WeakPolarHBondContact O-CG2 3.49Å; I259-V263 PolarHBondContact O-N 2.7Å; R260-V263 PolarHBondContact O-N 3.49Å; V263-M268 HydrophobicContact CG1-SD 4.31Å; V263-M268 HydrophobicContact CG2-SD 4.37Å; V263-F294 HydrophobicContact CB-CE1 4.25Å; V263-F294 HydrophobicContact CB-CZ 4.34Å; V263-F294 HydrophobicContact CG1-CD1 4.03Å; V263-F294 HydrophobicContact CG1-CE1 4.06Å; V263-F294 HydrophobicContact CG2-CE2 4.33Å; V263-F294 HydrophobicContact CG2-CZ 4.3Å
264	E	82.5	Confident	84.5	Confident	113 Å²	113	57.5 Å²	57.5	53%	0.528	31%	0.313	S	S	.	.	H	α-helix	trans	-99.7	-33.8	-171.6	-58.8	170.5	-172.6	0	0	112.9	R260	R260-E264 IonicContact NH1-OE1 3.06Å; R260-E264 WeakPolarHBondContact O-CA 3.45Å; R260-E264 WeakPolarHBondContact O-CB 3.19Å; R260-E264 WeakPolarHBondContact O-CG 3.46Å; R260-E264 PolarHBondContact O-N 3.11Å
265	L	75.1	Confident	84.7	Confident	129 Å²	129	56.1 Å²	56.1	68%	0.675	30%	0.295	S	S	*	.	H	α-helix	trans	-110.5	-7.3	-168.8	-54.4	176.4	0	0	0	114.6	Q261	Q261-L265 HydrophobicContact CB-CD1 4.38Å; Q261-L265 HydrophobicContact CG-CB 4.34Å; Q261-L265 HydrophobicContact CG-CD1 4.05Å; Q261-L265 CarbonylContact O-C 3.56Å; Q261-L265 WeakPolarHBondContact O-CA 3.37Å; Q261-L265 VanDerWaalsContact O-CB 3.26Å; Q261-L265 WeakPolarHBondContact O-CB 3.42Å; Q261-L265 PolarHBondContact O-N 3.28Å
266	S	71.6	Confident	85	Confident	32 Å²	32	55 Å²	55	22%	0.224	29%	0.29	C	S	.	.	S	Bend	trans	-100.4	17.3	-175.9	-54.5	0	0	0	0	114.2	A235 L236 Q261 I262 M268	A235-S266 WeakPolarHBondContact CA-O 3.27Å; L236-S266 PolarHBondContact N-O 3.04Å; Q261-S266 PolarHBondContact O-N 3.11Å; Q261-S266 PolarHBondContact O-OG 3.29Å; Q261-S266 VanDerWaalsContact O-OG 3.13Å; I262-S266 VanDerWaalsContact O-CB 3.27Å; I262-S266 WeakPolarHBondContact O-CB 3.01Å; S266-M268 VanDerWaalsContact C-N 3.31Å; S266-M268 PolarHBondContact O-N 3Å
267	G	76.7	Confident	85.1	Confident	36 Å²	36	51.8 Å²	51.8	37%	0.371	28%	0.275	S	S	.	.			trans	71.2	21.1	178.8	0	0	0	0	0	114.2	L237	L237-G267 VanDerWaalsContact CA-O 3.25Å; L237-G267 WeakPolarHBondContact CA-O 3.41Å; L237-G267 WeakPolarHBondContact CD2-O 3Å; L237-G267 PolarHBondContact N-O 3.48Å
268	M	83.2	Confident	85.2	Confident	16 Å²	16	47.8 Å²	47.8	8%	0.079	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-63.9	140	173	-172.3	179.2	-69.6	0	0	110.3	L183 L236 C239 L242 I262 V263 S266	L183-M268 HydrophobicContact CD2-CE 3.63Å; L236-M268 HydrophobicContact CB-CB 4.14Å; L236-M268 HydrophobicContact CB-CE 4.45Å; L236-M268 HydrophobicContact CD1-CE 3.64Å; C239-M268 HydrophobicContact CB-CG 4.4Å; L242-M268 HydrophobicContact CB-SD 4.39Å; L242-M268 HydrophobicContact CD1-CE 4.04Å; L242-M268 HydrophobicContact CD1-SD 4.47Å; L242-M268 HydrophobicContact CD2-CE 4.36Å; L242-M268 HydrophobicContact CD2-SD 3.8Å; L242-M268 HydrophobicContact CG-SD 4.44Å; I262-M268 HydrophobicContact CG2-CE 4.12Å; V263-M268 HydrophobicContact CG1-SD 4.31Å; V263-M268 HydrophobicContact CG2-SD 4.37Å; S266-M268 VanDerWaalsContact C-N 3.31Å; S266-M268 PolarHBondContact O-N 3Å
269	P	84.7	Confident	85.2	Confident	29 Å²	29	45.9 Å²	45.9	19%	0.188	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-52.2	145.9	172.8	-26.7	33.9	0	0	0	111.6	L236 L237 C239 N273 R274	L236-P269 VanDerWaalsContact O-CD 3.32Å; L236-P269 WeakPolarHBondContact O-CD 2.97Å; L237-P269 WeakPolarHBondContact O-CG 3.37Å; C239-P269 WeakPolarHBondContact O-CD 3.14Å; C239-P269 WeakPolarHBondContact O-CG 2.99Å; P269-N273 HydrophobicContact CB-CB 4.04Å; P269-R274 HydrophobicContact CB-CB 4.47Å; P269-R274 WeakPolarHBondContact O-CD 3.26Å; P269-R274 PolarHBondContact O-NH1 3.49Å
270	E	87.5	Confident	85.1	Confident	141 Å²	141	46 Å²	46	66%	0.659	24%	0.242	S	C	*	.	P	Polyproline II helix	trans	-56.6	157.4	173.8	-65.6	-176.2	177.9	0	0	111.8	S272 N273 R274	E270-S272 PolarHBondContact O-N 2.85Å; E270-N273 PolarHBondContact O-N 3.33Å; E270-R274 PolarHBondContact O-N 3.15Å
271	R	89.3	Confident	84.6	Confident	88 Å²	88	44.4 Å²	44.4	33%	0.332	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-23.9	-177.6	64.3	178.1	176.7	-176.7	-8.6	114.6	N273 Q292 E293 F294 L295 V296	R271-N273 VanDerWaalsContact C-N 3.31Å; R271-Q292 PolarHBondContact NH1-O 3.41Å; R271-E293 PolarHBondContact NH1-O 3.43Å; R271-F294 WeakPolarHBondContact CB-O 3.41Å; R271-L295 VanDerWaalsContact CD-O 3.3Å; R271-L295 WeakPolarHBondContact CD-O 3.45Å; R271-L295 PolarHBondContact NH1-O 3.47Å; R271-V296 HydrophobicContact CB-CG2 4.31Å; R271-V296 HydrophobicContact CG-CG2 4.33Å; R271-V296 WeakPolarHBondContact O-CG2 3.37Å
272	S	87	Confident	84.2	Confident	80 Å²	80	41.8 Å²	41.8	56%	0.559	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-18.8	175.1	50.1	0	0	0	0	114.1	E270	E270-S272 PolarHBondContact O-N 2.85Å
273	N	86.5	Confident	84.3	Confident	114 Å²	114	41.9 Å²	41.9	61%	0.61	23%	0.227	S	C	*	.	S	Bend	trans	-115.5	6.2	-173.8	-66.7	-50.7	0	0	0	113.1	P269 E270 R271	P269-N273 HydrophobicContact CB-CB 4.04Å; E270-N273 PolarHBondContact O-N 3.33Å; R271-N273 VanDerWaalsContact C-N 3.31Å
274	R	87.7	Confident	84.2	Confident	21 Å²	21	43.6 Å²	43.6	8%	0.079	24%	0.238	C	C	.	.	S	Bend	trans	-135.2	156.4	173.3	67.6	177.5	-169.7	-105.7	-2.4	108.3	R240 P269 E270 T276 F294	R240-R274 CarbonylContact O-C 3.56Å; R240-R274 WeakPolarHBondContact O-CA 3.14Å; R240-R274 WeakPolarHBondContact O-CB 3.41Å; P269-R274 HydrophobicContact CB-CB 4.47Å; P269-R274 WeakPolarHBondContact O-CD 3.26Å; P269-R274 PolarHBondContact O-NH1 3.49Å; E270-R274 PolarHBondContact O-N 3.15Å; R274-T276 PolarHBondContact NE-OG1 2.8Å; R274-T276 VanDerWaalsContact NE-OG1 3.08Å; R274-F294 PolarHBondContact NH2-O 3.09Å
275	Q	87	Confident	84.4	Confident	13 Å²	13	44 Å²	44	6%	0.061	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	129.7	167.4	-173.3	176.2	18.6	0	0	108.9	A133 G136 R137 D138 R240 F241 L242 M277	A133-Q275 PolarHBondContact O-NE2 3.4Å; G136-Q275 VanDerWaalsContact C-NE2 3.25Å; R137-Q275 PolarHBondContact O-NE2 3.25Å; D138-Q275 WeakPolarHBondContact OD1-CA 3.34Å; R240-Q275 PolarHBondContact O-N 3.12Å; F241-Q275 WeakPolarHBondContact CA-O 3.27Å; F241-Q275 HydrophobicContact CD1-CB 3.89Å; F241-Q275 HydrophobicContact CE1-CB 3.99Å; L242-Q275 PolarHBondContact N-O 3.47Å; Q275-M277 HydrophobicContact CG-CE 3.84Å
276	T	90.5	Very high	85.1	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	135.6	-178.2	-50.1	0	0	0	0	110.6	D138 L139 L242 L244 R274 L295	D138-T276 VanDerWaalsContact CA-O 3.31Å; D138-T276 WeakPolarHBondContact CA-O 3.43Å; D138-T276 WeakPolarHBondContact CB-O 3.35Å; D138-T276 PolarHBondContact OD1-N 3.04Å; L139-T276 PolarHBondContact N-O 3.22Å; L242-T276 HydrophobicContact CB-CG2 4.16Å; L242-T276 HydrophobicContact CD2-CG2 3.83Å; L242-T276 HydrophobicContact CG-CG2 4.02Å; L242-T276 CarbonylContact O-C 3.58Å; L242-T276 VanDerWaalsContact O-CA 3.3Å; L242-T276 WeakPolarHBondContact O-CA 3.39Å; L244-T276 HydrophobicContact CD1-CG2 4.48Å; R274-T276 PolarHBondContact NE-OG1 2.8Å; R274-T276 VanDerWaalsContact NE-OG1 3.08Å; T276-L295 HydrophobicContact CG2-CD2 3.56Å; T276-L295 WeakPolarHBondContact O-CD2 3.39Å
277	M	89.6	Confident	85.9	Confident	2 Å²	2	41.7 Å²	41.7	1%	0.01	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	136.3	176.2	-57.7	-165.1	175.6	0	0	111.3	A133 R137 L139 F150 F153 L242 V243 L244 Q275 F279	A133-M277 VanDerWaalsContact CA-CE 3.45Å; A133-M277 HydrophobicContact CB-CE 3.19Å; A133-M277 HydrophobicContact CB-SD 3.81Å; R137-M277 WeakPolarHBondContact O-CE 3.18Å; L139-M277 HydrophobicContact CB-CB 4.44Å; L139-M277 HydrophobicContact CB-CE 4.38Å; L139-M277 HydrophobicContact CB-CG 4.02Å; L139-M277 HydrophobicContact CB-SD 4.17Å; L139-M277 HydrophobicContact CD2-SD 4.24Å; L139-M277 CarbonylContact O-C 3.52Å; L139-M277 VanDerWaalsContact O-CA 3.3Å; L139-M277 WeakPolarHBondContact O-CA 3.49Å; F150-M277 HydrophobicContact CE2-CB 3.97Å; F150-M277 HydrophobicContact CE2-CG 4.23Å; F150-M277 HydrophobicContact CE2-SD 3.36Å; F150-M277 WeakPolarHBondContact CE2-SD 3.25Å; F150-M277 HydrophobicContact CZ-CB 3.85Å; F150-M277 HydrophobicContact CZ-CG 3.98Å; F150-M277 HydrophobicContact CZ-SD 3.33Å; F150-M277 WeakPolarHBondContact CZ-SD 3.47Å; F153-M277 HydrophobicContact CD1-SD 4.26Å; F153-M277 HydrophobicContact CE1-CE 3.75Å; F153-M277 HydrophobicContact CE1-SD 4.03Å; F153-M277 HydrophobicContact CE2-CE 4.34Å; F153-M277 HydrophobicContact CZ-CE 3.66Å; F153-M277 HydrophobicContact CZ-SD 4.4Å; L242-M277 PolarHBondContact O-N 3Å; V243-M277 CarbonylContact C-O 3.57Å; V243-M277 VanDerWaalsContact CA-O 3.3Å; V243-M277 WeakPolarHBondContact CA-O 3.17Å; L244-M277 PolarHBondContact N-O 3.48Å; Q275-M277 HydrophobicContact CG-CE 3.84Å; M277-F279 HydrophobicContact CB-CE2 3.78Å; M277-F279 HydrophobicContact CB-CZ 4.42Å
278	M	91	Very high	86.6	Confident	0 Å²	0	41 Å²	41	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	129.1	179.6	-69.8	178.7	58.3	0	0	109.5	L139 M140 A141 L244 A247 L290 A291 L295	L139-M278 PolarHBondContact O-N 2.93Å; M140-M278 HydrophobicContact SD-CB 3.47Å; M140-M278 WeakPolarHBondContact SD-CB 3.49Å; M140-M278 HydrophobicContact SD-CE 4.17Å; A141-M278 PolarHBondContact N-O 3.46Å; L244-M278 HydrophobicContact CB-CG 4.12Å; L244-M278 HydrophobicContact CD1-CG 4.37Å; A247-M278 HydrophobicContact CB-CE 4.17Å; M278-L290 HydrophobicContact CE-CB 4.14Å; M278-L290 HydrophobicContact CE-CD2 3.75Å; M278-L290 HydrophobicContact CE-CG 4.03Å; M278-A291 HydrophobicContact CE-CB 4.15Å; M278-A291 HydrophobicContact SD-CB 4.05Å; M278-L295 HydrophobicContact CG-CD2 4.18Å; M278-L295 HydrophobicContact SD-CD1 4.26Å; M278-L295 HydrophobicContact SD-CD2 4.19Å; M278-L295 HydrophobicContact SD-CG 4.06Å
279	F	87.7	Confident	87	Confident	8 Å²	8	45 Å²	45	4%	0.035	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131.3	176.5	-64.7	-88.3	0	0	0	109.4	L139 A141 P147 F150 V243 L244 E246 A247 M277	L139-F279 HydrophobicContact CD2-CE1 4.3Å; L139-F279 HydrophobicContact CD2-CZ 3.95Å; A141-F279 HydrophobicContact CB-CD1 3.6Å; A141-F279 HydrophobicContact CB-CE1 3.56Å; A141-F279 HydrophobicContact CB-CZ 4.46Å; A141-F279 WeakPolarHBondContact O-CA 3.41Å; P147-F279 HydrophobicContact CG-CD1 3.46Å; P147-F279 VanDerWaalsContact CG-CD1 3.46Å; P147-F279 HydrophobicContact CG-CE1 3.69Å; P147-F279 HydrophobicContact CG-CG 4.23Å; F150-F279 HydrophobicContact CD2-CD2 4.14Å; F150-F279 HydrophobicContact CD2-CE1 4.21Å; F150-F279 AromaticContact CD2-CE2 3.15Å; F150-F279 HydrophobicContact CD2-CE2 3.15Å; F150-F279 AromaticContact CD2-CZ 3.2Å; F150-F279 HydrophobicContact CD2-CZ 3.2Å; F150-F279 HydrophobicContact CE2-CD2 4.32Å; F150-F279 AromaticContact CE2-CE2 3.09Å; F150-F279 HydrophobicContact CE2-CE2 3.09Å; F150-F279 AromaticContact CE2-CZ 3.24Å; F150-F279 HydrophobicContact CE2-CZ 3.24Å; F150-F279 HydrophobicContact CG-CE2 4.11Å; F150-F279 HydrophobicContact CG-CZ 4.42Å; F150-F279 HydrophobicContact CZ-CE2 4.02Å; F150-F279 HydrophobicContact CZ-CZ 4.47Å; V243-F279 HydrophobicContact CG1-CD2 4.14Å; V243-F279 HydrophobicContact CG1-CE2 4.13Å; L244-F279 PolarHBondContact O-N 3.48Å; E246-F279 WeakPolarHBondContact CA-O 3.17Å; E246-F279 PolarHBondContact N-O 3.06Å; E246-F279 VanDerWaalsContact N-O 3.13Å; A247-F279 PolarHBondContact N-O 3.35Å; M277-F279 HydrophobicContact CB-CE2 3.78Å; M277-F279 HydrophobicContact CB-CZ 4.42Å
280	S	85.5	Confident	87.4	Confident	5 Å²	5	43.7 Å²	43.7	4%	0.035	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	148	-175.6	-159.8	0	0	0	0	109.4	A141 C142 A143 D248 T282	A141-S280 PolarHBondContact O-N 3.29Å; C142-S280 CarbonylContact C-O 3.59Å; C142-S280 VanDerWaalsContact CA-O 3.24Å; C142-S280 WeakPolarHBondContact CA-O 3.45Å; A143-S280 PolarHBondContact N-O 3.2Å; D248-S280 WeakPolarHBondContact CB-OG 3.26Å; D248-S280 PolarHBondContact N-OG 3.06Å; D248-S280 PolarHBondContact OD1-OG 3.4Å; D248-S280 PolarHBondContact OD2-OG 3Å; D248-S280 VanDerWaalsContact OD2-OG 3.11Å; S280-T282 VanDerWaalsContact CB-O 3.25Å; S280-T282 WeakPolarHBondContact CB-O 3.39Å; S280-T282 PolarHBondContact OG-O 2.99Å
281	A	78	Confident	87.6	Confident	14 Å²	14	37 Å²	37	12%	0.116	19%	0.186	C	C	.	.	S	Bend	trans	-84.4	-34.9	172.3	0	0	0	0	0	110.7	A143 D248 H426	A143-A281 WeakPolarHBondContact O-CA 3.26Å; D248-A281 PolarHBondContact OD2-N 2.9Å; A281-H426 WeakPolarHBondContact CB-NE2 3.47Å
282	T	78.2	Confident	87.7	Confident	12 Å²	12	37.6 Å²	37.6	7%	0.074	19%	0.193	C	C	.	.			trans	-113.2	163.6	177.9	69.4	0	0	0	0	111.2	D248 S280 P284 D422	D248-T282 WeakPolarHBondContact CB-OG1 3.25Å; D248-T282 PolarHBondContact OD2-N 3.33Å; D248-T282 PolarHBondContact OD2-OG1 3.18Å; S280-T282 VanDerWaalsContact CB-O 3.25Å; S280-T282 WeakPolarHBondContact CB-O 3.39Å; S280-T282 PolarHBondContact OG-O 2.99Å; T282-P284 WeakPolarHBondContact OG1-CD 3.29Å; T282-D422 HydrophobicContact CG2-CB 4.23Å
283	F	86.2	Confident	87.9	Confident	18 Å²	18	37.1 Å²	37.1	8%	0.079	18%	0.182	C	C	.	.			trans	-131	55.7	178.2	-157.6	-124.8	0	0	0	112.7	M140 C142 I287 Q288 F301 V307	M140-F283 HydrophobicContact CE-CD2 3.57Å; M140-F283 HydrophobicContact CE-CE2 3.56Å; M140-F283 HydrophobicContact CG-CD2 4.42Å; M140-F283 HydrophobicContact CG-CE2 3.63Å; M140-F283 HydrophobicContact CG-CZ 4.15Å; M140-F283 HydrophobicContact SD-CD2 4.47Å; M140-F283 HydrophobicContact SD-CE2 3.85Å; C142-F283 VanDerWaalsContact SG-CD2 3.52Å; F283-I287 HydrophobicContact CD2-CB 4.39Å; F283-I287 HydrophobicContact CD2-CG2 3.56Å; F283-I287 HydrophobicContact CE2-CG2 3.78Å; F283-Q288 VanDerWaalsContact CD1-CD 3.4Å; F283-Q288 HydrophobicContact CD1-CG 3.6Å; F283-Q288 HydrophobicContact CD2-CG 4.25Å; F283-Q288 HydrophobicContact CE1-CB 4.11Å; F283-Q288 HydrophobicContact CE1-CG 3.4Å; F283-Q288 VanDerWaalsContact CE1-CG 3.4Å; F283-Q288 HydrophobicContact CE2-CG 4.07Å; F283-Q288 HydrophobicContact CG-CG 4.04Å; F283-Q288 HydrophobicContact CZ-CB 3.98Å; F283-Q288 HydrophobicContact CZ-CG 3.65Å; F283-Q288 PolarHBondContact O-NE2 3.14Å; F283-F301 AromaticContact CD1-CE2 3.83Å; F283-F301 HydrophobicContact CD1-CE2 3.83Å; F283-F301 AromaticContact CD1-CZ 4Å; F283-F301 HydrophobicContact CD1-CZ 4Å; F283-F301 HydrophobicContact CD2-CE2 4.19Å; F283-F301 HydrophobicContact CE1-CD2 4.31Å; F283-F301 AromaticContact CE1-CE2 3.57Å; F283-F301 HydrophobicContact CE1-CE2 3.57Å; F283-F301 HydrophobicContact CE1-CZ 4.05Å; F283-F301 AromaticContact CE2-CE2 3.97Å; F283-F301 HydrophobicContact CE2-CE2 3.97Å; F283-F301 HydrophobicContact CG-CE2 4.14Å; F283-F301 HydrophobicContact CG-CZ 4.45Å; F283-F301 HydrophobicContact CZ-CD2 4.12Å; F283-F301 AromaticContact CZ-CE2 3.66Å; F283-F301 HydrophobicContact CZ-CE2 3.66Å; F283-V307 HydrophobicContact CB-CG1 4.07Å
284	P	83	Confident	88.1	Confident	44 Å²	44	31.8 Å²	31.8	29%	0.286	15%	0.153	S	C	.	.			trans	-67.4	164.9	177.7	33.1	-38.5	0	0	0	111	T282 E286 I287 Q288	T282-P284 WeakPolarHBondContact OG1-CD 3.29Å; P284-E286 PolarHBondContact O-N 2.99Å; P284-E286 VanDerWaalsContact O-N 3.11Å; P284-I287 HydrophobicContact CG-CB 4.24Å; P284-I287 HydrophobicContact CG-CG1 3.91Å; P284-I287 PolarHBondContact O-N 3.25Å; P284-Q288 VanDerWaalsContact O-CG 3.25Å; P284-Q288 WeakPolarHBondContact O-CG 3.42Å; P284-Q288 PolarHBondContact O-N 3.4Å; P284-Q288 VanDerWaalsContact O-N 3.14Å
285	H	86.5	Confident	88.3	Confident	122 Å²	122	30.8 Å²	30.8	57%	0.565	15%	0.149	S	C	*	.	H	α-helix	trans	-52.9	-38.3	-173.5	-177.9	63.6	0	0	0	113	I287 Q288 K289	H285-I287 VanDerWaalsContact C-N 3.34Å; H285-I287 PolarHBondContact O-N 3.41Å; H285-Q288 PolarHBondContact O-N 3.49Å; H285-K289 PolarHBondContact O-N 3.17Å
286	E	89	Confident	88.6	Confident	112 Å²	112	32 Å²	32	52%	0.523	16%	0.158	S	C	.	.	H	α-helix	trans	-60.7	-41.6	177.9	-63.2	77.9	-172.3	0	0	111.8	L251 P284 K289 L290	L251-E286 HydrophobicContact CD1-CB 3.85Å; P284-E286 PolarHBondContact O-N 2.99Å; P284-E286 VanDerWaalsContact O-N 3.11Å; E286-K289 PolarHBondContact O-N 3.19Å; E286-L290 WeakPolarHBondContact O-CB 3.01Å; E286-L290 PolarHBondContact O-N 3.47Å
287	I	89.9	Confident	88.5	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-71.3	-36.7	176.9	-69.8	-68.4	0	0	0	111.6	M140 A247 D248 L251 F283 P284 H285 K289 L290 A291	M140-I287 HydrophobicContact CE-CG2 3.79Å; M140-I287 HydrophobicContact SD-CG2 4.49Å; A247-I287 HydrophobicContact CB-CD1 3.91Å; A247-I287 WeakPolarHBondContact O-CD1 3.49Å; D248-I287 HydrophobicContact CB-CD1 4.29Å; D248-I287 HydrophobicContact CB-CG1 4.1Å; L251-I287 HydrophobicContact CD1-CD1 3.37Å; L251-I287 HydrophobicContact CD1-CG1 3.91Å; L251-I287 HydrophobicContact CG-CD1 3.86Å; F283-I287 HydrophobicContact CD2-CB 4.39Å; F283-I287 HydrophobicContact CD2-CG2 3.56Å; F283-I287 HydrophobicContact CE2-CG2 3.78Å; P284-I287 HydrophobicContact CG-CB 4.24Å; P284-I287 HydrophobicContact CG-CG1 3.91Å; P284-I287 PolarHBondContact O-N 3.25Å; H285-I287 VanDerWaalsContact C-N 3.34Å; H285-I287 PolarHBondContact O-N 3.41Å; I287-K289 VanDerWaalsContact C-N 3.31Å; I287-K289 PolarHBondContact O-N 2.99Å; I287-L290 HydrophobicContact CD1-CD2 4.38Å; I287-L290 PolarHBondContact O-N 2.86Å; I287-A291 WeakPolarHBondContact O-CB 3.33Å; I287-A291 PolarHBondContact O-N 2.82Å
288	Q	91.1	Very high	88.6	Confident	22 Å²	22	38.7 Å²	38.7	10%	0.103	20%	0.198	C	C	.	.	H	α-helix	trans	-64.9	-40.6	176.3	-41.5	-158.4	20.4	0	0	110.9	F283 P284 H285 A291 Q292 F492	F283-Q288 VanDerWaalsContact CD1-CD 3.4Å; F283-Q288 HydrophobicContact CD1-CG 3.6Å; F283-Q288 HydrophobicContact CD2-CG 4.25Å; F283-Q288 HydrophobicContact CE1-CB 4.11Å; F283-Q288 HydrophobicContact CE1-CG 3.4Å; F283-Q288 VanDerWaalsContact CE1-CG 3.4Å; F283-Q288 HydrophobicContact CE2-CG 4.07Å; F283-Q288 HydrophobicContact CG-CG 4.04Å; F283-Q288 HydrophobicContact CZ-CB 3.98Å; F283-Q288 HydrophobicContact CZ-CG 3.65Å; F283-Q288 PolarHBondContact O-NE2 3.14Å; P284-Q288 VanDerWaalsContact O-CG 3.25Å; P284-Q288 WeakPolarHBondContact O-CG 3.42Å; P284-Q288 PolarHBondContact O-N 3.4Å; P284-Q288 VanDerWaalsContact O-N 3.14Å; H285-Q288 PolarHBondContact O-N 3.49Å; Q288-A291 PolarHBondContact O-N 3.36Å; Q288-Q292 VanDerWaalsContact O-CG 3.28Å; Q288-Q292 WeakPolarHBondContact O-CG 3.42Å; Q288-Q292 PolarHBondContact O-N 3.13Å; Q288-F492 HydrophobicContact CB-CD2 4.45Å; Q288-F492 VanDerWaalsContact CD-CE2 3.47Å
289	K	92.2	Very high	88.6	Confident	100 Å²	100	38.9 Å²	38.9	44%	0.435	20%	0.199	S	C	.	.	H	α-helix	trans	-62.6	-45.5	173.8	-174.4	-179	175.9	-171.2	0	111.4	H285 E286 I287 A291 Q292 E293	H285-K289 PolarHBondContact O-N 3.17Å; E286-K289 PolarHBondContact O-N 3.19Å; I287-K289 VanDerWaalsContact C-N 3.31Å; I287-K289 PolarHBondContact O-N 2.99Å; K289-A291 VanDerWaalsContact C-N 3.33Å; K289-A291 PolarHBondContact O-N 3.19Å; K289-Q292 PolarHBondContact O-N 3.28Å; K289-E293 WeakPolarHBondContact CE-OE1 3.5Å; K289-E293 WeakPolarHBondContact O-CG 3.41Å; K289-E293 PolarHBondContact O-N 2.67Å; K289-E293 VanDerWaalsContact O-N 3.15Å
290	L	91.5	Very high	88.8	Confident	1 Å²	1	38.6 Å²	38.6	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-59.6	-44.1	176.8	-164.5	73.4	0	0	0	111.7	L244 L251 M278 E286 I287 E293 F294	L244-L290 HydrophobicContact CD2-CD2 4.2Å; L251-L290 HydrophobicContact CD1-CD2 4.23Å; L251-L290 HydrophobicContact CD2-CD2 4.05Å; L251-L290 HydrophobicContact CG-CD2 4.3Å; M278-L290 HydrophobicContact CE-CB 4.14Å; M278-L290 HydrophobicContact CE-CD2 3.75Å; M278-L290 HydrophobicContact CE-CG 4.03Å; E286-L290 WeakPolarHBondContact O-CB 3.01Å; E286-L290 PolarHBondContact O-N 3.47Å; I287-L290 HydrophobicContact CD1-CD2 4.38Å; I287-L290 PolarHBondContact O-N 2.86Å; L290-E293 PolarHBondContact O-N 2.77Å; L290-F294 HydrophobicContact CD1-CD2 3.98Å; L290-F294 HydrophobicContact CD1-CE2 3.39Å; L290-F294 HydrophobicContact CD1-CZ 3.76Å; L290-F294 HydrophobicContact CD2-CE2 4.34Å; L290-F294 HydrophobicContact CG-CD2 3.89Å; L290-F294 HydrophobicContact CG-CE2 3.78Å; L290-F294 PolarHBondContact O-N 2.67Å
291	A	92	Very high	89.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-61.8	-43.4	176.7	0	0	0	0	0	112.1	M140 M278 I287 Q288 K289 E293 F294 L295	M140-A291 HydrophobicContact SD-CB 4.2Å; M278-A291 HydrophobicContact CE-CB 4.15Å; M278-A291 HydrophobicContact SD-CB 4.05Å; I287-A291 WeakPolarHBondContact O-CB 3.33Å; I287-A291 PolarHBondContact O-N 2.82Å; Q288-A291 PolarHBondContact O-N 3.36Å; K289-A291 VanDerWaalsContact C-N 3.33Å; K289-A291 PolarHBondContact O-N 3.19Å; A291-E293 PolarHBondContact O-N 3.14Å; A291-F294 PolarHBondContact O-N 2.78Å; A291-L295 HydrophobicContact CB-CD1 3.97Å; A291-L295 WeakPolarHBondContact O-CB 3.39Å; A291-L295 WeakPolarHBondContact O-CG 3.33Å; A291-L295 PolarHBondContact O-N 2.84Å
292	Q	91.4	Very high	89.7	Confident	100 Å²	100	38 Å²	38	47%	0.467	19%	0.192	S	C	.	.	H	α-helix	trans	-62.7	-29.7	177.1	-74	174.2	12.6	0	0	113.6	R271 Q288 K289	R271-Q292 PolarHBondContact NH1-O 3.41Å; Q288-Q292 VanDerWaalsContact O-CG 3.28Å; Q288-Q292 WeakPolarHBondContact O-CG 3.42Å; Q288-Q292 PolarHBondContact O-N 3.13Å; K289-Q292 PolarHBondContact O-N 3.28Å
293	E	91.2	Very high	90.1	Very high	70 Å²	70	37.8 Å²	37.8	33%	0.327	19%	0.192	S	C	.	.	H	α-helix	trans	-85.1	-38.5	-178.8	-70.2	170.1	177.5	0	0	112.1	R260 R271 K289 L290 A291	R260-E293 IonicContact CZ-OE2 2.71Å; R260-E293 IonicContact NH1-OE2 3Å; R260-E293 PolarHBondContact NH1-OE2 2.71Å; R260-E293 IonicContact NH2-OE1 3.57Å; R260-E293 IonicContact NH2-OE2 3.96Å; R260-E293 PolarHBondContact NH2-OE2 3.23Å; R271-E293 PolarHBondContact NH1-O 3.43Å; K289-E293 WeakPolarHBondContact CE-OE1 3.5Å; K289-E293 WeakPolarHBondContact O-CG 3.41Å; K289-E293 PolarHBondContact O-N 2.67Å; K289-E293 VanDerWaalsContact O-N 3.15Å; L290-E293 PolarHBondContact O-N 2.77Å; A291-E293 PolarHBondContact O-N 3.14Å
294	F	91.8	Very high	89.8	Confident	3 Å²	3	37.4 Å²	37.4	1%	0.013	19%	0.191	C	C	.	.	H	α-helix	trans	-95.8	-29.8	-173.8	-66.8	-12.1	0	0	0	115.3	L244 I259 R260 V263 R271 R274 L290 A291	L244-F294 HydrophobicContact CD2-CD2 4.25Å; L244-F294 HydrophobicContact CD2-CE2 4.36Å; I259-F294 HydrophobicContact CG2-CD2 4.49Å; I259-F294 HydrophobicContact CG2-CE2 3.45Å; I259-F294 VanDerWaalsContact CG2-CE2 3.45Å; I259-F294 HydrophobicContact CG2-CZ 3.95Å; R260-F294 HydrophobicContact CG-CZ 4.07Å; V263-F294 HydrophobicContact CB-CE1 4.25Å; V263-F294 HydrophobicContact CB-CZ 4.34Å; V263-F294 HydrophobicContact CG1-CD1 4.03Å; V263-F294 HydrophobicContact CG1-CE1 4.06Å; V263-F294 HydrophobicContact CG2-CE2 4.33Å; V263-F294 HydrophobicContact CG2-CZ 4.3Å; R271-F294 WeakPolarHBondContact CB-O 3.41Å; R274-F294 PolarHBondContact NH2-O 3.09Å; L290-F294 HydrophobicContact CD1-CD2 3.98Å; L290-F294 HydrophobicContact CD1-CE2 3.39Å; L290-F294 HydrophobicContact CD1-CZ 3.76Å; L290-F294 HydrophobicContact CD2-CE2 4.34Å; L290-F294 HydrophobicContact CG-CD2 3.89Å; L290-F294 HydrophobicContact CG-CE2 3.78Å; L290-F294 PolarHBondContact O-N 2.67Å; A291-F294 PolarHBondContact O-N 2.78Å
295	L	92	Very high	89.4	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	19%	0.188	C	C	.	.	S	Bend	trans	-89.9	153.2	178.6	-52.6	178.7	0	0	0	111.1	D138 M140 R271 T276 M278 A291 Y299	D138-L295 HydrophobicContact CB-CB 4.29Å; D138-L295 HydrophobicContact CB-CD2 4.2Å; D138-L295 VanDerWaalsContact OD2-CA 3.3Å; D138-L295 WeakPolarHBondContact OD2-CA 3.3Å; M140-L295 HydrophobicContact CB-CD1 3.8Å; R271-L295 VanDerWaalsContact CD-O 3.3Å; R271-L295 WeakPolarHBondContact CD-O 3.45Å; R271-L295 PolarHBondContact NH1-O 3.47Å; T276-L295 HydrophobicContact CG2-CD2 3.56Å; T276-L295 WeakPolarHBondContact O-CD2 3.39Å; M278-L295 HydrophobicContact CG-CD2 4.18Å; M278-L295 HydrophobicContact SD-CD1 4.26Å; M278-L295 HydrophobicContact SD-CD2 4.19Å; M278-L295 HydrophobicContact SD-CG 4.06Å; A291-L295 HydrophobicContact CB-CD1 3.97Å; A291-L295 WeakPolarHBondContact O-CB 3.39Å; A291-L295 WeakPolarHBondContact O-CG 3.33Å; A291-L295 PolarHBondContact O-N 2.84Å; L295-Y299 HydrophobicContact CB-CD1 4.05Å; L295-Y299 HydrophobicContact CB-CG 4.09Å; L295-Y299 HydrophobicContact CD1-CD1 4.23Å; L295-Y299 HydrophobicContact CD1-CD2 3.74Å; L295-Y299 HydrophobicContact CD1-CE2 4.21Å; L295-Y299 HydrophobicContact CD1-CG 3.76Å
296	V	92.4	Very high	88.5	Confident	38 Å²	38	37.5 Å²	37.5	23%	0.23	19%	0.187	C	C	.	.			trans	-66.7	140.5	169.2	-172	0	0	0	0	109.4	D138 R271 D298 Y299	D138-V296 PolarHBondContact OD2-N 2.99Å; R271-V296 HydrophobicContact CB-CG2 4.31Å; R271-V296 HydrophobicContact CG-CG2 4.33Å; R271-V296 WeakPolarHBondContact O-CG2 3.37Å; V296-D298 WeakPolarHBondContact CG1-OD1 3.17Å; V296-D298 PolarHBondContact O-N 3.22Å; V296-Y299 WeakPolarHBondContact O-CB 3.43Å; V296-Y299 VanDerWaalsContact O-CD1 3.31Å; V296-Y299 WeakPolarHBondContact O-CD1 3.14Å; V296-Y299 PolarHBondContact O-N 3.19Å
297	P	89.5	Confident	87.2	Confident	88 Å²	88	33.4 Å²	33.4	57%	0.571	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.1	-26.9	-172.5	-31.6	36.5	0	0	0	116.9	Y299 R493	P297-Y299 VanDerWaalsContact C-N 3.33Å; P297-R493 PolarHBondContact O-NH1 3.13Å
298	D	89.8	Confident	85.7	Confident	54 Å²	54	34.3 Å²	34.3	29%	0.289	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	16.2	179.9	72.9	-53.8	0	0	0	113.8	R137 V296	R137-D298 IonicContact CZ-OD2 2.79Å; R137-D298 IonicContact NE-OD2 3.48Å; R137-D298 PolarHBondContact NE-OD2 3.39Å; R137-D298 VanDerWaalsContact NE-OD2 3.17Å; R137-D298 PolarHBondContact NH2-O 3.33Å; R137-D298 IonicContact NH2-OD2 3.95Å; R137-D298 PolarHBondContact NH2-OD2 2.88Å; V296-D298 WeakPolarHBondContact CG1-OD1 3.17Å; V296-D298 PolarHBondContact O-N 3.22Å
299	Y	92	Very high	84.3	Confident	5 Å²	5	34.2 Å²	34.2	2%	0.02	18%	0.181	C	C	.	.	P	Polyproline II helix	trans	-51.6	153.1	178.8	70	-87.1	0	0	0	113.7	D138 M140 L295 V296 P297 F301 R493	D138-Y299 CarbonylContact O-C 3.55Å; D138-Y299 WeakPolarHBondContact O-CA 3.39Å; M140-Y299 HydrophobicContact CB-CD2 3.78Å; M140-Y299 HydrophobicContact CB-CE2 3.66Å; M140-Y299 HydrophobicContact CG-CE2 4.49Å; L295-Y299 HydrophobicContact CB-CD1 4.05Å; L295-Y299 HydrophobicContact CB-CG 4.09Å; L295-Y299 HydrophobicContact CD1-CD1 4.23Å; L295-Y299 HydrophobicContact CD1-CD2 3.74Å; L295-Y299 HydrophobicContact CD1-CE2 4.21Å; L295-Y299 HydrophobicContact CD1-CG 3.76Å; V296-Y299 WeakPolarHBondContact O-CB 3.43Å; V296-Y299 VanDerWaalsContact O-CD1 3.31Å; V296-Y299 WeakPolarHBondContact O-CD1 3.14Å; V296-Y299 PolarHBondContact O-N 3.19Å; P297-Y299 VanDerWaalsContact C-N 3.33Å; Y299-F301 HydrophobicContact CD2-CB 4.48Å; Y299-F301 HydrophobicContact CE2-CB 3.98Å; Y299-F301 HydrophobicContact CE2-CD2 4.48Å; Y299-R493 VanDerWaalsContact O-CZ 3.23Å; Y299-R493 PolarHBondContact O-NH1 3.05Å; Y299-R493 PolarHBondContact O-NH2 3.19Å
300	V	92.1	Very high	83.1	Confident	1 Å²	1	29.9 Å²	29.9	1%	0.006	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	127.6	171.4	178.3	0	0	0	0	108.5	A89 T90 V94 T132 R137 D138 L139 M140	A89-V300 HydrophobicContact CB-CG1 4.48Å; T90-V300 CarbonylContact O-C 3.59Å; T90-V300 WeakPolarHBondContact O-CA 3.28Å; V94-V300 HydrophobicContact CG1-CG1 4.05Å; V94-V300 HydrophobicContact CG2-CG1 4.28Å; V94-V300 HydrophobicContact CG2-CG2 4.28Å; T132-V300 HydrophobicContact CG2-CB 3.76Å; T132-V300 HydrophobicContact CG2-CG1 4.29Å; T132-V300 HydrophobicContact CG2-CG2 3.68Å; R137-V300 HydrophobicContact CB-CG2 4.48Å; D138-V300 PolarHBondContact O-N 3.41Å; L139-V300 WeakPolarHBondContact CA-O 3.47Å; L139-V300 HydrophobicContact CD1-CB 4.31Å; L139-V300 HydrophobicContact CD1-CG1 4.3Å; M140-V300 PolarHBondContact N-O 2.86Å
301	F	92.4	Very high	82	Confident	5 Å²	5	31.7 Å²	31.7	2%	0.022	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	124.6	170.5	177.1	-102.9	0	0	0	108.8	A89 T90 M140 C142 F283 Y299 A303 D491	A89-F301 CarbonylContact C-O 3.6Å; A89-F301 WeakPolarHBondContact CA-O 3.05Å; T90-F301 PolarHBondContact N-O 3.16Å; T90-F301 PolarHBondContact O-N 2.79Å; T90-F301 WeakPolarHBondContact OG1-CB 3.26Å; M140-F301 HydrophobicContact CB-CD2 4.03Å; M140-F301 HydrophobicContact CG-CD2 3.73Å; M140-F301 HydrophobicContact CG-CE2 4.04Å; M140-F301 CarbonylContact O-C 3.48Å; M140-F301 WeakPolarHBondContact O-CA 3.33Å; C142-F301 HydrophobicContact CB-CZ 4.5Å; C142-F301 VanDerWaalsContact SG-CE2 3.6Å; F283-F301 AromaticContact CD1-CE2 3.83Å; F283-F301 HydrophobicContact CD1-CE2 3.83Å; F283-F301 AromaticContact CD1-CZ 4Å; F283-F301 HydrophobicContact CD1-CZ 4Å; F283-F301 HydrophobicContact CD2-CE2 4.19Å; F283-F301 HydrophobicContact CE1-CD2 4.31Å; F283-F301 AromaticContact CE1-CE2 3.57Å; F283-F301 HydrophobicContact CE1-CE2 3.57Å; F283-F301 HydrophobicContact CE1-CZ 4.05Å; F283-F301 AromaticContact CE2-CE2 3.97Å; F283-F301 HydrophobicContact CE2-CE2 3.97Å; F283-F301 HydrophobicContact CG-CE2 4.14Å; F283-F301 HydrophobicContact CG-CZ 4.45Å; F283-F301 HydrophobicContact CZ-CD2 4.12Å; F283-F301 AromaticContact CZ-CE2 3.66Å; F283-F301 HydrophobicContact CZ-CE2 3.66Å; Y299-F301 HydrophobicContact CD2-CB 4.48Å; Y299-F301 HydrophobicContact CE2-CB 3.98Å; Y299-F301 HydrophobicContact CE2-CD2 4.48Å; F301-A303 HydrophobicContact CE1-CB 3.93Å; F301-A303 HydrophobicContact CZ-CB 4.4Å; F301-D491 HydrophobicContact CD1-CB 4.32Å
302	L	89.2	Confident	81.2	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	113.4	-177.6	-176	70.4	0	0	0	108.9	V87 E88 A89 V125 F128 A129 L139 M140 A141 C142 V304	V87-L302 HydrophobicContact CG1-CD1 3.37Å; V87-L302 HydrophobicContact CG1-CG 4.24Å; E88-L302 WeakPolarHBondContact O-CA 3.32Å; A89-L302 HydrophobicContact CB-CD1 3.84Å; V125-L302 HydrophobicContact CG1-CD2 4.19Å; F128-L302 HydrophobicContact CB-CD1 3.47Å; F128-L302 VanDerWaalsContact CB-CD1 3.47Å; F128-L302 HydrophobicContact CB-CD2 3.9Å; F128-L302 HydrophobicContact CB-CG 4.36Å; F128-L302 HydrophobicContact CD1-CD1 4.17Å; F128-L302 HydrophobicContact CD2-CD1 4.32Å; F128-L302 HydrophobicContact CG-CD1 3.75Å; A129-L302 HydrophobicContact CB-CD2 4.41Å; L139-L302 HydrophobicContact CD1-CB 3.89Å; M140-L302 PolarHBondContact O-N 2.75Å; A141-L302 CarbonylContact C-O 3.58Å; A141-L302 WeakPolarHBondContact CA-O 3.35Å; A141-L302 HydrophobicContact CB-CB 4.26Å; A141-L302 HydrophobicContact CB-CD2 4.27Å; C142-L302 PolarHBondContact N-O 3.07Å; L302-V304 HydrophobicContact CD2-CG2 4.34Å; L302-V304 HydrophobicContact CG-CG2 4.17Å
303	A	87.4	Confident	80.6	Confident	9 Å²	9	36.1 Å²	36.1	7%	0.074	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	120.1	171.9	0	0	0	0	0	109.4	V87 E88 F301 V307	V87-A303 WeakPolarHBondContact CA-O 3.24Å; E88-A303 PolarHBondContact N-O 3.02Å; E88-A303 PolarHBondContact O-N 3.4Å; F301-A303 HydrophobicContact CE1-CB 3.93Å; F301-A303 HydrophobicContact CZ-CB 4.4Å; A303-V307 HydrophobicContact CB-CG2 3.94Å
304	V	78.8	Confident	80.3	Confident	9 Å²	9	32.9 Å²	32.9	6%	0.055	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.8	176.2	178.2	0	0	0	0	109.6	I85 V87 P124 V125 C142 A143 L302	I85-V304 HydrophobicContact CG2-CG1 3.84Å; V87-V304 HydrophobicContact CG1-CG2 3.97Å; V87-V304 HydrophobicContact CG2-CB 4.42Å; V87-V304 HydrophobicContact CG2-CG1 4.11Å; V87-V304 HydrophobicContact CG2-CG2 3.97Å; P124-V304 HydrophobicContact CB-CG1 4.34Å; V125-V304 HydrophobicContact CB-CG2 4.37Å; V125-V304 HydrophobicContact CG2-CB 4.11Å; V125-V304 HydrophobicContact CG2-CG1 4.1Å; V125-V304 HydrophobicContact CG2-CG2 3.63Å; C142-V304 PolarHBondContact O-N 2.87Å; A143-V304 HydrophobicContact CB-CB 3.95Å; A143-V304 HydrophobicContact CB-CG2 4.32Å; L302-V304 HydrophobicContact CD2-CG2 4.34Å; L302-V304 HydrophobicContact CG-CG2 4.17Å
305	G	74.7	Confident	80.3	Confident	23 Å²	23	35.6 Å²	35.6	24%	0.237	20%	0.2	C	C	.	.	S	Bend	trans	64	-162.4	-170.4	0	0	0	0	0	111.6	P86 V307	P86-G305 WeakPolarHBondContact O-CA 3.45Å; P86-G305 PolarHBondContact O-N 2.62Å; G305-V307 PolarHBondContact O-N 3.34Å
306	R	67.5	Low	80.3	Confident	145 Å²	145	36 Å²	36	55%	0.547	20%	0.201	S	C	.	.	S	Bend	trans	-82.1	113.6	171.6	-171.2	163.3	178.7	-150.1	-7.1	108.9	G308 S309 E461	R306-G308 PolarHBondContact O-N 3.46Å; R306-S309 VanDerWaalsContact O-CB 3.26Å; R306-S309 WeakPolarHBondContact O-CB 3.4Å; R306-S309 PolarHBondContact O-N 2.96Å; R306-E461 VanDerWaalsContact CD-OE1 3.26Å; R306-E461 WeakPolarHBondContact CD-OE1 3.49Å; R306-E461 IonicContact CZ-OE1 3.62Å; R306-E461 IonicContact CZ-OE2 2.75Å; R306-E461 IonicContact NE-OE1 3.7Å; R306-E461 IonicContact NE-OE2 2.84Å; R306-E461 IonicContact NH1-OE1 3.81Å; R306-E461 PolarHBondContact NH1-OE1 3.3Å; R306-E461 VanDerWaalsContact NH1-OE1 3.11Å; R306-E461 IonicContact NH1-OE2 3.26Å; R306-E461 PolarHBondContact NH1-OE2 3.1Å; R306-E461 IonicContact NH2-OE2 3.5Å; R306-E461 PolarHBondContact NH2-OE2 3.31Å
307	V	62.4	Low	80.4	Confident	27 Å²	27	39.5 Å²	39.5	16%	0.164	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	124.3	179.5	-177.5	0	0	0	0	109.7	C142 F283 A303 G305	C142-V307 HydrophobicContact CB-CG1 4.17Å; C142-V307 HydrophobicContact CB-CG2 3.9Å; F283-V307 HydrophobicContact CB-CG1 4.07Å; A303-V307 HydrophobicContact CB-CG2 3.94Å; G305-V307 PolarHBondContact O-N 3.34Å
308	G	58.5	Low	80.6	Confident	20 Å²	20	36.2 Å²	36.2	21%	0.206	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	83.3	3.3	-178.8	0	0	0	0	0	116.3	R306	R306-G308 PolarHBondContact O-N 3.46Å
309	S	62.6	Low	80.8	Confident	19 Å²	19	36 Å²	36	13%	0.133	19%	0.189	C	C	.	.			trans	-81.1	175.6	176.8	-157.9	0	0	0	0	112.6	L144 R306 E461	L144-S309 WeakPolarHBondContact CD1-O 3.44Å; L144-S309 WeakPolarHBondContact CD2-O 3.28Å; R306-S309 VanDerWaalsContact O-CB 3.26Å; R306-S309 WeakPolarHBondContact O-CB 3.4Å; R306-S309 PolarHBondContact O-N 2.96Å; S309-E461 VanDerWaalsContact CB-OE1 3.25Å; S309-E461 WeakPolarHBondContact CB-OE1 3.46Å; S309-E461 PolarHBondContact OG-OE1 3.47Å
310	T	66.2	Low	80.9	Confident	10 Å²	10	39.3 Å²	39.3	6%	0.061	20%	0.202	C	C	.	.			trans	-104.8	154.3	174.5	57.3	0	0	0	0	111.6	E312 Q316 V425 I428 L458 A462	T310-E312 PolarHBondContact O-N 3.29Å; T310-Q316 PolarHBondContact OG1-NE2 2.97Å; T310-V425 HydrophobicContact CG2-CB 4.42Å; T310-V425 HydrophobicContact CG2-CG1 4.17Å; T310-V425 HydrophobicContact CG2-CG2 3.89Å; T310-I428 HydrophobicContact CG2-CD1 3.52Å; T310-I428 HydrophobicContact CG2-CG1 4.41Å; T310-L458 HydrophobicContact CG2-CD1 3.79Å; T310-L458 HydrophobicContact CG2-CD2 3.74Å; T310-L458 HydrophobicContact CG2-CG 3.92Å; T310-A462 WeakPolarHBondContact OG1-CB 3.48Å
311	S	68.9	Low	81.1	Confident	39 Å²	39	39.3 Å²	39.3	27%	0.273	20%	0.201	S	C	.	.			trans	-66.2	131.5	173.5	-175.8	0	0	0	0	111.2	N313 I314	S311-N313 PolarHBondContact O-N 3.16Å; S311-N313 VanDerWaalsContact O-N 3.16Å; S311-N313 PolarHBondContact OG-N 3.41Å; S311-I314 PolarHBondContact O-N 3.27Å
312	E	73.8	Confident	81.2	Confident	169 Å²	169	42 Å²	42	79%	0.79	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.5	174.7	-61.6	-177.8	177.7	0	0	113.1	T310 I314	T310-E312 PolarHBondContact O-N 3.29Å; E312-I314 PolarHBondContact O-N 3.5Å
313	N	79	Confident	81.4	Confident	24 Å²	24	45.2 Å²	45.2	13%	0.128	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	0.4	178.4	-65.8	-40.2	0	0	0	113.5	S311 V437 G438	S311-N313 PolarHBondContact O-N 3.16Å; S311-N313 VanDerWaalsContact O-N 3.16Å; S311-N313 PolarHBondContact OG-N 3.41Å; N313-V437 WeakPolarHBondContact O-CA 3.16Å; N313-G438 PolarHBondContact O-N 3.28Å
314	I	86.3	Confident	81.6	Confident	2 Å²	2	51.4 Å²	51.4	1%	0.01	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	112.3	-179.1	-55.8	169	0	0	0	108.9	S311 E312 Q316 I428 T431 G438 A440	S311-I314 PolarHBondContact O-N 3.27Å; E312-I314 PolarHBondContact O-N 3.5Å; I314-Q316 HydrophobicContact CG2-CG 4.13Å; I314-Q316 PolarHBondContact O-N 3.31Å; I314-I428 HydrophobicContact CD1-CG1 4.31Å; I314-I428 HydrophobicContact CG2-CB 4.49Å; I314-T431 HydrophobicContact CG1-CG2 4.38Å; I314-T431 HydrophobicContact CG2-CG2 4.06Å; I314-G438 CarbonylContact C-O 3.55Å; I314-G438 WeakPolarHBondContact CA-O 3.09Å; I314-A440 HydrophobicContact CG2-CB 3.69Å
315	T	91	Very high	82.4	Confident	60 Å²	60	55.4 Å²	55.4	37%	0.368	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	120	168.4	-56.7	0	0	0	0	109.3	G438 L439 A440	T315-G438 PolarHBondContact N-O 2.96Å; T315-L439 HydrophobicContact CG2-CD1 4.19Å; T315-A440 PolarHBondContact O-N 2.94Å
316	Q	92.6	Very high	83.4	Confident	7 Å²	7	54.5 Å²	54.5	3%	0.033	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.5	-176.5	-54.3	-177.4	51.3	0	0	110.2	T310 I314 Y424 I428 A440 Q464	T310-Q316 PolarHBondContact OG1-NE2 2.97Å; I314-Q316 HydrophobicContact CG2-CG 4.13Å; I314-Q316 PolarHBondContact O-N 3.31Å; Q316-Y424 PolarHBondContact OE1-OH 2.51Å; Q316-I428 HydrophobicContact CG-CD1 4.26Å; Q316-A440 CarbonylContact C-O 3.59Å; Q316-A440 WeakPolarHBondContact CA-O 3.37Å; Q316-Q464 HydrophobicContact CB-CG 4.05Å; Q316-Q464 HydrophobicContact CG-CG 4.16Å
317	K	93.1	Very high	84.7	Confident	113 Å²	113	53 Å²	53	49%	0.491	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	121.6	176.6	-67.1	-170.1	177.8	-176.9	0	110.4	L439 A440 T441 S442	K317-L439 HydrophobicContact CD-CD1 4.18Å; K317-L439 HydrophobicContact CG-CD1 4.25Å; K317-A440 PolarHBondContact N-O 3.45Å; K317-T441 HydrophobicContact CB-CG2 4.38Å; K317-T441 CarbonylContact O-C 3.54Å; K317-T441 WeakPolarHBondContact O-CA 3.29Å; K317-S442 PolarHBondContact O-N 3.3Å
318	L	93.8	Very high	86.2	Confident	18 Å²	18	53.4 Å²	53.4	9%	0.094	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	128.9	171.5	-68.6	-172.2	0	0	0	110.8	L455 I459 P467 W469 L470	L318-L455 HydrophobicContact CD1-CD2 3.72Å; L318-L455 HydrophobicContact CD1-CG 4.08Å; L318-L455 HydrophobicContact CD2-CD2 3.94Å; L318-L455 HydrophobicContact CG-CD2 4.49Å; L318-I459 HydrophobicContact CD1-CD1 3.1Å; L318-I459 HydrophobicContact CD2-CD1 4.45Å; L318-I459 HydrophobicContact CG-CD1 3.63Å; L318-P467 HydrophobicContact CB-CG 3.97Å; L318-W469 HydrophobicContact CB-CH2 4.21Å; L318-W469 HydrophobicContact CB-CZ2 4.05Å; L318-W469 HydrophobicContact CD1-CH2 4.35Å; L318-L470 HydrophobicContact CD1-CD2 3.35Å
319	I	94.3	Very high	87.9	Confident	49 Å²	49	55.9 Å²	55.9	25%	0.251	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	131.2	-178.9	-50.6	177.3	0	0	0	108.4	V321 F329 T441 S442 F444	I319-V321 HydrophobicContact CB-CG2 4.14Å; I319-V321 HydrophobicContact CG2-CG2 3.7Å; I319-V321 PolarHBondContact O-N 3.36Å; I319-F329 HydrophobicContact CG2-CE1 4.48Å; I319-T441 HydrophobicContact CD1-CG2 3.68Å; I319-T441 HydrophobicContact CG1-CG2 4.26Å; I319-S442 PolarHBondContact N-O 2.84Å; I319-F444 PolarHBondContact O-N 2.99Å
320	W	95.2	Very high	89.5	Confident	76 Å²	76	55 Å²	55	29%	0.288	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	118.7	170.6	-171.1	-82.7	0	0	0	110.1	E322 F444 H446 W469 L473	W320-E322 PolarHBondContact NE1-OE1 3.4Å; W320-F444 CarbonylContact C-O 3.6Å; W320-F444 WeakPolarHBondContact CA-O 3.39Å; W320-F444 AromaticContact CE3-CD1 3.79Å; W320-F444 HydrophobicContact CE3-CD1 3.79Å; W320-F444 HydrophobicContact CE3-CE1 4.41Å; W320-F444 AromaticContact CZ3-CD1 3.62Å; W320-F444 HydrophobicContact CZ3-CD1 3.62Å; W320-F444 AromaticContact CZ3-CE1 3.79Å; W320-F444 HydrophobicContact CZ3-CE1 3.79Å; W320-H446 AromaticContact CZ2-CE1 3.38Å; W320-H446 WeakPolarHBondContact CZ2-CE1 3.32Å; W320-H446 AromaticContact CZ2-CG 3.97Å; W320-H446 AromaticContact CZ2-ND1 3.47Å; W320-H446 WeakPolarHBondContact CZ2-ND1 3.43Å; W320-H446 AromaticContact CZ2-NE2 3.77Å; W320-W469 AromaticContact CE3-CD2 3.9Å; W320-W469 HydrophobicContact CE3-CD2 3.9Å; W320-W469 AromaticContact CE3-CE3 3.57Å; W320-W469 HydrophobicContact CE3-CE3 3.57Å; W320-W469 HydrophobicContact CE3-CH2 4.43Å; W320-W469 AromaticContact CE3-CZ3 3.87Å; W320-W469 HydrophobicContact CE3-CZ3 3.87Å; W320-W469 HydrophobicContact CZ3-CD2 4.49Å; W320-W469 AromaticContact CZ3-CE3 3.81Å; W320-W469 HydrophobicContact CZ3-CE3 3.81Å; W320-W469 HydrophobicContact CZ3-CZ3 4.14Å; W320-L473 HydrophobicContact CH2-CD1 4.34Å; W320-L473 HydrophobicContact CZ3-CD1 3.81Å
321	V	95.3	Very high	90.9	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.278	C	S	.	.			trans	-141.6	117.3	-178.4	-171.9	0	0	0	0	111	I319 Q325 K326 F329 F443 F444 N445	I319-V321 HydrophobicContact CB-CG2 4.14Å; I319-V321 HydrophobicContact CG2-CG2 3.7Å; I319-V321 PolarHBondContact O-N 3.36Å; V321-Q325 HydrophobicContact CG1-CB 3.93Å; V321-K326 HydrophobicContact CB-CG 4.31Å; V321-K326 HydrophobicContact CG1-CB 4.21Å; V321-K326 HydrophobicContact CG1-CG 3.72Å; V321-F329 HydrophobicContact CB-CD2 4.35Å; V321-F329 HydrophobicContact CG1-CB 4.33Å; V321-F329 HydrophobicContact CG1-CD2 3.46Å; V321-F329 VanDerWaalsContact CG1-CD2 3.46Å; V321-F329 HydrophobicContact CG1-CE2 4.05Å; V321-F329 HydrophobicContact CG1-CG 4.13Å; V321-F329 HydrophobicContact CG2-CB 4.48Å; V321-F329 HydrophobicContact CG2-CD1 4.48Å; V321-F329 HydrophobicContact CG2-CD2 3.95Å; V321-F329 HydrophobicContact CG2-CE2 4.25Å; V321-F329 HydrophobicContact CG2-CG 4.06Å; V321-F443 HydrophobicContact CB-CB 4.19Å; V321-F443 HydrophobicContact CB-CD1 4.38Å; V321-F443 HydrophobicContact CB-CG 4.22Å; V321-F443 HydrophobicContact CG2-CB 4.31Å; V321-F443 HydrophobicContact CG2-CD1 3.68Å; V321-F443 HydrophobicContact CG2-CE1 4.17Å; V321-F443 HydrophobicContact CG2-CG 4.03Å; V321-F444 PolarHBondContact N-O 3Å; V321-N445 WeakPolarHBondContact O-CB 3.19Å
322	E	94.8	Very high	92.1	Very high	62 Å²	62	59.7 Å²	59.7	29%	0.29	29%	0.293	S	S	.	.			trans	-67.2	151.5	173.2	-64	-60.2	156.7	0	0	111.3	W320 N324 Q325 K326 H446	W320-E322 PolarHBondContact NE1-OE1 3.4Å; E322-N324 WeakPolarHBondContact CB-OD1 3.46Å; E322-N324 PolarHBondContact O-N 3.46Å; E322-N324 VanDerWaalsContact O-N 3.12Å; E322-Q325 PolarHBondContact O-N 3.31Å; E322-K326 PolarHBondContact O-N 2.75Å; E322-H446 IonicContact OE1-CE1 3.94Å; E322-H446 PolarHBondContact OE1-CE1 3.19Å; E322-H446 IonicContact OE1-ND1 3.97Å; E322-H446 PolarHBondContact OE1-ND1 2.89Å; E322-H446 IonicContact OE2-ND1 2.85Å
323	E	92.6	Very high	93	Very high	68 Å²	68	53.2 Å²	53.2	32%	0.318	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-37.6	-172.3	-68.5	-67.4	175.1	0	0	114.1	Q325 K326 N445 K447	E323-Q325 VanDerWaalsContact C-N 3.27Å; E323-Q325 PolarHBondContact O-N 3Å; E323-K326 VanDerWaalsContact CD-NZ 3.27Å; E323-K326 IonicContact OE1-NZ 3.3Å; E323-K326 PolarHBondContact OE1-NZ 2.99Å; E323-K326 VanDerWaalsContact OE1-NZ 3.16Å; E323-K326 WeakPolarHBondContact OE2-CD 3.29Å; E323-K326 WeakPolarHBondContact OE2-CE 3.24Å; E323-K326 IonicContact OE2-NZ 3.78Å; E323-K326 PolarHBondContact OE2-NZ 3.27Å; E323-N445 VanDerWaalsContact CD-ND2 3.32Å; E323-N445 PolarHBondContact OE1-ND2 3.23Å; E323-K447 VanDerWaalsContact CD-NZ 3.33Å; E323-K447 WeakPolarHBondContact OE1-CD 3.16Å; E323-K447 WeakPolarHBondContact OE1-CE 3.33Å; E323-K447 IonicContact OE1-NZ 2.78Å; E323-K447 PolarHBondContact OE1-NZ 2.74Å
324	N	92.9	Very high	93.7	Very high	139 Å²	139	52.4 Å²	52.4	74%	0.743	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-19.3	178.7	61.4	-26.8	0	0	0	113.3	E322	E322-N324 WeakPolarHBondContact CB-OD1 3.46Å; E322-N324 PolarHBondContact O-N 3.46Å; E322-N324 VanDerWaalsContact O-N 3.12Å
325	Q	94.1	Very high	94	Very high	94 Å²	94	55 Å²	55	44%	0.439	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-18.7	-177.9	-66.4	175.7	-22.2	0	0	113	V321 E322 E323 R327 G328 F329	V321-Q325 HydrophobicContact CG1-CB 3.93Å; E322-Q325 PolarHBondContact O-N 3.31Å; E323-Q325 VanDerWaalsContact C-N 3.27Å; E323-Q325 PolarHBondContact O-N 3Å; Q325-R327 PolarHBondContact O-N 3Å; Q325-R327 VanDerWaalsContact O-N 3.13Å; Q325-G328 PolarHBondContact O-N 3.41Å; Q325-F329 HydrophobicContact CB-CD2 4.03Å; Q325-F329 HydrophobicContact CB-CE2 4.18Å; Q325-F329 PolarHBondContact O-N 3.26Å
326	K	95.6	Very high	93.9	Very high	3 Å²	3	56.4 Å²	56.4	1%	0.013	30%	0.304	C	S	.	.	H	α-helix	trans	-51.8	-39.1	-177.1	-73.2	-176.1	173.1	168.3	0	113.8	V321 E322 E323 L330 Y415 D416 F443	V321-K326 HydrophobicContact CB-CG 4.31Å; V321-K326 HydrophobicContact CG1-CB 4.21Å; V321-K326 HydrophobicContact CG1-CG 3.72Å; E322-K326 PolarHBondContact O-N 2.75Å; E323-K326 VanDerWaalsContact CD-NZ 3.27Å; E323-K326 IonicContact OE1-NZ 3.3Å; E323-K326 PolarHBondContact OE1-NZ 2.99Å; E323-K326 VanDerWaalsContact OE1-NZ 3.16Å; E323-K326 WeakPolarHBondContact OE2-CD 3.29Å; E323-K326 WeakPolarHBondContact OE2-CE 3.24Å; E323-K326 IonicContact OE2-NZ 3.78Å; E323-K326 PolarHBondContact OE2-NZ 3.27Å; K326-L330 VanDerWaalsContact O-CB 3.31Å; K326-L330 WeakPolarHBondContact O-CB 3.28Å; K326-L330 PolarHBondContact O-N 2.84Å; K326-Y415 HydrophobicContact CB-CD2 4.33Å; K326-Y415 HydrophobicContact CB-CE1 4.03Å; K326-Y415 HydrophobicContact CB-CE2 3.56Å; K326-Y415 VanDerWaalsContact CB-OH 3.29Å; K326-Y415 WeakPolarHBondContact CB-OH 3.34Å; K326-Y415 HydrophobicContact CD-CD1 4.05Å; K326-Y415 HydrophobicContact CD-CE1 3.65Å; K326-Y415 WeakPolarHBondContact CD-O 3.36Å; K326-Y415 WeakPolarHBondContact CE-O 3.34Å; K326-Y415 PolarHBondContact NZ-O 3.14Å; K326-D416 IonicContact NZ-OD1 3.6Å; K326-D416 PolarHBondContact NZ-OD1 2.91Å; K326-F443 HydrophobicContact CB-CD2 4.07Å; K326-F443 HydrophobicContact CB-CE2 4.29Å; K326-F443 HydrophobicContact CD-CD2 4.28Å; K326-F443 HydrophobicContact CG-CD2 3.86Å
327	R	94.9	Very high	93.7	Very high	114 Å²	114	57.6 Å²	57.6	43%	0.43	31%	0.313	S	S	.	.	H	α-helix	trans	-64.6	-43.7	177.6	-68.8	-173	179.8	174.5	-1.5	112.6	Q325 L330 L331 F359 Y415	Q325-R327 PolarHBondContact O-N 3Å; Q325-R327 VanDerWaalsContact O-N 3.13Å; R327-L330 PolarHBondContact O-N 2.8Å; R327-L331 WeakPolarHBondContact O-CG 3.48Å; R327-L331 PolarHBondContact O-N 2.78Å; R327-L331 VanDerWaalsContact O-N 3.1Å; R327-F359 HydrophobicContact CB-CE1 3.91Å; R327-F359 HydrophobicContact CB-CZ 4.05Å; R327-F359 HydrophobicContact CG-CD1 4.46Å; R327-F359 HydrophobicContact CG-CE1 4.24Å; R327-Y415 WeakPolarHBondContact CG-OH 3.47Å
328	G	95.3	Very high	93.2	Very high	35 Å²	35	55.1 Å²	55.1	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-63.6	-49.8	177.7	0	0	0	0	0	111.4	Q325 L330 L331 D332	Q325-G328 PolarHBondContact O-N 3.41Å; G328-L330 VanDerWaalsContact C-N 3.29Å; G328-L330 PolarHBondContact O-N 3.13Å; G328-L331 WeakPolarHBondContact O-CB 3.05Å; G328-L331 PolarHBondContact O-N 2.95Å; G328-D332 PolarHBondContact O-N 3.15Å
329	F	94.6	Very high	92.5	Very high	72 Å²	72	59.4 Å²	59.4	32%	0.316	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-37.5	176	-86.7	-78.2	0	0	0	113.1	I319 V321 Q325 L331 D332 L333 F443	I319-F329 HydrophobicContact CG2-CE1 4.48Å; V321-F329 HydrophobicContact CB-CD2 4.35Å; V321-F329 HydrophobicContact CG1-CB 4.33Å; V321-F329 HydrophobicContact CG1-CD2 3.46Å; V321-F329 VanDerWaalsContact CG1-CD2 3.46Å; V321-F329 HydrophobicContact CG1-CE2 4.05Å; V321-F329 HydrophobicContact CG1-CG 4.13Å; V321-F329 HydrophobicContact CG2-CB 4.48Å; V321-F329 HydrophobicContact CG2-CD1 4.48Å; V321-F329 HydrophobicContact CG2-CD2 3.95Å; V321-F329 HydrophobicContact CG2-CE2 4.25Å; V321-F329 HydrophobicContact CG2-CG 4.06Å; Q325-F329 HydrophobicContact CB-CD2 4.03Å; Q325-F329 HydrophobicContact CB-CE2 4.18Å; Q325-F329 PolarHBondContact O-N 3.26Å; F329-L331 VanDerWaalsContact C-N 3.34Å; F329-D332 PolarHBondContact O-N 3.06Å; F329-L333 WeakPolarHBondContact O-CG 3.32Å; F329-L333 PolarHBondContact O-N 3.05Å; F329-F443 HydrophobicContact CB-CE1 4.17Å; F329-F443 HydrophobicContact CB-CE2 4.44Å; F329-F443 HydrophobicContact CB-CZ 3.81Å
330	L	95.6	Very high	91.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-44.2	174.6	-178.4	65.5	0	0	0	110.9	K326 R327 G328 D332 L333 L334 V345 L356 L360 I413 Y415 F443	K326-L330 VanDerWaalsContact O-CB 3.31Å; K326-L330 WeakPolarHBondContact O-CB 3.28Å; K326-L330 PolarHBondContact O-N 2.84Å; R327-L330 PolarHBondContact O-N 2.8Å; G328-L330 VanDerWaalsContact C-N 3.29Å; G328-L330 PolarHBondContact O-N 3.13Å; L330-D332 VanDerWaalsContact C-N 3.32Å; L330-D332 PolarHBondContact O-N 2.65Å; L330-L333 PolarHBondContact O-N 3.26Å; L330-L334 HydrophobicContact CD1-CD1 4.34Å; L330-L334 HydrophobicContact CD1-CG 4.26Å; L330-L334 HydrophobicContact CG-CD1 3.99Å; L330-L334 HydrophobicContact CG-CG 4.3Å; L330-L334 WeakPolarHBondContact O-CB 3.4Å; L330-L334 WeakPolarHBondContact O-CG 3.35Å; L330-L334 PolarHBondContact O-N 2.97Å; L330-V345 HydrophobicContact CD1-CG1 4.34Å; L330-V345 HydrophobicContact CD1-CG2 4.27Å; L330-L356 HydrophobicContact CD2-CD1 3.76Å; L330-L356 HydrophobicContact CD2-CD2 3.95Å; L330-L356 HydrophobicContact CD2-CG 4.16Å; L330-L360 HydrophobicContact CD2-CD1 4.12Å; L330-L360 HydrophobicContact CD2-CD2 4.19Å; L330-L360 HydrophobicContact CD2-CG 4.49Å; L330-I413 HydrophobicContact CD1-CD1 3.78Å; L330-I413 HydrophobicContact CD1-CG2 4.07Å; L330-Y415 HydrophobicContact CB-CD2 4.37Å; L330-Y415 HydrophobicContact CB-CE2 4.33Å; L330-Y415 HydrophobicContact CD2-CD2 3.95Å; L330-Y415 HydrophobicContact CD2-CE2 4.09Å; L330-F443 HydrophobicContact CB-CE2 4.34Å; L330-F443 HydrophobicContact CB-CZ 4.5Å
331	L	94.9	Very high	91.5	Very high	37 Å²	37	61 Å²	61	19%	0.194	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-39.9	176.5	-68.7	174.9	0	0	0	112.1	R327 G328 F329 L334 G335 F359 L360 E363 Y365	R327-L331 WeakPolarHBondContact O-CG 3.48Å; R327-L331 PolarHBondContact O-N 2.78Å; R327-L331 VanDerWaalsContact O-N 3.1Å; G328-L331 WeakPolarHBondContact O-CB 3.05Å; G328-L331 PolarHBondContact O-N 2.95Å; F329-L331 VanDerWaalsContact C-N 3.34Å; L331-L334 PolarHBondContact O-N 3.3Å; L331-G335 PolarHBondContact O-N 3.12Å; L331-F359 HydrophobicContact CD1-CE1 4.07Å; L331-F359 HydrophobicContact CD1-CZ 3.81Å; L331-F359 HydrophobicContact CD2-CE1 4.21Å; L331-F359 HydrophobicContact CG-CE1 4.12Å; L331-F359 HydrophobicContact CG-CZ 4.37Å; L331-L360 HydrophobicContact CD2-CD2 3.92Å; L331-E363 HydrophobicContact CD1-CG 4.3Å; L331-E363 HydrophobicContact CD2-CB 4.1Å; L331-E363 HydrophobicContact CD2-CG 4.04Å; L331-Y365 HydrophobicContact CD2-CD2 4.3Å; L331-Y365 HydrophobicContact CD2-CE2 3.71Å
332	D	94.3	Very high	91.3	Very high	111 Å²	111	62 Å²	62	59%	0.594	36%	0.359	S	S	*	.	H	α-helix	trans	-63.3	-42.8	176.6	-64.9	-25.7	0	0	0	111.6	G328 F329 L330 G335 A336	G328-D332 PolarHBondContact O-N 3.15Å; F329-D332 PolarHBondContact O-N 3.06Å; L330-D332 VanDerWaalsContact C-N 3.32Å; L330-D332 PolarHBondContact O-N 2.65Å; D332-G335 PolarHBondContact O-N 2.69Å; D332-A336 WeakPolarHBondContact O-CB 3.46Å; D332-A336 PolarHBondContact O-N 3.25Å
333	L	93.8	Very high	91.3	Very high	33 Å²	33	59.2 Å²	59.2	17%	0.173	35%	0.347	C	S	.	.	H	α-helix	trans	-65	-42.2	176	-70.7	177.7	0	0	0	112.3	F329 L330 S337 I413 T441 F443	F329-L333 WeakPolarHBondContact O-CG 3.32Å; F329-L333 PolarHBondContact O-N 3.05Å; L330-L333 PolarHBondContact O-N 3.26Å; L333-S337 PolarHBondContact O-N 2.79Å; L333-S337 PolarHBondContact O-OG 3.02Å; L333-I413 HydrophobicContact CB-CD1 4.27Å; L333-I413 HydrophobicContact CD1-CD1 4.15Å; L333-I413 HydrophobicContact CD1-CG2 4.47Å; L333-T441 HydrophobicContact CD1-CG2 3.79Å; L333-T441 HydrophobicContact CD2-CG2 4.46Å; L333-F443 HydrophobicContact CD1-CE1 3.72Å; L333-F443 HydrophobicContact CD1-CZ 3.75Å
334	L	93.3	Very high	91.3	Very high	8 Å²	8	56 Å²	56	4%	0.042	33%	0.332	C	S	.	.	H	α-helix	trans	-67.6	-40.3	177.8	-68	177	0	0	0	111.4	L330 L331 A336 S337 I343 L360 Y365 I393	L330-L334 HydrophobicContact CD1-CD1 4.34Å; L330-L334 HydrophobicContact CD1-CG 4.26Å; L330-L334 HydrophobicContact CG-CD1 3.99Å; L330-L334 HydrophobicContact CG-CG 4.3Å; L330-L334 WeakPolarHBondContact O-CB 3.4Å; L330-L334 WeakPolarHBondContact O-CG 3.35Å; L330-L334 PolarHBondContact O-N 2.97Å; L331-L334 PolarHBondContact O-N 3.3Å; L334-A336 VanDerWaalsContact C-N 3.35Å; L334-S337 WeakPolarHBondContact O-CB 3.24Å; L334-S337 PolarHBondContact O-N 3.27Å; L334-I343 HydrophobicContact CD2-CB 4.48Å; L334-I343 HydrophobicContact CD2-CD1 3.48Å; L334-I343 VanDerWaalsContact CD2-CD1 3.48Å; L334-I343 HydrophobicContact CD2-CG2 4.1Å; L334-L360 HydrophobicContact CD1-CD1 4.23Å; L334-L360 HydrophobicContact CD1-CD2 3.5Å; L334-L360 VanDerWaalsContact CD1-CD2 3.5Å; L334-Y365 HydrophobicContact CB-CE1 3.85Å; L334-I393 HydrophobicContact CD1-CD1 3.86Å; L334-I393 HydrophobicContact CD2-CD1 3.67Å; L334-I393 HydrophobicContact CD2-CG1 4.18Å; L334-I393 HydrophobicContact CG-CD1 4.31Å
335	G	91.1	Very high	91.4	Very high	56 Å²	56	49.4 Å²	49.4	58%	0.577	30%	0.296	S	S	*	.	H	α-helix	trans	-70.1	-28	178.2	0	0	0	0	0	113.9	L331 D332 S337	L331-G335 PolarHBondContact O-N 3.12Å; D332-G335 PolarHBondContact O-N 2.69Å; G335-S337 VanDerWaalsContact C-N 3.31Å
336	A	90.4	Very high	91.5	Very high	90 Å²	90	45 Å²	45	74%	0.744	28%	0.276	S	S	*	.	H	α-helix	trans	-78.3	-15.8	172.9	0	0	0	0	0	113.4	D332 L334	D332-A336 WeakPolarHBondContact O-CB 3.46Å; D332-A336 PolarHBondContact O-N 3.25Å; L334-A336 VanDerWaalsContact C-N 3.35Å
337	S	87	Confident	91.5	Very high	31 Å²	31	45 Å²	45	22%	0.217	28%	0.276	C	S	.	.	S	Bend	trans	-86.4	149.8	-178.2	-63	0	0	0	0	111.5	L333 L334 G335	L333-S337 PolarHBondContact O-N 2.79Å; L333-S337 PolarHBondContact O-OG 3.02Å; L334-S337 WeakPolarHBondContact O-CB 3.24Å; L334-S337 PolarHBondContact O-N 3.27Å; G335-S337 VanDerWaalsContact C-N 3.31Å
338	S	84.3	Confident	91.3	Very high	62 Å²	62	46.3 Å²	46.3	43%	0.434	29%	0.287	S	S	.	.			trans	-67.7	143.9	174.2	68.7	0	0	0	0	110.6	D340 T341	S338-D340 PolarHBondContact O-N 3.45Å; S338-D340 VanDerWaalsContact O-N 3.09Å; S338-T341 WeakPolarHBondContact O-CB 3.43Å; S338-T341 PolarHBondContact O-N 3.48Å; S338-T341 WeakPolarHBondContact OG-CB 3.25Å; S338-T341 PolarHBondContact OG-OG1 2.67Å
339	P	78.1	Confident	91.2	Very high	107 Å²	107	48 Å²	48	70%	0.695	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-32.6	-177.9	-27.2	34.8	0	0	0	114.8	T341	P339-T341 VanDerWaalsContact C-N 3.3Å; P339-T341 PolarHBondContact O-N 2.88Å
340	D	81.4	Confident	91.1	Very high	144 Å²	144	48.8 Å²	48.8	77%	0.77	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	1.2	-177.5	-52.5	-35.2	0	0	0	113.5	S338	S338-D340 PolarHBondContact O-N 3.45Å; S338-D340 VanDerWaalsContact O-N 3.09Å
341	T	87.2	Confident	91	Very high	15 Å²	15	58.1 Å²	58.1	9%	0.092	33%	0.329	C	S	.	.			trans	-79.9	125	-179.9	-78.6	0	0	0	0	110	S338 P339 I343 K410	S338-T341 WeakPolarHBondContact O-CB 3.43Å; S338-T341 PolarHBondContact O-N 3.48Å; S338-T341 WeakPolarHBondContact OG-CB 3.25Å; S338-T341 PolarHBondContact OG-OG1 2.67Å; P339-T341 VanDerWaalsContact C-N 3.3Å; P339-T341 PolarHBondContact O-N 2.88Å; T341-I343 HydrophobicContact CG2-CG1 3.92Å; T341-I343 PolarHBondContact O-N 3.25Å; T341-K410 HydrophobicContact CG2-CB 3.78Å; T341-K410 HydrophobicContact CG2-CD 4.06Å; T341-K410 HydrophobicContact CG2-CG 4.39Å
342	L	91.7	Very high	91	Very high	20 Å²	20	57.3 Å²	57.3	11%	0.105	33%	0.33	C	S	.	.			trans	-74.5	118.7	173.6	-60.1	-176.5	0	0	0	110.5	F386 P392 K410 H411	L342-F386 HydrophobicContact CB-CE1 4.45Å; L342-F386 HydrophobicContact CB-CE2 4.22Å; L342-F386 HydrophobicContact CB-CZ 3.85Å; L342-F386 HydrophobicContact CD2-CE2 4.33Å; L342-F386 WeakPolarHBondContact CD2-O 3Å; L342-P392 WeakPolarHBondContact CA-O 3.4Å; L342-P392 HydrophobicContact CD2-CB 4.3Å; L342-K410 PolarHBondContact O-N 2.89Å; L342-K410 VanDerWaalsContact O-N 3.12Å; L342-H411 PolarHBondContact O-N 2.84Å
343	I	93.4	Very high	91	Very high	5 Å²	5	52 Å²	52	3%	0.026	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	124.1	-176.5	-54.2	178.6	0	0	0	109.9	L334 T341 V345 F386 P392 I393 L394 H411 I413	L334-I343 HydrophobicContact CD2-CB 4.48Å; L334-I343 HydrophobicContact CD2-CD1 3.48Å; L334-I343 VanDerWaalsContact CD2-CD1 3.48Å; L334-I343 HydrophobicContact CD2-CG2 4.1Å; T341-I343 HydrophobicContact CG2-CG1 3.92Å; T341-I343 PolarHBondContact O-N 3.25Å; I343-V345 HydrophobicContact CG2-CG2 4.05Å; I343-F386 WeakPolarHBondContact O-CE2 3.47Å; I343-P392 PolarHBondContact N-O 3.41Å; I343-I393 WeakPolarHBondContact O-CA 3.47Å; I343-L394 PolarHBondContact O-N 3.47Å; I343-H411 WeakPolarHBondContact CA-O 3.16Å; I343-H411 HydrophobicContact CG1-CB 4.2Å; I343-H411 HydrophobicContact CG2-CB 4.39Å; I343-I413 HydrophobicContact CG2-CD1 3.69Å; I343-I413 HydrophobicContact CG2-CG1 4.07Å
344	L	93.5	Very high	91.1	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	115.4	176.1	-178.1	61.7	0	0	0	109.9	F346 L394 A396 I406 V409 H411 V412 I413 R430	L344-F346 HydrophobicContact CD2-CD2 4.43Å; L344-F346 HydrophobicContact CD2-CE2 3.51Å; L344-F346 HydrophobicContact CD2-CZ 3.7Å; L344-F346 HydrophobicContact CG-CD2 4.26Å; L344-F346 HydrophobicContact CG-CE2 3.8Å; L344-F346 HydrophobicContact CG-CZ 4.24Å; L344-L394 HydrophobicContact CD1-CB 3.99Å; L344-L394 HydrophobicContact CD1-CD2 3.79Å; L344-L394 HydrophobicContact CD1-CG 3.84Å; L344-A396 HydrophobicContact CD1-CB 4Å; L344-I406 HydrophobicContact CD2-CD1 4.48Å; L344-V409 HydrophobicContact CB-CG1 3.83Å; L344-H411 PolarHBondContact N-O 3.23Å; L344-V412 HydrophobicContact CB-CG2 4.45Å; L344-V412 CarbonylContact O-C 3.39Å; L344-V412 WeakPolarHBondContact O-CA 3.39Å; L344-I413 PolarHBondContact O-N 3.35Å; L344-R430 HydrophobicContact CD2-CB 3.74Å; L344-R430 HydrophobicContact CD2-CG 3.78Å
345	V	95.2	Very high	91.2	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	115.9	-178.3	-173.5	0	0	0	0	109.7	L330 I343 L356 I393 L394 V395 A396 I413	L330-V345 HydrophobicContact CD1-CG1 4.34Å; L330-V345 HydrophobicContact CD1-CG2 4.27Å; I343-V345 HydrophobicContact CG2-CG2 4.05Å; V345-L356 HydrophobicContact CG1-CD2 3.96Å; V345-I393 HydrophobicContact CG2-CG2 4.07Å; V345-L394 PolarHBondContact N-O 3.37Å; V345-V395 HydrophobicContact CB-CG2 4.27Å; V345-V395 CarbonylContact O-C 3.35Å; V345-V395 WeakPolarHBondContact O-CA 3.15Å; V345-A396 PolarHBondContact O-N 3.41Å; V345-I413 CarbonylContact C-O 2.97Å; V345-I413 WeakPolarHBondContact CA-O 3.34Å; V345-I413 HydrophobicContact CG1-CB 4.49Å; V345-I413 HydrophobicContact CG2-CB 4.34Å; V345-I413 HydrophobicContact CG2-CD1 4.48Å
346	F	95.3	Very high	91.4	Very high	3 Å²	3	53.3 Å²	53.3	1%	0.013	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	130.8	177.2	-77.9	-82.5	0	0	0	112.4	L344 A396 A401 V412 I413 Y415 D416 R427 R430	L344-F346 HydrophobicContact CD2-CD2 4.43Å; L344-F346 HydrophobicContact CD2-CE2 3.51Å; L344-F346 HydrophobicContact CD2-CZ 3.7Å; L344-F346 HydrophobicContact CG-CD2 4.26Å; L344-F346 HydrophobicContact CG-CE2 3.8Å; L344-F346 HydrophobicContact CG-CZ 4.24Å; F346-A396 WeakPolarHBondContact CA-O 3.11Å; F346-A401 HydrophobicContact CD1-CB 4.19Å; F346-A401 HydrophobicContact CE1-CB 3.2Å; F346-A401 HydrophobicContact CZ-CB 3.59Å; F346-V412 HydrophobicContact CD2-CG1 3.82Å; F346-V412 HydrophobicContact CE2-CG1 3.86Å; F346-I413 PolarHBondContact N-O 3.44Å; F346-Y415 WeakPolarHBondContact O-CA 3.36Å; F346-Y415 VanDerWaalsContact O-CB 3.26Å; F346-Y415 WeakPolarHBondContact O-CB 3.26Å; F346-Y415 PolarHBondContact O-N 2.87Å; F346-D416 PolarHBondContact O-N 3.32Å; F346-R427 HydrophobicContact CD1-CG 3.89Å; F346-R427 HydrophobicContact CD2-CB 3.91Å; F346-R427 HydrophobicContact CD2-CG 3.98Å; F346-R427 HydrophobicContact CE1-CB 4.43Å; F346-R427 HydrophobicContact CE1-CG 3.7Å; F346-R427 HydrophobicContact CE2-CB 3.65Å; F346-R427 HydrophobicContact CE2-CG 3.83Å; F346-R427 HydrophobicContact CG-CB 4.42Å; F346-R427 HydrophobicContact CG-CG 4Å; F346-R427 HydrophobicContact CZ-CB 3.93Å; F346-R427 HydrophobicContact CZ-CG 3.69Å; F346-R430 HydrophobicContact CE2-CG 4.28Å; F346-R430 HydrophobicContact CZ-CG 4.08Å
347	V	95.2	Very high	91.7	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	156.9	174.5	-63.7	0	0	0	0	110.7	A353 L356 V395 A396 T397 Y415 D416	V347-A353 HydrophobicContact CG2-CB 3.53Å; V347-L356 HydrophobicContact CG1-CD2 3.65Å; V347-V395 HydrophobicContact CG1-CG1 4.02Å; V347-V395 HydrophobicContact CG2-CG1 3.97Å; V347-A396 PolarHBondContact N-O 2.85Å; V347-T397 HydrophobicContact CG2-CG2 4.18Å; V347-Y415 HydrophobicContact CG1-CD1 4.03Å; V347-Y415 HydrophobicContact CG1-CG 4.22Å; V347-D416 WeakPolarHBondContact CA-OD2 3.17Å
348	E	92.4	Very high	92.1	Very high	141 Å²	141	54.5 Å²	54.5	66%	0.659	29%	0.285	S	S	*	.	S	Bend	trans	-74	-48.3	-176.6	-174.7	-178.8	-178.2	0	0	112	D416	E348-D416 HydrophobicContact CB-CB 3.89Å; E348-D416 PolarHBondContact N-OD2 2.82Å
349	T	92.6	Very high	92.7	Very high	71 Å²	71	53.4 Å²	53.4	44%	0.436	27%	0.273	S	S	.	.	S	Bend	trans	-107.8	149.3	-168.9	71.1	0	0	0	0	113	R351 G352 A353	T349-R351 VanDerWaalsContact C-N 3.31Å; T349-R351 PolarHBondContact O-N 2.85Å; T349-G352 PolarHBondContact O-N 3.47Å; T349-G352 WeakPolarHBondContact OG1-CA 3.48Å; T349-G352 PolarHBondContact OG1-N 3.42Å; T349-A353 PolarHBondContact O-N 2.9Å
350	K	92.7	Very high	93.6	Very high	89 Å²	89	48.3 Å²	48.3	39%	0.387	24%	0.24	S	C	.	.	H	α-helix	trans	-59.7	-42.7	176.4	-54.2	-178.5	-174.3	173	0	111.8	A353 S354 H371 D373 T397	K350-A353 WeakPolarHBondContact O-CB 3.3Å; K350-A353 PolarHBondContact O-N 2.89Å; K350-S354 PolarHBondContact O-N 3.07Å; K350-S354 PolarHBondContact O-OG 2.9Å; K350-H371 HydrophobicContact CB-CB 4.03Å; K350-H371 HydrophobicContact CG-CB 4.15Å; K350-D373 VanDerWaalsContact CD-CG 3.45Å; K350-D373 VanDerWaalsContact CD-OD1 3.3Å; K350-D373 WeakPolarHBondContact CD-OD1 3.4Å; K350-D373 WeakPolarHBondContact CD-OD2 3.48Å; K350-D373 IonicContact NZ-OD1 2.96Å; K350-D373 PolarHBondContact NZ-OD1 2.78Å; K350-D373 IonicContact NZ-OD2 3.42Å; K350-T397 HydrophobicContact CG-CG2 4.39Å
351	R	93.9	Very high	94.2	Very high	195 Å²	195	44.9 Å²	44.9	74%	0.736	22%	0.224	S	C	*	.	H	α-helix	trans	-63.7	-43.3	175.6	-173.9	175.2	-178.7	168.7	3.3	111.5	T349 A353 S354 D355	T349-R351 VanDerWaalsContact C-N 3.31Å; T349-R351 PolarHBondContact O-N 2.85Å; R351-A353 PolarHBondContact O-N 3.43Å; R351-S354 PolarHBondContact O-N 3.45Å; R351-D355 IonicContact NE-OD2 2.83Å; R351-D355 WeakPolarHBondContact O-CB 3.12Å; R351-D355 VanDerWaalsContact O-CG 3.22Å; R351-D355 PolarHBondContact O-N 3.44Å
352	G	93.8	Very high	94.6	Very high	21 Å²	21	48.4 Å²	48.4	22%	0.216	24%	0.243	C	C	.	.	H	α-helix	trans	-57.4	-37.8	173.7	0	0	0	0	0	112.6	T349 L356	T349-G352 PolarHBondContact O-N 3.47Å; T349-G352 WeakPolarHBondContact OG1-CA 3.48Å; T349-G352 PolarHBondContact OG1-N 3.42Å; G352-L356 WeakPolarHBondContact O-CB 3.43Å; G352-L356 PolarHBondContact O-N 3.32Å
353	A	94.9	Very high	94.8	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-64	-48.3	176.1	0	0	0	0	0	112.5	V347 T349 K350 R351 A357 H371 V395 T397	V347-A353 HydrophobicContact CG2-CB 3.53Å; T349-A353 PolarHBondContact O-N 2.9Å; K350-A353 WeakPolarHBondContact O-CB 3.3Å; K350-A353 PolarHBondContact O-N 2.89Å; R351-A353 PolarHBondContact O-N 3.43Å; A353-A357 WeakPolarHBondContact O-CB 3.24Å; A353-A357 PolarHBondContact O-N 2.9Å; A353-H371 HydrophobicContact CB-CB 4.45Å; A353-V395 HydrophobicContact CB-CG1 3.98Å; A353-T397 HydrophobicContact CB-CG2 4.13Å
354	S	94.8	Very high	94.7	Very high	47 Å²	47	62.6 Å²	62.6	33%	0.329	30%	0.299	S	S	.	.	H	α-helix	trans	-63.5	-45.3	177.1	-52.7	0	0	0	0	111.8	K350 R351 A357 F358 H371	K350-S354 PolarHBondContact O-N 3.07Å; K350-S354 PolarHBondContact O-OG 2.9Å; R351-S354 PolarHBondContact O-N 3.45Å; S354-A357 PolarHBondContact O-N 3.37Å; S354-F358 WeakPolarHBondContact O-CB 3.35Å; S354-F358 PolarHBondContact O-N 3.11Å; S354-H371 PolarHBondContact OG-NE2 3.15Å; S354-H371 VanDerWaalsContact OG-NE2 3.15Å
355	D	96.1	Very high	94.7	Very high	72 Å²	72	65.9 Å²	65.9	39%	0.385	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-41	-178.6	-69.9	-13.1	0	0	0	111.4	R351 F358 F359	R351-D355 IonicContact NE-OD2 2.83Å; R351-D355 WeakPolarHBondContact O-CB 3.12Å; R351-D355 VanDerWaalsContact O-CG 3.22Å; R351-D355 PolarHBondContact O-N 3.44Å; D355-F358 PolarHBondContact O-N 2.69Å; D355-F359 WeakPolarHBondContact O-CB 3.14Å; D355-F359 PolarHBondContact O-N 3.4Å
356	L	96.4	Very high	94.7	Very high	5 Å²	5	71 Å²	71	3%	0.026	34%	0.338	C	S	.	.	H	α-helix	trans	-69.1	-42.1	178	-172.8	63.2	0	0	0	111.6	L330 V345 V347 G352 F358 F359 L360 V395 Y415	L330-L356 HydrophobicContact CD2-CD1 3.76Å; L330-L356 HydrophobicContact CD2-CD2 3.95Å; L330-L356 HydrophobicContact CD2-CG 4.16Å; V345-L356 HydrophobicContact CG1-CD2 3.96Å; V347-L356 HydrophobicContact CG1-CD2 3.65Å; G352-L356 WeakPolarHBondContact O-CB 3.43Å; G352-L356 PolarHBondContact O-N 3.32Å; L356-F358 VanDerWaalsContact C-N 3.35Å; L356-F359 HydrophobicContact CD1-CD1 4.32Å; L356-F359 WeakPolarHBondContact O-CB 3.42Å; L356-F359 PolarHBondContact O-N 2.96Å; L356-L360 HydrophobicContact CG-CD1 4.29Å; L356-L360 WeakPolarHBondContact O-CB 3.45Å; L356-L360 WeakPolarHBondContact O-CG 3.46Å; L356-L360 PolarHBondContact O-N 3.19Å; L356-V395 HydrophobicContact CB-CG1 4.41Å; L356-V395 HydrophobicContact CD2-CG1 4.08Å; L356-V395 HydrophobicContact CD2-CG2 4.36Å; L356-Y415 HydrophobicContact CD1-CE2 4.03Å; L356-Y415 HydrophobicContact CD2-CD2 4.01Å; L356-Y415 HydrophobicContact CD2-CE2 4.24Å; L356-Y415 HydrophobicContact CD2-CG 4.16Å
357	A	95.5	Very high	94.6	Very high	9 Å²	9	71.6 Å²	71.6	7%	0.074	34%	0.342	C	S	.	.	H	α-helix	trans	-64.5	-39.5	175.6	0	0	0	0	0	112	A353 S354 L360 T361 V367 A369 V395	A353-A357 WeakPolarHBondContact O-CB 3.24Å; A353-A357 PolarHBondContact O-N 2.9Å; S354-A357 PolarHBondContact O-N 3.37Å; A357-L360 PolarHBondContact O-N 3.26Å; A357-T361 WeakPolarHBondContact O-CB 3.14Å; A357-T361 PolarHBondContact O-N 2.84Å; A357-T361 PolarHBondContact O-OG1 3.13Å; A357-V367 HydrophobicContact CB-CG1 4.39Å; A357-V367 HydrophobicContact CB-CG2 4.23Å; A357-V367 VanDerWaalsContact O-CG1 3.3Å; A357-V367 WeakPolarHBondContact O-CG1 3.47Å; A357-A369 HydrophobicContact CB-CB 3.83Å; A357-V395 HydrophobicContact CB-CG2 4.46Å
358	F	96.2	Very high	94.6	Very high	137 Å²	137	72.3 Å²	72.3	60%	0.601	35%	0.347	S	S	*	.	H	α-helix	trans	-62.5	-44.8	173.8	-179.2	-102.7	0	0	0	111.6	S354 D355 L356 T361 N362	S354-F358 WeakPolarHBondContact O-CB 3.35Å; S354-F358 PolarHBondContact O-N 3.11Å; D355-F358 PolarHBondContact O-N 2.69Å; L356-F358 VanDerWaalsContact C-N 3.35Å; F358-T361 PolarHBondContact O-N 3.33Å; F358-N362 WeakPolarHBondContact CE1-ND2 3.49Å; F358-N362 WeakPolarHBondContact CZ-ND2 3.48Å; F358-N362 PolarHBondContact O-N 3.3Å; F358-N362 VanDerWaalsContact O-N 3.08Å; F358-N362 PolarHBondContact O-ND2 3.48Å
359	F	96.6	Very high	94.7	Very high	38 Å²	38	66.1 Å²	66.1	17%	0.167	32%	0.32	C	S	.	.	H	α-helix	trans	-57.6	-51.6	175	171.5	-103.1	0	0	0	112	R327 L331 D355 L356 T361 N362 E363	R327-F359 HydrophobicContact CB-CE1 3.91Å; R327-F359 HydrophobicContact CB-CZ 4.05Å; R327-F359 HydrophobicContact CG-CD1 4.46Å; R327-F359 HydrophobicContact CG-CE1 4.24Å; L331-F359 HydrophobicContact CD1-CE1 4.07Å; L331-F359 HydrophobicContact CD1-CZ 3.81Å; L331-F359 HydrophobicContact CD2-CE1 4.21Å; L331-F359 HydrophobicContact CG-CE1 4.12Å; L331-F359 HydrophobicContact CG-CZ 4.37Å; D355-F359 WeakPolarHBondContact O-CB 3.14Å; D355-F359 PolarHBondContact O-N 3.4Å; L356-F359 HydrophobicContact CD1-CD1 4.32Å; L356-F359 WeakPolarHBondContact O-CB 3.42Å; L356-F359 PolarHBondContact O-N 2.96Å; F359-T361 VanDerWaalsContact C-N 3.31Å; F359-T361 PolarHBondContact O-N 3.04Å; F359-N362 WeakPolarHBondContact O-CB 3.1Å; F359-N362 PolarHBondContact O-N 3.21Å; F359-N362 VanDerWaalsContact O-N 3.13Å; F359-E363 HydrophobicContact CE1-CG 4.3Å; F359-E363 HydrophobicContact CE2-CG 4.2Å; F359-E363 HydrophobicContact CZ-CG 4.03Å; F359-E363 PolarHBondContact O-N 2.71Å; F359-E363 VanDerWaalsContact O-N 3.11Å
360	L	95.9	Very high	94.6	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.8	-34.9	179.7	-72.2	176.2	0	0	0	112.8	L330 L331 L334 L356 A357 N362 E363 R364 Y365 V367 I393 V395	L330-L360 HydrophobicContact CD2-CD1 4.12Å; L330-L360 HydrophobicContact CD2-CD2 4.19Å; L330-L360 HydrophobicContact CD2-CG 4.49Å; L331-L360 HydrophobicContact CD2-CD2 3.92Å; L334-L360 HydrophobicContact CD1-CD1 4.23Å; L334-L360 HydrophobicContact CD1-CD2 3.5Å; L334-L360 VanDerWaalsContact CD1-CD2 3.5Å; L356-L360 HydrophobicContact CG-CD1 4.29Å; L356-L360 WeakPolarHBondContact O-CB 3.45Å; L356-L360 WeakPolarHBondContact O-CG 3.46Å; L356-L360 PolarHBondContact O-N 3.19Å; A357-L360 PolarHBondContact O-N 3.26Å; L360-N362 VanDerWaalsContact C-N 3.34Å; L360-E363 CarbonylContact O-C 3.56Å; L360-E363 PolarHBondContact O-N 2.95Å; L360-R364 PolarHBondContact O-N 2.95Å; L360-Y365 HydrophobicContact CD2-CD2 4.41Å; L360-Y365 WeakPolarHBondContact O-CB 3.38Å; L360-Y365 PolarHBondContact O-N 3.23Å; L360-V367 HydrophobicContact CB-CB 4.33Å; L360-V367 HydrophobicContact CB-CG1 3.8Å; L360-V367 HydrophobicContact CD1-CG2 4.11Å; L360-I393 HydrophobicContact CD1-CG2 4.35Å; L360-V395 HydrophobicContact CD1-CG2 4.22Å
361	T	95.6	Very high	94.5	Very high	72 Å²	72	59.1 Å²	59.1	44%	0.442	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-40.3	173.9	-56	0	0	0	0	111.4	A357 F358 F359 E363 R364 V367	A357-T361 WeakPolarHBondContact O-CB 3.14Å; A357-T361 PolarHBondContact O-N 2.84Å; A357-T361 PolarHBondContact O-OG1 3.13Å; F358-T361 PolarHBondContact O-N 3.33Å; F359-T361 VanDerWaalsContact C-N 3.31Å; F359-T361 PolarHBondContact O-N 3.04Å; T361-E363 VanDerWaalsContact C-N 3.31Å; T361-E363 PolarHBondContact O-N 3Å; T361-R364 PolarHBondContact O-N 2.9Å; T361-V367 VanDerWaalsContact OG1-CG1 3.27Å; T361-V367 WeakPolarHBondContact OG1-CG1 3.45Å
362	N	95.7	Very high	94	Very high	90 Å²	90	51.8 Å²	51.8	48%	0.481	27%	0.269	S	S	.	.	H	α-helix	trans	-66.5	-34.3	176.4	-68.9	-22	0	0	0	112.1	F358 F359 L360 R364	F358-N362 WeakPolarHBondContact CE1-ND2 3.49Å; F358-N362 WeakPolarHBondContact CZ-ND2 3.48Å; F358-N362 PolarHBondContact O-N 3.3Å; F358-N362 VanDerWaalsContact O-N 3.08Å; F358-N362 PolarHBondContact O-ND2 3.48Å; F359-N362 WeakPolarHBondContact O-CB 3.1Å; F359-N362 PolarHBondContact O-N 3.21Å; F359-N362 VanDerWaalsContact O-N 3.13Å; L360-N362 VanDerWaalsContact C-N 3.34Å; N362-R364 PolarHBondContact O-N 3.11Å
363	E	94.2	Very high	93.6	Very high	97 Å²	97	56 Å²	56	45%	0.453	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	12.1	171.7	-62.9	-60.3	143.4	0	0	113.3	L331 F359 L360 T361 Y365	L331-E363 HydrophobicContact CD1-CG 4.3Å; L331-E363 HydrophobicContact CD2-CB 4.1Å; L331-E363 HydrophobicContact CD2-CG 4.04Å; F359-E363 HydrophobicContact CE1-CG 4.3Å; F359-E363 HydrophobicContact CE2-CG 4.2Å; F359-E363 HydrophobicContact CZ-CG 4.03Å; F359-E363 PolarHBondContact O-N 2.71Å; F359-E363 VanDerWaalsContact O-N 3.11Å; L360-E363 CarbonylContact O-C 3.56Å; L360-E363 PolarHBondContact O-N 2.95Å; T361-E363 VanDerWaalsContact C-N 3.31Å; T361-E363 PolarHBondContact O-N 3Å; E363-Y365 VanDerWaalsContact C-N 3.32Å; E363-Y365 HydrophobicContact CB-CD2 3.93Å; E363-Y365 HydrophobicContact CB-CE2 4.2Å; E363-Y365 WeakPolarHBondContact O-CD2 3.4Å; E363-Y365 PolarHBondContact O-N 2.67Å
364	R	92.9	Very high	93.1	Very high	226 Å²	226	57.9 Å²	57.9	85%	0.853	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	21.1	176	-52.2	-64	-171.9	171.6	-0.1	115.5	L360 T361 N362	L360-R364 PolarHBondContact O-N 2.95Å; T361-R364 PolarHBondContact O-N 2.9Å; N362-R364 PolarHBondContact O-N 3.11Å
365	Y	93.8	Very high	92.7	Very high	69 Å²	69	61.8 Å²	61.8	27%	0.271	31%	0.307	S	S	.	.			trans	-86.2	142.2	170.5	-71	-87	0	0	0	112	L331 L334 L360 E363 V367 I393	L331-Y365 HydrophobicContact CD2-CD2 4.3Å; L331-Y365 HydrophobicContact CD2-CE2 3.71Å; L334-Y365 HydrophobicContact CB-CE1 3.85Å; L360-Y365 HydrophobicContact CD2-CD2 4.41Å; L360-Y365 WeakPolarHBondContact O-CB 3.38Å; L360-Y365 PolarHBondContact O-N 3.23Å; E363-Y365 VanDerWaalsContact C-N 3.32Å; E363-Y365 HydrophobicContact CB-CD2 3.93Å; E363-Y365 HydrophobicContact CB-CE2 4.2Å; E363-Y365 WeakPolarHBondContact O-CD2 3.4Å; E363-Y365 PolarHBondContact O-N 2.67Å; Y365-V367 PolarHBondContact O-N 3.1Å; Y365-I393 HydrophobicContact CD1-CD1 3.74Å; Y365-I393 HydrophobicContact CG-CD1 4.13Å
366	N	93.7	Very high	91.8	Very high	106 Å²	106	58.9 Å²	58.9	57%	0.567	29%	0.291	S	S	*	.			trans	-81.2	99.1	172.3	-70.9	-19.9	0	0	0	109.7	T391 P392 I393	N366-T391 HydrophobicContact CB-CG2 4.37Å; N366-P392 WeakPolarHBondContact O-CD 3.32Å; N366-I393 PolarHBondContact O-N 3.45Å
367	V	94.6	Very high	91.2	Very high	16 Å²	16	62.1 Å²	62.1	10%	0.097	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	147.8	-173	62	0	0	0	0	111.6	A357 L360 T361 Y365 I393 V395	A357-V367 HydrophobicContact CB-CG1 4.39Å; A357-V367 HydrophobicContact CB-CG2 4.23Å; A357-V367 VanDerWaalsContact O-CG1 3.3Å; A357-V367 WeakPolarHBondContact O-CG1 3.47Å; L360-V367 HydrophobicContact CB-CB 4.33Å; L360-V367 HydrophobicContact CB-CG1 3.8Å; L360-V367 HydrophobicContact CD1-CG2 4.11Å; T361-V367 VanDerWaalsContact OG1-CG1 3.27Å; T361-V367 WeakPolarHBondContact OG1-CG1 3.45Å; Y365-V367 PolarHBondContact O-N 3.1Å; V367-I393 WeakPolarHBondContact CA-O 3.49Å; V367-I393 HydrophobicContact CB-CB 4.13Å; V367-I393 HydrophobicContact CB-CG2 4.35Å; V367-I393 HydrophobicContact CG2-CB 4.04Å; V367-I393 HydrophobicContact CG2-CG2 3.78Å; V367-V395 HydrophobicContact CG2-CG2 3.72Å
368	V	94.5	Very high	90.9	Very high	17 Å²	17	64.4 Å²	64.4	10%	0.103	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.8	168.7	-75.4	0	0	0	0	110	H382 T391 I393 L394 V395	V368-H382 HydrophobicContact CB-CB 4.05Å; V368-H382 HydrophobicContact CG1-CB 4.44Å; V368-H382 HydrophobicContact CG2-CB 4.16Å; V368-T391 HydrophobicContact CG1-CG2 3.93Å; V368-T391 WeakPolarHBondContact CG2-OG1 3.42Å; V368-I393 PolarHBondContact N-O 3.47Å; V368-I393 VanDerWaalsContact N-O 3.07Å; V368-L394 HydrophobicContact CG2-CD1 3.78Å; V368-L394 WeakPolarHBondContact O-CA 3.38Å; V368-V395 PolarHBondContact O-N 3.19Å
369	A	94.2	Very high	90.4	Very high	11 Å²	11	58.9 Å²	58.9	9%	0.091	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	148.1	173.7	0	0	0	0	0	111	A357 L374 H382 V395	A357-A369 HydrophobicContact CB-CB 3.83Å; A369-L374 WeakPolarHBondContact O-CD1 3.43Å; A369-H382 PolarHBondContact O-ND1 3.22Å; A369-V395 CarbonylContact C-O 3.43Å; A369-V395 VanDerWaalsContact CA-O 3.24Å; A369-V395 WeakPolarHBondContact CA-O 3.46Å
370	I	90.8	Very high	89.7	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	117.8	168.6	-158.8	-177.3	0	0	0	110.5	R379 L383 L394 V395 A396 T397 A400 L404	I370-R379 HydrophobicContact CD1-CB 4.14Å; I370-R379 HydrophobicContact CD1-CG 4.33Å; I370-R379 HydrophobicContact CG1-CB 4.21Å; I370-R379 HydrophobicContact CG1-CG 3.92Å; I370-L383 HydrophobicContact CD1-CD1 3.92Å; I370-L383 HydrophobicContact CD1-CD2 3.83Å; I370-L383 HydrophobicContact CD1-CG 3.8Å; I370-L394 HydrophobicContact CB-CD1 4.04Å; I370-L394 HydrophobicContact CG2-CD1 3.83Å; I370-L394 HydrophobicContact CG2-CD2 4.32Å; I370-L394 HydrophobicContact CG2-CG 4.18Å; I370-V395 PolarHBondContact N-O 3.01Å; I370-A396 HydrophobicContact CG2-CB 3.44Å; I370-A396 VanDerWaalsContact CG2-CB 3.44Å; I370-A396 WeakPolarHBondContact O-CA 2.99Å; I370-T397 PolarHBondContact O-N 2.84Å; I370-A400 HydrophobicContact CB-CB 4.32Å; I370-A400 HydrophobicContact CD1-CB 4.46Å; I370-A400 HydrophobicContact CG1-CB 4.01Å; I370-A400 HydrophobicContact CG2-CB 3.94Å; I370-A400 VanDerWaalsContact O-CB 3.27Å; I370-A400 WeakPolarHBondContact O-CB 3.2Å; I370-L404 HydrophobicContact CD1-CD1 4.4Å
371	H	90	Very high	89.4	Confident	14 Å²	14	68.5 Å²	68.5	7%	0.065	34%	0.337	C	S	.	.			trans	-149.8	167.9	179.2	58.9	90.9	0	0	0	110.3	K350 A353 S354 D373 L374 T397	K350-H371 HydrophobicContact CB-CB 4.03Å; K350-H371 HydrophobicContact CG-CB 4.15Å; A353-H371 HydrophobicContact CB-CB 4.45Å; S354-H371 PolarHBondContact OG-NE2 3.15Å; S354-H371 VanDerWaalsContact OG-NE2 3.15Å; H371-D373 PolarHBondContact ND1-N 2.95Å; H371-D373 PolarHBondContact O-N 3.37Å; H371-D373 VanDerWaalsContact O-N 3.1Å; H371-L374 PolarHBondContact O-N 2.92Å; H371-T397 HydrophobicContact CB-CG2 3.92Å
372	G	83	Confident	89.1	Confident	41 Å²	41	67.2 Å²	67.2	42%	0.423	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-6.5	-171.5	0	0	0	0	0	116.7
373	D	85.8	Confident	88.7	Confident	108 Å²	108	63.2 Å²	63.2	58%	0.578	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	-8.1	178.4	-56.5	-23.6	0	0	0	112.5	K350 H371	K350-D373 VanDerWaalsContact CD-CG 3.45Å; K350-D373 VanDerWaalsContact CD-OD1 3.3Å; K350-D373 WeakPolarHBondContact CD-OD1 3.4Å; K350-D373 WeakPolarHBondContact CD-OD2 3.48Å; K350-D373 IonicContact NZ-OD1 2.96Å; K350-D373 PolarHBondContact NZ-OD1 2.78Å; K350-D373 IonicContact NZ-OD2 3.42Å; H371-D373 PolarHBondContact ND1-N 2.95Å; H371-D373 PolarHBondContact O-N 3.37Å; H371-D373 VanDerWaalsContact O-N 3.1Å
374	L	86.1	Confident	88.3	Confident	40 Å²	40	64 Å²	64	21%	0.209	31%	0.308	C	S	.	.	S	Bend	trans	-73.5	144.9	173.2	-65.9	176.9	0	0	0	110.7	A369 H371 R379	A369-L374 WeakPolarHBondContact O-CD1 3.43Å; H371-L374 PolarHBondContact O-N 2.92Å; L374-R379 HydrophobicContact CB-CG 3.72Å; L374-R379 HydrophobicContact CD1-CG 4.38Å
375	K	85.5	Confident	88.1	Confident	129 Å²	129	54.4 Å²	54.4	56%	0.561	28%	0.276	S	S	*	.			trans	-64.4	151.2	171.1	-59.3	-174.1	176.3	-168.3	0	109.7	C377 D378 R379	K375-C377 VanDerWaalsContact C-N 3.27Å; K375-C377 PolarHBondContact O-N 2.85Å; K375-D378 WeakPolarHBondContact CB-OD2 3.02Å; K375-D378 WeakPolarHBondContact O-CB 3.34Å; K375-D378 PolarHBondContact O-N 2.81Å; K375-R379 PolarHBondContact O-N 3.13Å
376	Q	77.8	Confident	87.9	Confident	11 Å²	11	51.1 Å²	51.1	5%	0.051	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-37.5	-177	-171.3	61.9	25.9	0	0	112.5	R189 E190 Y214 D378 R379 E380	R189-Q376 VanDerWaalsContact CD-CD 3.41Å; E190-Q376 PolarHBondContact OE1-NE2 2.91Å; E190-Q376 VanDerWaalsContact OE1-NE2 3.11Å; Y214-Q376 HydrophobicContact CE2-CG 4.5Å; Q376-D378 VanDerWaalsContact C-N 3.27Å; Q376-D378 PolarHBondContact O-N 3.04Å; Q376-R379 PolarHBondContact O-N 3.14Å; Q376-E380 WeakPolarHBondContact O-CG 3.31Å; Q376-E380 PolarHBondContact O-N 3.49Å
377	C	83.6	Confident	87.5	Confident	74 Å²	74	51.2 Å²	51.2	50%	0.5	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-38	175	58.9	0	0	0	0	112.3	K375 R381	K375-C377 VanDerWaalsContact C-N 3.27Å; K375-C377 PolarHBondContact O-N 2.85Å; C377-R381 WeakPolarHBondContact O-CB 3.5Å; C377-R381 PolarHBondContact O-N 3.23Å
378	D	88.4	Confident	87.1	Confident	57 Å²	57	53.8 Å²	53.8	31%	0.305	27%	0.274	S	S	.	.	H	α-helix	trans	-73.1	-40.2	-179.8	-57.7	-28.8	0	0	0	110.2	K375 Q376 R381 H382	K375-D378 WeakPolarHBondContact CB-OD2 3.02Å; K375-D378 WeakPolarHBondContact O-CB 3.34Å; K375-D378 PolarHBondContact O-N 2.81Å; Q376-D378 VanDerWaalsContact C-N 3.27Å; Q376-D378 PolarHBondContact O-N 3.04Å; D378-R381 PolarHBondContact O-N 2.68Å; D378-H382 WeakPolarHBondContact O-CB 3.33Å; D378-H382 PolarHBondContact O-CD2 2.96Å; D378-H382 VanDerWaalsContact O-CD2 3.27Å; D378-H382 PolarHBondContact O-N 3.24Å
379	R	84.9	Confident	86.8	Confident	20 Å²	20	54.7 Å²	54.7	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-58.1	-49.2	172.4	-67.4	-176.2	67.6	-145.7	-0.5	111.3	E190 I370 L374 K375 Q376 R381 H382 L383 A400	E190-R379 IonicContact OE1-CZ 3.7Å; E190-R379 IonicContact OE1-NE 3.22Å; E190-R379 IonicContact OE1-NH1 2.65Å; E190-R379 PolarHBondContact OE1-NH1 3.05Å; E190-R379 IonicContact OE1-NH2 2.7Å; E190-R379 PolarHBondContact OE1-NH2 3.44Å; E190-R379 IonicContact OE2-NH1 2.83Å; E190-R379 IonicContact OE2-NH2 3.73Å; E190-R379 PolarHBondContact OE2-NH2 3.03Å; I370-R379 HydrophobicContact CD1-CB 4.14Å; I370-R379 HydrophobicContact CD1-CG 4.33Å; I370-R379 HydrophobicContact CG1-CB 4.21Å; I370-R379 HydrophobicContact CG1-CG 3.92Å; L374-R379 HydrophobicContact CB-CG 3.72Å; L374-R379 HydrophobicContact CD1-CG 4.38Å; K375-R379 PolarHBondContact O-N 3.13Å; Q376-R379 PolarHBondContact O-N 3.14Å; R379-R381 VanDerWaalsContact C-N 3.35Å; R379-R381 PolarHBondContact O-N 3.43Å; R379-H382 PolarHBondContact O-N 3.3Å; R379-L383 WeakPolarHBondContact O-CB 3.46Å; R379-L383 VanDerWaalsContact O-CG 3.24Å; R379-L383 WeakPolarHBondContact O-CG 3.33Å; R379-L383 PolarHBondContact O-N 2.77Å; R379-A400 PolarHBondContact NH2-O 2.93Å
380	E	82.3	Confident	86.6	Confident	53 Å²	53	58.7 Å²	58.7	25%	0.248	31%	0.31	C	S	.	.	H	α-helix	trans	-60.4	-43.7	177.4	-71.9	172.2	-166.5	0	0	111.3	Y214 R217 Q376 L383 E384	Y214-E380 PolarHBondContact OH-OE1 3.26Å; R217-E380 IonicContact CZ-OE1 3.89Å; R217-E380 IonicContact CZ-OE2 3.58Å; R217-E380 IonicContact NE-OE1 3.01Å; R217-E380 IonicContact NH2-OE1 3.01Å; R217-E380 PolarHBondContact NH2-OE1 3.32Å; R217-E380 IonicContact NH2-OE2 3.51Å; R217-E380 PolarHBondContact NH2-OE2 3Å; Q376-E380 WeakPolarHBondContact O-CG 3.31Å; Q376-E380 PolarHBondContact O-N 3.49Å; E380-L383 PolarHBondContact O-N 3.39Å; E380-E384 WeakPolarHBondContact O-CB 3.3Å; E380-E384 PolarHBondContact O-N 3.15Å
381	R	89.3	Confident	86.7	Confident	187 Å²	187	59.4 Å²	59.4	71%	0.706	32%	0.315	S	S	*	.	H	α-helix	trans	-62.9	-43.8	176.5	-177.7	-179.2	177.6	-179.8	-0.7	112.8	C377 D378 R379 L383 E384 S385	C377-R381 WeakPolarHBondContact O-CB 3.5Å; C377-R381 PolarHBondContact O-N 3.23Å; D378-R381 PolarHBondContact O-N 2.68Å; R379-R381 VanDerWaalsContact C-N 3.35Å; R379-R381 PolarHBondContact O-N 3.43Å; R381-L383 VanDerWaalsContact C-N 3.35Å; R381-E384 PolarHBondContact O-N 3.41Å; R381-S385 WeakPolarHBondContact O-CB 3.46Å; R381-S385 PolarHBondContact O-N 3.36Å
382	H	90.9	Very high	86.8	Confident	45 Å²	45	59.7 Å²	59.7	21%	0.208	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-39.5	179	-70	-174	0	0	0	111.4	V368 A369 D378 R379 S385 F386	V368-H382 HydrophobicContact CB-CB 4.05Å; V368-H382 HydrophobicContact CG1-CB 4.44Å; V368-H382 HydrophobicContact CG2-CB 4.16Å; A369-H382 PolarHBondContact O-ND1 3.22Å; D378-H382 WeakPolarHBondContact O-CB 3.33Å; D378-H382 PolarHBondContact O-CD2 2.96Å; D378-H382 VanDerWaalsContact O-CD2 3.27Å; D378-H382 PolarHBondContact O-N 3.24Å; R379-H382 PolarHBondContact O-N 3.3Å; H382-S385 PolarHBondContact O-N 3.01Å; H382-F386 WeakPolarHBondContact O-CB 3.4Å; H382-F386 PolarHBondContact O-N 2.77Å
383	L	86.2	Confident	87.3	Confident	7 Å²	7	58 Å²	58	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-64.3	-41.5	174.8	-70.4	170.8	0	0	0	112.1	E190 I370 R379 E380 R381 F386 R387 L394 L404	E190-L383 HydrophobicContact CG-CD1 4.1Å; I370-L383 HydrophobicContact CD1-CD1 3.92Å; I370-L383 HydrophobicContact CD1-CD2 3.83Å; I370-L383 HydrophobicContact CD1-CG 3.8Å; R379-L383 WeakPolarHBondContact O-CB 3.46Å; R379-L383 VanDerWaalsContact O-CG 3.24Å; R379-L383 WeakPolarHBondContact O-CG 3.33Å; R379-L383 PolarHBondContact O-N 2.77Å; E380-L383 PolarHBondContact O-N 3.39Å; R381-L383 VanDerWaalsContact C-N 3.35Å; L383-F386 PolarHBondContact O-N 2.76Å; L383-R387 WeakPolarHBondContact O-CB 3.41Å; L383-R387 VanDerWaalsContact O-CG 3.31Å; L383-R387 WeakPolarHBondContact O-CG 3.47Å; L383-R387 PolarHBondContact O-N 3.5Å; L383-L394 HydrophobicContact CD2-CD2 4.03Å; L383-L404 HydrophobicContact CD1-CD2 3.59Å; L383-L404 HydrophobicContact CD2-CD1 3.47Å; L383-L404 VanDerWaalsContact CD2-CD1 3.47Å; L383-L404 HydrophobicContact CD2-CD2 3.97Å; L383-L404 HydrophobicContact CD2-CG 4.32Å; L383-L404 HydrophobicContact CG-CD2 4.44Å
384	E	85.6	Confident	87.7	Confident	112 Å²	112	52.9 Å²	52.9	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-66	-40.8	176.7	-168.4	57.9	-150.6	0	0	111.7	E380 R381 F386 R387 S388	E380-E384 WeakPolarHBondContact O-CB 3.3Å; E380-E384 PolarHBondContact O-N 3.15Å; R381-E384 PolarHBondContact O-N 3.41Å; E384-F386 VanDerWaalsContact C-N 3.3Å; E384-F386 PolarHBondContact O-N 2.74Å; E384-R387 PolarHBondContact O-N 2.88Å; E384-S388 WeakPolarHBondContact O-CB 3.36Å; E384-S388 PolarHBondContact O-N 2.82Å; E384-S388 PolarHBondContact O-OG 2.94Å
385	S	90.2	Very high	88.1	Confident	25 Å²	25	51 Å²	51	18%	0.175	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-37.6	174.1	-173	0	0	0	0	112.4	R381 H382 S388 G389 V390 T391	R381-S385 WeakPolarHBondContact O-CB 3.46Å; R381-S385 PolarHBondContact O-N 3.36Å; H382-S385 PolarHBondContact O-N 3.01Å; S385-S388 WeakPolarHBondContact CA-OG 3.3Å; S385-S388 PolarHBondContact O-OG 3.02Å; S385-S388 VanDerWaalsContact O-OG 3.11Å; S385-G389 PolarHBondContact O-N 3.02Å; S385-V390 PolarHBondContact O-N 2.92Å; S385-V390 VanDerWaalsContact O-N 3.14Å; S385-T391 VanDerWaalsContact C-OG1 3.23Å; S385-T391 WeakPolarHBondContact CB-OG1 3.39Å; S385-T391 PolarHBondContact O-N 3.1Å; S385-T391 VanDerWaalsContact O-N 3.14Å; S385-T391 PolarHBondContact O-OG1 2.99Å; S385-T391 VanDerWaalsContact OG-CG2 3.28Å; S385-T391 WeakPolarHBondContact OG-CG2 3.42Å; S385-T391 PolarHBondContact OG-OG1 3.07Å
386	F	89.8	Confident	88.5	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-72.1	-45.2	175.6	-177.5	-108.8	0	0	0	112.1	L342 I343 H382 L383 E384 S388 G389 T391 P392 L394 I406 V409	L342-F386 HydrophobicContact CB-CE1 4.45Å; L342-F386 HydrophobicContact CB-CE2 4.22Å; L342-F386 HydrophobicContact CB-CZ 3.85Å; L342-F386 HydrophobicContact CD2-CE2 4.33Å; L342-F386 WeakPolarHBondContact CD2-O 3Å; I343-F386 WeakPolarHBondContact O-CE2 3.47Å; H382-F386 WeakPolarHBondContact O-CB 3.4Å; H382-F386 PolarHBondContact O-N 2.77Å; L383-F386 PolarHBondContact O-N 2.76Å; E384-F386 VanDerWaalsContact C-N 3.3Å; E384-F386 PolarHBondContact O-N 2.74Å; F386-S388 VanDerWaalsContact C-N 3.33Å; F386-S388 PolarHBondContact O-N 2.92Å; F386-G389 PolarHBondContact O-N 3.09Å; F386-G389 VanDerWaalsContact O-N 3.09Å; F386-T391 WeakPolarHBondContact CA-O 3.4Å; F386-T391 WeakPolarHBondContact CD2-O 3.48Å; F386-T391 PolarHBondContact N-OG1 2.99Å; F386-P392 VanDerWaalsContact CE2-O 3.23Å; F386-P392 WeakPolarHBondContact CE2-O 3.25Å; F386-L394 HydrophobicContact CB-CB 4.41Å; F386-L394 HydrophobicContact CB-CD2 4.49Å; F386-L394 HydrophobicContact CD1-CB 4.13Å; F386-L394 HydrophobicContact CD1-CD2 3.88Å; F386-L394 HydrophobicContact CD2-CB 3.4Å; F386-L394 VanDerWaalsContact CD2-CB 3.4Å; F386-L394 HydrophobicContact CE1-CB 4.21Å; F386-L394 HydrophobicContact CE1-CD2 4.21Å; F386-L394 HydrophobicContact CE2-CB 3.51Å; F386-L394 HydrophobicContact CG-CB 3.75Å; F386-L394 HydrophobicContact CG-CD2 4.1Å; F386-L394 HydrophobicContact CG-CG 4.47Å; F386-L394 HydrophobicContact CZ-CB 3.93Å; F386-I406 HydrophobicContact CD1-CD1 4.18Å; F386-I406 HydrophobicContact CD1-CG2 3.62Å; F386-I406 HydrophobicContact CE1-CB 4.39Å; F386-I406 HydrophobicContact CE1-CD1 3.94Å; F386-I406 HydrophobicContact CE1-CG2 3.37Å; F386-V409 HydrophobicContact CE1-CG2 4.09Å; F386-V409 HydrophobicContact CZ-CG2 4.35Å
387	R	84.6	Confident	89.1	Confident	109 Å²	109	44.6 Å²	44.6	41%	0.411	23%	0.234	S	C	.	.	H	α-helix	trans	-63.1	-37	178.2	-75.9	175.3	178.9	164.4	-3.3	113.3	L383 E384 G389 D405 I406	L383-R387 WeakPolarHBondContact O-CB 3.41Å; L383-R387 VanDerWaalsContact O-CG 3.31Å; L383-R387 WeakPolarHBondContact O-CG 3.47Å; L383-R387 PolarHBondContact O-N 3.5Å; E384-R387 PolarHBondContact O-N 2.88Å; R387-G389 PolarHBondContact O-N 3.18Å; R387-D405 PolarHBondContact NH2-O 3.26Å; R387-I406 HydrophobicContact CG-CG2 4.44Å
388	S	86.3	Confident	88.8	Confident	69 Å²	69	41.8 Å²	41.8	48%	0.483	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.9	176.5	55.9	0	0	0	0	113.6	E384 S385 F386 V390	E384-S388 WeakPolarHBondContact O-CB 3.36Å; E384-S388 PolarHBondContact O-N 2.82Å; E384-S388 PolarHBondContact O-OG 2.94Å; S385-S388 WeakPolarHBondContact CA-OG 3.3Å; S385-S388 PolarHBondContact O-OG 3.02Å; S385-S388 VanDerWaalsContact O-OG 3.11Å; F386-S388 VanDerWaalsContact C-N 3.33Å; F386-S388 PolarHBondContact O-N 2.92Å; S388-V390 PolarHBondContact O-N 3.11Å; S388-V390 WeakPolarHBondContact OG-CG2 3.47Å
389	G	87.4	Confident	87.8	Confident	37 Å²	37	43 Å²	43	38%	0.381	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.9	0.8	-177.6	0	0	0	0	0	114.7	S385 F386 R387 T391	S385-G389 PolarHBondContact O-N 3.02Å; F386-G389 PolarHBondContact O-N 3.09Å; F386-G389 VanDerWaalsContact O-N 3.09Å; R387-G389 PolarHBondContact O-N 3.18Å; G389-T391 PolarHBondContact O-N 2.82Å
390	V	90.3	Very high	86.7	Confident	95 Å²	95	42 Å²	42	58%	0.576	22%	0.222	S	C	*	.	S	Bend	trans	-59.9	-40.1	176.6	176	0	0	0	0	110.7	S385 S388	S385-V390 PolarHBondContact O-N 2.92Å; S385-V390 VanDerWaalsContact O-N 3.14Å; S388-V390 PolarHBondContact O-N 3.11Å; S388-V390 WeakPolarHBondContact OG-CG2 3.47Å
391	T	92	Very high	85.7	Confident	15 Å²	15	39.6 Å²	39.6	9%	0.092	21%	0.211	C	C	.	.	S	Bend	trans	-120.9	92.6	173.1	51.4	0	0	0	0	108.4	N366 V368 S385 F386 G389 I393	N366-T391 HydrophobicContact CB-CG2 4.37Å; V368-T391 HydrophobicContact CG1-CG2 3.93Å; V368-T391 WeakPolarHBondContact CG2-OG1 3.42Å; S385-T391 VanDerWaalsContact C-OG1 3.23Å; S385-T391 WeakPolarHBondContact CB-OG1 3.39Å; S385-T391 PolarHBondContact O-N 3.1Å; S385-T391 VanDerWaalsContact O-N 3.14Å; S385-T391 PolarHBondContact O-OG1 2.99Å; S385-T391 VanDerWaalsContact OG-CG2 3.28Å; S385-T391 WeakPolarHBondContact OG-CG2 3.42Å; S385-T391 PolarHBondContact OG-OG1 3.07Å; F386-T391 WeakPolarHBondContact CA-O 3.4Å; F386-T391 WeakPolarHBondContact CD2-O 3.48Å; F386-T391 PolarHBondContact N-OG1 2.99Å; G389-T391 PolarHBondContact O-N 2.82Å; T391-I393 PolarHBondContact O-N 2.89Å; T391-I393 VanDerWaalsContact O-N 3.16Å
392	P	92.7	Very high	84.6	Confident	20 Å²	20	32.3 Å²	32.3	13%	0.13	18%	0.183	C	C	.	.			trans	-71.6	-5	-173.7	29	-36	0	0	0	113.9	L342 I343 N366 F386	L342-P392 WeakPolarHBondContact CA-O 3.4Å; L342-P392 HydrophobicContact CD2-CB 4.3Å; I343-P392 PolarHBondContact N-O 3.41Å; N366-P392 WeakPolarHBondContact O-CD 3.32Å; F386-P392 VanDerWaalsContact CE2-O 3.23Å; F386-P392 WeakPolarHBondContact CE2-O 3.25Å
393	I	94.3	Very high	83	Confident	6 Å²	6	30.2 Å²	30.2	3%	0.031	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	124.5	178.3	-53.5	172.5	0	0	0	109.7	L334 I343 V345 L360 Y365 N366 V367 V368 T391	L334-I393 HydrophobicContact CD1-CD1 3.86Å; L334-I393 HydrophobicContact CD2-CD1 3.67Å; L334-I393 HydrophobicContact CD2-CG1 4.18Å; L334-I393 HydrophobicContact CG-CD1 4.31Å; I343-I393 WeakPolarHBondContact O-CA 3.47Å; V345-I393 HydrophobicContact CG2-CG2 4.07Å; L360-I393 HydrophobicContact CD1-CG2 4.35Å; Y365-I393 HydrophobicContact CD1-CD1 3.74Å; Y365-I393 HydrophobicContact CG-CD1 4.13Å; N366-I393 PolarHBondContact O-N 3.45Å; V367-I393 WeakPolarHBondContact CA-O 3.49Å; V367-I393 HydrophobicContact CB-CB 4.13Å; V367-I393 HydrophobicContact CB-CG2 4.35Å; V367-I393 HydrophobicContact CG2-CB 4.04Å; V367-I393 HydrophobicContact CG2-CG2 3.78Å; V368-I393 PolarHBondContact N-O 3.47Å; V368-I393 VanDerWaalsContact N-O 3.07Å; T391-I393 PolarHBondContact O-N 2.89Å; T391-I393 VanDerWaalsContact O-N 3.16Å
394	L	93.8	Very high	82	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	117.6	173.7	178.3	63.6	0	0	0	109.6	I343 L344 V345 V368 I370 L383 F386 I406	I343-L394 PolarHBondContact O-N 3.47Å; L344-L394 HydrophobicContact CD1-CB 3.99Å; L344-L394 HydrophobicContact CD1-CD2 3.79Å; L344-L394 HydrophobicContact CD1-CG 3.84Å; V345-L394 PolarHBondContact N-O 3.37Å; V368-L394 HydrophobicContact CG2-CD1 3.78Å; V368-L394 WeakPolarHBondContact O-CA 3.38Å; I370-L394 HydrophobicContact CB-CD1 4.04Å; I370-L394 HydrophobicContact CG2-CD1 3.83Å; I370-L394 HydrophobicContact CG2-CD2 4.32Å; I370-L394 HydrophobicContact CG2-CG 4.18Å; L383-L394 HydrophobicContact CD2-CD2 4.03Å; F386-L394 HydrophobicContact CB-CB 4.41Å; F386-L394 HydrophobicContact CB-CD2 4.49Å; F386-L394 HydrophobicContact CD1-CB 4.13Å; F386-L394 HydrophobicContact CD1-CD2 3.88Å; F386-L394 HydrophobicContact CD2-CB 3.4Å; F386-L394 VanDerWaalsContact CD2-CB 3.4Å; F386-L394 HydrophobicContact CE1-CB 4.21Å; F386-L394 HydrophobicContact CE1-CD2 4.21Å; F386-L394 HydrophobicContact CE2-CB 3.51Å; F386-L394 HydrophobicContact CG-CB 3.75Å; F386-L394 HydrophobicContact CG-CD2 4.1Å; F386-L394 HydrophobicContact CG-CG 4.47Å; F386-L394 HydrophobicContact CZ-CB 3.93Å; L394-I406 HydrophobicContact CD2-CD1 3.87Å
395	V	95.3	Very high	80.9	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	121.3	172.1	-177.6	0	0	0	0	108.7	V345 V347 A353 L356 A357 L360 V367 V368 A369 I370	V345-V395 HydrophobicContact CB-CG2 4.27Å; V345-V395 CarbonylContact O-C 3.35Å; V345-V395 WeakPolarHBondContact O-CA 3.15Å; V347-V395 HydrophobicContact CG1-CG1 4.02Å; V347-V395 HydrophobicContact CG2-CG1 3.97Å; A353-V395 HydrophobicContact CB-CG1 3.98Å; L356-V395 HydrophobicContact CB-CG1 4.41Å; L356-V395 HydrophobicContact CD2-CG1 4.08Å; L356-V395 HydrophobicContact CD2-CG2 4.36Å; A357-V395 HydrophobicContact CB-CG2 4.46Å; L360-V395 HydrophobicContact CD1-CG2 4.22Å; V367-V395 HydrophobicContact CG2-CG2 3.72Å; V368-V395 PolarHBondContact O-N 3.19Å; A369-V395 CarbonylContact C-O 3.43Å; A369-V395 VanDerWaalsContact CA-O 3.24Å; A369-V395 WeakPolarHBondContact CA-O 3.46Å; I370-V395 PolarHBondContact N-O 3.01Å
396	A	92.9	Very high	79.9	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	144.3	-172.9	0	0	0	0	0	112.9	L344 V345 F346 V347 I370 A401	L344-A396 HydrophobicContact CD1-CB 4Å; V345-A396 PolarHBondContact O-N 3.41Å; F346-A396 WeakPolarHBondContact CA-O 3.11Å; V347-A396 PolarHBondContact N-O 2.85Å; I370-A396 HydrophobicContact CG2-CB 3.44Å; I370-A396 VanDerWaalsContact CG2-CB 3.44Å; I370-A396 WeakPolarHBondContact O-CA 2.99Å; A396-A401 HydrophobicContact CB-CB 3.49Å; A396-A401 VanDerWaalsContact CB-CB 3.49Å
397	T	91	Very high	78.7	Confident	5 Å²	5	27.3 Å²	27.3	3%	0.031	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	159.8	162.3	64.1	0	0	0	0	111.1	V347 K350 A353 I370 H371 V399 A400 A401	V347-T397 HydrophobicContact CG2-CG2 4.18Å; K350-T397 HydrophobicContact CG-CG2 4.39Å; A353-T397 HydrophobicContact CB-CG2 4.13Å; I370-T397 PolarHBondContact O-N 2.84Å; H371-T397 HydrophobicContact CB-CG2 3.92Å; T397-V399 VanDerWaalsContact C-N 3.31Å; T397-V399 PolarHBondContact O-N 3.22Å; T397-A400 PolarHBondContact O-N 3.41Å; T397-A401 PolarHBondContact O-N 2.98Å
398	A	76.5	Confident	78	Confident	15 Å²	15	26.4 Å²	26.4	12%	0.124	17%	0.166	C	C	.	.	H	α-helix	trans	-43.2	-54.1	175.1	0	0	0	0	0	112.9	A400 R402 E423	A398-A400 VanDerWaalsContact C-N 3.25Å; A398-A400 PolarHBondContact O-N 3.35Å; A398-R402 WeakPolarHBondContact O-CB 3.44Å; A398-R402 PolarHBondContact O-N 2.87Å; A398-E423 WeakPolarHBondContact CB-OE1 3.41Å
399	V	67.6	Low	78.1	Confident	82 Å²	82	23.5 Å²	23.5	50%	0.497	15%	0.145	S	C	.	.	H	α-helix	trans	-62.2	-35	-176.5	-178.2	0	0	0	0	112.1	T397	T397-V399 VanDerWaalsContact C-N 3.31Å; T397-V399 PolarHBondContact O-N 3.22Å
400	A	62.9	Low	78.1	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.008	15%	0.151	C	C	.	.	H	α-helix	trans	-85.4	-30.3	-171.7	0	0	0	0	0	113.9	I370 R379 T397 A398 L404	I370-A400 HydrophobicContact CB-CB 4.32Å; I370-A400 HydrophobicContact CD1-CB 4.46Å; I370-A400 HydrophobicContact CG1-CB 4.01Å; I370-A400 HydrophobicContact CG2-CB 3.94Å; I370-A400 VanDerWaalsContact O-CB 3.27Å; I370-A400 WeakPolarHBondContact O-CB 3.2Å; R379-A400 PolarHBondContact NH2-O 2.93Å; T397-A400 PolarHBondContact O-N 3.41Å; A398-A400 VanDerWaalsContact C-N 3.25Å; A398-A400 PolarHBondContact O-N 3.35Å; A400-L404 WeakPolarHBondContact O-CD1 3.28Å; A400-L404 WeakPolarHBondContact O-CG 3.45Å
401	A	59.9	Low	78.3	Confident	1 Å²	1	23.1 Å²	23.1	1%	0.008	13%	0.125	C	C	.	.	H	α-helix	trans	-89.6	-14.3	-177.1	0	0	0	0	0	114.8	F346 A396 T397 L404	F346-A401 HydrophobicContact CD1-CB 4.19Å; F346-A401 HydrophobicContact CE1-CB 3.2Å; F346-A401 HydrophobicContact CZ-CB 3.59Å; A396-A401 HydrophobicContact CB-CB 3.49Å; A396-A401 VanDerWaalsContact CB-CB 3.49Å; T397-A401 PolarHBondContact O-N 2.98Å; A401-L404 HydrophobicContact CB-CD1 4.29Å; A401-L404 WeakPolarHBondContact O-CB 3.49Å; A401-L404 WeakPolarHBondContact O-CG 3.45Å; A401-L404 PolarHBondContact O-N 3.4Å
402	R	65.8	Low	78.3	Confident	35 Å²	35	22.4 Å²	22.4	13%	0.132	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.6	127.8	-170.9	-155.7	-165.2	-158.2	147.5	20.8	105.2	T188 R249 A398 L404 E423	T188-R402 PolarHBondContact OG1-O 3.15Å; R249-R402 PolarHBondContact NH1-O 2.88Å; R249-R402 VanDerWaalsContact NH1-O 3.14Å; R249-R402 VanDerWaalsContact NH2-CA 3.35Å; R249-R402 VanDerWaalsContact NH2-CG 3.27Å; R249-R402 PolarHBondContact NH2-O 2.83Å; A398-R402 WeakPolarHBondContact O-CB 3.44Å; A398-R402 PolarHBondContact O-N 2.87Å; R402-L404 VanDerWaalsContact C-N 3.26Å; R402-L404 PolarHBondContact O-N 3.15Å; R402-E423 IonicContact CZ-OE2 3.17Å; R402-E423 IonicContact NH1-OE2 2.69Å; R402-E423 IonicContact NH2-OE2 3.1Å; R402-E423 PolarHBondContact NH2-OE2 2.92Å
403	G	57.3	Low	78.5	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.3	-10.6	-178.9	0	0	0	0	0	114.3	D405	G403-D405 PolarHBondContact O-N 3.13Å
404	L	65.4	Low	78.6	Confident	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.113	C	C	.	.			trans	-63.8	121.5	168.8	-56.1	-176.4	0	0	0	109.4	E190 I370 L383 A400 A401 R402 I406 R430	E190-L404 HydrophobicContact CB-CD2 3.51Å; E190-L404 HydrophobicContact CG-CD2 3.4Å; E190-L404 VanDerWaalsContact CG-CD2 3.4Å; I370-L404 HydrophobicContact CD1-CD1 4.4Å; L383-L404 HydrophobicContact CD1-CD2 3.59Å; L383-L404 HydrophobicContact CD2-CD1 3.47Å; L383-L404 VanDerWaalsContact CD2-CD1 3.47Å; L383-L404 HydrophobicContact CD2-CD2 3.97Å; L383-L404 HydrophobicContact CD2-CG 4.32Å; L383-L404 HydrophobicContact CG-CD2 4.44Å; A400-L404 WeakPolarHBondContact O-CD1 3.28Å; A400-L404 WeakPolarHBondContact O-CG 3.45Å; A401-L404 HydrophobicContact CB-CD1 4.29Å; A401-L404 WeakPolarHBondContact O-CB 3.49Å; A401-L404 WeakPolarHBondContact O-CG 3.45Å; A401-L404 PolarHBondContact O-N 3.4Å; R402-L404 VanDerWaalsContact C-N 3.26Å; R402-L404 PolarHBondContact O-N 3.15Å; L404-I406 HydrophobicContact CB-CD1 4.09Å; L404-I406 HydrophobicContact CB-CG1 3.82Å; L404-I406 HydrophobicContact CD1-CD1 3.84Å; L404-I406 HydrophobicContact CD1-CG1 4.33Å; L404-I406 PolarHBondContact O-N 2.96Å; L404-R430 PolarHBondContact O-NH1 3.09Å
405	D	63.4	Low	78.7	Confident	29 Å²	29	22.2 Å²	22.2	16%	0.155	12%	0.117	C	C	.	.			trans	-87.3	101	158.1	-166.6	22.7	0	0	0	108.5	Q148 Q194 R387 G403 R433	Q148-D405 PolarHBondContact NE2-OD2 3.43Å; Q194-D405 VanDerWaalsContact CD-CB 3.44Å; Q194-D405 HydrophobicContact CG-CB 4.48Å; Q194-D405 PolarHBondContact NE2-OD2 3.36Å; R387-D405 PolarHBondContact NH2-O 3.26Å; G403-D405 PolarHBondContact O-N 3.13Å; D405-R433 IonicContact OD1-NH1 3.31Å; D405-R433 PolarHBondContact OD1-NH1 3Å
406	I	69.1	Low	78.7	Confident	2 Å²	2	23.2 Å²	23.2	1%	0.01	12%	0.123	C	C	.	.			trans	-108.7	103.8	173.1	-50.7	168	0	0	0	106.3	L344 F386 R387 L394 L404 V409	L344-I406 HydrophobicContact CD2-CD1 4.48Å; F386-I406 HydrophobicContact CD1-CD1 4.18Å; F386-I406 HydrophobicContact CD1-CG2 3.62Å; F386-I406 HydrophobicContact CE1-CB 4.39Å; F386-I406 HydrophobicContact CE1-CD1 3.94Å; F386-I406 HydrophobicContact CE1-CG2 3.37Å; R387-I406 HydrophobicContact CG-CG2 4.44Å; L394-I406 HydrophobicContact CD2-CD1 3.87Å; L404-I406 HydrophobicContact CB-CD1 4.09Å; L404-I406 HydrophobicContact CB-CG1 3.82Å; L404-I406 HydrophobicContact CD1-CD1 3.84Å; L404-I406 HydrophobicContact CD1-CG1 4.33Å; L404-I406 PolarHBondContact O-N 2.96Å; I406-V409 HydrophobicContact CB-CG2 3.88Å; I406-V409 HydrophobicContact CG2-CG2 3.72Å
407	P	64.4	Low	78.7	Confident	53 Å²	53	23.7 Å²	23.7	34%	0.344	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	145.2	175.5	27	-32.4	0	0	0	109.3	V409	P407-V409 PolarHBondContact O-N 2.87Å
408	N	70.6	Confident	78.7	Confident	90 Å²	90	23.8 Å²	23.8	48%	0.481	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.1	26.4	167.5	-50.6	-29.9	0	0	0	117.3	K410	N408-K410 PolarHBondContact O-N 2.83Å
409	V	86.8	Confident	79.2	Confident	7 Å²	7	27.6 Å²	27.6	4%	0.042	15%	0.151	C	C	.	.			trans	-65.4	117.5	163.8	-175.9	0	0	0	0	108.3	L344 F386 I406 P407 H411 V412 T431	L344-V409 HydrophobicContact CB-CG1 3.83Å; F386-V409 HydrophobicContact CE1-CG2 4.09Å; F386-V409 HydrophobicContact CZ-CG2 4.35Å; I406-V409 HydrophobicContact CB-CG2 3.88Å; I406-V409 HydrophobicContact CG2-CG2 3.72Å; P407-V409 PolarHBondContact O-N 2.87Å; V409-H411 WeakPolarHBondContact CG1-O 3.06Å; V409-V412 HydrophobicContact CG1-CG2 3.95Å; V409-T431 WeakPolarHBondContact O-CA 3.18Å; V409-T431 VanDerWaalsContact O-CB 3.24Å; V409-T431 WeakPolarHBondContact O-CB 3.45Å; V409-T431 PolarHBondContact O-OG1 3.33Å
410	K	89	Confident	80	Confident	117 Å²	117	26.6 Å²	26.6	51%	0.509	14%	0.144	S	C	.	.			trans	-92.5	-28.2	178.3	-62.2	-179.3	175.8	176.2	0	112.5	T341 L342 N408 T431 L439	T341-K410 HydrophobicContact CG2-CB 3.78Å; T341-K410 HydrophobicContact CG2-CD 4.06Å; T341-K410 HydrophobicContact CG2-CG 4.39Å; L342-K410 PolarHBondContact O-N 2.89Å; L342-K410 VanDerWaalsContact O-N 3.12Å; N408-K410 PolarHBondContact O-N 2.83Å; K410-T431 PolarHBondContact O-OG1 2.93Å; K410-L439 PolarHBondContact O-N 3.3Å
411	H	92.9	Very high	81.1	Confident	7 Å²	7	27.7 Å²	27.7	3%	0.032	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	120.6	-178.5	-164.6	179.7	0	0	0	111	L342 I343 L344 V409 L439 T441	L342-H411 PolarHBondContact O-N 2.84Å; I343-H411 WeakPolarHBondContact CA-O 3.16Å; I343-H411 HydrophobicContact CG1-CB 4.2Å; I343-H411 HydrophobicContact CG2-CB 4.39Å; L344-H411 PolarHBondContact N-O 3.23Å; V409-H411 WeakPolarHBondContact CG1-O 3.06Å; H411-L439 CarbonylContact C-O 3.49Å; H411-L439 VanDerWaalsContact CA-O 3.28Å; H411-L439 WeakPolarHBondContact CA-O 3.44Å; H411-L439 PolarHBondContact CD2-O 3.48Å; H411-L439 WeakPolarHBondContact NE2-CD2 3.16Å; H411-T441 WeakPolarHBondContact NE2-CB 3.39Å; H411-T441 PolarHBondContact NE2-OG1 2.94Å
412	V	93.4	Very high	82.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.8	167.9	173.8	0	0	0	0	108.4	L344 F346 V409 R430 T431 L439 A440 T441	L344-V412 HydrophobicContact CB-CG2 4.45Å; L344-V412 CarbonylContact O-C 3.39Å; L344-V412 WeakPolarHBondContact O-CA 3.39Å; F346-V412 HydrophobicContact CD2-CG1 3.82Å; F346-V412 HydrophobicContact CE2-CG1 3.86Å; V409-V412 HydrophobicContact CG1-CG2 3.95Å; V412-R430 HydrophobicContact CG2-CB 3.98Å; V412-T431 HydrophobicContact CB-CG2 4.26Å; V412-T431 HydrophobicContact CG2-CG2 3.78Å; V412-L439 PolarHBondContact N-O 3.46Å; V412-A440 CarbonylContact O-C 3.52Å; V412-A440 VanDerWaalsContact O-CA 3.29Å; V412-A440 WeakPolarHBondContact O-CA 3.49Å; V412-T441 PolarHBondContact O-N 3.33Å
413	I	95.8	Very high	82.9	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	113.1	176.1	-57.5	177.1	0	0	0	108.6	L330 L333 I343 L344 V345 F346 Y415 T441 F443	L330-I413 HydrophobicContact CD1-CD1 3.78Å; L330-I413 HydrophobicContact CD1-CG2 4.07Å; L333-I413 HydrophobicContact CB-CD1 4.27Å; L333-I413 HydrophobicContact CD1-CD1 4.15Å; L333-I413 HydrophobicContact CD1-CG2 4.47Å; I343-I413 HydrophobicContact CG2-CD1 3.69Å; I343-I413 HydrophobicContact CG2-CG1 4.07Å; L344-I413 PolarHBondContact O-N 3.35Å; V345-I413 CarbonylContact C-O 2.97Å; V345-I413 WeakPolarHBondContact CA-O 3.34Å; V345-I413 HydrophobicContact CG1-CB 4.49Å; V345-I413 HydrophobicContact CG2-CB 4.34Å; V345-I413 HydrophobicContact CG2-CD1 4.48Å; F346-I413 PolarHBondContact N-O 3.44Å; I413-Y415 PolarHBondContact O-N 2.79Å; I413-T441 CarbonylContact C-O 3.57Å; I413-T441 VanDerWaalsContact CA-O 3.26Å; I413-T441 WeakPolarHBondContact CA-O 2.97Å; I413-F443 HydrophobicContact CG2-CZ 4.44Å
414	N	96.1	Very high	84.3	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	90.8	167.1	-66.4	-59.8	0	0	0	108.3	D416 L417 R427 T441 S442 F443	N414-D416 VanDerWaalsContact C-N 3.3Å; N414-L417 HydrophobicContact CB-CD2 4.2Å; N414-R427 WeakPolarHBondContact OD1-CD 3.23Å; N414-T441 PolarHBondContact N-O 3.11Å; N414-S442 PolarHBondContact ND2-OG 2.94Å; N414-F443 PolarHBondContact O-N 3.02Å
415	Y	96.5	Very high	85.2	Confident	22 Å²	22	29.6 Å²	29.6	9%	0.086	16%	0.161	C	C	.	.	S	Bend	trans	-64.9	-40.5	174.9	-175.9	-83.3	0	0	0	110.5	K326 R327 L330 F346 V347 L356 I413 F443	K326-Y415 HydrophobicContact CB-CD2 4.33Å; K326-Y415 HydrophobicContact CB-CE1 4.03Å; K326-Y415 HydrophobicContact CB-CE2 3.56Å; K326-Y415 VanDerWaalsContact CB-OH 3.29Å; K326-Y415 WeakPolarHBondContact CB-OH 3.34Å; K326-Y415 HydrophobicContact CD-CD1 4.05Å; K326-Y415 HydrophobicContact CD-CE1 3.65Å; K326-Y415 WeakPolarHBondContact CD-O 3.36Å; K326-Y415 WeakPolarHBondContact CE-O 3.34Å; K326-Y415 PolarHBondContact NZ-O 3.14Å; R327-Y415 WeakPolarHBondContact CG-OH 3.47Å; L330-Y415 HydrophobicContact CB-CD2 4.37Å; L330-Y415 HydrophobicContact CB-CE2 4.33Å; L330-Y415 HydrophobicContact CD2-CD2 3.95Å; L330-Y415 HydrophobicContact CD2-CE2 4.09Å; F346-Y415 WeakPolarHBondContact O-CA 3.36Å; F346-Y415 VanDerWaalsContact O-CB 3.26Å; F346-Y415 WeakPolarHBondContact O-CB 3.26Å; F346-Y415 PolarHBondContact O-N 2.87Å; V347-Y415 HydrophobicContact CG1-CD1 4.03Å; V347-Y415 HydrophobicContact CG1-CG 4.22Å; L356-Y415 HydrophobicContact CD1-CE2 4.03Å; L356-Y415 HydrophobicContact CD2-CD2 4.01Å; L356-Y415 HydrophobicContact CD2-CE2 4.24Å; L356-Y415 HydrophobicContact CD2-CG 4.16Å; I413-Y415 PolarHBondContact O-N 2.79Å; Y415-F443 HydrophobicContact CD2-CD2 4.08Å; Y415-F443 AromaticContact CD2-CE2 3.85Å; Y415-F443 HydrophobicContact CD2-CE2 3.85Å; Y415-F443 HydrophobicContact CE2-CE2 4.34Å; Y415-F443 HydrophobicContact CG-CD2 4.36Å
416	D	94.8	Very high	85.9	Confident	22 Å²	22	29.7 Å²	29.7	12%	0.118	16%	0.16	C	C	.	.	S	Bend	trans	-119.7	119.7	166.8	-56.6	-46.8	0	0	0	109.4	K326 F346 V347 E348 N414 R427	K326-D416 IonicContact NZ-OD1 3.6Å; K326-D416 PolarHBondContact NZ-OD1 2.91Å; F346-D416 PolarHBondContact O-N 3.32Å; V347-D416 WeakPolarHBondContact CA-OD2 3.17Å; E348-D416 HydrophobicContact CB-CB 3.89Å; E348-D416 PolarHBondContact N-OD2 2.82Å; N414-D416 VanDerWaalsContact C-N 3.3Å; D416-R427 PolarHBondContact O-NH1 3.42Å
417	L	93.1	Very high	86.7	Confident	9 Å²	9	30 Å²	30	5%	0.047	16%	0.162	C	C	.	.			trans	-64.4	139	173.7	-84.7	171.6	0	0	0	111	N414 Y424 F443 F444 N448	N414-L417 HydrophobicContact CB-CD2 4.2Å; L417-Y424 HydrophobicContact CD2-CD2 3.77Å; L417-Y424 HydrophobicContact CD2-CE2 4Å; L417-F443 WeakPolarHBondContact CD1-O 3.28Å; L417-F443 WeakPolarHBondContact CG-O 3.33Å; L417-F444 HydrophobicContact CD1-CB 3.99Å; L417-F444 HydrophobicContact CD1-CD2 3.42Å; L417-F444 VanDerWaalsContact CD1-CD2 3.42Å; L417-F444 HydrophobicContact CD1-CE2 4.24Å; L417-F444 HydrophobicContact CD1-CG 4.06Å; L417-N448 HydrophobicContact CB-CB 4.44Å; L417-N448 WeakPolarHBondContact CB-ND2 3.4Å; L417-N448 HydrophobicContact CD1-CB 4.11Å
418	P	90.9	Very high	87.8	Confident	8 Å²	8	27.5 Å²	27.5	5%	0.052	15%	0.145	C	C	.	.			trans	-66.7	157.8	172.9	29.7	-32.3	0	0	0	111	D420 E423	P418-D420 WeakPolarHBondContact CG-O 3.3Å; P418-D420 PolarHBondContact O-N 2.82Å; P418-E423 HydrophobicContact CB-CB 3.92Å; P418-E423 HydrophobicContact CB-CG 3.99Å; P418-E423 HydrophobicContact CG-CB 4.25Å; P418-E423 HydrophobicContact CG-CG 4.43Å
419	S	87.2	Confident	88.3	Confident	94 Å²	94	24.5 Å²	24.5	66%	0.657	14%	0.135	S	C	*	.	S	Bend	trans	-77.6	-10.2	174.6	55.7	0	0	0	0	113.7	N450 V451	S419-N450 PolarHBondContact O-ND2 3.45Å; S419-V451 VanDerWaalsContact C-CG1 3.43Å; S419-V451 WeakPolarHBondContact O-CG1 3.3Å
420	D	85	Confident	88.1	Confident	62 Å²	62	24.9 Å²	24.9	33%	0.332	14%	0.136	S	C	.	.	S	Bend	trans	-124.9	139.6	-176.7	173.6	34.3	0	0	0	110.3	P418 D422 E423 Y424	P418-D420 WeakPolarHBondContact CG-O 3.3Å; P418-D420 PolarHBondContact O-N 2.82Å; D420-D422 PolarHBondContact OD1-N 2.71Å; D420-E423 HydrophobicContact CB-CB 4.48Å; D420-Y424 PolarHBondContact O-N 3.17Å
421	I	85.8	Confident	87.9	Confident	23 Å²	23	19.5 Å²	19.5	12%	0.118	11%	0.113	C	C	.	.	H	α-helix	trans	-76.5	-33.3	-174.7	-165.6	64.1	0	0	0	112	E423 Y424 V425 D454 L455 L458	I421-E423 VanDerWaalsContact C-N 3.27Å; I421-E423 PolarHBondContact O-N 3.27Å; I421-Y424 HydrophobicContact CD1-CD1 4Å; I421-Y424 HydrophobicContact CD1-CG 4.35Å; I421-Y424 WeakPolarHBondContact O-CA 3.38Å; I421-Y424 VanDerWaalsContact O-CB 3.3Å; I421-Y424 WeakPolarHBondContact O-CB 3.5Å; I421-Y424 PolarHBondContact O-N 2.79Å; I421-V425 WeakPolarHBondContact O-CG2 3.31Å; I421-V425 PolarHBondContact O-N 2.58Å; I421-D454 HydrophobicContact CB-CB 4.08Å; I421-D454 HydrophobicContact CD1-CB 4.39Å; I421-D454 HydrophobicContact CG1-CB 4.05Å; I421-D454 HydrophobicContact CG2-CB 4.26Å; I421-L455 HydrophobicContact CD1-CB 4.15Å; I421-L455 HydrophobicContact CD1-CD1 4.12Å; I421-L458 HydrophobicContact CD1-CD1 3.95Å; I421-L458 HydrophobicContact CG1-CD1 4.01Å
422	D	80.3	Confident	87.1	Confident	37 Å²	37	19.4 Å²	19.4	20%	0.198	11%	0.114	C	C	.	.	H	α-helix	trans	-64.7	-38.8	177.6	-68.2	-30.4	0	0	0	109.9	T282 D420 Y424 V425 H426	T282-D422 HydrophobicContact CG2-CB 4.23Å; D420-D422 PolarHBondContact OD1-N 2.71Å; D422-Y424 VanDerWaalsContact C-N 3.34Å; D422-Y424 PolarHBondContact O-N 3.28Å; D422-V425 PolarHBondContact O-N 3.04Å; D422-H426 VanDerWaalsContact O-CG 3.23Å; D422-H426 PolarHBondContact O-N 3.28Å; D422-H426 PolarHBondContact O-ND1 3.24Å
423	E	82.5	Confident	86.1	Confident	25 Å²	25	22 Å²	22	12%	0.117	12%	0.124	C	C	.	.	H	α-helix	trans	-62.7	-39	171.1	-168.2	176.4	141.9	0	0	112.7	A398 R402 P418 D420 I421 H426 R427	A398-E423 WeakPolarHBondContact CB-OE1 3.41Å; R402-E423 IonicContact CZ-OE2 3.17Å; R402-E423 IonicContact NH1-OE2 2.69Å; R402-E423 IonicContact NH2-OE2 3.1Å; R402-E423 PolarHBondContact NH2-OE2 2.92Å; P418-E423 HydrophobicContact CB-CB 3.92Å; P418-E423 HydrophobicContact CB-CG 3.99Å; P418-E423 HydrophobicContact CG-CB 4.25Å; P418-E423 HydrophobicContact CG-CG 4.43Å; D420-E423 HydrophobicContact CB-CB 4.48Å; I421-E423 VanDerWaalsContact C-N 3.27Å; I421-E423 PolarHBondContact O-N 3.27Å; E423-H426 PolarHBondContact O-N 3.16Å; E423-R427 HydrophobicContact CG-CG 4.42Å; E423-R427 VanDerWaalsContact O-CG 3.26Å; E423-R427 WeakPolarHBondContact O-CG 3.39Å; E423-R427 PolarHBondContact O-N 3.43Å; E423-R427 IonicContact OE1-CZ 2.82Å; E423-R427 VanDerWaalsContact OE1-CZ 3.22Å; E423-R427 IonicContact OE1-NE 2.65Å; E423-R427 PolarHBondContact OE1-NE 2.82Å; E423-R427 IonicContact OE1-NH2 3.41Å; E423-R427 PolarHBondContact OE1-NH2 2.88Å
424	Y	87.5	Confident	84.6	Confident	4 Å²	4	24.2 Å²	24.2	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-59.5	-49	175.6	170.2	-95.6	0	0	0	111.7	Q316 L417 D420 I421 D422 H426 R427 I428 S442 L455 L458	Q316-Y424 PolarHBondContact OE1-OH 2.51Å; L417-Y424 HydrophobicContact CD2-CD2 3.77Å; L417-Y424 HydrophobicContact CD2-CE2 4Å; D420-Y424 PolarHBondContact O-N 3.17Å; I421-Y424 HydrophobicContact CD1-CD1 4Å; I421-Y424 HydrophobicContact CD1-CG 4.35Å; I421-Y424 WeakPolarHBondContact O-CA 3.38Å; I421-Y424 VanDerWaalsContact O-CB 3.3Å; I421-Y424 WeakPolarHBondContact O-CB 3.5Å; I421-Y424 PolarHBondContact O-N 2.79Å; D422-Y424 VanDerWaalsContact C-N 3.34Å; D422-Y424 PolarHBondContact O-N 3.28Å; Y424-H426 VanDerWaalsContact C-N 3.28Å; Y424-H426 PolarHBondContact O-N 3.26Å; Y424-R427 PolarHBondContact O-N 2.79Å; Y424-R427 VanDerWaalsContact O-N 3.12Å; Y424-I428 HydrophobicContact CD1-CD1 4.44Å; Y424-I428 HydrophobicContact CD2-CG2 4.3Å; Y424-I428 HydrophobicContact CE1-CD1 3.79Å; Y424-I428 HydrophobicContact CE1-CG2 4.3Å; Y424-I428 HydrophobicContact CE2-CG2 3.85Å; Y424-I428 PolarHBondContact O-N 3.47Å; Y424-S442 WeakPolarHBondContact CE2-OG 3.45Å; Y424-L455 HydrophobicContact CD1-CD1 3.93Å; Y424-L455 HydrophobicContact CD2-CD1 4.43Å; Y424-L455 HydrophobicContact CE1-CD1 3.53Å; Y424-L455 HydrophobicContact CE2-CD1 4.06Å; Y424-L455 HydrophobicContact CG-CD1 4.37Å; Y424-L458 HydrophobicContact CD1-CD1 4Å; Y424-L458 HydrophobicContact CE1-CD1 4.13Å; Y424-L458 HydrophobicContact CE1-CD2 3.94Å
425	V	83.1	Confident	83.1	Confident	11 Å²	11	24.3 Å²	24.3	7%	0.067	14%	0.138	C	C	.	.	H	α-helix	trans	-54.8	-46.1	175.8	174.5	0	0	0	0	110.5	L144 T310 I421 D422 R427 I428 G429 L458	L144-V425 HydrophobicContact CD2-CG1 3.93Å; T310-V425 HydrophobicContact CG2-CB 4.42Å; T310-V425 HydrophobicContact CG2-CG1 4.17Å; T310-V425 HydrophobicContact CG2-CG2 3.89Å; I421-V425 WeakPolarHBondContact O-CG2 3.31Å; I421-V425 PolarHBondContact O-N 2.58Å; D422-V425 PolarHBondContact O-N 3.04Å; V425-R427 VanDerWaalsContact C-N 3.34Å; V425-R427 PolarHBondContact O-N 2.91Å; V425-I428 WeakPolarHBondContact O-CG1 3.44Å; V425-I428 PolarHBondContact O-N 2.91Å; V425-G429 PolarHBondContact O-N 3.1Å; V425-L458 HydrophobicContact CG2-CD1 3.53Å
426	H	78.9	Confident	82	Confident	30 Å²	30	25.7 Å²	25.7	14%	0.139	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-32.8	179	-68.9	146.8	0	0	0	114.7	A281 D422 E423 Y424 R430	A281-H426 WeakPolarHBondContact CB-NE2 3.47Å; D422-H426 VanDerWaalsContact O-CG 3.23Å; D422-H426 PolarHBondContact O-N 3.28Å; D422-H426 PolarHBondContact O-ND1 3.24Å; E423-H426 PolarHBondContact O-N 3.16Å; Y424-H426 VanDerWaalsContact C-N 3.28Å; Y424-H426 PolarHBondContact O-N 3.26Å; H426-R430 PolarHBondContact O-NE 3.1Å
427	R	86.4	Confident	81.5	Confident	10 Å²	10	29.5 Å²	29.5	4%	0.038	17%	0.171	C	C	.	.	H	α-helix	trans	-72	-48.6	177.6	-72.9	-179.6	-176.7	-164.8	3.8	110.8	F346 N414 D416 E423 Y424 V425 G429 R430	F346-R427 HydrophobicContact CD1-CG 3.89Å; F346-R427 HydrophobicContact CD2-CB 3.91Å; F346-R427 HydrophobicContact CD2-CG 3.98Å; F346-R427 HydrophobicContact CE1-CB 4.43Å; F346-R427 HydrophobicContact CE1-CG 3.7Å; F346-R427 HydrophobicContact CE2-CB 3.65Å; F346-R427 HydrophobicContact CE2-CG 3.83Å; F346-R427 HydrophobicContact CG-CB 4.42Å; F346-R427 HydrophobicContact CG-CG 4Å; F346-R427 HydrophobicContact CZ-CB 3.93Å; F346-R427 HydrophobicContact CZ-CG 3.69Å; N414-R427 WeakPolarHBondContact OD1-CD 3.23Å; D416-R427 PolarHBondContact O-NH1 3.42Å; E423-R427 HydrophobicContact CG-CG 4.42Å; E423-R427 VanDerWaalsContact O-CG 3.26Å; E423-R427 WeakPolarHBondContact O-CG 3.39Å; E423-R427 PolarHBondContact O-N 3.43Å; E423-R427 IonicContact OE1-CZ 2.82Å; E423-R427 VanDerWaalsContact OE1-CZ 3.22Å; E423-R427 IonicContact OE1-NE 2.65Å; E423-R427 PolarHBondContact OE1-NE 2.82Å; E423-R427 IonicContact OE1-NH2 3.41Å; E423-R427 PolarHBondContact OE1-NH2 2.88Å; Y424-R427 PolarHBondContact O-N 2.79Å; Y424-R427 VanDerWaalsContact O-N 3.12Å; V425-R427 VanDerWaalsContact C-N 3.34Å; V425-R427 PolarHBondContact O-N 2.91Å; R427-G429 VanDerWaalsContact C-N 3.3Å; R427-G429 PolarHBondContact O-N 3.16Å; R427-R430 VanDerWaalsContact O-CB 3.32Å; R427-R430 WeakPolarHBondContact O-CB 3.31Å; R427-R430 WeakPolarHBondContact O-CG 3.43Å; R427-R430 PolarHBondContact O-N 3.37Å; R427-R430 VanDerWaalsContact O-N 3.17Å
428	I	87.1	Confident	81.2	Confident	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-69.4	-31.2	179.9	70.8	171.6	0	0	0	111.6	T310 I314 Q316 Y424 V425 R430 T431 A440	T310-I428 HydrophobicContact CG2-CD1 3.52Å; T310-I428 HydrophobicContact CG2-CG1 4.41Å; I314-I428 HydrophobicContact CD1-CG1 4.31Å; I314-I428 HydrophobicContact CG2-CB 4.49Å; Q316-I428 HydrophobicContact CG-CD1 4.26Å; Y424-I428 HydrophobicContact CD1-CD1 4.44Å; Y424-I428 HydrophobicContact CD2-CG2 4.3Å; Y424-I428 HydrophobicContact CE1-CD1 3.79Å; Y424-I428 HydrophobicContact CE1-CG2 4.3Å; Y424-I428 HydrophobicContact CE2-CG2 3.85Å; Y424-I428 PolarHBondContact O-N 3.47Å; V425-I428 WeakPolarHBondContact O-CG1 3.44Å; V425-I428 PolarHBondContact O-N 2.91Å; I428-R430 PolarHBondContact O-N 3.01Å; I428-T431 VanDerWaalsContact O-CG2 3.26Å; I428-T431 WeakPolarHBondContact O-CG2 3.28Å; I428-T431 PolarHBondContact O-N 3.19Å; I428-A440 HydrophobicContact CB-CB 3.89Å; I428-A440 HydrophobicContact CG2-CB 3.64Å
429	G	80.9	Confident	81.3	Confident	27 Å²	27	31.1 Å²	31.1	28%	0.278	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.3	5.4	171.8	0	0	0	0	0	115.1	V425 R427 R433	V425-G429 PolarHBondContact O-N 3.1Å; R427-G429 VanDerWaalsContact C-N 3.3Å; R427-G429 PolarHBondContact O-N 3.16Å; G429-R433 PolarHBondContact O-NE 2.87Å; G429-R433 PolarHBondContact O-NH2 2.82Å
430	R	82.1	Confident	81.6	Confident	15 Å²	15	26.6 Å²	26.6	6%	0.057	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78	-22.3	165.6	-57.6	-63	134.7	-178.5	-1.1	112.2	L344 F346 L404 V412 H426 R427 I428	L344-R430 HydrophobicContact CD2-CB 3.74Å; L344-R430 HydrophobicContact CD2-CG 3.78Å; F346-R430 HydrophobicContact CE2-CG 4.28Å; F346-R430 HydrophobicContact CZ-CG 4.08Å; L404-R430 PolarHBondContact O-NH1 3.09Å; V412-R430 HydrophobicContact CG2-CB 3.98Å; H426-R430 PolarHBondContact O-NE 3.1Å; R427-R430 VanDerWaalsContact O-CB 3.32Å; R427-R430 WeakPolarHBondContact O-CB 3.31Å; R427-R430 WeakPolarHBondContact O-CG 3.43Å; R427-R430 PolarHBondContact O-N 3.37Å; R427-R430 VanDerWaalsContact O-N 3.17Å; I428-R430 PolarHBondContact O-N 3.01Å
431	T	84.7	Confident	82.1	Confident	3 Å²	3	23.7 Å²	23.7	2%	0.018	13%	0.132	C	C	.	.	S	Bend	trans	-106.7	176.2	169.6	-167.7	0	0	0	0	110.9	I314 V409 K410 V412 I428 R433 G438	I314-T431 HydrophobicContact CG1-CG2 4.38Å; I314-T431 HydrophobicContact CG2-CG2 4.06Å; V409-T431 WeakPolarHBondContact O-CA 3.18Å; V409-T431 VanDerWaalsContact O-CB 3.24Å; V409-T431 WeakPolarHBondContact O-CB 3.45Å; V409-T431 PolarHBondContact O-OG1 3.33Å; K410-T431 PolarHBondContact O-OG1 2.93Å; V412-T431 HydrophobicContact CB-CG2 4.26Å; V412-T431 HydrophobicContact CG2-CG2 3.78Å; I428-T431 VanDerWaalsContact O-CG2 3.26Å; I428-T431 WeakPolarHBondContact O-CG2 3.28Å; I428-T431 PolarHBondContact O-N 3.19Å; T431-R433 VanDerWaalsContact C-N 3.32Å; T431-R433 PolarHBondContact O-N 2.84Å; T431-G438 WeakPolarHBondContact OG1-CA 3.24Å
432	G	77.1	Confident	82.6	Confident	6 Å²	6	22.6 Å²	22.6	6%	0.062	13%	0.127	C	C	.	.	S	Bend	trans	72.6	19.5	177.3	0	0	0	0	0	115.1	N436	G432-N436 CarbonylContact C-O 3.51Å; G432-N436 VanDerWaalsContact CA-O 3.23Å; G432-N436 WeakPolarHBondContact CA-O 3.33Å
433	R	72	Confident	83.4	Confident	55 Å²	55	20.9 Å²	20.9	21%	0.208	12%	0.117	C	C	.	.	G	3₁₀ helix	trans	-85.7	149.2	-175.2	-64.8	-173.2	178.6	-176	-0.5	112.7	D405 G429 T431 G435 N436	D405-R433 IonicContact OD1-NH1 3.31Å; D405-R433 PolarHBondContact OD1-NH1 3Å; G429-R433 PolarHBondContact O-NE 2.87Å; G429-R433 PolarHBondContact O-NH2 2.82Å; T431-R433 VanDerWaalsContact C-N 3.32Å; T431-R433 PolarHBondContact O-N 2.84Å; R433-G435 PolarHBondContact O-N 2.78Å; R433-N436 WeakPolarHBondContact O-CB 3.25Å; R433-N436 PolarHBondContact O-N 3.44Å; R433-N436 PolarHBondContact O-ND2 2.87Å; R433-N436 VanDerWaalsContact O-ND2 3.16Å
434	V	64.4	Low	84	Confident	46 Å²	46	19.7 Å²	19.7	28%	0.279	11%	0.112	S	C	.	.	G	3₁₀ helix	trans	56	33.1	177.1	-157.1	0	0	0	0	111.9	G76 F79 Y82 N436	G76-V434 CarbonylContact C-O 3.37Å; G76-V434 WeakPolarHBondContact CA-O 3.29Å; F79-V434 HydrophobicContact CD2-CG1 4.29Å; Y82-V434 WeakPolarHBondContact OH-CA 3.35Å; Y82-V434 PolarHBondContact OH-N 3.03Å; V434-N436 VanDerWaalsContact C-N 3.26Å; V434-N436 PolarHBondContact O-N 3.41Å
435	G	64.4	Low	84.3	Confident	1 Å²	1	19.6 Å²	19.6	1%	0.01	11%	0.112	C	C	.	.	G	3₁₀ helix	trans	78.7	4.7	177	0	0	0	0	0	114.8	N78 Y82 R433	N78-G435 PolarHBondContact ND2-O 3.19Å; Y82-G435 VanDerWaalsContact CE2-N 3.31Å; Y82-G435 PolarHBondContact OH-N 3.34Å; R433-G435 PolarHBondContact O-N 2.78Å
436	N	73.7	Confident	84.5	Confident	52 Å²	52	23.6 Å²	23.6	28%	0.278	13%	0.129	S	C	.	.			trans	-70.5	145.8	165.5	-65.2	-53.1	0	0	0	109.8	G432 R433 V434	G432-N436 CarbonylContact C-O 3.51Å; G432-N436 VanDerWaalsContact CA-O 3.23Å; G432-N436 WeakPolarHBondContact CA-O 3.33Å; R433-N436 WeakPolarHBondContact O-CB 3.25Å; R433-N436 PolarHBondContact O-N 3.44Å; R433-N436 PolarHBondContact O-ND2 2.87Å; R433-N436 VanDerWaalsContact O-ND2 3.16Å; V434-N436 VanDerWaalsContact C-N 3.26Å; V434-N436 PolarHBondContact O-N 3.41Å
437	V	83.6	Confident	85	Confident	101 Å²	101	29 Å²	29	61%	0.612	15%	0.152	S	C	*	.			trans	-76.6	132.1	171.5	-178.1	0	0	0	0	109	N313	N313-V437 WeakPolarHBondContact O-CA 3.16Å
438	G	87.5	Confident	85.2	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.021	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	151.2	175.8	0	0	0	0	0	112.3	N313 I314 T315 T431	N313-G438 PolarHBondContact O-N 3.28Å; I314-G438 CarbonylContact C-O 3.55Å; I314-G438 WeakPolarHBondContact CA-O 3.09Å; T315-G438 PolarHBondContact N-O 2.96Å; T431-G438 WeakPolarHBondContact OG1-CA 3.24Å
439	L	92.5	Very high	85.2	Confident	49 Å²	49	34.8 Å²	34.8	26%	0.257	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	129.5	169.4	-179.1	63.9	0	0	0	109.1	T315 K317 K410 H411 V412	T315-L439 HydrophobicContact CG2-CD1 4.19Å; K317-L439 HydrophobicContact CD-CD1 4.18Å; K317-L439 HydrophobicContact CG-CD1 4.25Å; K410-L439 PolarHBondContact O-N 3.3Å; H411-L439 CarbonylContact C-O 3.49Å; H411-L439 VanDerWaalsContact CA-O 3.28Å; H411-L439 WeakPolarHBondContact CA-O 3.44Å; H411-L439 PolarHBondContact CD2-O 3.48Å; H411-L439 WeakPolarHBondContact NE2-CD2 3.16Å; V412-L439 PolarHBondContact N-O 3.46Å
440	A	93.9	Very high	85.5	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	123.4	169.2	0	0	0	0	0	109	I314 T315 Q316 K317 V412 I428	I314-A440 HydrophobicContact CG2-CB 3.69Å; T315-A440 PolarHBondContact O-N 2.94Å; Q316-A440 CarbonylContact C-O 3.59Å; Q316-A440 WeakPolarHBondContact CA-O 3.37Å; K317-A440 PolarHBondContact N-O 3.45Å; V412-A440 CarbonylContact O-C 3.52Å; V412-A440 VanDerWaalsContact O-CA 3.29Å; V412-A440 WeakPolarHBondContact O-CA 3.49Å; I428-A440 HydrophobicContact CB-CB 3.89Å; I428-A440 HydrophobicContact CG2-CB 3.64Å
441	T	95.8	Very high	85.8	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.9	174.5	-55.7	0	0	0	0	109.5	K317 I319 L333 H411 V412 I413 N414 F443	K317-T441 HydrophobicContact CB-CG2 4.38Å; K317-T441 CarbonylContact O-C 3.54Å; K317-T441 WeakPolarHBondContact O-CA 3.29Å; I319-T441 HydrophobicContact CD1-CG2 3.68Å; I319-T441 HydrophobicContact CG1-CG2 4.26Å; L333-T441 HydrophobicContact CD1-CG2 3.79Å; L333-T441 HydrophobicContact CD2-CG2 4.46Å; H411-T441 WeakPolarHBondContact NE2-CB 3.39Å; H411-T441 PolarHBondContact NE2-OG1 2.94Å; V412-T441 PolarHBondContact O-N 3.33Å; I413-T441 CarbonylContact C-O 3.57Å; I413-T441 VanDerWaalsContact CA-O 3.26Å; I413-T441 WeakPolarHBondContact CA-O 2.97Å; N414-T441 PolarHBondContact N-O 3.11Å; T441-F443 HydrophobicContact CG2-CE1 4.44Å
442	S	96.4	Very high	86.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	131.5	-177.8	-45	0	0	0	0	111.9	K317 I319 N414 Y424	K317-S442 PolarHBondContact O-N 3.3Å; I319-S442 PolarHBondContact N-O 2.84Å; N414-S442 PolarHBondContact ND2-OG 2.94Å; Y424-S442 WeakPolarHBondContact CE2-OG 3.45Å
443	F	96.8	Very high	86.6	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.2	174.8	-62.7	-18.8	0	0	0	109.4	V321 K326 F329 L330 L333 I413 N414 Y415 L417 T441	V321-F443 HydrophobicContact CB-CB 4.19Å; V321-F443 HydrophobicContact CB-CD1 4.38Å; V321-F443 HydrophobicContact CB-CG 4.22Å; V321-F443 HydrophobicContact CG2-CB 4.31Å; V321-F443 HydrophobicContact CG2-CD1 3.68Å; V321-F443 HydrophobicContact CG2-CE1 4.17Å; V321-F443 HydrophobicContact CG2-CG 4.03Å; K326-F443 HydrophobicContact CB-CD2 4.07Å; K326-F443 HydrophobicContact CB-CE2 4.29Å; K326-F443 HydrophobicContact CD-CD2 4.28Å; K326-F443 HydrophobicContact CG-CD2 3.86Å; F329-F443 HydrophobicContact CB-CE1 4.17Å; F329-F443 HydrophobicContact CB-CE2 4.44Å; F329-F443 HydrophobicContact CB-CZ 3.81Å; L330-F443 HydrophobicContact CB-CE2 4.34Å; L330-F443 HydrophobicContact CB-CZ 4.5Å; L333-F443 HydrophobicContact CD1-CE1 3.72Å; L333-F443 HydrophobicContact CD1-CZ 3.75Å; I413-F443 HydrophobicContact CG2-CZ 4.44Å; N414-F443 PolarHBondContact O-N 3.02Å; Y415-F443 HydrophobicContact CD2-CD2 4.08Å; Y415-F443 AromaticContact CD2-CE2 3.85Å; Y415-F443 HydrophobicContact CD2-CE2 3.85Å; Y415-F443 HydrophobicContact CE2-CE2 4.34Å; Y415-F443 HydrophobicContact CG-CD2 4.36Å; L417-F443 WeakPolarHBondContact CD1-O 3.28Å; L417-F443 WeakPolarHBondContact CG-O 3.33Å; T441-F443 HydrophobicContact CG2-CE1 4.44Å
444	F	95.9	Very high	87.4	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	138.4	179.5	-166.5	-76.3	0	0	0	110	I319 W320 V321 L417 N448 A452 L455 W469 L470 L473	I319-F444 PolarHBondContact O-N 2.99Å; W320-F444 CarbonylContact C-O 3.6Å; W320-F444 WeakPolarHBondContact CA-O 3.39Å; W320-F444 AromaticContact CE3-CD1 3.79Å; W320-F444 HydrophobicContact CE3-CD1 3.79Å; W320-F444 HydrophobicContact CE3-CE1 4.41Å; W320-F444 AromaticContact CZ3-CD1 3.62Å; W320-F444 HydrophobicContact CZ3-CD1 3.62Å; W320-F444 AromaticContact CZ3-CE1 3.79Å; W320-F444 HydrophobicContact CZ3-CE1 3.79Å; V321-F444 PolarHBondContact N-O 3Å; L417-F444 HydrophobicContact CD1-CB 3.99Å; L417-F444 HydrophobicContact CD1-CD2 3.42Å; L417-F444 VanDerWaalsContact CD1-CD2 3.42Å; L417-F444 HydrophobicContact CD1-CE2 4.24Å; L417-F444 HydrophobicContact CD1-CG 4.06Å; F444-N448 HydrophobicContact CD2-CB 3.97Å; F444-N448 HydrophobicContact CE1-CB 4.27Å; F444-N448 HydrophobicContact CE2-CB 3.69Å; F444-N448 WeakPolarHBondContact CE2-O 3.46Å; F444-N448 HydrophobicContact CG-CB 4.37Å; F444-N448 HydrophobicContact CZ-CB 3.84Å; F444-N448 VanDerWaalsContact CZ-O 3.3Å; F444-N448 WeakPolarHBondContact CZ-O 3.18Å; F444-A452 HydrophobicContact CE2-CB 4.44Å; F444-A452 HydrophobicContact CZ-CB 4.01Å; F444-L455 HydrophobicContact CD2-CD2 4.19Å; F444-L455 HydrophobicContact CE2-CD2 4.33Å; F444-W469 HydrophobicContact CB-CH2 3.51Å; F444-W469 HydrophobicContact CB-CZ2 4.41Å; F444-W469 HydrophobicContact CB-CZ3 4.01Å; F444-W469 HydrophobicContact CD1-CE3 4.24Å; F444-W469 AromaticContact CD1-CH2 3.79Å; F444-W469 HydrophobicContact CD1-CH2 3.79Å; F444-W469 AromaticContact CD1-CZ3 3.32Å; F444-W469 HydrophobicContact CD1-CZ3 3.32Å; F444-W469 HydrophobicContact CD2-CH2 4.07Å; F444-W469 HydrophobicContact CD2-CZ3 4.04Å; F444-W469 HydrophobicContact CE1-CE3 4.5Å; F444-W469 AromaticContact CE1-CZ3 3.75Å; F444-W469 HydrophobicContact CE1-CZ3 3.75Å; F444-W469 HydrophobicContact CE2-CZ3 4.39Å; F444-W469 AromaticContact CG-CH2 3.51Å; F444-W469 HydrophobicContact CG-CH2 3.51Å; F444-W469 AromaticContact CG-CZ3 3.51Å; F444-W469 HydrophobicContact CG-CZ3 3.51Å; F444-W469 HydrophobicContact CZ-CZ3 4.27Å; F444-L470 HydrophobicContact CE2-CD1 4.08Å; F444-L470 HydrophobicContact CZ-CD1 4.26Å; F444-L473 HydrophobicContact CE1-CD1 3.76Å; F444-L473 HydrophobicContact CZ-CD1 4.22Å
445	N	92.4	Very high	88.6	Confident	3 Å²	3	36.9 Å²	36.9	2%	0.016	18%	0.177	C	C	.	.			trans	-145	-174.5	170.4	67.9	34	0	0	0	112	V321 E323 K447 N448	V321-N445 WeakPolarHBondContact O-CB 3.19Å; E323-N445 VanDerWaalsContact CD-ND2 3.32Å; E323-N445 PolarHBondContact OE1-ND2 3.23Å; N445-K447 PolarHBondContact O-N 3.02Å; N445-K447 VanDerWaalsContact OD1-CB 3.22Å; N445-K447 WeakPolarHBondContact OD1-CB 3.39Å; N445-K447 PolarHBondContact OD1-N 3.24Å; N445-N448 PolarHBondContact N-OD1 2.69Å; N445-N448 VanDerWaalsContact N-OD1 3.09Å; N445-N448 PolarHBondContact O-N 2.8Å; N445-N448 PolarHBondContact OD1-OD1 2.67Å
446	H	88.8	Confident	89.8	Confident	94 Å²	94	37.2 Å²	37.2	44%	0.435	18%	0.179	S	C	.	.	G	3₁₀ helix	trans	-53.5	-26.2	179.7	-66.3	94.2	0	0	0	115.1	W320 E322 N448 R449	W320-H446 AromaticContact CZ2-CE1 3.38Å; W320-H446 WeakPolarHBondContact CZ2-CE1 3.32Å; W320-H446 AromaticContact CZ2-CG 3.97Å; W320-H446 AromaticContact CZ2-ND1 3.47Å; W320-H446 WeakPolarHBondContact CZ2-ND1 3.43Å; W320-H446 AromaticContact CZ2-NE2 3.77Å; E322-H446 IonicContact OE1-CE1 3.94Å; E322-H446 PolarHBondContact OE1-CE1 3.19Å; E322-H446 IonicContact OE1-ND1 3.97Å; E322-H446 PolarHBondContact OE1-ND1 2.89Å; E322-H446 IonicContact OE2-ND1 2.85Å; H446-N448 VanDerWaalsContact C-N 3.3Å; H446-N448 PolarHBondContact O-N 2.96Å; H446-R449 WeakPolarHBondContact O-CD 3.41Å; H446-R449 VanDerWaalsContact O-CG 3.3Å; H446-R449 WeakPolarHBondContact O-CG 3.4Å
447	K	88.9	Confident	90.4	Very high	143 Å²	143	39.6 Å²	39.6	62%	0.622	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	-73.7	-22.5	179	-58.5	178.5	-176.7	166.1	0	112.7	E323 N445 R449	E323-K447 VanDerWaalsContact CD-NZ 3.33Å; E323-K447 WeakPolarHBondContact OE1-CD 3.16Å; E323-K447 WeakPolarHBondContact OE1-CE 3.33Å; E323-K447 IonicContact OE1-NZ 2.78Å; E323-K447 PolarHBondContact OE1-NZ 2.74Å; N445-K447 PolarHBondContact O-N 3.02Å; N445-K447 VanDerWaalsContact OD1-CB 3.22Å; N445-K447 WeakPolarHBondContact OD1-CB 3.39Å; N445-K447 PolarHBondContact OD1-N 3.24Å; K447-R449 VanDerWaalsContact C-N 3.33Å; K447-R449 PolarHBondContact O-N 2.73Å
448	N	89.5	Confident	90.5	Very high	16 Å²	16	35.5 Å²	35.5	9%	0.086	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-92.9	13.9	-174.6	-49.3	114.8	0	0	0	113.2	L417 F444 N445 H446 N450 V451 A452	L417-N448 HydrophobicContact CB-CB 4.44Å; L417-N448 WeakPolarHBondContact CB-ND2 3.4Å; L417-N448 HydrophobicContact CD1-CB 4.11Å; F444-N448 HydrophobicContact CD2-CB 3.97Å; F444-N448 HydrophobicContact CE1-CB 4.27Å; F444-N448 HydrophobicContact CE2-CB 3.69Å; F444-N448 WeakPolarHBondContact CE2-O 3.46Å; F444-N448 HydrophobicContact CG-CB 4.37Å; F444-N448 HydrophobicContact CZ-CB 3.84Å; F444-N448 VanDerWaalsContact CZ-O 3.3Å; F444-N448 WeakPolarHBondContact CZ-O 3.18Å; N445-N448 PolarHBondContact N-OD1 2.69Å; N445-N448 VanDerWaalsContact N-OD1 3.09Å; N445-N448 PolarHBondContact O-N 2.8Å; N445-N448 PolarHBondContact OD1-OD1 2.67Å; H446-N448 VanDerWaalsContact C-N 3.3Å; H446-N448 PolarHBondContact O-N 2.96Å; N448-N450 PolarHBondContact O-N 2.79Å; N448-N450 VanDerWaalsContact O-N 3.15Å; N448-N450 PolarHBondContact O-OD1 3.17Å; N448-V451 HydrophobicContact CB-CG2 4.09Å; N448-V451 WeakPolarHBondContact O-CG2 3.37Å; N448-V451 PolarHBondContact O-N 3.24Å; N448-V451 VanDerWaalsContact O-N 3.16Å; N448-A452 PolarHBondContact O-N 2.95Å
449	R	87.4	Confident	90.5	Very high	116 Å²	116	35.5 Å²	35.5	44%	0.438	16%	0.163	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-26.7	179.9	-76.6	177.5	175.8	-157.3	-1.7	113.8	H446 K447 V451 A452 L473 N477	H446-R449 WeakPolarHBondContact O-CD 3.41Å; H446-R449 VanDerWaalsContact O-CG 3.3Å; H446-R449 WeakPolarHBondContact O-CG 3.4Å; K447-R449 VanDerWaalsContact C-N 3.33Å; K447-R449 PolarHBondContact O-N 2.73Å; R449-V451 VanDerWaalsContact C-N 3.35Å; R449-A452 WeakPolarHBondContact O-CB 3.39Å; R449-A452 PolarHBondContact O-N 3.06Å; R449-L473 HydrophobicContact CG-CD2 4.38Å; R449-N477 PolarHBondContact O-ND2 2.73Å
450	N	87.4	Confident	90.3	Very high	79 Å²	79	37.6 Å²	37.6	42%	0.422	18%	0.177	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-35.5	177.8	62.6	-35.3	0	0	0	113.1	S419 N448	S419-N450 PolarHBondContact O-ND2 3.45Å; N448-N450 PolarHBondContact O-N 2.79Å; N448-N450 VanDerWaalsContact O-N 3.15Å; N448-N450 PolarHBondContact O-OD1 3.17Å
451	V	89.7	Confident	89.7	Confident	6 Å²	6	41 Å²	41	4%	0.036	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-3	179.9	-64.4	0	0	0	0	113.3	S419 N448 R449 R453 D454 L455	S419-V451 VanDerWaalsContact C-CG1 3.43Å; S419-V451 WeakPolarHBondContact O-CG1 3.3Å; N448-V451 HydrophobicContact CB-CG2 4.09Å; N448-V451 WeakPolarHBondContact O-CG2 3.37Å; N448-V451 PolarHBondContact O-N 3.24Å; N448-V451 VanDerWaalsContact O-N 3.16Å; R449-V451 VanDerWaalsContact C-N 3.35Å; V451-R453 VanDerWaalsContact C-N 3.32Å; V451-R453 PolarHBondContact O-N 2.99Å; V451-D454 PolarHBondContact O-N 3.26Å; V451-L455 WeakPolarHBondContact O-CB 3.16Å; V451-L455 PolarHBondContact O-N 3.1Å
452	A	90.1	Very high	89	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-56.1	-43.6	-172.9	0	0	0	0	0	113.3	F444 N448 R449 A456 L470 L473	F444-A452 HydrophobicContact CE2-CB 4.44Å; F444-A452 HydrophobicContact CZ-CB 4.01Å; N448-A452 PolarHBondContact O-N 2.95Å; R449-A452 WeakPolarHBondContact O-CB 3.39Å; R449-A452 PolarHBondContact O-N 3.06Å; A452-A456 WeakPolarHBondContact O-CB 3.37Å; A452-A456 PolarHBondContact O-N 3.04Å; A452-L470 HydrophobicContact CB-CD1 3.84Å; A452-L470 WeakPolarHBondContact O-CD1 3.41Å; A452-L473 HydrophobicContact CB-CB 4.07Å
453	R	87.8	Confident	88.4	Confident	81 Å²	81	48.6 Å²	48.6	31%	0.306	24%	0.235	S	C	.	.	H	α-helix	trans	-67.8	-53.7	-179.7	178.9	-179	168.2	178	-3.2	111.7	V451 L455 A456 E457 A474	V451-R453 VanDerWaalsContact C-N 3.32Å; V451-R453 PolarHBondContact O-N 2.99Å; R453-L455 PolarHBondContact O-N 3.47Å; R453-A456 WeakPolarHBondContact O-CB 3.22Å; R453-A456 PolarHBondContact O-N 2.04Å; R453-A456 VanDerWaalsContact O-N 3.11Å; R453-E457 IonicContact CZ-OE1 2.77Å; R453-E457 IonicContact NE-OE1 2.66Å; R453-E457 PolarHBondContact NE-OE1 3.5Å; R453-E457 IonicContact NH2-OE1 3.5Å; R453-E457 PolarHBondContact NH2-OE1 3Å; R453-E457 PolarHBondContact O-N 3.16Å; R453-A474 HydrophobicContact CB-CB 4.44Å
454	D	88	Confident	87.9	Confident	30 Å²	30	50.4 Å²	50.4	16%	0.16	24%	0.243	C	C	.	.	H	α-helix	trans	-63	-36.1	-176.5	-57.7	-22.6	0	0	0	110.4	I421 V451 L458 R479	I421-D454 HydrophobicContact CB-CB 4.08Å; I421-D454 HydrophobicContact CD1-CB 4.39Å; I421-D454 HydrophobicContact CG1-CB 4.05Å; I421-D454 HydrophobicContact CG2-CB 4.26Å; V451-D454 PolarHBondContact O-N 3.26Å; D454-L458 WeakPolarHBondContact O-CB 3.44Å; D454-L458 PolarHBondContact O-N 3.13Å; D454-R479 IonicContact OD1-CZ 3.28Å; D454-R479 VanDerWaalsContact OD1-CZ 3.31Å; D454-R479 IonicContact OD1-NH1 2.66Å; D454-R479 PolarHBondContact OD1-NH1 3.42Å; D454-R479 IonicContact OD1-NH2 3.82Å; D454-R479 PolarHBondContact OD1-NH2 3.09Å; D454-R479 IonicContact OD2-CZ 2.73Å; D454-R479 IonicContact OD2-NH1 3.08Å; D454-R479 IonicContact OD2-NH2 3.26Å; D454-R479 PolarHBondContact OD2-NH2 3.19Å
455	L	90	Very high	87.5	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-68.3	-38	174.4	-173.5	61.3	0	0	0	113.1	L318 I421 Y424 F444 V451 R453 L458 I459 L470	L318-L455 HydrophobicContact CD1-CD2 3.72Å; L318-L455 HydrophobicContact CD1-CG 4.08Å; L318-L455 HydrophobicContact CD2-CD2 3.94Å; L318-L455 HydrophobicContact CG-CD2 4.49Å; I421-L455 HydrophobicContact CD1-CB 4.15Å; I421-L455 HydrophobicContact CD1-CD1 4.12Å; Y424-L455 HydrophobicContact CD1-CD1 3.93Å; Y424-L455 HydrophobicContact CD2-CD1 4.43Å; Y424-L455 HydrophobicContact CE1-CD1 3.53Å; Y424-L455 HydrophobicContact CE2-CD1 4.06Å; Y424-L455 HydrophobicContact CG-CD1 4.37Å; F444-L455 HydrophobicContact CD2-CD2 4.19Å; F444-L455 HydrophobicContact CE2-CD2 4.33Å; V451-L455 WeakPolarHBondContact O-CB 3.16Å; V451-L455 PolarHBondContact O-N 3.1Å; R453-L455 PolarHBondContact O-N 3.47Å; L455-L458 PolarHBondContact O-N 2.71Å; L455-I459 HydrophobicContact CD1-CD1 4.21Å; L455-I459 HydrophobicContact CD1-CG1 4.47Å; L455-I459 HydrophobicContact CG-CD1 4.04Å; L455-I459 WeakPolarHBondContact O-CB 3.37Å; L455-I459 VanDerWaalsContact O-CG1 3.28Å; L455-I459 WeakPolarHBondContact O-CG1 3.45Å; L455-I459 PolarHBondContact O-N 2.87Å; L455-L470 HydrophobicContact CD2-CD2 4.4Å; L455-L470 HydrophobicContact CG-CD2 4.27Å
456	A	89.9	Confident	87.3	Confident	8 Å²	8	59.9 Å²	59.9	7%	0.066	29%	0.294	C	S	.	.	H	α-helix	trans	-65.4	-44.1	175.6	0	0	0	0	0	111.5	A452 R453 L458 I459 V460 L466 L470 A474	A452-A456 WeakPolarHBondContact O-CB 3.37Å; A452-A456 PolarHBondContact O-N 3.04Å; R453-A456 WeakPolarHBondContact O-CB 3.22Å; R453-A456 PolarHBondContact O-N 2.04Å; R453-A456 VanDerWaalsContact O-N 3.11Å; A456-L458 VanDerWaalsContact C-N 3.33Å; A456-L458 PolarHBondContact O-N 3.35Å; A456-I459 PolarHBondContact O-N 3.21Å; A456-V460 WeakPolarHBondContact O-CG2 3.48Å; A456-V460 PolarHBondContact O-N 3.07Å; A456-V460 VanDerWaalsContact O-N 3.09Å; A456-L466 HydrophobicContact CB-CD1 4.01Å; A456-L470 HydrophobicContact CB-CD2 4.16Å; A456-L470 HydrophobicContact CB-CG 4.14Å; A456-A474 HydrophobicContact CB-CB 3.9Å
457	E	86.6	Confident	87.4	Confident	101 Å²	101	56.5 Å²	56.5	47%	0.472	28%	0.28	S	S	.	.	H	α-helix	trans	-59.1	-45.1	175.6	-69.6	176.4	-168.8	0	0	110.7	R453 E461	R453-E457 IonicContact CZ-OE1 2.77Å; R453-E457 IonicContact NE-OE1 2.66Å; R453-E457 PolarHBondContact NE-OE1 3.5Å; R453-E457 IonicContact NH2-OE1 3.5Å; R453-E457 PolarHBondContact NH2-OE1 3Å; R453-E457 PolarHBondContact O-N 3.16Å; E457-E461 WeakPolarHBondContact O-CB 3.25Å; E457-E461 PolarHBondContact O-N 3Å
458	L	86.1	Confident	87.5	Confident	16 Å²	16	54.9 Å²	54.9	8%	0.084	28%	0.278	C	S	.	.	H	α-helix	trans	-63.8	-42.2	177.5	-179.9	161.3	0	0	0	113.1	T310 I421 Y424 V425 D454 L455 A456 E461 A462	T310-L458 HydrophobicContact CG2-CD1 3.79Å; T310-L458 HydrophobicContact CG2-CD2 3.74Å; T310-L458 HydrophobicContact CG2-CG 3.92Å; I421-L458 HydrophobicContact CD1-CD1 3.95Å; I421-L458 HydrophobicContact CG1-CD1 4.01Å; Y424-L458 HydrophobicContact CD1-CD1 4Å; Y424-L458 HydrophobicContact CE1-CD1 4.13Å; Y424-L458 HydrophobicContact CE1-CD2 3.94Å; V425-L458 HydrophobicContact CG2-CD1 3.53Å; D454-L458 WeakPolarHBondContact O-CB 3.44Å; D454-L458 PolarHBondContact O-N 3.13Å; L455-L458 PolarHBondContact O-N 2.71Å; A456-L458 VanDerWaalsContact C-N 3.33Å; A456-L458 PolarHBondContact O-N 3.35Å; L458-E461 PolarHBondContact O-N 2.93Å; L458-A462 WeakPolarHBondContact O-CB 3.27Å; L458-A462 PolarHBondContact O-N 3.37Å
459	I	87.6	Confident	87.6	Confident	2 Å²	2	57.1 Å²	57.1	1%	0.01	29%	0.286	C	S	.	.	H	α-helix	trans	-66.7	-42.2	-179.3	-77.5	174.5	0	0	0	111.8	L318 L455 A456 E461 A462 N463 Q464 L466 L470	L318-I459 HydrophobicContact CD1-CD1 3.1Å; L318-I459 HydrophobicContact CD2-CD1 4.45Å; L318-I459 HydrophobicContact CG-CD1 3.63Å; L455-I459 HydrophobicContact CD1-CD1 4.21Å; L455-I459 HydrophobicContact CD1-CG1 4.47Å; L455-I459 HydrophobicContact CG-CD1 4.04Å; L455-I459 WeakPolarHBondContact O-CB 3.37Å; L455-I459 VanDerWaalsContact O-CG1 3.28Å; L455-I459 WeakPolarHBondContact O-CG1 3.45Å; L455-I459 PolarHBondContact O-N 2.87Å; A456-I459 PolarHBondContact O-N 3.21Å; I459-E461 VanDerWaalsContact C-N 3.32Å; I459-A462 PolarHBondContact O-N 3Å; I459-N463 PolarHBondContact O-N 3.26Å; I459-Q464 HydrophobicContact CG2-CB 3.93Å; I459-Q464 PolarHBondContact O-N 2.78Å; I459-L466 HydrophobicContact CB-CD1 4.3Å; I459-L466 HydrophobicContact CG2-CB 4.05Å; I459-L466 HydrophobicContact CG2-CD1 3.9Å; I459-L470 HydrophobicContact CD1-CD2 4.07Å
460	V	86.8	Confident	87.8	Confident	92 Å²	92	51.6 Å²	51.6	56%	0.558	27%	0.265	S	S	*	.	H	α-helix	trans	-63.5	-43	174.9	172.5	0	0	0	0	110.3	A456 A462 N463 L466	A456-V460 WeakPolarHBondContact O-CG2 3.48Å; A456-V460 PolarHBondContact O-N 3.07Å; A456-V460 VanDerWaalsContact O-N 3.09Å; V460-A462 VanDerWaalsContact C-N 3.34Å; V460-A462 PolarHBondContact O-N 2.97Å; V460-N463 PolarHBondContact O-N 3.32Å; V460-L466 HydrophobicContact CG2-CD2 3.95Å
461	E	82.2	Confident	87.9	Confident	73 Å²	73	51.4 Å²	51.4	34%	0.341	26%	0.261	S	S	.	.	H	α-helix	trans	-61.7	-41.1	176.3	178.3	172.1	158.2	0	0	112.7	R306 S309 E457 L458 I459 N463	R306-E461 VanDerWaalsContact CD-OE1 3.26Å; R306-E461 WeakPolarHBondContact CD-OE1 3.49Å; R306-E461 IonicContact CZ-OE1 3.62Å; R306-E461 IonicContact CZ-OE2 2.75Å; R306-E461 IonicContact NE-OE1 3.7Å; R306-E461 IonicContact NE-OE2 2.84Å; R306-E461 IonicContact NH1-OE1 3.81Å; R306-E461 PolarHBondContact NH1-OE1 3.3Å; R306-E461 VanDerWaalsContact NH1-OE1 3.11Å; R306-E461 IonicContact NH1-OE2 3.26Å; R306-E461 PolarHBondContact NH1-OE2 3.1Å; R306-E461 IonicContact NH2-OE2 3.5Å; R306-E461 PolarHBondContact NH2-OE2 3.31Å; S309-E461 VanDerWaalsContact CB-OE1 3.25Å; S309-E461 WeakPolarHBondContact CB-OE1 3.46Å; S309-E461 PolarHBondContact OG-OE1 3.47Å; E457-E461 WeakPolarHBondContact O-CB 3.25Å; E457-E461 PolarHBondContact O-N 3Å; L458-E461 PolarHBondContact O-N 2.93Å; I459-E461 VanDerWaalsContact C-N 3.32Å; E461-N463 PolarHBondContact O-N 3.39Å
462	A	80.4	Confident	87.9	Confident	8 Å²	8	58.8 Å²	58.8	7%	0.066	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.7	5.6	178.3	0	0	0	0	0	113.9	T310 L458 I459 V460 Q464	T310-A462 WeakPolarHBondContact OG1-CB 3.48Å; L458-A462 WeakPolarHBondContact O-CB 3.27Å; L458-A462 PolarHBondContact O-N 3.37Å; I459-A462 PolarHBondContact O-N 3Å; V460-A462 VanDerWaalsContact C-N 3.34Å; V460-A462 PolarHBondContact O-N 2.97Å; A462-Q464 HydrophobicContact CB-CG 3.84Å; A462-Q464 WeakPolarHBondContact O-CG 3.26Å; A462-Q464 PolarHBondContact O-N 3.17Å; A462-Q464 PolarHBondContact O-NE2 3.08Å
463	N	83.8	Confident	87.8	Confident	151 Å²	151	59.7 Å²	59.7	81%	0.807	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	41.8	-178.1	-155.1	25.2	0	0	0	112.9	I459 V460 E461	I459-N463 PolarHBondContact O-N 3.26Å; V460-N463 PolarHBondContact O-N 3.32Å; E461-N463 PolarHBondContact O-N 3.39Å
464	Q	86.3	Confident	87.6	Confident	39 Å²	39	56.8 Å²	56.8	18%	0.182	29%	0.287	C	S	.	.			trans	-101.6	159.8	179.2	-58.9	-61.8	-61.7	0	0	110.9	Q316 I459 A462 L466	Q316-Q464 HydrophobicContact CB-CG 4.05Å; Q316-Q464 HydrophobicContact CG-CG 4.16Å; I459-Q464 HydrophobicContact CG2-CB 3.93Å; I459-Q464 PolarHBondContact O-N 2.78Å; A462-Q464 HydrophobicContact CB-CG 3.84Å; A462-Q464 WeakPolarHBondContact O-CG 3.26Å; A462-Q464 PolarHBondContact O-N 3.17Å; A462-Q464 PolarHBondContact O-NE2 3.08Å; Q464-L466 PolarHBondContact O-N 2.66Å; Q464-L466 VanDerWaalsContact O-N 3.1Å
465	D	87.2	Confident	87.5	Confident	153 Å²	153	64.2 Å²	64.2	82%	0.818	31%	0.312	S	S	*	.			trans	-65.1	111	179.1	-66.9	-35.1	0	0	0	111	P467	D465-P467 WeakPolarHBondContact O-CD 3.38Å
466	L	89.3	Confident	86.9	Confident	48 Å²	48	70.6 Å²	70.6	25%	0.251	34%	0.342	S	S	.	.			trans	-82.7	118.7	176.2	-176.2	69.8	0	0	0	110.3	A456 I459 V460 Q464 L470 E471	A456-L466 HydrophobicContact CB-CD1 4.01Å; I459-L466 HydrophobicContact CB-CD1 4.3Å; I459-L466 HydrophobicContact CG2-CB 4.05Å; I459-L466 HydrophobicContact CG2-CD1 3.9Å; V460-L466 HydrophobicContact CG2-CD2 3.95Å; Q464-L466 PolarHBondContact O-N 2.66Å; Q464-L466 VanDerWaalsContact O-N 3.1Å; L466-L470 HydrophobicContact CD1-CB 4.34Å; L466-L470 HydrophobicContact CD1-CD2 3.74Å; L466-L470 HydrophobicContact CD1-CG 4.18Å; L466-E471 HydrophobicContact CD2-CB 3.89Å; L466-E471 HydrophobicContact CD2-CG 4.05Å; L466-E471 HydrophobicContact CG-CB 4.47Å
467	P	91.5	Very high	85.7	Confident	24 Å²	24	73.6 Å²	73.6	16%	0.156	36%	0.357	C	S	.	.			trans	-70.5	137.4	175.8	-17.5	31.4	0	0	0	112.3	L318 D465 W469 L470 E471	L318-P467 HydrophobicContact CB-CG 3.97Å; D465-P467 WeakPolarHBondContact O-CD 3.38Å; P467-W469 HydrophobicContact CB-CD2 4.15Å; P467-W469 HydrophobicContact CB-CG 4.23Å; P467-W469 HydrophobicContact CB-CZ2 3.93Å; P467-W469 HydrophobicContact CG-CZ2 3.89Å; P467-W469 PolarHBondContact O-N 2.94Å; P467-W469 VanDerWaalsContact O-N 3.07Å; P467-L470 WeakPolarHBondContact O-CB 3.19Å; P467-L470 PolarHBondContact O-N 3.02Å; P467-E471 PolarHBondContact O-N 2.77Å
468	D	90.9	Very high	84.2	Confident	108 Å²	108	73.5 Å²	73.5	58%	0.578	37%	0.365	S	S	*	.	H	α-helix	trans	-50.3	-38	179.5	-65.3	-7.5	0	0	0	113.9	L470 E471 R472	D468-L470 VanDerWaalsContact C-N 3.33Å; D468-E471 PolarHBondContact O-N 2.66Å; D468-R472 WeakPolarHBondContact O-CG 3.35Å; D468-R472 PolarHBondContact O-N 2.9Å; D468-R472 VanDerWaalsContact O-N 3.13Å
469	W	91.8	Very high	82.7	Confident	64 Å²	64	79.1 Å²	79.1	24%	0.242	39%	0.385	C	S	.	.	H	α-helix	trans	-68.9	-32.2	-179.4	58.2	-99.9	0	0	0	112.2	L318 W320 F444 P467 L473	L318-W469 HydrophobicContact CB-CH2 4.21Å; L318-W469 HydrophobicContact CB-CZ2 4.05Å; L318-W469 HydrophobicContact CD1-CH2 4.35Å; W320-W469 AromaticContact CE3-CD2 3.9Å; W320-W469 HydrophobicContact CE3-CD2 3.9Å; W320-W469 AromaticContact CE3-CE3 3.57Å; W320-W469 HydrophobicContact CE3-CE3 3.57Å; W320-W469 HydrophobicContact CE3-CH2 4.43Å; W320-W469 AromaticContact CE3-CZ3 3.87Å; W320-W469 HydrophobicContact CE3-CZ3 3.87Å; W320-W469 HydrophobicContact CZ3-CD2 4.49Å; W320-W469 AromaticContact CZ3-CE3 3.81Å; W320-W469 HydrophobicContact CZ3-CE3 3.81Å; W320-W469 HydrophobicContact CZ3-CZ3 4.14Å; F444-W469 HydrophobicContact CB-CH2 3.51Å; F444-W469 HydrophobicContact CB-CZ2 4.41Å; F444-W469 HydrophobicContact CB-CZ3 4.01Å; F444-W469 HydrophobicContact CD1-CE3 4.24Å; F444-W469 AromaticContact CD1-CH2 3.79Å; F444-W469 HydrophobicContact CD1-CH2 3.79Å; F444-W469 AromaticContact CD1-CZ3 3.32Å; F444-W469 HydrophobicContact CD1-CZ3 3.32Å; F444-W469 HydrophobicContact CD2-CH2 4.07Å; F444-W469 HydrophobicContact CD2-CZ3 4.04Å; F444-W469 HydrophobicContact CE1-CE3 4.5Å; F444-W469 AromaticContact CE1-CZ3 3.75Å; F444-W469 HydrophobicContact CE1-CZ3 3.75Å; F444-W469 HydrophobicContact CE2-CZ3 4.39Å; F444-W469 AromaticContact CG-CH2 3.51Å; F444-W469 HydrophobicContact CG-CH2 3.51Å; F444-W469 AromaticContact CG-CZ3 3.51Å; F444-W469 HydrophobicContact CG-CZ3 3.51Å; F444-W469 HydrophobicContact CZ-CZ3 4.27Å; P467-W469 HydrophobicContact CB-CD2 4.15Å; P467-W469 HydrophobicContact CB-CG 4.23Å; P467-W469 HydrophobicContact CB-CZ2 3.93Å; P467-W469 HydrophobicContact CG-CZ2 3.89Å; P467-W469 PolarHBondContact O-N 2.94Å; P467-W469 VanDerWaalsContact O-N 3.07Å; W469-L473 HydrophobicContact CE3-CD1 4.15Å; W469-L473 WeakPolarHBondContact O-CG 3.32Å; W469-L473 PolarHBondContact O-N 2.84Å; W469-L473 VanDerWaalsContact O-N 3.15Å
470	L	90.7	Very high	80.7	Confident	0 Å²	0	85.6 Å²	85.6	0%	0	43%	0.425	C	S	.	.	H	α-helix	trans	-73.6	-41	177.5	-178.1	63.4	0	0	0	110.2	L318 F444 A452 L455 A456 I459 L466 P467 D468 R472 L473 A474	L318-L470 HydrophobicContact CD1-CD2 3.35Å; F444-L470 HydrophobicContact CE2-CD1 4.08Å; F444-L470 HydrophobicContact CZ-CD1 4.26Å; A452-L470 HydrophobicContact CB-CD1 3.84Å; A452-L470 WeakPolarHBondContact O-CD1 3.41Å; L455-L470 HydrophobicContact CD2-CD2 4.4Å; L455-L470 HydrophobicContact CG-CD2 4.27Å; A456-L470 HydrophobicContact CB-CD2 4.16Å; A456-L470 HydrophobicContact CB-CG 4.14Å; I459-L470 HydrophobicContact CD1-CD2 4.07Å; L466-L470 HydrophobicContact CD1-CB 4.34Å; L466-L470 HydrophobicContact CD1-CD2 3.74Å; L466-L470 HydrophobicContact CD1-CG 4.18Å; P467-L470 WeakPolarHBondContact O-CB 3.19Å; P467-L470 PolarHBondContact O-N 3.02Å; D468-L470 VanDerWaalsContact C-N 3.33Å; L470-R472 VanDerWaalsContact C-N 3.29Å; L470-R472 PolarHBondContact O-N 3.26Å; L470-L473 PolarHBondContact O-N 3.48Å; L470-A474 WeakPolarHBondContact O-CB 3.5Å; L470-A474 PolarHBondContact O-N 3.26Å
471	E	89.5	Confident	78.3	Confident	75 Å²	75	89.5 Å²	89.5	35%	0.35	44%	0.437	S	S	.	.	H	α-helix	trans	-58.4	-42.6	175.5	-166	-172.8	174.2	0	0	111.5	L466 P467 D468 A474 R475	L466-E471 HydrophobicContact CD2-CB 3.89Å; L466-E471 HydrophobicContact CD2-CG 4.05Å; L466-E471 HydrophobicContact CG-CB 4.47Å; P467-E471 PolarHBondContact O-N 2.77Å; D468-E471 PolarHBondContact O-N 2.66Å; E471-A474 PolarHBondContact O-N 3.31Å; E471-R475 WeakPolarHBondContact O-CG 3.1Å; E471-R475 PolarHBondContact O-N 3.15Å; E471-R475 IonicContact OE1-CZ 3.68Å; E471-R475 IonicContact OE1-NE 2.71Å; E471-R475 IonicContact OE1-NH2 2.81Å; E471-R475 PolarHBondContact OE1-NH2 3.5Å
472	R	89.7	Confident	76.1	Confident	161 Å²	161	90.3 Å²	90.3	61%	0.608	45%	0.448	S	S	*	.	H	α-helix	trans	-62.2	-47.5	175.2	-69.2	173.4	-163	176.1	6.8	111.9	D468 L470 A474 R475 E476	D468-R472 WeakPolarHBondContact O-CG 3.35Å; D468-R472 PolarHBondContact O-N 2.9Å; D468-R472 VanDerWaalsContact O-N 3.13Å; L470-R472 VanDerWaalsContact C-N 3.29Å; L470-R472 PolarHBondContact O-N 3.26Å; R472-A474 VanDerWaalsContact C-N 3.33Å; R472-A474 PolarHBondContact O-N 2.78Å; R472-R475 PolarHBondContact O-N 3.36Å; R472-E476 WeakPolarHBondContact O-CG 3.3Å; R472-E476 PolarHBondContact O-N 3.42Å
473	L	87.6	Confident	73.8	Confident	19 Å²	19	99.8 Å²	99.8	10%	0.099	49%	0.489	C	S	.	.	H	α-helix	trans	-63.5	-36.5	178.8	-73.8	175	0	0	0	113	W320 F444 R449 A452 W469 L470 R475 E476 N477	W320-L473 HydrophobicContact CH2-CD1 4.34Å; W320-L473 HydrophobicContact CZ3-CD1 3.81Å; F444-L473 HydrophobicContact CE1-CD1 3.76Å; F444-L473 HydrophobicContact CZ-CD1 4.22Å; R449-L473 HydrophobicContact CG-CD2 4.38Å; A452-L473 HydrophobicContact CB-CB 4.07Å; W469-L473 HydrophobicContact CE3-CD1 4.15Å; W469-L473 WeakPolarHBondContact O-CG 3.32Å; W469-L473 PolarHBondContact O-N 2.84Å; W469-L473 VanDerWaalsContact O-N 3.15Å; L470-L473 PolarHBondContact O-N 3.48Å; L473-R475 VanDerWaalsContact C-N 3.32Å; L473-R475 PolarHBondContact O-N 2.97Å; L473-E476 PolarHBondContact O-N 2.95Å; L473-N477 PolarHBondContact O-N 2.83Å
474	A	84.9	Confident	71.6	Confident	20 Å²	20	96.1 Å²	96.1	17%	0.165	49%	0.486	C	S	.	.	H	α-helix	trans	-64.5	-37	176	0	0	0	0	0	111.9	R453 A456 L470 E471 R472	R453-A474 HydrophobicContact CB-CB 4.44Å; A456-A474 HydrophobicContact CB-CB 3.9Å; L470-A474 WeakPolarHBondContact O-CB 3.5Å; L470-A474 PolarHBondContact O-N 3.26Å; E471-A474 PolarHBondContact O-N 3.31Å; R472-A474 VanDerWaalsContact C-N 3.33Å; R472-A474 PolarHBondContact O-N 2.78Å
475	R	83.9	Confident	69.2	Low	185 Å²	185	99 Å²	99	70%	0.698	51%	0.511	S	S	*	.	H	α-helix	trans	-72.7	-34.2	175.8	-68.3	176.1	-176	-159.9	3.3	112.9	E471 R472 L473 N477	E471-R475 WeakPolarHBondContact O-CG 3.1Å; E471-R475 PolarHBondContact O-N 3.15Å; E471-R475 IonicContact OE1-CZ 3.68Å; E471-R475 IonicContact OE1-NE 2.71Å; E471-R475 IonicContact OE1-NH2 2.81Å; E471-R475 PolarHBondContact OE1-NH2 3.5Å; R472-R475 PolarHBondContact O-N 3.36Å; L473-R475 VanDerWaalsContact C-N 3.32Å; L473-R475 PolarHBondContact O-N 2.97Å; R475-N477 PolarHBondContact O-N 3.06Å
476	E	78.3	Confident	66.9	Low	136 Å²	136	97.8 Å²	97.8	64%	0.636	50%	0.504	S	S	*	.	H	α-helix	trans	-70.8	-16	178.2	-75.6	177.2	-172.8	0	0	113.7	R472 L473 P478	R472-E476 WeakPolarHBondContact O-CG 3.3Å; R472-E476 PolarHBondContact O-N 3.42Å; L473-E476 PolarHBondContact O-N 2.95Å; E476-P478 WeakPolarHBondContact O-CD 3.07Å
477	N	65.3	Low	64.6	Low	70 Å²	70	103.5 Å²	103.5	37%	0.374	53%	0.527	S	S	.	.			trans	-111.3	67.4	-177.4	-149.9	-1.9	0	0	0	111.8	R449 L473 R475 R479	R449-N477 PolarHBondContact O-ND2 2.73Å; L473-N477 PolarHBondContact O-N 2.83Å; R475-N477 PolarHBondContact O-N 3.06Å; N477-R479 PolarHBondContact O-N 3.36Å; N477-R479 VanDerWaalsContact O-N 3.13Å
478	P	54.2	Low	62.3	Low	99 Å²	99	104.3 Å²	104.3	64%	0.643	54%	0.54	S	S	*	.			trans	-68.7	111.9	175.9	27.7	-31.3	0	0	0	109.3	E476 V480	E476-P478 WeakPolarHBondContact O-CD 3.07Å; P478-V480 PolarHBondContact O-N 2.82Å; P478-V480 VanDerWaalsContact O-N 3.14Å
479	R	55	Low	60.5	Low	135 Å²	135	100.8 Å²	100.8	51%	0.509	53%	0.529	S	S	.	.			trans	-59.6	120	163.3	-73.4	-178	168.4	148	-1.6	107.3	D454 N477 Q481	D454-R479 IonicContact OD1-CZ 3.28Å; D454-R479 VanDerWaalsContact OD1-CZ 3.31Å; D454-R479 IonicContact OD1-NH1 2.66Å; D454-R479 PolarHBondContact OD1-NH1 3.42Å; D454-R479 IonicContact OD1-NH2 3.82Å; D454-R479 PolarHBondContact OD1-NH2 3.09Å; D454-R479 IonicContact OD2-CZ 2.73Å; D454-R479 IonicContact OD2-NH1 3.08Å; D454-R479 IonicContact OD2-NH2 3.26Å; D454-R479 PolarHBondContact OD2-NH2 3.19Å; N477-R479 PolarHBondContact O-N 3.36Å; N477-R479 VanDerWaalsContact O-N 3.13Å; R479-Q481 PolarHBondContact O-N 3.38Å; R479-Q481 VanDerWaalsContact O-N 3.13Å
480	V	45.4	Very low	58.6	Low	138 Å²	138	106.8 Å²	106.8	84%	0.836	55%	0.552	S	S	*	*			trans	-49.2	118.5	160.9	176.7	0	0	0	0	106.4	P478 P482	P478-V480 PolarHBondContact O-N 2.82Å; P478-V480 VanDerWaalsContact O-N 3.14Å; V480-P482 WeakPolarHBondContact O-CD 3.39Å; V480-P482 VanDerWaalsContact O-N 3.16Å
481	Q	36	Very low	56.9	Low	173 Å²	173	107.5 Å²	107.5	81%	0.808	56%	0.556	S	S	*	*			trans	-43	119.3	-176.3	-71.9	-175.1	1.3	0	0	111.7	R479	R479-Q481 PolarHBondContact O-N 3.38Å; R479-Q481 VanDerWaalsContact O-N 3.13Å
482	P	36.3	Very low	55.5	Low	90 Å²	90	107.1 Å²	107.1	58%	0.584	55%	0.553	S	S	*	*			trans	-90	123.5	150.8	4.1	17.2	0	0	0	106.9	V480 G484	V480-P482 WeakPolarHBondContact O-CD 3.39Å; V480-P482 VanDerWaalsContact O-N 3.16Å; P482-G484 PolarHBondContact O-N 3.13Å; P482-G484 VanDerWaalsContact O-N 3.16Å
483	F	33.3	Very low	54.4	Low	208 Å²	208	102.5 Å²	102.5	91%	0.912	54%	0.536	S	S	*	.	S	Bend	trans	-38.6	117.3	166.9	-92.7	-113.1	0	0	0	111.5
484	G	36.6	Very low	52.8	Low	74 Å²	74	107.1 Å²	107.1	76%	0.763	56%	0.56	S	S	*	*			trans	89.1	54.5	160	0	0	0	0	0	118.2	P482 N486	P482-G484 PolarHBondContact O-N 3.13Å; P482-G484 VanDerWaalsContact O-N 3.16Å; G484-N486 PolarHBondContact O-N 3.35Å
485	S	35.9	Very low	51.3	Low	99 Å²	99	112.7 Å²	112.7	69%	0.692	58%	0.583	S	S	*	*			trans	-89.9	72.2	171	40.9	0	0	0	0	112.3	F487	S485-F487 PolarHBondContact O-N 2.9Å
486	N	39	Very low	49.7	Very low	128 Å²	128	114.3 Å²	114.3	68%	0.684	59%	0.59	S	S	*	*			trans	-78.6	65.1	161.8	-95.5	59.5	0	0	0	109.6	G484 G488	G484-N486 PolarHBondContact O-N 3.35Å; N486-G488 PolarHBondContact O-N 3.44Å
487	F	40.8	Very low	48.3	Very low	168 Å²	168	117.7 Å²	117.7	74%	0.737	60%	0.597	S	S	*	*			trans	-70	81.3	177.6	-152	-94.9	0	0	0	109.4	S485	S485-F487 PolarHBondContact O-N 2.9Å
488	G	43.4	Very low	47.3	Very low	41 Å²	41	119.6 Å²	119.6	42%	0.423	62%	0.616	S	S	.	*	S	Bend	trans	179.4	87	-176.6	0	0	0	0	0	110.1	N486 R490	N486-G488 PolarHBondContact O-N 3.44Å; G488-R490 PolarHBondContact O-N 3.03Å
489	G	52.8	Low	46.6	Very low	34 Å²	34	118.6 Å²	118.6	35%	0.351	62%	0.624	S	S	.	*			trans	42.6	19.6	147.5	0	0	0	0	0	121.1
490	R	52.6	Low	45.7	Very low	190 Å²	190	116 Å²	116	72%	0.717	64%	0.639	S	S	*	*			trans	-87.2	123.9	179.2	-81.5	-173.6	-179.5	171.2	0.4	111.1	G488 F492	G488-R490 PolarHBondContact O-N 3.03Å; R490-F492 PolarHBondContact O-N 3.27Å
491	D	55	Low	45.1	Very low	14 Å²	14	112.8 Å²	112.8	8%	0.075	63%	0.634	C	S	.	*			trans	-63.6	122.7	169	-172.7	-18.8	0	0	0	110.4	F301 R493 D494	F301-D491 HydrophobicContact CD1-CB 4.32Å; D491-R493 PolarHBondContact O-N 2.89Å; D491-R493 VanDerWaalsContact O-N 3.09Å; D491-R493 WeakPolarHBondContact OD1-CB 3.25Å; D491-R493 VanDerWaalsContact OD1-CG 3.24Å; D491-R493 WeakPolarHBondContact OD1-CG 3.34Å; D491-R493 PolarHBondContact OD1-N 3.48Å; D491-R493 IonicContact OD1-NE 3.69Å; D491-R493 PolarHBondContact OD1-NE 3.44Å; D491-R493 IonicContact OD2-CZ 3.11Å; D491-R493 IonicContact OD2-NE 3.81Å; D491-R493 PolarHBondContact OD2-NE 3.33Å; D491-R493 IonicContact OD2-NH2 3.58Å; D491-R493 PolarHBondContact OD2-NH2 2.78Å; D491-D494 PolarHBondContact O-N 2.84Å
492	F	58.8	Low	45.3	Very low	67 Å²	67	110.2 Å²	110.2	29%	0.294	64%	0.635	S	S	.	*	G	3₁₀ helix	trans	-63.7	-11.3	179.3	-75.1	-63.6	0	0	0	114.1	Q288 R490 D494 Q495	Q288-F492 HydrophobicContact CB-CD2 4.45Å; Q288-F492 VanDerWaalsContact CD-CE2 3.47Å; R490-F492 PolarHBondContact O-N 3.27Å; F492-D494 PolarHBondContact O-N 2.99Å; F492-D494 VanDerWaalsContact O-N 3.13Å; F492-Q495 PolarHBondContact O-N 2.66Å
493	R	66.6	Low	45.2	Very low	65 Å²	65	114.2 Å²	114.2	25%	0.245	65%	0.651	C	S	.	*	G	3₁₀ helix	trans	-58	-26	176.6	-71.9	-175.6	-69.6	172.4	1.4	113.2	P297 Y299 D491	P297-R493 PolarHBondContact O-NH1 3.13Å; Y299-R493 VanDerWaalsContact O-CZ 3.23Å; Y299-R493 PolarHBondContact O-NH1 3.05Å; Y299-R493 PolarHBondContact O-NH2 3.19Å; D491-R493 PolarHBondContact O-N 2.89Å; D491-R493 VanDerWaalsContact O-N 3.09Å; D491-R493 WeakPolarHBondContact OD1-CB 3.25Å; D491-R493 VanDerWaalsContact OD1-CG 3.24Å; D491-R493 WeakPolarHBondContact OD1-CG 3.34Å; D491-R493 PolarHBondContact OD1-N 3.48Å; D491-R493 IonicContact OD1-NE 3.69Å; D491-R493 PolarHBondContact OD1-NE 3.44Å; D491-R493 IonicContact OD2-CZ 3.11Å; D491-R493 IonicContact OD2-NE 3.81Å; D491-R493 PolarHBondContact OD2-NE 3.33Å; D491-R493 IonicContact OD2-NH2 3.58Å; D491-R493 PolarHBondContact OD2-NH2 2.78Å
494	D	55.7	Low	45.7	Very low	115 Å²	115	109.2 Å²	109.2	62%	0.615	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-79.4	-18.6	178	-75.4	-27.6	0	0	0	114.3	D491 F492 Y496 R497	D491-D494 PolarHBondContact O-N 2.84Å; F492-D494 PolarHBondContact O-N 2.99Å; F492-D494 VanDerWaalsContact O-N 3.13Å; D494-Y496 VanDerWaalsContact C-N 3.3Å; D494-Y496 PolarHBondContact O-N 3.44Å; D494-R497 PolarHBondContact O-N 3.45Å
495	Q	52.7	Low	45.7	Very low	137 Å²	137	112.4 Å²	112.4	64%	0.64	64%	0.642	S	S	*	*	G	3₁₀ helix	trans	-71.6	-22.7	-179.2	-78.7	-177.7	6.3	0	0	113.5	F492	F492-Q495 PolarHBondContact O-N 2.66Å
496	Y	50.2	Low	46	Very low	219 Å²	219	116.8 Å²	116.8	86%	0.859	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-90.9	-11.3	178.5	-79.5	-83.4	0	0	0	114.2	D494	D494-Y496 VanDerWaalsContact C-N 3.3Å; D494-Y496 PolarHBondContact O-N 3.44Å
497	R	48.2	Very low	45.9	Very low	207 Å²	207	121.6 Å²	121.6	78%	0.781	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	-14.6	-179.1	-112.1	-178.5	177.8	-179.9	-0.2	114.6	D494 G499	D494-R497 PolarHBondContact O-N 3.45Å; R497-G499 PolarHBondContact O-N 3.08Å
498	S	44.7	Very low	46	Very low	111 Å²	111	117.2 Å²	117.2	78%	0.776	66%	0.664	S	S	*	*			trans	-102	54.1	176.2	-173	0	0	0	0	112
499	G	39.7	Very low	45.6	Very low	78 Å²	78	119.1 Å²	119.1	80%	0.804	68%	0.684	S	S	*	*			trans	-114.9	55.8	174.5	0	0	0	0	0	111.4	R497	R497-G499 PolarHBondContact O-N 3.08Å
500	G	35.3	Very low	45.3	Very low	80 Å²	80	122.4 Å²	122.4	83%	0.825	71%	0.707	S	S	*	*			trans	-164.6	85.4	-178.4	0	0	0	0	0	111.4
501	G	34.4	Very low	44.8	Very low	71 Å²	71	119.8 Å²	119.8	73%	0.732	72%	0.715	S	S	*	*			trans	178.5	110.2	177	0	0	0	0	0	114.3
502	S	39.4	Very low	44.2	Very low	118 Å²	118	122.7 Å²	122.7	83%	0.825	75%	0.748	S	S	*	*			trans	68.8	78.1	155.9	-63.2	0	0	0	0	118.6	S504	S502-S504 PolarHBondContact O-N 2.97Å
503	N	34.5	Very low	43.2	Very low	174 Å²	174	131.5 Å²	131.5	93%	0.93	78%	0.779	S	S	*	*			trans	-85.7	87.1	154.3	-144.6	18	0	0	0	108.5
504	S	44.5	Very low	41.9	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	80%	0.803	S	S	*	*			trans	-89.2	114.1	174.4	54.1	0	0	0	0	110.6	S502 H506	S502-S504 PolarHBondContact O-N 2.97Å; S504-H506 PolarHBondContact O-N 2.82Å
505	N	36.7	Very low	41.1	Very low	141 Å²	141	130.1 Å²	130.1	75%	0.754	80%	0.8	S	S	*	*			trans	-21.3	119.9	165.5	-70.7	-28.1	0	0	0	115.4
506	H	40.4	Very low	40.4	Very low	190 Å²	190	133.3 Å²	133.3	88%	0.88	81%	0.808	S	S	*	*			trans	-135.5	105.5	147.5	-114.7	58.9	0	0	0	110.3	S504	S504-H506 PolarHBondContact O-N 2.82Å
507	Y	38.7	Very low	39.7	Very low	229 Å²	229	128.1 Å²	128.1	90%	0.898	80%	0.803	S	S	*	*			trans	-59.4	130.7	162.4	-94.9	-107.2	0	0	0	109.5
508	G	42.2	Very low	39.1	Very low	76 Å²	76	125.1 Å²	125.1	78%	0.784	81%	0.808	S	S	*	*			trans	-179.9	72.4	175.1	0	0	0	0	0	110.9
509	G	34.6	Very low	38.7	Very low	82 Å²	82	123.6 Å²	123.6	85%	0.845	81%	0.81	S	S	*	*			trans	-75.1	148.6	178.2	0	0	0	0	0	113.3
510	A	47.6	Very low	38.5	Very low	102 Å²	102	122.9 Å²	122.9	84%	0.843	80%	0.802	S	S	*	*			trans	-158.6	144.4	134.7	0	0	0	0	0	109.5
511	P	42.1	Very low	38.3	Very low	136 Å²	136	123.7 Å²	123.7	88%	0.883	80%	0.801	S	S	*	*			trans	-112.1	160.1	-159.3	38.7	-27	0	0	0	114.4
512	G	40.8	Very low	38.5	Very low	75 Å²	75	130.9 Å²	130.9	77%	0.773	81%	0.808	S	S	*	*			trans	130.6	144	162.5	0	0	0	0	0	112.7
513	R	39.3	Very low	38.2	Very low	251 Å²	251	134.7 Å²	134.7	95%	0.947	81%	0.813	S	S	*	*			cis	-174.6	131	3	-152.1	-173.3	-165.2	-155.4	4.6	106.9
514	G	38.2	Very low	38.4	Very low	71 Å²	71	131 Å²	131	73%	0.732	81%	0.806	S	S	*	*			trans	71.7	150.9	160.4	0	0	0	0	0	116.4
515	S	38.7	Very low	38.1	Very low	80 Å²	80	131.1 Å²	131.1	56%	0.559	81%	0.807	S	S	*	*			cis	-173.6	117.2	10.1	171.1	0	0	0	0	109.1
516	Y	37.6	Very low	37.9	Very low	205 Å²	205	133.7 Å²	133.7	80%	0.804	81%	0.814	S	S	*	*			trans	-0.1	133.1	146.4	35.8	-87.2	0	0	0	120.5
517	S	37	Very low	37.8	Very low	110 Å²	110	133.8 Å²	133.8	77%	0.769	82%	0.815	S	S	*	*				160.4	102.7	122.5	-164.6	0	0	0	0	109
518	V	35.2	Very low	37.4	Very low	143 Å²	143	134.9 Å²	134.9	87%	0.867	82%	0.818	S	S	*	*				44.2	116.9	82	-172	0	0	0	0	114.5
519	G	35.5	Very low	37.2	Very low	80 Å²	80	134.4 Å²	134.4	83%	0.825	81%	0.812	S	S	*	*			trans	142.3	121.7	152.1	0	0	0	0	0	115.3
520	G	35.3	Very low	37.1	Very low	63 Å²	63	136.5 Å²	136.5	65%	0.649	81%	0.811	S	S	*	*			trans	128.6	79	149.6	0	0	0	0	0	116.9
521	A	32.7	Very low	36.3	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	81%	0.812	S	S	*	*			trans	-71.5	139.9	161.4	0	0	0	0	0	111
522	Y	38	Very low	36	Very low	223 Å²	223	139.1 Å²	139.1	88%	0.875	81%	0.812	S	S	*	*			trans	-137.4	112.6	160.2	-65.5	-76.9	0	0	0	110.7
523	Q	33.6	Very low	35.5	Very low	198 Å²	198	147.7 Å²	147.7	93%	0.925	82%	0.821	S	S	*	*			trans	-62.5	139.5	161	-85.4	169.5	-28.7	0	0	111.5
524	A	38.3	Very low	35.1	Very low	95 Å²	95	139.2 Å²	139.2	79%	0.785	81%	0.812	S	S	*	*			trans	179.4	142.2	140.8	0	0	0	0	0	107.5
525	S	38	Very low	34.7	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	81%	0.811	S	S	*	*			cis	-166.5	130.2	-9.9	39.9	0	0	0	0	104.2	Q527	S525-Q527 PolarHBondContact O-N 2.9Å
526	Q	32.5	Very low	34.3	Very low	195 Å²	195	144.2 Å²	144.2	91%	0.911	82%	0.819	S	S	*	*			trans	-76.3	120.2	171.3	-74.9	177.9	14.3	0	0	108.6
527	Q	37.5	Very low	34.1	Very low	193 Å²	193	142.6 Å²	142.6	90%	0.902	82%	0.819	S	S	*	*			trans	-127.6	111.2	158.3	-87.1	-176.7	3.6	0	0	109.9	S525	S525-Q527 PolarHBondContact O-N 2.9Å
528	R	30.8	Very low	33.7	Very low	252 Å²	252	142.2 Å²	142.2	95%	0.951	81%	0.808	S	S	*	*			trans	-67	125.6	165.8	-76.2	176.8	167.5	-173.3	-3.9	109.1
529	G	37.2	Very low	33.7	Very low	65 Å²	65	143.8 Å²	143.8	67%	0.67	80%	0.799	S	S	*	*			trans	-116.3	145.2	163.1	0	0	0	0	0	110.2
530	P	34.1	Very low	33.8	Very low	127 Å²	127	146 Å²	146	83%	0.825	79%	0.786	S	S	*	*			trans	-79.6	147.4	-162.3	32.1	-33.7	0	0	0	113.2	Q532	P530-Q532 PolarHBondContact O-N 3.01Å
531	A	30.2	Very low	33.3	Very low	104 Å²	104	148.6 Å²	148.6	86%	0.86	79%	0.785	S	S	*	*			trans	-59.5	111	174.1	0	0	0	0	0	111.6
532	Q	35.4	Very low	33.1	Very low	189 Å²	189	154.3 Å²	154.3	88%	0.883	80%	0.802	S	S	*	*			trans	-82.3	115.9	158.9	-79.3	-175.2	4.5	0	0	108.7	P530 G534	P530-Q532 PolarHBondContact O-N 3.01Å; Q532-G534 VanDerWaalsContact C-N 3.33Å; Q532-G534 PolarHBondContact O-N 2.95Å
533	R	30.2	Very low	32.8	Very low	255 Å²	255	150.9 Å²	150.9	96%	0.962	80%	0.798	S	S	*	*			trans	-62	93.1	164.5	-84.7	-179.7	167.2	-173.3	-2.8	108.6
534	G	31	Very low	32.8	Very low	73 Å²	73	148.4 Å²	148.4	75%	0.753	79%	0.792	S	S	*	*			trans	-75.1	127.3	167	0	0	0	0	0	110.3	Q532	Q532-G534 VanDerWaalsContact C-N 3.33Å; Q532-G534 PolarHBondContact O-N 2.95Å
535	G	29.9	Very low	32.5	Very low	69 Å²	69	151.3 Å²	151.3	71%	0.711	79%	0.792	S	S	*	*			trans	-61.9	151.6	-178.2	0	0	0	0	0	113.2	Q537	G535-Q537 PolarHBondContact O-N 3.18Å
536	Y	30.4	Very low	32.2	Very low	187 Å²	187	153.9 Å²	153.9	73%	0.733	79%	0.794	S	S	*	*			trans	-60.2	103.1	168	-86.1	-94.3	0	0	0	109.2
537	Q	32.6	Very low	32.1	Very low	171 Å²	171	151.4 Å²	151.4	80%	0.799	79%	0.787	S	S	*	*			trans	-80	129.9	166.1	-150.2	106.7	21.3	0	0	108.2	G535	G535-Q537 PolarHBondContact O-N 3.18Å
538	D	29.9	Very low	31.8	Very low	102 Å²	102	148.6 Å²	148.6	55%	0.545	78%	0.779	S	S	.	*			trans	-62.6	129.9	-178.5	-82.1	-49.5	0	0	0	112.2	F540 D541	D538-F540 VanDerWaalsContact C-N 3.28Å; D538-F540 PolarHBondContact O-N 3.5Å; D538-D541 HydrophobicContact CB-CB 4.46Å
539	W	35.2	Very low	31.9	Very low	176 Å²	176	141.2 Å²	141.2	67%	0.667	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-5.6	-177.6	-86.8	60.2	0	0	0	114.1	Q261	Q261-W539 HydrophobicContact CG-CH2 3.78Å; Q261-W539 HydrophobicContact CG-CZ2 4.38Å
540	F	36.3	Very low	31.4	Very low	126 Å²	126	147.1 Å²	147.1	55%	0.553	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.6	5.6	-171.1	-64.2	-74.2	0	0	0	113.3	D538	D538-F540 VanDerWaalsContact C-N 3.28Å; D538-F540 PolarHBondContact O-N 3.5Å
541	D	26.2	Very low	31.2	Very low	118 Å²	118	148.8 Å²	148.8	63%	0.631	77%	0.771	S	S	*	*			trans	-116.3	76.9	177.1	-75.2	-31.9	0	0	0	110.3	D538	D538-D541 HydrophobicContact CB-CB 4.46Å
542	N	27.5	Very low	31.3	Very low	215 Å²	215	152.8 Å²	152.8	100%	1.15	76%	0.762	S	S	*	*			trans	174.9	0	145.6	-91.7	-24.9	0	0	0	113.3

Retrieved 542 of 542 residues in 97.6 ms (Link to these results)

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