A0A3Q0KI35_SCHMA Loading...

Ashwin

AlphaFold DB , UniProt , Accession A0A3Q0KI35, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 237 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	53.1	Low	59.7	Low	230 Å²	230	129.9 Å²	129.9	100%	1.133	64%	0.637	S	S	*	*				0	109.6	0	-84.4	-68.5	158	0	0	107.9
2	S	54.1	Low	59.8	Low	75 Å²	75	125.9 Å²	125.9	52%	0.524	63%	0.625	S	S	.	*			trans	-72.6	136.5	-175.4	176.9	0	0	0	0	110.2	L4 S5 F6	S2-L4 PolarHBondContact O-N 3.3Å; S2-L4 VanDerWaalsContact O-N 3.08Å; S2-L4 PolarHBondContact OG-N 3.15Å; S2-S5 WeakPolarHBondContact O-CB 3.23Å; S2-S5 PolarHBondContact O-N 3.24Å; S2-F6 PolarHBondContact O-N 2.88Å
3	T	62.5	Low	59.6	Low	119 Å²	119	126.6 Å²	126.6	73%	0.73	62%	0.623	S	S	*	*	H	α-helix	trans	-53	-28.1	174.9	44.9	0	0	0	0	112.5	F6 Y7	T3-F6 PolarHBondContact O-N 2.75Å; T3-Y7 PolarHBondContact O-N 3.4Å
4	L	60.7	Low	59.5	Low	128 Å²	128	124 Å²	124	67%	0.67	61%	0.613	S	S	*	*	H	α-helix	trans	-67.8	-35.9	175.5	-157.9	71.5	0	0	0	112.4	S2 Y7 V8	S2-L4 PolarHBondContact O-N 3.3Å; S2-L4 VanDerWaalsContact O-N 3.08Å; S2-L4 PolarHBondContact OG-N 3.15Å; L4-Y7 PolarHBondContact O-N 2.95Å; L4-V8 WeakPolarHBondContact O-CG2 3.24Å; L4-V8 PolarHBondContact O-N 3.38Å
5	S	60.8	Low	59.2	Low	46 Å²	46	125.5 Å²	125.5	32%	0.322	62%	0.615	S	S	.	*	H	α-helix	trans	-67.8	-39.4	177.6	-171.2	0	0	0	0	111	S2 Y7 V8 F9	S2-S5 WeakPolarHBondContact O-CB 3.23Å; S2-S5 PolarHBondContact O-N 3.24Å; S5-Y7 PolarHBondContact O-N 3.41Å; S5-V8 PolarHBondContact O-N 3.39Å; S5-F9 VanDerWaalsContact O-CD2 3.25Å; S5-F9 WeakPolarHBondContact O-CD2 3.42Å; S5-F9 PolarHBondContact O-N 3.17Å
6	F	60.3	Low	59	Low	149 Å²	149	125.3 Å²	125.3	65%	0.654	61%	0.612	S	S	*	*	H	α-helix	trans	-62.7	-41.5	177.2	-160.5	-92.6	0	0	0	112.4	S2 T3 F9 Q10	S2-F6 PolarHBondContact O-N 2.88Å; T3-F6 PolarHBondContact O-N 2.75Å; F6-F9 PolarHBondContact O-N 3.39Å; F6-Q10 WeakPolarHBondContact O-CB 3.44Å; F6-Q10 PolarHBondContact O-N 3.26Å
7	Y	60.2	Low	58.7	Low	174 Å²	174	120.5 Å²	120.5	68%	0.682	59%	0.592	S	S	*	*	H	α-helix	trans	-66.8	-37	177.1	-99.5	-86.2	0	0	0	113.5	T3 L4 S5 R11	T3-Y7 PolarHBondContact O-N 3.4Å; L4-Y7 PolarHBondContact O-N 2.95Å; S5-Y7 PolarHBondContact O-N 3.41Å; Y7-R11 PolarHBondContact O-N 2.77Å; Y7-R11 VanDerWaalsContact O-N 3.13Å
8	V	63.7	Low	58.3	Low	89 Å²	89	119.6 Å²	119.6	54%	0.539	59%	0.589	S	S	.	*	H	α-helix	trans	-68.9	-44.8	176.8	174.7	0	0	0	0	110.5	L4 S5 Q10 R11 V12	L4-V8 WeakPolarHBondContact O-CG2 3.24Å; L4-V8 PolarHBondContact O-N 3.38Å; S5-V8 PolarHBondContact O-N 3.39Å; V8-Q10 PolarHBondContact O-N 2.98Å; V8-R11 PolarHBondContact O-N 2.9Å; V8-V12 HydrophobicContact CG1-CG2 4.47Å; V8-V12 WeakPolarHBondContact O-CG2 3.11Å; V8-V12 PolarHBondContact O-N 3.13Å
9	F	61.4	Low	57.8	Low	148 Å²	148	119.6 Å²	119.6	65%	0.649	59%	0.592	S	S	*	*	H	α-helix	trans	-61.9	-42.3	176.5	-87.5	-72.8	0	0	0	112.3	S5 F6 R11 V12 F13	S5-F9 VanDerWaalsContact O-CD2 3.25Å; S5-F9 WeakPolarHBondContact O-CD2 3.42Å; S5-F9 PolarHBondContact O-N 3.17Å; F6-F9 PolarHBondContact O-N 3.39Å; F9-R11 VanDerWaalsContact C-N 3.34Å; F9-R11 PolarHBondContact O-N 2.96Å; F9-V12 PolarHBondContact O-N 3.11Å; F9-F13 WeakPolarHBondContact O-CB 3.41Å; F9-F13 PolarHBondContact O-N 3.06Å
10	Q	60.1	Low	57.6	Low	91 Å²	91	120.9 Å²	120.9	43%	0.425	60%	0.596	S	S	.	*	H	α-helix	trans	-64.6	-36.8	177.7	-167.7	65.3	63.1	0	0	112.4	F6 V8 N14	F6-Q10 WeakPolarHBondContact O-CB 3.44Å; F6-Q10 PolarHBondContact O-N 3.26Å; V8-Q10 PolarHBondContact O-N 2.98Å; Q10-N14 WeakPolarHBondContact O-CB 3.41Å; Q10-N14 PolarHBondContact O-N 3.01Å; Q10-N14 PolarHBondContact O-ND2 3.34Å
11	R	59.3	Low	57.2	Low	180 Å²	180	121 Å²	121	68%	0.679	60%	0.597	S	S	*	*	H	α-helix	trans	-67.9	-45.7	174.4	-85.1	-158.1	-179.7	-177.6	2.9	112.2	Y7 V8 F9 F13 N14 F15	Y7-R11 PolarHBondContact O-N 2.77Å; Y7-R11 VanDerWaalsContact O-N 3.13Å; V8-R11 PolarHBondContact O-N 2.9Å; F9-R11 VanDerWaalsContact C-N 3.34Å; F9-R11 PolarHBondContact O-N 2.96Å; R11-F13 VanDerWaalsContact C-N 3.32Å; R11-F13 PolarHBondContact O-N 3.06Å; R11-N14 PolarHBondContact O-N 3.46Å; R11-F15 VanDerWaalsContact O-CD2 3.27Å; R11-F15 WeakPolarHBondContact O-CD2 3.3Å; R11-F15 PolarHBondContact O-N 3.09Å
12	V	61.1	Low	57.1	Low	82 Å²	82	116.8 Å²	116.8	50%	0.497	57%	0.572	S	S	.	*	H	α-helix	trans	-63	-40.7	179.6	174.6	0	0	0	0	111	V8 F9 F15 Q16	V8-V12 HydrophobicContact CG1-CG2 4.47Å; V8-V12 WeakPolarHBondContact O-CG2 3.11Å; V8-V12 PolarHBondContact O-N 3.13Å; F9-V12 PolarHBondContact O-N 3.11Å; V12-F15 PolarHBondContact O-N 3.32Å; V12-Q16 PolarHBondContact O-N 2.87Å
13	F	58.1	Low	57	Low	135 Å²	135	121.5 Å²	121.5	59%	0.592	58%	0.583	S	S	*	*	H	α-helix	trans	-65.9	-41.3	177.4	-154.6	-92.2	0	0	0	112	F9 R11 Q16 T17	F9-F13 WeakPolarHBondContact O-CB 3.41Å; F9-F13 PolarHBondContact O-N 3.06Å; R11-F13 VanDerWaalsContact C-N 3.32Å; R11-F13 PolarHBondContact O-N 3.06Å; F13-Q16 PolarHBondContact O-N 3.08Å; F13-T17 WeakPolarHBondContact O-CB 3.46Å; F13-T17 PolarHBondContact O-N 3.45Å; F13-T17 PolarHBondContact O-OG1 3.4Å
14	N	58.1	Low	56.3	Low	90 Å²	90	123.8 Å²	123.8	48%	0.481	59%	0.585	S	S	.	*	H	α-helix	trans	-66.7	-35.6	174.9	-79.7	-27	0	0	0	112.4	Q10 R11 T17 L18	Q10-N14 WeakPolarHBondContact O-CB 3.41Å; Q10-N14 PolarHBondContact O-N 3.01Å; Q10-N14 PolarHBondContact O-ND2 3.34Å; R11-N14 PolarHBondContact O-N 3.46Å; N14-T17 PolarHBondContact O-N 3.05Å; N14-L18 WeakPolarHBondContact O-CB 3.44Å; N14-L18 PolarHBondContact O-N 3.14Å
15	F	55.3	Low	55.4	Low	146 Å²	146	125.1 Å²	125.1	64%	0.64	59%	0.588	S	S	*	*	H	α-helix	trans	-67.5	-42.5	174.6	-90.3	-74.7	0	0	0	112.2	R11 V12 T17 L18 D19	R11-F15 VanDerWaalsContact O-CD2 3.27Å; R11-F15 WeakPolarHBondContact O-CD2 3.3Å; R11-F15 PolarHBondContact O-N 3.09Å; V12-F15 PolarHBondContact O-N 3.32Å; F15-T17 VanDerWaalsContact C-N 3.33Å; F15-T17 PolarHBondContact O-N 3.29Å; F15-L18 PolarHBondContact O-N 3.22Å; F15-D19 WeakPolarHBondContact O-CB 3.34Å; F15-D19 PolarHBondContact O-N 3.21Å
16	Q	54.8	Low	54.9	Low	123 Å²	123	132.5 Å²	132.5	58%	0.575	62%	0.615	S	S	*	*	H	α-helix	trans	-66.7	-32.8	175.3	-92.8	-176.5	-12.1	0	0	113.5	V12 F13 Q20	V12-Q16 PolarHBondContact O-N 2.87Å; F13-Q16 PolarHBondContact O-N 3.08Å; Q16-Q20 WeakPolarHBondContact O-CG 3.42Å; Q16-Q20 PolarHBondContact O-N 3.15Å; Q16-Q20 PolarHBondContact O-NE2 2.9Å
17	T	54.4	Low	54.3	Low	44 Å²	44	132.3 Å²	132.3	27%	0.27	62%	0.62	S	S	.	*	H	α-helix	trans	-75.7	-38.1	177.5	-47.2	0	0	0	0	110.6	F13 N14 F15 Q20 M21	F13-T17 WeakPolarHBondContact O-CB 3.46Å; F13-T17 PolarHBondContact O-N 3.45Å; F13-T17 PolarHBondContact O-OG1 3.4Å; N14-T17 PolarHBondContact O-N 3.05Å; F15-T17 VanDerWaalsContact C-N 3.33Å; F15-T17 PolarHBondContact O-N 3.29Å; T17-Q20 PolarHBondContact O-N 2.85Å; T17-M21 HydrophobicContact CG2-CE 3.67Å; T17-M21 HydrophobicContact CG2-SD 4.21Å; T17-M21 WeakPolarHBondContact O-CB 3.27Å; T17-M21 VanDerWaalsContact O-CG 3.32Å; T17-M21 WeakPolarHBondContact O-CG 3.44Å; T17-M21 PolarHBondContact O-N 2.9Å
18	L	50.9	Low	53.5	Low	104 Å²	104	133 Å²	133	55%	0.545	63%	0.63	S	S	.	*	H	α-helix	trans	-68.6	-37.1	175.2	-156.1	81.6	0	0	0	111.7	N14 F15 Q20 M21 K22	N14-L18 WeakPolarHBondContact O-CB 3.44Å; N14-L18 PolarHBondContact O-N 3.14Å; F15-L18 PolarHBondContact O-N 3.22Å; L18-Q20 VanDerWaalsContact C-N 3.29Å; L18-Q20 PolarHBondContact O-N 3.38Å; L18-M21 PolarHBondContact O-N 3.15Å; L18-K22 WeakPolarHBondContact O-CB 3.48Å; L18-K22 PolarHBondContact O-N 3.08Å
19	D	50.2	Low	53.1	Low	120 Å²	120	133.9 Å²	133.9	64%	0.642	64%	0.64	S	S	*	*	H	α-helix	trans	-71.2	-25.3	176.6	-135.2	20.1	0	0	0	112.4	F15	F15-D19 WeakPolarHBondContact O-CB 3.34Å; F15-D19 PolarHBondContact O-N 3.21Å
20	Q	52.8	Low	53	Low	144 Å²	144	135.4 Å²	135.4	67%	0.673	65%	0.646	S	S	*	*	H	α-helix	trans	-77.6	-37.4	169	-77.4	-177.8	80.2	0	0	112.3	Q16 T17 L18	Q16-Q20 WeakPolarHBondContact O-CG 3.42Å; Q16-Q20 PolarHBondContact O-N 3.15Å; Q16-Q20 PolarHBondContact O-NE2 2.9Å; T17-Q20 PolarHBondContact O-N 2.85Å; L18-Q20 VanDerWaalsContact C-N 3.29Å; L18-Q20 PolarHBondContact O-N 3.38Å
21	M	49.1	Very low	53	Low	123 Å²	123	135.7 Å²	135.7	61%	0.606	66%	0.656	S	S	*	*	H	α-helix	trans	-77.7	-23.7	178	-71	176.7	-178.3	0	0	113.3	T17 L18 K23	T17-M21 HydrophobicContact CG2-CE 3.67Å; T17-M21 HydrophobicContact CG2-SD 4.21Å; T17-M21 WeakPolarHBondContact O-CB 3.27Å; T17-M21 VanDerWaalsContact O-CG 3.32Å; T17-M21 WeakPolarHBondContact O-CG 3.44Å; T17-M21 PolarHBondContact O-N 2.9Å; L18-M21 PolarHBondContact O-N 3.15Å; M21-K23 VanDerWaalsContact C-N 3.29Å; M21-K23 PolarHBondContact O-N 3.32Å
22	K	51.8	Low	53.5	Low	142 Å²	142	134.2 Å²	134.2	62%	0.617	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-80.4	-6	175.4	-121.2	178.3	177.4	-176.3	0	114.3	L18 E24	L18-K22 WeakPolarHBondContact O-CB 3.48Å; L18-K22 PolarHBondContact O-N 3.08Å; K22-E24 VanDerWaalsContact C-N 3.32Å
23	K	51.3	Low	54.7	Low	175 Å²	175	133.3 Å²	133.3	76%	0.761	65%	0.649	S	S	*	*	G	3₁₀ helix	trans	-86.1	1.3	171.3	-85.8	-177.7	176.3	176	0	113.9	M21	M21-K23 VanDerWaalsContact C-N 3.29Å; M21-K23 PolarHBondContact O-N 3.32Å
24	E	47.6	Very low	56.2	Low	166 Å²	166	130 Å²	130	78%	0.776	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-93.1	6.1	174.5	-84.7	-175.9	148.9	0	0	114.4	K22 K26	K22-E24 VanDerWaalsContact C-N 3.32Å; E24-K26 PolarHBondContact O-N 3.14Å
25	E	43.2	Very low	57.9	Low	156 Å²	156	127.5 Å²	127.5	73%	0.729	63%	0.628	S	S	*	*	S	Bend	trans	-87	107.9	175.5	-76.2	-169.8	139.7	0	0	112.1
26	K	50.2	Low	59.9	Low	202 Å²	202	126.9 Å²	126.9	88%	0.878	62%	0.623	S	S	*	*			trans	67.1	63.2	166	-63.7	-178.2	176.6	177.4	0	116.7	E24 E28	E24-K26 PolarHBondContact O-N 3.14Å; K26-E28 PolarHBondContact O-N 2.76Å; K26-E28 VanDerWaalsContact O-N 3.13Å
27	N	45.8	Very low	61.9	Low	144 Å²	144	121 Å²	121	77%	0.77	60%	0.595	S	S	*	*			trans	-71.8	99.2	148.1	-73.1	-44.1	0	0	0	107.5	S29	N27-S29 PolarHBondContact O-N 3.07Å
28	E	45.1	Very low	63.9	Low	190 Å²	190	122.4 Å²	122.4	89%	0.888	61%	0.605	S	S	*	*			trans	-51.6	102.6	151.2	-91.7	-177.1	157.5	0	0	105.7	K26 K30	K26-E28 PolarHBondContact O-N 2.76Å; K26-E28 VanDerWaalsContact O-N 3.13Å; E28-K30 PolarHBondContact O-N 2.57Å
29	S	55.2	Low	66	Low	106 Å²	106	124.4 Å²	124.4	74%	0.741	61%	0.609	S	S	*	*			trans	-59.6	109.2	179.5	54.8	0	0	0	0	106.3	N27	N27-S29 PolarHBondContact O-N 3.07Å
30	K	58.7	Low	68.1	Low	181 Å²	181	120.9 Å²	120.9	79%	0.787	59%	0.593	S	S	*	*			trans	-43.6	138.7	166.9	-69.8	-178.1	-179.9	178.7	0	107.3	E28 K32	E28-K30 PolarHBondContact O-N 2.57Å; K30-K32 PolarHBondContact O-N 2.8Å
31	P	60.1	Low	70.1	Confident	96 Å²	96	116 Å²	116	62%	0.623	58%	0.582	S	S	*	*			trans	-53	112.2	-177.7	21.6	-32.3	0	0	0	108.2	V33 Y47	P31-V33 PolarHBondContact O-N 3.47Å; P31-Y47 WeakPolarHBondContact O-CE2 3.19Å
32	K	69.6	Low	72.3	Confident	149 Å²	149	112.7 Å²	112.7	65%	0.648	57%	0.569	S	S	*	*			trans	-72.2	96.9	-178.9	-172.6	173.1	-173.6	175.9	0	107.4	K30 S34 D45	K30-K32 PolarHBondContact O-N 2.8Å; K32-S34 PolarHBondContact O-N 2.72Å; K32-D45 WeakPolarHBondContact CE-OD2 3.33Å
33	V	85.7	Confident	74.4	Confident	63 Å²	63	110.3 Å²	110.3	38%	0.382	57%	0.566	S	S	.	*			trans	-82.1	104.7	175.3	176.3	0	0	0	0	106.8	P31 L46 Y47	P31-V33 PolarHBondContact O-N 3.47Å; V33-L46 HydrophobicContact CG1-CB 4.24Å; V33-L46 HydrophobicContact CG1-CD1 3.93Å; V33-L46 HydrophobicContact CG1-CG 4.39Å; V33-L46 WeakPolarHBondContact O-CB 3.04Å; V33-L46 PolarHBondContact O-N 2.8Å; V33-Y47 HydrophobicContact CB-CD2 4.07Å; V33-Y47 HydrophobicContact CB-CE2 3.61Å; V33-Y47 HydrophobicContact CG2-CD2 4.39Å; V33-Y47 HydrophobicContact CG2-CE2 3.48Å; V33-Y47 VanDerWaalsContact CG2-CE2 3.48Å
34	S	90.9	Very high	76.4	Confident	67 Å²	67	102.5 Å²	102.5	47%	0.469	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	144.6	-178.4	57.1	0	0	0	0	111.8	K32 V44	K32-S34 PolarHBondContact O-N 2.72Å; S34-V44 CarbonylContact C-O 3.58Å; S34-V44 WeakPolarHBondContact CA-O 3.48Å; S34-V44 WeakPolarHBondContact CB-O 3.18Å
35	E	93.8	Very high	78.6	Confident	37 Å²	37	96.5 Å²	96.5	17%	0.173	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	136.8	179.5	-175	175.9	168.7	0	0	110	L37 T43 V44 L46 R63 R64	E35-L37 HydrophobicContact CG-CD2 4.48Å; E35-T43 WeakPolarHBondContact O-CA 3.42Å; E35-V44 PolarHBondContact N-O 3.47Å; E35-V44 PolarHBondContact O-N 3.43Å; E35-L46 HydrophobicContact CB-CD1 3.99Å; E35-L46 HydrophobicContact CB-CD2 4.03Å; E35-L46 HydrophobicContact CB-CG 4.1Å; E35-R63 IonicContact OE1-CZ 2.95Å; E35-R63 VanDerWaalsContact OE1-CZ 3.32Å; E35-R63 IonicContact OE1-NE 2.82Å; E35-R63 PolarHBondContact OE1-NE 2.78Å; E35-R63 IonicContact OE1-NH2 3.69Å; E35-R63 PolarHBondContact OE1-NH2 3.43Å; E35-R64 IonicContact OE2-CZ 2.74Å; E35-R64 IonicContact OE2-NH2 3.32Å; E35-R64 PolarHBondContact OE2-NH2 2.87Å
36	Y	97	Very high	80.9	Confident	133 Å²	133	90.2 Å²	90.2	52%	0.522	48%	0.477	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	126.8	172.5	179.6	-104.1	0	0	0	110.6	P38	Y36-P38 HydrophobicContact CE1-CB 4.1Å; Y36-P38 WeakPolarHBondContact O-CD 3.35Å
37	L	96.7	Very high	82.8	Confident	0 Å²	0	86.5 Å²	86.5	0%	0	46%	0.459	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	102	179.4	-63.4	-171.9	0	0	0	109.7	E35 K39 C40 G41 V42 V44 Q56 E59 I60	E35-L37 HydrophobicContact CG-CD2 4.48Å; L37-K39 PolarHBondContact O-N 3.06Å; L37-C40 HydrophobicContact CB-CB 4.25Å; L37-C40 PolarHBondContact O-N 2.82Å; L37-G41 WeakPolarHBondContact O-CA 3.47Å; L37-G41 PolarHBondContact O-N 3.46Å; L37-V42 PolarHBondContact N-O 2.82Å; L37-V42 PolarHBondContact O-N 3.48Å; L37-V44 HydrophobicContact CD1-CB 4.46Å; L37-V44 HydrophobicContact CD1-CG1 3.71Å; L37-V44 HydrophobicContact CD1-CG2 3.85Å; L37-V44 HydrophobicContact CD2-CG2 4.46Å; L37-V44 HydrophobicContact CG-CG1 4.28Å; L37-V44 HydrophobicContact CG-CG2 3.97Å; L37-Q56 HydrophobicContact CD1-CB 3.62Å; L37-Q56 HydrophobicContact CD1-CG 3.87Å; L37-E59 WeakPolarHBondContact CB-OE2 3.43Å; L37-E59 HydrophobicContact CD2-CG 4.36Å; L37-I60 HydrophobicContact CD1-CD1 4.26Å; L37-I60 HydrophobicContact CD1-CG1 4.11Å; L37-I60 HydrophobicContact CD2-CD1 4.42Å; L37-I60 HydrophobicContact CD2-CG1 3.64Å
38	P	96.4	Very high	85	Confident	73 Å²	73	81.2 Å²	81.2	47%	0.474	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-28.9	-173.1	23.6	-34.5	0	0	0	115.2	Y36 E59	Y36-P38 HydrophobicContact CE1-CB 4.1Å; Y36-P38 WeakPolarHBondContact O-CD 3.35Å; P38-E59 WeakPolarHBondContact CD-OE1 3.23Å; P38-E59 WeakPolarHBondContact CG-OE1 3.39Å
39	K	95.3	Very high	87.3	Confident	145 Å²	145	72.2 Å²	72.2	63%	0.63	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-40.6	177.5	-54.7	178.9	173.3	-171.7	0	111	L37 E59 E62	L37-K39 PolarHBondContact O-N 3.06Å; K39-E59 HydrophobicContact CB-CG 4.47Å; K39-E59 VanDerWaalsContact CB-OE2 3.27Å; K39-E59 WeakPolarHBondContact CB-OE2 3.44Å; K39-E59 HydrophobicContact CD-CG 4.15Å; K39-E59 HydrophobicContact CG-CG 4.31Å; K39-E59 WeakPolarHBondContact CG-OE1 3.35Å; K39-E59 PolarHBondContact N-OE1 2.82Å; K39-E59 PolarHBondContact N-OE2 3.38Å; K39-E62 IonicContact NZ-OE1 3.84Å; K39-E62 IonicContact NZ-OE2 3.79Å; K39-E62 PolarHBondContact NZ-OE2 3.33Å
40	C	93.6	Very high	89.1	Confident	46 Å²	46	71.8 Å²	71.8	31%	0.311	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-19.7	177.4	-58.7	0	0	0	0	113.4	L37 V42 Q56 E59	L37-C40 HydrophobicContact CB-CB 4.25Å; L37-C40 PolarHBondContact O-N 2.82Å; C40-V42 VanDerWaalsContact C-N 3.32Å; C40-V42 HydrophobicContact CB-CG2 3.65Å; C40-V42 PolarHBondContact O-N 3.39Å; C40-Q56 HydrophobicContact CB-CG 4.09Å; C40-E59 PolarHBondContact N-OE2 3.06Å; C40-E59 VanDerWaalsContact N-OE2 3.1Å; C40-E59 PolarHBondContact SG-OE2 3.02Å
41	G	95.2	Very high	90.8	Very high	43 Å²	43	70.6 Å²	70.6	44%	0.443	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	20.3	-178.9	0	0	0	0	0	114.8	L37	L37-G41 WeakPolarHBondContact O-CA 3.47Å; L37-G41 PolarHBondContact O-N 3.46Å
42	V	95.6	Very high	92.4	Very high	53 Å²	53	66.4 Å²	66.4	32%	0.321	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	154.9	-170.7	-64.9	0	0	0	0	112.3	L37 C40 V44 Q56	L37-V42 PolarHBondContact N-O 2.82Å; L37-V42 PolarHBondContact O-N 3.48Å; C40-V42 VanDerWaalsContact C-N 3.32Å; C40-V42 HydrophobicContact CB-CG2 3.65Å; C40-V42 PolarHBondContact O-N 3.39Å; V42-V44 HydrophobicContact CG2-CG1 4.13Å; V42-Q56 HydrophobicContact CG2-CG 4.16Å
43	T	95.8	Very high	93.6	Very high	91 Å²	91	61.8 Å²	61.8	56%	0.558	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.6	126.9	170.9	-58.6	0	0	0	0	109.6	E35	E35-T43 WeakPolarHBondContact O-CA 3.42Å
44	V	94.2	Very high	94	Very high	11 Å²	11	61.8 Å²	61.8	7%	0.067	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	154	-177.6	-59.9	0	0	0	0	111.7	S34 E35 L37 V42 L46 M52 Q56 I60	S34-V44 CarbonylContact C-O 3.58Å; S34-V44 WeakPolarHBondContact CA-O 3.48Å; S34-V44 WeakPolarHBondContact CB-O 3.18Å; E35-V44 PolarHBondContact N-O 3.47Å; E35-V44 PolarHBondContact O-N 3.43Å; L37-V44 HydrophobicContact CD1-CB 4.46Å; L37-V44 HydrophobicContact CD1-CG1 3.71Å; L37-V44 HydrophobicContact CD1-CG2 3.85Å; L37-V44 HydrophobicContact CD2-CG2 4.46Å; L37-V44 HydrophobicContact CG-CG1 4.28Å; L37-V44 HydrophobicContact CG-CG2 3.97Å; V42-V44 HydrophobicContact CG2-CG1 4.13Å; V44-L46 HydrophobicContact CG2-CD2 4.08Å; V44-M52 HydrophobicContact CB-CE 4Å; V44-M52 HydrophobicContact CB-CG 4.35Å; V44-M52 HydrophobicContact CB-SD 4.2Å; V44-M52 HydrophobicContact CG1-CG 4.47Å; V44-M52 HydrophobicContact CG2-CE 3.93Å; V44-M52 HydrophobicContact CG2-SD 4.15Å; V44-Q56 HydrophobicContact CG1-CB 4.47Å; V44-Q56 HydrophobicContact CG1-CG 4.27Å; V44-I60 HydrophobicContact CG2-CD1 4.18Å
45	D	92.2	Very high	94.3	Very high	40 Å²	40	64 Å²	64	21%	0.214	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	113	173.8	-169.8	-24.7	0	0	0	110.3	K32 Y47 C48 M52	K32-D45 WeakPolarHBondContact CE-OD2 3.33Å; D45-Y47 PolarHBondContact O-N 3.43Å; D45-Y47 VanDerWaalsContact O-N 3.14Å; D45-Y47 PolarHBondContact OD1-N 3.4Å; D45-C48 PolarHBondContact O-N 3.25Å; D45-C48 VanDerWaalsContact O-N 3.11Å; D45-M52 WeakPolarHBondContact O-CE 3.45Å
46	L	92.2	Very high	94.4	Very high	24 Å²	24	63.8 Å²	63.8	13%	0.126	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-10.1	-174.1	-64.9	-170.6	0	0	0	114.1	V33 E35 V44 M52 I60 Y83	V33-L46 HydrophobicContact CG1-CB 4.24Å; V33-L46 HydrophobicContact CG1-CD1 3.93Å; V33-L46 HydrophobicContact CG1-CG 4.39Å; V33-L46 WeakPolarHBondContact O-CB 3.04Å; V33-L46 PolarHBondContact O-N 2.8Å; E35-L46 HydrophobicContact CB-CD1 3.99Å; E35-L46 HydrophobicContact CB-CD2 4.03Å; E35-L46 HydrophobicContact CB-CG 4.1Å; V44-L46 HydrophobicContact CG2-CD2 4.08Å; L46-M52 HydrophobicContact CD2-CE 4.17Å; L46-I60 HydrophobicContact CD2-CD1 4.11Å; L46-Y83 WeakPolarHBondContact CA-OH 3.38Å; L46-Y83 WeakPolarHBondContact CB-OH 3.37Å; L46-Y83 WeakPolarHBondContact O-CE1 3.16Å; L46-Y83 PolarHBondContact O-OH 3.47Å
47	Y	90.1	Very high	94.3	Very high	124 Å²	124	57.5 Å²	57.5	49%	0.486	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.8	174.2	-71.9	-68.4	0	0	0	114	P31 V33 D45 P49	P31-Y47 WeakPolarHBondContact O-CE2 3.19Å; V33-Y47 HydrophobicContact CB-CD2 4.07Å; V33-Y47 HydrophobicContact CB-CE2 3.61Å; V33-Y47 HydrophobicContact CG2-CD2 4.39Å; V33-Y47 HydrophobicContact CG2-CE2 3.48Å; V33-Y47 VanDerWaalsContact CG2-CE2 3.48Å; D45-Y47 PolarHBondContact O-N 3.43Å; D45-Y47 VanDerWaalsContact O-N 3.14Å; D45-Y47 PolarHBondContact OD1-N 3.4Å; Y47-P49 VanDerWaalsContact C-CD 3.48Å
48	C	91.2	Very high	94.3	Very high	34 Å²	34	60.1 Å²	60.1	23%	0.23	33%	0.325	C	S	.	.			trans	-129.7	63.4	-178.6	-61.3	0	0	0	0	111.4	D45 E50 Q51	D45-C48 PolarHBondContact O-N 3.25Å; D45-C48 VanDerWaalsContact O-N 3.11Å; C48-E50 PolarHBondContact O-N 2.78Å; C48-Q51 HydrophobicContact CB-CB 4.38Å; C48-Q51 HydrophobicContact CB-CG 4.08Å; C48-Q51 PolarHBondContact O-N 3.39Å; C48-Q51 VanDerWaalsContact O-N 3.09Å
49	P	93.4	Very high	94.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25.2	-178.9	27.6	-36.2	0	0	0	113.6	Y47 Q51 M52 L57 V80 Y83 Y84	Y47-P49 VanDerWaalsContact C-CD 3.48Å; P49-Q51 PolarHBondContact O-N 3.39Å; P49-M52 WeakPolarHBondContact O-CB 3.46Å; P49-M52 PolarHBondContact O-N 2.83Å; P49-M52 VanDerWaalsContact O-N 3.14Å; P49-L57 HydrophobicContact CB-CD2 4.03Å; P49-V80 HydrophobicContact CB-CG1 4.43Å; P49-V80 HydrophobicContact CB-CG2 4.41Å; P49-V80 HydrophobicContact CG-CG1 4.17Å; P49-Y83 HydrophobicContact CB-CD1 3.64Å; P49-Y83 HydrophobicContact CB-CD2 4.23Å; P49-Y83 HydrophobicContact CB-CE1 3.94Å; P49-Y83 HydrophobicContact CB-CG 3.82Å; P49-Y83 HydrophobicContact CG-CD1 3.69Å; P49-Y83 HydrophobicContact CG-CE1 3.98Å; P49-Y83 HydrophobicContact CG-CG 4.32Å; P49-Y84 HydrophobicContact CG-CE1 4.37Å; P49-Y84 HydrophobicContact CG-CE2 3.82Å
50	E	94.4	Very high	94.3	Very high	98 Å²	98	50 Å²	50	46%	0.458	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-66.5	-23.4	176.9	-56.8	78.9	-176.5	0	0	113.1	C48 M52 V80 Y84	C48-E50 PolarHBondContact O-N 2.78Å; E50-M52 VanDerWaalsContact C-N 3.3Å; E50-V80 HydrophobicContact CG-CG1 4.14Å; E50-Y84 WeakPolarHBondContact OE1-CE2 3.46Å; E50-Y84 VanDerWaalsContact OE1-CZ 3.23Å; E50-Y84 PolarHBondContact OE1-OH 3.14Å; E50-Y84 PolarHBondContact OE2-OH 2.7Å
51	Q	93.4	Very high	94.5	Very high	156 Å²	156	47.8 Å²	47.8	73%	0.729	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-86.6	-6.4	178.1	-60.2	-178.3	12.8	0	0	112.1	C48 P49	C48-Q51 HydrophobicContact CB-CB 4.38Å; C48-Q51 HydrophobicContact CB-CG 4.08Å; C48-Q51 PolarHBondContact O-N 3.39Å; C48-Q51 VanDerWaalsContact O-N 3.09Å; P49-Q51 PolarHBondContact O-N 3.39Å
52	M	94	Very high	94.5	Very high	7 Å²	7	49 Å²	49	3%	0.034	25%	0.253	C	S	.	.	S	Bend	trans	-88	142.9	179.2	-57.6	-176.8	-163.3	0	0	110.7	V44 D45 L46 P49 E50 Q56 L57 I60 L76	V44-M52 HydrophobicContact CB-CE 4Å; V44-M52 HydrophobicContact CB-CG 4.35Å; V44-M52 HydrophobicContact CB-SD 4.2Å; V44-M52 HydrophobicContact CG1-CG 4.47Å; V44-M52 HydrophobicContact CG2-CE 3.93Å; V44-M52 HydrophobicContact CG2-SD 4.15Å; D45-M52 WeakPolarHBondContact O-CE 3.45Å; L46-M52 HydrophobicContact CD2-CE 4.17Å; P49-M52 WeakPolarHBondContact O-CB 3.46Å; P49-M52 PolarHBondContact O-N 2.83Å; P49-M52 VanDerWaalsContact O-N 3.14Å; E50-M52 VanDerWaalsContact C-N 3.3Å; M52-Q56 VanDerWaalsContact CA-OE1 3.26Å; M52-Q56 HydrophobicContact CB-CB 4.16Å; M52-L57 HydrophobicContact CB-CD1 4.43Å; M52-L57 HydrophobicContact CB-CD2 4.09Å; M52-L57 HydrophobicContact CB-CG 3.88Å; M52-L57 HydrophobicContact CG-CD2 4.48Å; M52-L57 HydrophobicContact SD-CD2 3.72Å; M52-L57 HydrophobicContact SD-CG 4.38Å; M52-I60 HydrophobicContact CE-CD1 4.15Å; M52-I60 HydrophobicContact SD-CD1 3.47Å; M52-I60 WeakPolarHBondContact SD-CD1 3.46Å; M52-L76 WeakPolarHBondContact O-CD1 3.47Å
53	S	94.7	Very high	94.4	Very high	52 Å²	52	52.6 Å²	52.6	36%	0.364	26%	0.261	S	S	.	.			trans	-66.6	158.8	166.1	65.6	0	0	0	0	111.3	D55 Q56 L57	S53-D55 VanDerWaalsContact C-N 3.28Å; S53-D55 PolarHBondContact O-N 3.1Å; S53-Q56 WeakPolarHBondContact O-CB 3.48Å; S53-Q56 PolarHBondContact O-N 2.83Å; S53-Q56 VanDerWaalsContact O-N 3.16Å; S53-Q56 WeakPolarHBondContact OG-CG 3.33Å; S53-Q56 PolarHBondContact OG-N 2.8Å; S53-Q56 PolarHBondContact OG-OE1 3.17Å; S53-Q56 VanDerWaalsContact OG-OE1 3.12Å; S53-L57 PolarHBondContact O-N 3.33Å; S53-L57 VanDerWaalsContact O-N 3.1Å
54	I	95	Very high	94.3	Very high	63 Å²	63	51.7 Å²	51.7	32%	0.323	25%	0.247	S	C	.	.	H	α-helix	trans	-54.6	-45.2	176.5	-68.4	174.5	0	0	0	110.9	Q56 L57 L58 L76 I79	I54-Q56 VanDerWaalsContact C-N 3.32Å; I54-Q56 PolarHBondContact O-N 2.94Å; I54-L57 PolarHBondContact O-N 2.74Å; I54-L58 HydrophobicContact CG2-CD1 3.86Å; I54-L58 HydrophobicContact CG2-CG 4.14Å; I54-L58 VanDerWaalsContact O-CG 3.31Å; I54-L58 WeakPolarHBondContact O-CG 3.29Å; I54-L58 PolarHBondContact O-N 2.95Å; I54-L76 HydrophobicContact CD1-CB 4.47Å; I54-L76 HydrophobicContact CG1-CB 4.24Å; I54-L76 HydrophobicContact CG1-CD1 4.13Å; I54-I79 HydrophobicContact CG1-CD1 4.38Å; I54-I79 HydrophobicContact CG2-CD1 3.75Å
55	D	95.6	Very high	94.4	Very high	113 Å²	113	54.2 Å²	54.2	60%	0.604	28%	0.275	S	S	*	.	H	α-helix	trans	-61.3	-39.5	-179.7	-65.7	-31.8	0	0	0	112.7	S53 L58 E59	S53-D55 VanDerWaalsContact C-N 3.28Å; S53-D55 PolarHBondContact O-N 3.1Å; D55-L58 PolarHBondContact O-N 3.36Å; D55-E59 WeakPolarHBondContact O-CB 3.31Å; D55-E59 PolarHBondContact O-N 3.17Å
56	Q	96.3	Very high	94.5	Very high	34 Å²	34	56 Å²	56	16%	0.159	28%	0.281	C	S	.	.	H	α-helix	trans	-64.4	-43.8	176.5	-72.1	165.3	-22.4	0	0	111.2	L37 C40 V42 V44 M52 S53 I54 E59 I60	L37-Q56 HydrophobicContact CD1-CB 3.62Å; L37-Q56 HydrophobicContact CD1-CG 3.87Å; C40-Q56 HydrophobicContact CB-CG 4.09Å; V42-Q56 HydrophobicContact CG2-CG 4.16Å; V44-Q56 HydrophobicContact CG1-CB 4.47Å; V44-Q56 HydrophobicContact CG1-CG 4.27Å; M52-Q56 VanDerWaalsContact CA-OE1 3.26Å; M52-Q56 HydrophobicContact CB-CB 4.16Å; S53-Q56 WeakPolarHBondContact O-CB 3.48Å; S53-Q56 PolarHBondContact O-N 2.83Å; S53-Q56 VanDerWaalsContact O-N 3.16Å; S53-Q56 WeakPolarHBondContact OG-CG 3.33Å; S53-Q56 PolarHBondContact OG-N 2.8Å; S53-Q56 PolarHBondContact OG-OE1 3.17Å; S53-Q56 VanDerWaalsContact OG-OE1 3.12Å; I54-Q56 VanDerWaalsContact C-N 3.32Å; I54-Q56 PolarHBondContact O-N 2.94Å; Q56-E59 PolarHBondContact O-N 3.41Å; Q56-I60 VanDerWaalsContact O-CG1 3.29Å; Q56-I60 WeakPolarHBondContact O-CG1 3.34Å; Q56-I60 PolarHBondContact O-N 3.13Å; Q56-I60 VanDerWaalsContact O-N 3.08Å
57	L	96	Very high	94.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.5	-46.3	176.3	-69.3	166.6	0	0	0	111	P49 M52 S53 I54 E59 I60 F61 L76 I79 V80 Y83	P49-L57 HydrophobicContact CB-CD2 4.03Å; M52-L57 HydrophobicContact CB-CD1 4.43Å; M52-L57 HydrophobicContact CB-CD2 4.09Å; M52-L57 HydrophobicContact CB-CG 3.88Å; M52-L57 HydrophobicContact CG-CD2 4.48Å; M52-L57 HydrophobicContact SD-CD2 3.72Å; M52-L57 HydrophobicContact SD-CG 4.38Å; S53-L57 PolarHBondContact O-N 3.33Å; S53-L57 VanDerWaalsContact O-N 3.1Å; I54-L57 PolarHBondContact O-N 2.74Å; L57-E59 VanDerWaalsContact C-N 3.3Å; L57-E59 PolarHBondContact O-N 3.3Å; L57-I60 WeakPolarHBondContact O-CA 3.47Å; L57-I60 WeakPolarHBondContact O-CB 3.3Å; L57-I60 PolarHBondContact O-N 3.47Å; L57-F61 VanDerWaalsContact O-CD2 3.23Å; L57-F61 WeakPolarHBondContact O-CD2 3.34Å; L57-F61 PolarHBondContact O-N 3.36Å; L57-L76 HydrophobicContact CD1-CD1 3.51Å; L57-I79 HydrophobicContact CB-CG2 3.57Å; L57-I79 HydrophobicContact CD1-CB 4.28Å; L57-I79 HydrophobicContact CD1-CG2 3.82Å; L57-I79 HydrophobicContact CG-CG2 4.23Å; L57-V80 HydrophobicContact CD1-CG2 3.96Å; L57-Y83 HydrophobicContact CD2-CD2 3.86Å; L57-Y83 HydrophobicContact CD2-CE2 4.4Å; L57-Y83 HydrophobicContact CD2-CG 4.49Å
58	L	95.9	Very high	94.7	Very high	55 Å²	55	59.5 Å²	59.5	29%	0.288	31%	0.31	S	S	.	.	H	α-helix	trans	-58.9	-41.9	177.9	-69.2	179	0	0	0	112	I54 D55 I60 F61 E62 V70 I79	I54-L58 HydrophobicContact CG2-CD1 3.86Å; I54-L58 HydrophobicContact CG2-CG 4.14Å; I54-L58 VanDerWaalsContact O-CG 3.31Å; I54-L58 WeakPolarHBondContact O-CG 3.29Å; I54-L58 PolarHBondContact O-N 2.95Å; D55-L58 PolarHBondContact O-N 3.36Å; L58-I60 VanDerWaalsContact C-N 3.32Å; L58-I60 PolarHBondContact O-N 3.42Å; L58-F61 PolarHBondContact O-N 2.98Å; L58-E62 WeakPolarHBondContact O-CB 3.38Å; L58-E62 PolarHBondContact O-N 2.85Å; L58-V70 HydrophobicContact CD2-CB 3.7Å; L58-V70 HydrophobicContact CD2-CG1 4.49Å; L58-V70 HydrophobicContact CD2-CG2 3.61Å; L58-I79 HydrophobicContact CD2-CD1 4.25Å
59	E	96.4	Very high	94.8	Very high	5 Å²	5	60.7 Å²	60.7	2%	0.023	31%	0.313	C	S	.	.	H	α-helix	trans	-60.1	-42.9	174.3	179.4	172.3	-175.8	0	0	111.5	L37 P38 K39 C40 D55 Q56 L57 E62 R63	L37-E59 WeakPolarHBondContact CB-OE2 3.43Å; L37-E59 HydrophobicContact CD2-CG 4.36Å; P38-E59 WeakPolarHBondContact CD-OE1 3.23Å; P38-E59 WeakPolarHBondContact CG-OE1 3.39Å; K39-E59 HydrophobicContact CB-CG 4.47Å; K39-E59 VanDerWaalsContact CB-OE2 3.27Å; K39-E59 WeakPolarHBondContact CB-OE2 3.44Å; K39-E59 HydrophobicContact CD-CG 4.15Å; K39-E59 HydrophobicContact CG-CG 4.31Å; K39-E59 WeakPolarHBondContact CG-OE1 3.35Å; K39-E59 PolarHBondContact N-OE1 2.82Å; K39-E59 PolarHBondContact N-OE2 3.38Å; C40-E59 PolarHBondContact N-OE2 3.06Å; C40-E59 VanDerWaalsContact N-OE2 3.1Å; C40-E59 PolarHBondContact SG-OE2 3.02Å; D55-E59 WeakPolarHBondContact O-CB 3.31Å; D55-E59 PolarHBondContact O-N 3.17Å; Q56-E59 PolarHBondContact O-N 3.41Å; L57-E59 VanDerWaalsContact C-N 3.3Å; L57-E59 PolarHBondContact O-N 3.3Å; E59-E62 PolarHBondContact O-N 3.42Å; E59-R63 HydrophobicContact CG-CG 4.35Å; E59-R63 WeakPolarHBondContact O-CB 2.89Å; E59-R63 WeakPolarHBondContact O-CD 3.43Å; E59-R63 WeakPolarHBondContact O-CG 3.45Å; E59-R63 PolarHBondContact O-N 2.95Å
60	I	96	Very high	94.8	Very high	0 Å²	0	61 Å²	61	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-48.9	175.4	-71.8	168.1	0	0	0	111.3	L37 V44 L46 M52 Q56 L57 L58 E62 R63 R64 Y83 L87	L37-I60 HydrophobicContact CD1-CD1 4.26Å; L37-I60 HydrophobicContact CD1-CG1 4.11Å; L37-I60 HydrophobicContact CD2-CD1 4.42Å; L37-I60 HydrophobicContact CD2-CG1 3.64Å; V44-I60 HydrophobicContact CG2-CD1 4.18Å; L46-I60 HydrophobicContact CD2-CD1 4.11Å; M52-I60 HydrophobicContact CE-CD1 4.15Å; M52-I60 HydrophobicContact SD-CD1 3.47Å; M52-I60 WeakPolarHBondContact SD-CD1 3.46Å; Q56-I60 VanDerWaalsContact O-CG1 3.29Å; Q56-I60 WeakPolarHBondContact O-CG1 3.34Å; Q56-I60 PolarHBondContact O-N 3.13Å; Q56-I60 VanDerWaalsContact O-N 3.08Å; L57-I60 WeakPolarHBondContact O-CA 3.47Å; L57-I60 WeakPolarHBondContact O-CB 3.3Å; L57-I60 PolarHBondContact O-N 3.47Å; L58-I60 VanDerWaalsContact C-N 3.32Å; L58-I60 PolarHBondContact O-N 3.42Å; I60-E62 VanDerWaalsContact C-N 3.32Å; I60-E62 PolarHBondContact O-N 3.17Å; I60-R63 PolarHBondContact O-N 3.38Å; I60-R64 WeakPolarHBondContact O-CB 3.31Å; I60-R64 WeakPolarHBondContact O-CG 3.49Å; I60-R64 PolarHBondContact O-N 3.33Å; I60-Y83 HydrophobicContact CD1-CE2 4.3Å; I60-Y83 HydrophobicContact CG2-CE2 4.09Å; I60-L87 HydrophobicContact CG2-CD1 3.74Å
61	F	96.2	Very high	94.6	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-60.2	-42.3	178.9	-85.8	-84.6	0	0	0	111.8	L57 L58 R64 G65 F66 L69 V70 I79 L82 L87	L57-F61 VanDerWaalsContact O-CD2 3.23Å; L57-F61 WeakPolarHBondContact O-CD2 3.34Å; L57-F61 PolarHBondContact O-N 3.36Å; L58-F61 PolarHBondContact O-N 2.98Å; F61-R64 PolarHBondContact O-N 3.27Å; F61-G65 PolarHBondContact O-N 2.9Å; F61-G65 VanDerWaalsContact O-N 3.17Å; F61-F66 HydrophobicContact CD1-CB 3.64Å; F61-F66 HydrophobicContact CE1-CB 4.43Å; F61-F66 PolarHBondContact O-N 3.42Å; F61-L69 HydrophobicContact CD1-CD2 4.43Å; F61-L69 HydrophobicContact CE1-CD2 3.93Å; F61-V70 HydrophobicContact CB-CG1 4.07Å; F61-V70 HydrophobicContact CB-CG2 3.71Å; F61-V70 HydrophobicContact CD1-CG1 3.58Å; F61-V70 HydrophobicContact CD2-CG1 3.55Å; F61-V70 HydrophobicContact CE1-CG1 3.85Å; F61-V70 HydrophobicContact CE2-CG1 3.81Å; F61-V70 HydrophobicContact CG-CB 4.41Å; F61-V70 HydrophobicContact CG-CG1 3.46Å; F61-V70 VanDerWaalsContact CG-CG1 3.46Å; F61-V70 HydrophobicContact CG-CG2 4.08Å; F61-V70 HydrophobicContact CZ-CG1 3.94Å; F61-I79 HydrophobicContact CD2-CG2 4.12Å; F61-I79 HydrophobicContact CE2-CG2 3.63Å; F61-L82 HydrophobicContact CE1-CB 4.08Å; F61-L82 HydrophobicContact CZ-CB 3.65Å; F61-L87 HydrophobicContact CD1-CD1 3.99Å; F61-L87 HydrophobicContact CD2-CD1 4.13Å; F61-L87 HydrophobicContact CE1-CD1 3.78Å; F61-L87 HydrophobicContact CE1-CG 4.07Å; F61-L87 HydrophobicContact CE2-CD1 3.94Å; F61-L87 HydrophobicContact CG-CD1 4.14Å; F61-L87 HydrophobicContact CZ-CD1 3.76Å; F61-L87 HydrophobicContact CZ-CG 4.29Å
62	E	95.1	Very high	94.3	Very high	69 Å²	69	60 Å²	60	32%	0.322	33%	0.325	S	S	.	.	H	α-helix	trans	-63.6	-45.6	176.5	-178.9	169.7	-150	0	0	112.1	K39 L58 E59 I60 R64 G65 K67	K39-E62 IonicContact NZ-OE1 3.84Å; K39-E62 IonicContact NZ-OE2 3.79Å; K39-E62 PolarHBondContact NZ-OE2 3.33Å; L58-E62 WeakPolarHBondContact O-CB 3.38Å; L58-E62 PolarHBondContact O-N 2.85Å; E59-E62 PolarHBondContact O-N 3.42Å; I60-E62 VanDerWaalsContact C-N 3.32Å; I60-E62 PolarHBondContact O-N 3.17Å; E62-R64 PolarHBondContact O-N 3.02Å; E62-G65 PolarHBondContact O-N 3.08Å; E62-G65 VanDerWaalsContact O-N 3.13Å; E62-K67 HydrophobicContact CG-CD 4.11Å; E62-K67 IonicContact OE1-NZ 2.57Å; E62-K67 PolarHBondContact OE1-NZ 3.32Å
63	R	94.7	Very high	93.9	Very high	129 Å²	129	60.8 Å²	60.8	49%	0.487	33%	0.33	S	S	.	.	H	α-helix	trans	-63	-31.3	177.8	-72.6	168.7	59.1	71.4	2.6	112.7	E35 E59 I60 G65	E35-R63 IonicContact OE1-CZ 2.95Å; E35-R63 VanDerWaalsContact OE1-CZ 3.32Å; E35-R63 IonicContact OE1-NE 2.82Å; E35-R63 PolarHBondContact OE1-NE 2.78Å; E35-R63 IonicContact OE1-NH2 3.69Å; E35-R63 PolarHBondContact OE1-NH2 3.43Å; E59-R63 HydrophobicContact CG-CG 4.35Å; E59-R63 WeakPolarHBondContact O-CB 2.89Å; E59-R63 WeakPolarHBondContact O-CD 3.43Å; E59-R63 WeakPolarHBondContact O-CG 3.45Å; E59-R63 PolarHBondContact O-N 2.95Å; I60-R63 PolarHBondContact O-N 3.38Å; R63-G65 VanDerWaalsContact C-N 3.35Å
64	R	94.3	Very high	93.5	Very high	72 Å²	72	64.8 Å²	64.8	27%	0.272	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	2.2	178.5	-65	-178.8	-174.3	148.8	9.1	113.6	E35 I60 F61 E62 F66 L87	E35-R64 IonicContact OE2-CZ 2.74Å; E35-R64 IonicContact OE2-NH2 3.32Å; E35-R64 PolarHBondContact OE2-NH2 2.87Å; I60-R64 WeakPolarHBondContact O-CB 3.31Å; I60-R64 WeakPolarHBondContact O-CG 3.49Å; I60-R64 PolarHBondContact O-N 3.33Å; F61-R64 PolarHBondContact O-N 3.27Å; E62-R64 PolarHBondContact O-N 3.02Å; R64-F66 HydrophobicContact CB-CD2 3.86Å; R64-F66 HydrophobicContact CB-CE2 4.3Å; R64-F66 WeakPolarHBondContact O-CD2 3.42Å; R64-L87 HydrophobicContact CB-CD2 4Å; R64-L87 HydrophobicContact CG-CD2 4.4Å
65	G	95	Very high	93.4	Very high	63 Å²	63	65 Å²	65	65%	0.649	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.8	11	176.4	0	0	0	0	0	115.2	F61 E62 R63	F61-G65 PolarHBondContact O-N 2.9Å; F61-G65 VanDerWaalsContact O-N 3.17Å; E62-G65 PolarHBondContact O-N 3.08Å; E62-G65 VanDerWaalsContact O-N 3.13Å; R63-G65 VanDerWaalsContact C-N 3.35Å
66	F	94.8	Very high	93.4	Very high	78 Å²	78	62.8 Å²	62.8	34%	0.342	34%	0.339	S	S	.	.			trans	-104	27	-177.9	-66.3	-75.1	0	0	0	112.9	F61 R64 S68 L69 L87	F61-F66 HydrophobicContact CD1-CB 3.64Å; F61-F66 HydrophobicContact CE1-CB 4.43Å; F61-F66 PolarHBondContact O-N 3.42Å; R64-F66 HydrophobicContact CB-CD2 3.86Å; R64-F66 HydrophobicContact CB-CE2 4.3Å; R64-F66 WeakPolarHBondContact O-CD2 3.42Å; F66-S68 PolarHBondContact O-N 3.46Å; F66-L69 HydrophobicContact CB-CB 4.34Å; F66-L69 HydrophobicContact CB-CD2 4.49Å; F66-L69 HydrophobicContact CD1-CD2 4.47Å; F66-L69 VanDerWaalsContact O-CB 3.3Å; F66-L69 WeakPolarHBondContact O-CB 3.41Å; F66-L69 PolarHBondContact O-N 3.36Å; F66-L87 HydrophobicContact CD2-CD2 3.49Å; F66-L87 VanDerWaalsContact CD2-CD2 3.49Å; F66-L87 HydrophobicContact CE2-CD2 3.64Å; F66-L87 HydrophobicContact CG-CD2 4.45Å
67	K	93.5	Very high	93.3	Very high	124 Å²	124	68.2 Å²	68.2	54%	0.539	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-37.3	-178.7	-172.8	175.3	-173.7	162.9	0	113.2	E62 L69 V70 S71	E62-K67 HydrophobicContact CG-CD 4.11Å; E62-K67 IonicContact OE1-NZ 2.57Å; E62-K67 PolarHBondContact OE1-NZ 3.32Å; K67-L69 VanDerWaalsContact C-N 3.27Å; K67-L69 PolarHBondContact O-N 3.16Å; K67-V70 WeakPolarHBondContact O-CG2 3.47Å; K67-V70 PolarHBondContact O-N 2.94Å; K67-S71 PolarHBondContact O-N 3.43Å
68	S	93.4	Very high	93.2	Very high	98 Å²	98	72.7 Å²	72.7	69%	0.685	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-27.8	178.8	50	0	0	0	0	113.3	F66 V70 S71	F66-S68 PolarHBondContact O-N 3.46Å; S68-V70 VanDerWaalsContact C-N 3.33Å; S68-S71 PolarHBondContact O-OG 3.19Å
69	L	92.4	Very high	93.3	Very high	58 Å²	58	70 Å²	70	30%	0.304	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-30.8	-178.1	-173.6	66.4	0	0	0	112.1	F61 F66 K67 L82 H86	F61-L69 HydrophobicContact CD1-CD2 4.43Å; F61-L69 HydrophobicContact CE1-CD2 3.93Å; F66-L69 HydrophobicContact CB-CB 4.34Å; F66-L69 HydrophobicContact CB-CD2 4.49Å; F66-L69 HydrophobicContact CD1-CD2 4.47Å; F66-L69 VanDerWaalsContact O-CB 3.3Å; F66-L69 WeakPolarHBondContact O-CB 3.41Å; F66-L69 PolarHBondContact O-N 3.36Å; K67-L69 VanDerWaalsContact C-N 3.27Å; K67-L69 PolarHBondContact O-N 3.16Å; L69-L82 HydrophobicContact CD1-CD2 4.08Å; L69-L82 HydrophobicContact CD2-CB 4.45Å; L69-L82 HydrophobicContact CD2-CD2 4.12Å; L69-L82 HydrophobicContact CG-CD1 4.17Å; L69-L82 HydrophobicContact CG-CD2 4.01Å; L69-H86 HydrophobicContact CD2-CB 4.15Å; L69-H86 WeakPolarHBondContact CD2-CD2 3.25Å
70	V	93.9	Very high	93.2	Very high	8 Å²	8	70.3 Å²	70.3	5%	0.048	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.3	6.7	-178.3	-66.2	0	0	0	0	113.5	L58 F61 K67 S68 N72 V73 I79 L82	L58-V70 HydrophobicContact CD2-CB 3.7Å; L58-V70 HydrophobicContact CD2-CG1 4.49Å; L58-V70 HydrophobicContact CD2-CG2 3.61Å; F61-V70 HydrophobicContact CB-CG1 4.07Å; F61-V70 HydrophobicContact CB-CG2 3.71Å; F61-V70 HydrophobicContact CD1-CG1 3.58Å; F61-V70 HydrophobicContact CD2-CG1 3.55Å; F61-V70 HydrophobicContact CE1-CG1 3.85Å; F61-V70 HydrophobicContact CE2-CG1 3.81Å; F61-V70 HydrophobicContact CG-CB 4.41Å; F61-V70 HydrophobicContact CG-CG1 3.46Å; F61-V70 VanDerWaalsContact CG-CG1 3.46Å; F61-V70 HydrophobicContact CG-CG2 4.08Å; F61-V70 HydrophobicContact CZ-CG1 3.94Å; K67-V70 WeakPolarHBondContact O-CG2 3.47Å; K67-V70 PolarHBondContact O-N 2.94Å; S68-V70 VanDerWaalsContact C-N 3.33Å; V70-N72 VanDerWaalsContact C-N 3.26Å; V70-N72 PolarHBondContact O-N 3.46Å; V70-V73 PolarHBondContact O-N 2.88Å; V70-I79 HydrophobicContact CG1-CG2 4.43Å; V70-L82 HydrophobicContact CG1-CD1 4.05Å
71	S	89.5	Confident	93.1	Very high	82 Å²	82	74.1 Å²	74.1	57%	0.573	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-27.9	-173.4	70.1	0	0	0	0	114	K67 S68	K67-S71 PolarHBondContact O-N 3.43Å; S68-S71 PolarHBondContact O-OG 3.19Å
72	N	88.3	Confident	93	Very high	151 Å²	151	75.1 Å²	75.1	81%	0.807	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	10.7	-174.8	-59.9	-25.4	0	0	0	112.7	V70	V70-N72 VanDerWaalsContact C-N 3.26Å; V70-N72 PolarHBondContact O-N 3.46Å
73	V	85.6	Confident	93	Very high	23 Å²	23	72 Å²	72	14%	0.139	38%	0.384	C	S	.	.			trans	-101.9	128.7	-174.1	-171.5	0	0	0	0	110	V70 H78 I79 L82	V70-V73 PolarHBondContact O-N 2.88Å; V73-H78 HydrophobicContact CG1-CB 3.54Å; V73-H78 WeakPolarHBondContact CG1-CD2 3.43Å; V73-H78 VanDerWaalsContact CG2-CD2 3.47Å; V73-H78 WeakPolarHBondContact CG2-CD2 3.4Å; V73-I79 HydrophobicContact CB-CG1 3.97Å; V73-I79 HydrophobicContact CG1-CB 4.49Å; V73-I79 HydrophobicContact CG1-CD1 4.26Å; V73-I79 HydrophobicContact CG1-CG1 3.38Å; V73-L82 HydrophobicContact CG2-CD1 3.81Å
74	N	85.4	Confident	92.9	Very high	135 Å²	135	69.9 Å²	69.9	72%	0.722	38%	0.377	S	S	*	.			trans	-120.8	-8.3	-177.6	63	-4.1	0	0	0	114.5
75	T	93.4	Very high	92.8	Very high	67 Å²	67	70.1 Å²	70.1	41%	0.411	38%	0.384	S	S	.	.			trans	-106.1	140	179	61.8	0	0	0	0	111.5	E77 H78 I79	T75-E77 VanDerWaalsContact C-N 3.31Å; T75-E77 PolarHBondContact O-N 2.93Å; T75-H78 PolarHBondContact O-N 3.03Å; T75-H78 VanDerWaalsContact OG1-CB 3.23Å; T75-H78 WeakPolarHBondContact OG1-CB 3.47Å; T75-I79 WeakPolarHBondContact O-CG1 3.19Å; T75-I79 PolarHBondContact O-N 3.21Å
76	L	94.8	Very high	92.6	Very high	67 Å²	67	71.3 Å²	71.3	35%	0.351	37%	0.372	S	S	.	.	H	α-helix	trans	-56.4	-46.4	177.6	178.8	63	0	0	0	111.5	M52 I54 L57 H78 I79 V80	M52-L76 WeakPolarHBondContact O-CD1 3.47Å; I54-L76 HydrophobicContact CD1-CB 4.47Å; I54-L76 HydrophobicContact CG1-CB 4.24Å; I54-L76 HydrophobicContact CG1-CD1 4.13Å; L57-L76 HydrophobicContact CD1-CD1 3.51Å; L76-H78 VanDerWaalsContact C-N 3.3Å; L76-H78 PolarHBondContact O-N 3.07Å; L76-I79 PolarHBondContact O-N 3.36Å; L76-V80 HydrophobicContact CD1-CG2 4.04Å; L76-V80 HydrophobicContact CG-CG2 4.21Å; L76-V80 WeakPolarHBondContact O-CB 3.29Å; L76-V80 VanDerWaalsContact O-CG2 3.28Å; L76-V80 WeakPolarHBondContact O-CG2 3.28Å; L76-V80 PolarHBondContact O-N 3.3Å
77	E	95	Very high	92.5	Very high	148 Å²	148	68.5 Å²	68.5	69%	0.692	36%	0.36	S	S	*	.	H	α-helix	trans	-54.3	-45	179.7	-176.2	-178.8	-175.3	0	0	112.3	T75 V80 N81	T75-E77 VanDerWaalsContact C-N 3.31Å; T75-E77 PolarHBondContact O-N 2.93Å; E77-V80 PolarHBondContact O-N 3.41Å; E77-N81 VanDerWaalsContact O-CG 3.23Å; E77-N81 PolarHBondContact O-N 2.95Å; E77-N81 PolarHBondContact O-ND2 3.1Å
78	H	94.7	Very high	92	Very high	94 Å²	94	64.6 Å²	64.6	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-69.7	-39	-178.9	-168	108.2	0	0	0	112	V73 T75 L76 V80 N81 L82	V73-H78 HydrophobicContact CG1-CB 3.54Å; V73-H78 WeakPolarHBondContact CG1-CD2 3.43Å; V73-H78 VanDerWaalsContact CG2-CD2 3.47Å; V73-H78 WeakPolarHBondContact CG2-CD2 3.4Å; T75-H78 PolarHBondContact O-N 3.03Å; T75-H78 VanDerWaalsContact OG1-CB 3.23Å; T75-H78 WeakPolarHBondContact OG1-CB 3.47Å; L76-H78 VanDerWaalsContact C-N 3.3Å; L76-H78 PolarHBondContact O-N 3.07Å; H78-V80 VanDerWaalsContact C-N 3.34Å; H78-N81 PolarHBondContact O-N 3.15Å; H78-L82 WeakPolarHBondContact O-CG 3.47Å; H78-L82 PolarHBondContact O-N 3.32Å; H78-L82 VanDerWaalsContact O-N 3.07Å
79	I	96.1	Very high	90.8	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-65.9	-40	176.1	-58.3	173	0	0	0	110.6	I54 L57 L58 F61 V70 V73 T75 L76 L82 Y83	I54-I79 HydrophobicContact CG1-CD1 4.38Å; I54-I79 HydrophobicContact CG2-CD1 3.75Å; L57-I79 HydrophobicContact CB-CG2 3.57Å; L57-I79 HydrophobicContact CD1-CB 4.28Å; L57-I79 HydrophobicContact CD1-CG2 3.82Å; L57-I79 HydrophobicContact CG-CG2 4.23Å; L58-I79 HydrophobicContact CD2-CD1 4.25Å; F61-I79 HydrophobicContact CD2-CG2 4.12Å; F61-I79 HydrophobicContact CE2-CG2 3.63Å; V70-I79 HydrophobicContact CG1-CG2 4.43Å; V73-I79 HydrophobicContact CB-CG1 3.97Å; V73-I79 HydrophobicContact CG1-CB 4.49Å; V73-I79 HydrophobicContact CG1-CD1 4.26Å; V73-I79 HydrophobicContact CG1-CG1 3.38Å; T75-I79 WeakPolarHBondContact O-CG1 3.19Å; T75-I79 PolarHBondContact O-N 3.21Å; L76-I79 PolarHBondContact O-N 3.36Å; I79-L82 PolarHBondContact O-N 3.26Å; I79-Y83 PolarHBondContact O-N 2.85Å
80	V	95.5	Very high	89.3	Confident	10 Å²	10	67.5 Å²	67.5	6%	0.061	35%	0.352	C	S	.	.	H	α-helix	trans	-63.2	-42.7	175.7	169.3	0	0	0	0	110.9	P49 E50 L57 L76 E77 H78 L82 Y83 Y84	P49-V80 HydrophobicContact CB-CG1 4.43Å; P49-V80 HydrophobicContact CB-CG2 4.41Å; P49-V80 HydrophobicContact CG-CG1 4.17Å; E50-V80 HydrophobicContact CG-CG1 4.14Å; L57-V80 HydrophobicContact CD1-CG2 3.96Å; L76-V80 HydrophobicContact CD1-CG2 4.04Å; L76-V80 HydrophobicContact CG-CG2 4.21Å; L76-V80 WeakPolarHBondContact O-CB 3.29Å; L76-V80 VanDerWaalsContact O-CG2 3.28Å; L76-V80 WeakPolarHBondContact O-CG2 3.28Å; L76-V80 PolarHBondContact O-N 3.3Å; E77-V80 PolarHBondContact O-N 3.41Å; H78-V80 VanDerWaalsContact C-N 3.34Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 3.23Å; V80-Y83 WeakPolarHBondContact O-CA 3.2Å; V80-Y83 VanDerWaalsContact O-CB 3.25Å; V80-Y83 WeakPolarHBondContact O-CB 3.23Å; V80-Y83 PolarHBondContact O-N 3.07Å; V80-Y84 HydrophobicContact CG1-CD2 3.78Å; V80-Y84 HydrophobicContact CG1-CE2 3.47Å; V80-Y84 VanDerWaalsContact CG1-CE2 3.47Å; V80-Y84 WeakPolarHBondContact O-CD2 3.32Å; V80-Y84 PolarHBondContact O-N 2.94Å
81	N	93.5	Very high	87.3	Confident	80 Å²	80	72.2 Å²	72.2	43%	0.428	39%	0.385	S	S	.	.	H	α-helix	trans	-59.7	-45.1	175.1	-70.5	-21.8	0	0	0	111.7	E77 H78 Y83 Y84 D85	E77-N81 VanDerWaalsContact O-CG 3.23Å; E77-N81 PolarHBondContact O-N 2.95Å; E77-N81 PolarHBondContact O-ND2 3.1Å; H78-N81 PolarHBondContact O-N 3.15Å; N81-Y83 PolarHBondContact O-N 2.89Å; N81-Y84 PolarHBondContact O-N 3.11Å; N81-D85 PolarHBondContact O-N 3.12Å
82	L	94.6	Very high	85	Confident	21 Å²	21	75.8 Å²	75.8	11%	0.11	40%	0.398	C	S	.	.	H	α-helix	trans	-61	-34.4	173.6	-67.4	171.6	0	0	0	112.1	F61 L69 V70 V73 H78 I79 V80 D85 H86	F61-L82 HydrophobicContact CE1-CB 4.08Å; F61-L82 HydrophobicContact CZ-CB 3.65Å; L69-L82 HydrophobicContact CD1-CD2 4.08Å; L69-L82 HydrophobicContact CD2-CB 4.45Å; L69-L82 HydrophobicContact CD2-CD2 4.12Å; L69-L82 HydrophobicContact CG-CD1 4.17Å; L69-L82 HydrophobicContact CG-CD2 4.01Å; V70-L82 HydrophobicContact CG1-CD1 4.05Å; V73-L82 HydrophobicContact CG2-CD1 3.81Å; H78-L82 WeakPolarHBondContact O-CG 3.47Å; H78-L82 PolarHBondContact O-N 3.32Å; H78-L82 VanDerWaalsContact O-N 3.07Å; I79-L82 PolarHBondContact O-N 3.26Å; V80-L82 VanDerWaalsContact C-N 3.34Å; V80-L82 PolarHBondContact O-N 3.23Å; L82-D85 PolarHBondContact O-N 3.42Å; L82-H86 WeakPolarHBondContact O-CB 3.35Å; L82-H86 PolarHBondContact O-CD2 3.41Å; L82-H86 VanDerWaalsContact O-CD2 3.28Å; L82-H86 PolarHBondContact O-N 2.85Å
83	Y	94.7	Very high	82.9	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.016	39%	0.386	C	S	.	.	H	α-helix	trans	-63.5	-45.8	178.2	-176.1	-80.1	0	0	0	110.2	L46 P49 L57 I60 I79 V80 N81 D85 L87 I88	L46-Y83 WeakPolarHBondContact CA-OH 3.38Å; L46-Y83 WeakPolarHBondContact CB-OH 3.37Å; L46-Y83 WeakPolarHBondContact O-CE1 3.16Å; L46-Y83 PolarHBondContact O-OH 3.47Å; P49-Y83 HydrophobicContact CB-CD1 3.64Å; P49-Y83 HydrophobicContact CB-CD2 4.23Å; P49-Y83 HydrophobicContact CB-CE1 3.94Å; P49-Y83 HydrophobicContact CB-CG 3.82Å; P49-Y83 HydrophobicContact CG-CD1 3.69Å; P49-Y83 HydrophobicContact CG-CE1 3.98Å; P49-Y83 HydrophobicContact CG-CG 4.32Å; L57-Y83 HydrophobicContact CD2-CD2 3.86Å; L57-Y83 HydrophobicContact CD2-CE2 4.4Å; L57-Y83 HydrophobicContact CD2-CG 4.49Å; I60-Y83 HydrophobicContact CD1-CE2 4.3Å; I60-Y83 HydrophobicContact CG2-CE2 4.09Å; I79-Y83 PolarHBondContact O-N 2.85Å; V80-Y83 WeakPolarHBondContact O-CA 3.2Å; V80-Y83 VanDerWaalsContact O-CB 3.25Å; V80-Y83 WeakPolarHBondContact O-CB 3.23Å; V80-Y83 PolarHBondContact O-N 3.07Å; N81-Y83 PolarHBondContact O-N 2.89Å; Y83-D85 VanDerWaalsContact C-N 3.31Å; Y83-D85 PolarHBondContact O-N 3.09Å; Y83-L87 HydrophobicContact CD2-CB 4.19Å; Y83-L87 HydrophobicContact CD2-CD1 3.58Å; Y83-L87 HydrophobicContact CD2-CG 4.43Å; Y83-L87 HydrophobicContact CE2-CB 4.28Å; Y83-L87 HydrophobicContact CE2-CD1 3.95Å; Y83-L87 HydrophobicContact CG-CB 4.31Å; Y83-L87 HydrophobicContact CG-CD1 4.27Å; Y83-L87 WeakPolarHBondContact O-CA 3.22Å; Y83-L87 WeakPolarHBondContact O-CB 3.43Å; Y83-L87 PolarHBondContact O-N 3.01Å; Y83-I88 HydrophobicContact CD1-CD1 4.08Å; Y83-I88 HydrophobicContact CD1-CG1 3.69Å; Y83-I88 HydrophobicContact CE1-CD1 3.88Å; Y83-I88 HydrophobicContact CE1-CG1 3.52Å; Y83-I88 PolarHBondContact O-N 3.28Å; Y83-I88 VanDerWaalsContact O-N 3.09Å
84	Y	93.2	Very high	81.1	Confident	85 Å²	85	82.7 Å²	82.7	33%	0.333	42%	0.418	S	S	.	.	H	α-helix	trans	-61.9	-37.6	174.9	-77.5	-65.4	0	0	0	113.2	P49 E50 V80 N81 I88	P49-Y84 HydrophobicContact CG-CE1 4.37Å; P49-Y84 HydrophobicContact CG-CE2 3.82Å; E50-Y84 WeakPolarHBondContact OE1-CE2 3.46Å; E50-Y84 VanDerWaalsContact OE1-CZ 3.23Å; E50-Y84 PolarHBondContact OE1-OH 3.14Å; E50-Y84 PolarHBondContact OE2-OH 2.7Å; V80-Y84 HydrophobicContact CG1-CD2 3.78Å; V80-Y84 HydrophobicContact CG1-CE2 3.47Å; V80-Y84 VanDerWaalsContact CG1-CE2 3.47Å; V80-Y84 WeakPolarHBondContact O-CD2 3.32Å; V80-Y84 PolarHBondContact O-N 2.94Å; N81-Y84 PolarHBondContact O-N 3.11Å; Y84-I88 HydrophobicContact CD1-CD1 3.24Å; Y84-I88 HydrophobicContact CD1-CG1 4.03Å; Y84-I88 HydrophobicContact CE1-CD1 3.26Å; Y84-I88 HydrophobicContact CE1-CG1 4.43Å; Y84-I88 HydrophobicContact CG-CD1 4.31Å
85	D	91.1	Very high	78.9	Confident	77 Å²	77	84.9 Å²	84.9	41%	0.412	42%	0.423	S	S	.	.	H	α-helix	trans	-77.5	-37	-176.5	-80.6	-30.4	0	0	0	114.2	N81 L82 Y83 R90	N81-D85 PolarHBondContact O-N 3.12Å; L82-D85 PolarHBondContact O-N 3.42Å; Y83-D85 VanDerWaalsContact C-N 3.31Å; Y83-D85 PolarHBondContact O-N 3.09Å; D85-R90 IonicContact OD1-NH2 2.8Å; D85-R90 PolarHBondContact OD1-NH2 3.03Å
86	H	91.9	Very high	76.5	Confident	87 Å²	87	85.6 Å²	85.6	40%	0.403	43%	0.432	S	S	.	.	H	α-helix	trans	-114.3	-25.2	-168	-62.7	-80.8	0	0	0	114.5	L69 L82	L69-H86 HydrophobicContact CD2-CB 4.15Å; L69-H86 WeakPolarHBondContact CD2-CD2 3.25Å; L82-H86 WeakPolarHBondContact O-CB 3.35Å; L82-H86 PolarHBondContact O-CD2 3.41Å; L82-H86 VanDerWaalsContact O-CD2 3.28Å; L82-H86 PolarHBondContact O-N 2.85Å
87	L	91.3	Very high	73.8	Confident	19 Å²	19	88.5 Å²	88.5	10%	0.099	45%	0.452	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113	-30.4	-169.6	-57.9	-175.2	0	0	0	113.7	I60 F61 R64 F66 Y83 P89	I60-L87 HydrophobicContact CG2-CD1 3.74Å; F61-L87 HydrophobicContact CD1-CD1 3.99Å; F61-L87 HydrophobicContact CD2-CD1 4.13Å; F61-L87 HydrophobicContact CE1-CD1 3.78Å; F61-L87 HydrophobicContact CE1-CG 4.07Å; F61-L87 HydrophobicContact CE2-CD1 3.94Å; F61-L87 HydrophobicContact CG-CD1 4.14Å; F61-L87 HydrophobicContact CZ-CD1 3.76Å; F61-L87 HydrophobicContact CZ-CG 4.29Å; R64-L87 HydrophobicContact CB-CD2 4Å; R64-L87 HydrophobicContact CG-CD2 4.4Å; F66-L87 HydrophobicContact CD2-CD2 3.49Å; F66-L87 VanDerWaalsContact CD2-CD2 3.49Å; F66-L87 HydrophobicContact CE2-CD2 3.64Å; F66-L87 HydrophobicContact CG-CD2 4.45Å; Y83-L87 HydrophobicContact CD2-CB 4.19Å; Y83-L87 HydrophobicContact CD2-CD1 3.58Å; Y83-L87 HydrophobicContact CD2-CG 4.43Å; Y83-L87 HydrophobicContact CE2-CB 4.28Å; Y83-L87 HydrophobicContact CE2-CD1 3.95Å; Y83-L87 HydrophobicContact CG-CB 4.31Å; Y83-L87 HydrophobicContact CG-CD1 4.27Å; Y83-L87 WeakPolarHBondContact O-CA 3.22Å; Y83-L87 WeakPolarHBondContact O-CB 3.43Å; Y83-L87 PolarHBondContact O-N 3.01Å; L87-P89 WeakPolarHBondContact O-CD 3.4Å
88	I	83.9	Confident	71.2	Confident	42 Å²	42	86.1 Å²	86.1	22%	0.215	45%	0.451	C	S	.	.	S	Bend	trans	-69.6	124.7	173.7	-64.3	-152.7	0	0	0	108.7	Y83 Y84 R90	Y83-I88 HydrophobicContact CD1-CD1 4.08Å; Y83-I88 HydrophobicContact CD1-CG1 3.69Å; Y83-I88 HydrophobicContact CE1-CD1 3.88Å; Y83-I88 HydrophobicContact CE1-CG1 3.52Å; Y83-I88 PolarHBondContact O-N 3.28Å; Y83-I88 VanDerWaalsContact O-N 3.09Å; Y84-I88 HydrophobicContact CD1-CD1 3.24Å; Y84-I88 HydrophobicContact CD1-CG1 4.03Å; Y84-I88 HydrophobicContact CE1-CD1 3.26Å; Y84-I88 HydrophobicContact CE1-CG1 4.43Å; Y84-I88 HydrophobicContact CG-CD1 4.31Å; I88-R90 PolarHBondContact O-N 2.92Å
89	P	68.3	Low	68.3	Low	115 Å²	115	89.3 Å²	89.3	75%	0.747	47%	0.466	S	S	*	.			trans	-58.3	105.6	170.6	-21.4	33.3	0	0	0	108.5	L87 S91	L87-P89 WeakPolarHBondContact O-CD 3.4Å; P89-S91 PolarHBondContact O-N 2.85Å
90	R	61.6	Low	65.7	Low	102 Å²	102	97.7 Å²	97.7	39%	0.385	51%	0.51	S	S	.	.			trans	-68.1	104.4	171.3	-71.3	167.9	164.8	-170.7	4.9	105.7	D85 I88 N92 R93	D85-R90 IonicContact OD1-NH2 2.8Å; D85-R90 PolarHBondContact OD1-NH2 3.03Å; I88-R90 PolarHBondContact O-N 2.92Å; R90-N92 VanDerWaalsContact C-N 3.33Å; R90-N92 PolarHBondContact O-N 3.31Å; R90-R93 HydrophobicContact CB-CB 3.89Å; R90-R93 VanDerWaalsContact CD-CD 3.47Å; R90-R93 VanDerWaalsContact CZ-NH1 3.26Å; R90-R93 VanDerWaalsContact CZ-NH2 3.32Å; R90-R93 VanDerWaalsContact NH2-NH1 3.1Å
91	S	51.5	Low	63	Low	108 Å²	108	102 Å²	102	76%	0.755	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	103.4	168.8	54.9	0	0	0	0	107	P89 R93	P89-S91 PolarHBondContact O-N 2.85Å; S91-R93 PolarHBondContact O-N 2.93Å
92	N	40.3	Very low	60.4	Low	157 Å²	157	106.2 Å²	106.2	84%	0.84	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	51.1	54.4	167.4	-41.3	4.6	0	0	0	112.8	R90 E94	R90-N92 VanDerWaalsContact C-N 3.33Å; R90-N92 PolarHBondContact O-N 3.31Å; N92-E94 PolarHBondContact O-N 3.33Å; N92-E94 VanDerWaalsContact O-N 3.11Å
93	R	44.4	Very low	57.4	Low	145 Å²	145	111.1 Å²	111.1	55%	0.547	59%	0.589	S	S	.	*			trans	-75.8	103.3	170.2	-164.9	174.2	172.4	160.7	127.9	107.2	R90 S91 E95	R90-R93 HydrophobicContact CB-CB 3.89Å; R90-R93 VanDerWaalsContact CD-CD 3.47Å; R90-R93 VanDerWaalsContact CZ-NH1 3.26Å; R90-R93 VanDerWaalsContact CZ-NH2 3.32Å; R90-R93 VanDerWaalsContact NH2-NH1 3.1Å; S91-R93 PolarHBondContact O-N 2.93Å; R93-E95 PolarHBondContact O-N 3.3Å
94	E	47.2	Very low	54.5	Low	174 Å²	174	115.9 Å²	115.9	81%	0.813	62%	0.618	S	S	*	*			trans	-45.8	124.7	163.4	-62.4	-174.5	167.5	0	0	107.9	N92 S96	N92-E94 PolarHBondContact O-N 3.33Å; N92-E94 VanDerWaalsContact O-N 3.11Å; E94-S96 VanDerWaalsContact C-N 3.29Å; E94-S96 PolarHBondContact O-N 2.96Å; E94-S96 PolarHBondContact O-OG 3.45Å
95	E	40.3	Very low	51.5	Low	180 Å²	180	116.4 Å²	116.4	84%	0.841	64%	0.635	S	S	*	*			trans	-57.4	88.7	-177.4	-75	-179.5	147	0	0	110.6	R93 V97	R93-E95 PolarHBondContact O-N 3.3Å; E95-V97 VanDerWaalsContact C-N 3.26Å; E95-V97 HydrophobicContact CB-CG2 4.24Å; E95-V97 PolarHBondContact O-N 3.22Å; E95-V97 VanDerWaalsContact O-N 3.15Å
96	S	41.8	Very low	49	Very low	83 Å²	83	118.6 Å²	118.6	58%	0.58	65%	0.65	S	S	*	*			trans	-79.8	88.9	156.1	-4.4	0	0	0	0	105.7	E94 S98	E94-S96 VanDerWaalsContact C-N 3.29Å; E94-S96 PolarHBondContact O-N 2.96Å; E94-S96 PolarHBondContact O-OG 3.45Å; S96-S98 PolarHBondContact O-N 3.03Å
97	V	38.7	Very low	46.2	Very low	128 Å²	128	123 Å²	123	78%	0.776	68%	0.677	S	S	*	*			trans	-64	82.5	168.2	-176.5	0	0	0	0	107.4	E95 E99	E95-V97 VanDerWaalsContact C-N 3.26Å; E95-V97 HydrophobicContact CB-CG2 4.24Å; E95-V97 PolarHBondContact O-N 3.22Å; E95-V97 VanDerWaalsContact O-N 3.15Å; V97-E99 PolarHBondContact O-N 3.28Å
98	S	40.2	Very low	43.5	Very low	97 Å²	97	126.3 Å²	126.3	68%	0.678	71%	0.707	S	S	*	*			trans	-82.2	90	168.9	-51.8	0	0	0	0	107.8	S96 L100	S96-S98 PolarHBondContact O-N 3.03Å; S98-L100 PolarHBondContact O-N 3.04Å; S98-L100 VanDerWaalsContact O-N 3.08Å
99	E	34.9	Very low	41.2	Very low	162 Å²	162	129.4 Å²	129.4	76%	0.757	73%	0.732	S	S	*	*			trans	37.1	66.3	136	-155.7	167.2	-159.8	0	0	115.8	V97 T101	V97-E99 PolarHBondContact O-N 3.28Å; E99-T101 HydrophobicContact CG-CG2 4.23Å; E99-T101 PolarHBondContact O-N 3Å
100	L	40.9	Very low	39.9	Very low	175 Å²	175	130.6 Å²	130.6	92%	0.916	73%	0.732	S	S	*	*			trans	-75.3	84.1	156.3	-117.3	115.5	0	0	0	107.1	S98 E102	S98-L100 PolarHBondContact O-N 3.04Å; S98-L100 VanDerWaalsContact O-N 3.08Å; L100-E102 PolarHBondContact O-N 3.23Å; L100-E102 VanDerWaalsContact O-N 3.09Å
101	T	39.3	Very low	38.8	Very low	102 Å²	102	132.5 Å²	132.5	63%	0.626	75%	0.75	S	S	*	*			trans	-61.9	106	158.5	28	0	0	0	0	107	E99 C103	E99-T101 HydrophobicContact CG-CG2 4.23Å; E99-T101 PolarHBondContact O-N 3Å; T101-C103 VanDerWaalsContact C-N 3.3Å; T101-C103 PolarHBondContact O-N 3.09Å
102	E	38	Very low	38.4	Very low	167 Å²	167	133 Å²	133	78%	0.78	75%	0.753	S	S	*	*			trans	-57.2	91.2	169.9	-174	174.2	-176.8	0	0	109	L100 T104	L100-E102 PolarHBondContact O-N 3.23Å; L100-E102 VanDerWaalsContact O-N 3.09Å; E102-T104 PolarHBondContact O-N 2.86Å
103	C	31.4	Very low	38.2	Very low	125 Å²	125	133.4 Å²	133.4	85%	0.845	76%	0.756	S	S	*	*			trans	-73.8	77.7	166.4	-68	0	0	0	0	109	T101	T101-C103 VanDerWaalsContact C-N 3.3Å; T101-C103 PolarHBondContact O-N 3.09Å
104	T	33.7	Very low	38.2	Very low	103 Å²	103	131.6 Å²	131.6	63%	0.632	77%	0.765	S	S	*	*			trans	-115.4	93.4	165.8	-51.2	0	0	0	0	109.2	E102	E102-T104 PolarHBondContact O-N 2.86Å
105	S	31.6	Very low	37.7	Very low	97 Å²	97	131.1 Å²	131.1	68%	0.678	77%	0.768	S	S	*	*				35.1	101.8	129.2	167.2	0	0	0	0	117.2
106	V	37.7	Very low	38.3	Very low	123 Å²	123	129.7 Å²	129.7	75%	0.745	77%	0.766	S	S	*	*				172.7	116.4	103.9	-78.9	0	0	0	0	109.9	A108	V106-A108 PolarHBondContact O-N 2.84Å; V106-A108 VanDerWaalsContact O-N 3.15Å
107	N	32.8	Very low	38.3	Very low	180 Å²	180	131.4 Å²	131.4	96%	0.963	78%	0.775	S	S	*	*			trans	-72.4	100.9	161.2	-78.1	-26.9	0	0	0	107.7
108	A	35.3	Very low	38.4	Very low	88 Å²	88	135 Å²	135	73%	0.727	78%	0.78	S	S	*	*			trans	-128.7	92.9	165.8	0	0	0	0	0	108.5	V106	V106-A108 PolarHBondContact O-N 2.84Å; V106-A108 VanDerWaalsContact O-N 3.15Å
109	S	35.8	Very low	38.4	Very low	106 Å²	106	138.4 Å²	138.4	74%	0.741	79%	0.785	S	S	*	*			trans	-58.9	144.2	163.9	40.3	0	0	0	0	111.7
110	N	40.4	Very low	38.6	Very low	140 Å²	140	139.3 Å²	139.3	75%	0.749	79%	0.787	S	S	*	*			trans	87.8	113.5	160.5	-65.8	0.8	0	0	0	119
111	D	38.2	Very low	38.9	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	77%	0.774	S	S	*	*			trans	50.2	113.3	130.4	-60.4	-37.5	0	0	0	118.1
112	S	43.3	Very low	38.9	Very low	118 Å²	118	137.4 Å²	137.4	83%	0.825	78%	0.777	S	S	*	*				169.4	128.9	119.7	-72.8	0	0	0	0	112.1	S114	S112-S114 PolarHBondContact O-N 2.89Å
113	N	37	Very low	39	Very low	167 Å²	167	134.4 Å²	134.4	89%	0.893	78%	0.775	S	S	*	*			trans	-20.6	120.2	163.3	-72.4	-36.6	0	0	0	116.7
114	S	44.5	Very low	39.5	Very low	107 Å²	107	133.4 Å²	133.4	75%	0.748	77%	0.769	S	S	*	*			trans	-148.1	123.5	144.3	57.9	0	0	0	0	111.2	S112 L116	S112-S114 PolarHBondContact O-N 2.89Å; S114-L116 PolarHBondContact O-N 3.09Å
115	N	35.9	Very low	40.1	Very low	163 Å²	163	139.6 Å²	139.6	87%	0.872	78%	0.781	S	S	*	*			trans	-76.7	111	175.5	-71	-65.9	0	0	0	109
116	L	52.7	Low	40.9	Very low	150 Å²	150	144 Å²	144	79%	0.785	79%	0.788	S	S	*	*			trans	-134.5	140.7	161.9	-74	175.9	0	0	0	109.6	S114 K118	S114-L116 PolarHBondContact O-N 3.09Å; L116-K118 PolarHBondContact O-N 3.2Å
117	P	41.2	Very low	41.6	Very low	119 Å²	119	148.8 Å²	148.8	77%	0.773	79%	0.792	S	S	*	*			trans	-66.2	128.5	-167.4	26.7	-31.6	0	0	0	109.7	E119	P117-E119 VanDerWaalsContact C-N 3.26Å; P117-E119 PolarHBondContact O-N 3.14Å
118	K	40.8	Very low	42.8	Very low	203 Å²	203	148 Å²	148	88%	0.883	79%	0.785	S	S	*	*			trans	-62.7	90.2	169.9	-68.7	-179.9	178.8	179.2	0	108.4	L116 K120	L116-K118 PolarHBondContact O-N 3.2Å; K118-K120 PolarHBondContact O-N 3.32Å
119	E	40.8	Very low	43.9	Very low	170 Å²	170	150.6 Å²	150.6	79%	0.794	79%	0.786	S	S	*	*			trans	-61.3	109.2	166.3	-166.7	176	164.5	0	0	107.1	P117 V121	P117-E119 VanDerWaalsContact C-N 3.26Å; P117-E119 PolarHBondContact O-N 3.14Å; E119-V121 PolarHBondContact O-N 3.43Å
120	K	40.3	Very low	45	Very low	181 Å²	181	149.9 Å²	149.9	79%	0.787	77%	0.774	S	S	*	*			trans	-67	84.7	171.7	-75.6	-177.4	176.5	-178	0	107.5	K118 N122	K118-K120 PolarHBondContact O-N 3.32Å; K120-N122 PolarHBondContact O-N 2.51Å
121	V	45.6	Very low	46.5	Very low	108 Å²	108	149.2 Å²	149.2	66%	0.655	77%	0.77	S	S	*	*			trans	-69	91.7	163.8	-175.7	0	0	0	0	105.8	E119 S123	E119-V121 PolarHBondContact O-N 3.43Å; V121-S123 PolarHBondContact O-N 3.11Å
122	N	40.8	Very low	48	Very low	129 Å²	129	150.1 Å²	150.1	69%	0.69	78%	0.775	S	S	*	*			trans	-59.7	92.2	166.6	-61.6	-27.3	0	0	0	106.3	K120 S124	K120-N122 PolarHBondContact O-N 2.51Å; N122-S124 PolarHBondContact O-N 3.19Å; N122-S124 PolarHBondContact O-OG 2.9Å
123	S	39.6	Very low	49.1	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	77%	0.766	S	S	*	*			trans	-64	79.6	166.1	-80.6	0	0	0	0	107.4	V121 R125	V121-S123 PolarHBondContact O-N 3.11Å; S123-R125 PolarHBondContact O-N 3.35Å
124	S	42.7	Very low	50.8	Low	103 Å²	103	147.6 Å²	147.6	72%	0.72	75%	0.752	S	S	*	*			trans	-69.1	83.4	164.8	37.3	0	0	0	0	105.9	N122 K126	N122-S124 PolarHBondContact O-N 3.19Å; N122-S124 PolarHBondContact O-OG 2.9Å; S124-K126 PolarHBondContact O-N 3.31Å
125	R	45.2	Very low	52.1	Low	234 Å²	234	148 Å²	148	88%	0.883	75%	0.749	S	S	*	*			trans	-57.9	90.6	166.7	-145.2	-178	-74.5	-175.5	-4.5	105.5	S123 R127	S123-R125 PolarHBondContact O-N 3.35Å; R125-R127 PolarHBondContact O-N 2.94Å
126	K	49.4	Very low	53.9	Low	190 Å²	190	147.4 Å²	147.4	83%	0.826	74%	0.744	S	S	*	*			trans	-57.7	111.4	176.1	-91.1	-179.9	172.8	176	0	106.4	S124 M128	S124-K126 PolarHBondContact O-N 3.31Å; K126-M128 PolarHBondContact O-N 3.43Å
127	R	51.3	Low	55	Low	223 Å²	223	145.7 Å²	145.7	84%	0.842	74%	0.74	S	S	*	*			trans	-56.1	112	170.7	-63.8	-157.2	-71.8	-161.4	-0	107.1	R125 D129	R125-R127 PolarHBondContact O-N 2.94Å; R127-D129 PolarHBondContact O-N 3.39Å
128	M	57.7	Low	56.3	Low	163 Å²	163	148.5 Å²	148.5	80%	0.803	74%	0.737	S	S	*	*			trans	-89.8	19.1	-176.7	-152.2	127.6	75.9	0	0	111.2	K126	K126-M128 PolarHBondContact O-N 3.43Å
129	D	58.9	Low	57.7	Low	142 Å²	142	141.4 Å²	141.4	76%	0.759	71%	0.709	S	S	*	*			trans	-102.3	14.5	-162.9	-50.9	-40.1	0	0	0	113.4	R127	R127-D129 PolarHBondContact O-N 3.39Å
130	D	59.6	Low	59.2	Low	91 Å²	91	137.9 Å²	137.9	49%	0.487	70%	0.699	S	S	.	*			trans	-129.3	70	178.8	-166.1	2.8	0	0	0	110.5	D132 N133	D130-D132 VanDerWaalsContact C-N 3.28Å; D130-N133 VanDerWaalsContact CG-ND2 3.29Å; D130-N133 WeakPolarHBondContact OD1-CB 3.38Å; D130-N133 PolarHBondContact OD1-N 2.74Å; D130-N133 VanDerWaalsContact OD1-N 3.14Å; D130-N133 PolarHBondContact OD1-ND2 3.22Å; D130-N133 VanDerWaalsContact OD1-ND2 3.07Å; D130-N133 PolarHBondContact OD2-ND2 3.27Å
131	L	71.5	Confident	60.9	Low	127 Å²	127	138.6 Å²	138.6	67%	0.665	70%	0.702	S	S	*	*			trans	-77	-20	168.7	-68.8	176.1	0	0	0	111.8	N133 L134	L131-N133 PolarHBondContact O-N 2.82Å; L131-L134 HydrophobicContact CD2-CD2 4.12Å; L131-L134 VanDerWaalsContact O-CB 3.3Å; L131-L134 WeakPolarHBondContact O-CB 3.36Å; L131-L134 PolarHBondContact O-N 3.36Å; L131-L134 VanDerWaalsContact O-N 3.08Å
132	D	69.2	Low	61.6	Low	161 Å²	161	143.1 Å²	143.1	86%	0.861	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	-25.4	-179.9	-68.8	-24	0	0	0	111.8	D130	D130-D132 VanDerWaalsContact C-N 3.28Å
133	N	66.2	Low	62.4	Low	119 Å²	119	143.7 Å²	143.7	64%	0.636	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.2	14.7	172.6	-64.9	-44.9	0	0	0	114.2	D130 L131 V135	D130-N133 VanDerWaalsContact CG-ND2 3.29Å; D130-N133 WeakPolarHBondContact OD1-CB 3.38Å; D130-N133 PolarHBondContact OD1-N 2.74Å; D130-N133 VanDerWaalsContact OD1-N 3.14Å; D130-N133 PolarHBondContact OD1-ND2 3.22Å; D130-N133 VanDerWaalsContact OD1-ND2 3.07Å; D130-N133 PolarHBondContact OD2-ND2 3.27Å; L131-N133 PolarHBondContact O-N 2.82Å; N133-V135 PolarHBondContact O-N 3.39Å
134	L	72.5	Confident	63.1	Low	112 Å²	112	145 Å²	145	59%	0.586	71%	0.707	S	S	*	*			trans	-70.5	93.9	179.4	-175.4	65.6	0	0	0	111.2	L131 I136	L131-L134 HydrophobicContact CD2-CD2 4.12Å; L131-L134 VanDerWaalsContact O-CB 3.3Å; L131-L134 WeakPolarHBondContact O-CB 3.36Å; L131-L134 PolarHBondContact O-N 3.36Å; L131-L134 VanDerWaalsContact O-N 3.08Å; L134-I136 HydrophobicContact CG-CG1 4.42Å; L134-I136 PolarHBondContact O-N 3.07Å
135	V	73.1	Confident	63.6	Low	115 Å²	115	145.6 Å²	145.6	70%	0.697	71%	0.709	S	S	*	*			trans	-83.2	106.4	168.8	-177.1	0	0	0	0	109	N133 T137	N133-V135 PolarHBondContact O-N 3.39Å; V135-T137 HydrophobicContact CG1-CG2 3.96Å; V135-T137 PolarHBondContact O-N 3.34Å; V135-T137 VanDerWaalsContact O-N 3.14Å
136	I	73.8	Confident	63.5	Low	151 Å²	151	139.9 Å²	139.9	77%	0.774	70%	0.704	S	S	*	*			trans	-72.8	105.1	168.7	-57.2	176.2	0	0	0	107.5	L134	L134-I136 HydrophobicContact CG-CG1 4.42Å; L134-I136 PolarHBondContact O-N 3.07Å
137	T	74.8	Confident	63.1	Low	114 Å²	114	135.8 Å²	135.8	70%	0.699	70%	0.699	S	S	*	*			trans	-88.6	133.6	172.9	50.8	0	0	0	0	110.1	V135 D139	V135-T137 HydrophobicContact CG1-CG2 3.96Å; V135-T137 PolarHBondContact O-N 3.34Å; V135-T137 VanDerWaalsContact O-N 3.14Å; T137-D139 PolarHBondContact O-N 2.84Å
138	Y	67.9	Low	62.6	Low	178 Å²	178	130.2 Å²	130.2	70%	0.698	69%	0.69	S	S	*	*			trans	-78.1	105.9	175.4	178	-110.4	0	0	0	109.6	V140 F143	Y138-V140 HydrophobicContact CD1-CG2 3.88Å; Y138-V140 HydrophobicContact CE1-CB 4.45Å; Y138-V140 HydrophobicContact CE1-CG2 3.29Å; Y138-F143 HydrophobicContact CD2-CE2 4.15Å; Y138-F143 HydrophobicContact CE2-CD2 4.21Å; Y138-F143 AromaticContact CE2-CE2 3.9Å; Y138-F143 HydrophobicContact CE2-CE2 3.9Å
139	D	71.9	Confident	61.6	Low	55 Å²	55	131.9 Å²	131.9	29%	0.294	69%	0.693	S	S	.	*			trans	-102.8	101.2	173.3	-172.4	-6.8	0	0	0	109.9	T137 K141 R142	T137-D139 PolarHBondContact O-N 2.84Å; D139-K141 PolarHBondContact O-N 3.08Å; D139-K141 WeakPolarHBondContact OD1-CB 3.38Å; D139-K141 PolarHBondContact OD1-N 3.13Å; D139-R142 HydrophobicContact CB-CB 4.44Å; D139-R142 HydrophobicContact CB-CG 3.98Å; D139-R142 PolarHBondContact O-N 3.15Å; D139-R142 WeakPolarHBondContact OD2-CG 3.45Å; D139-R142 IonicContact OD2-CZ 2.8Å; D139-R142 IonicContact OD2-NE 2.85Å; D139-R142 PolarHBondContact OD2-NE 3.43Å; D139-R142 IonicContact OD2-NH2 3.79Å
140	V	71.8	Confident	60.8	Low	96 Å²	96	131 Å²	131	58%	0.582	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-53.4	-28.9	178.8	-177.4	0	0	0	0	111.8	Y138 R142	Y138-V140 HydrophobicContact CD1-CG2 3.88Å; Y138-V140 HydrophobicContact CE1-CB 4.45Å; Y138-V140 HydrophobicContact CE1-CG2 3.29Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.21Å
141	K	75.3	Confident	59.9	Low	196 Å²	196	132.2 Å²	132.2	85%	0.852	71%	0.708	S	S	*	*	G	3₁₀ helix	trans	-77.9	-15.5	-176.7	-60.2	-177.9	-178.4	-179.6	0	113.6	D139	D139-K141 PolarHBondContact O-N 3.08Å; D139-K141 WeakPolarHBondContact OD1-CB 3.38Å; D139-K141 PolarHBondContact OD1-N 3.13Å
142	R	60.1	Low	58.3	Low	202 Å²	202	135 Å²	135	76%	0.762	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-89.5	-12.9	-179	-65.6	-176.5	-165.7	-143.3	2.5	113.6	D139 V140 T144	D139-R142 HydrophobicContact CB-CB 4.44Å; D139-R142 HydrophobicContact CB-CG 3.98Å; D139-R142 PolarHBondContact O-N 3.15Å; D139-R142 WeakPolarHBondContact OD2-CG 3.45Å; D139-R142 IonicContact OD2-CZ 2.8Å; D139-R142 IonicContact OD2-NE 2.85Å; D139-R142 PolarHBondContact OD2-NE 3.43Å; D139-R142 IonicContact OD2-NH2 3.79Å; V140-R142 VanDerWaalsContact C-N 3.33Å; V140-R142 PolarHBondContact O-N 3.21Å; R142-T144 PolarHBondContact O-N 3.48Å
143	F	57.9	Low	57.1	Low	141 Å²	141	134.1 Å²	134.1	62%	0.618	72%	0.717	S	S	*	*			trans	-83.7	113	172.7	-76.9	-85.3	0	0	0	109.5	Y138 P145	Y138-F143 HydrophobicContact CD2-CE2 4.15Å; Y138-F143 HydrophobicContact CE2-CD2 4.21Å; Y138-F143 AromaticContact CE2-CE2 3.9Å; Y138-F143 HydrophobicContact CE2-CE2 3.9Å; F143-P145 VanDerWaalsContact O-CD 3.24Å; F143-P145 WeakPolarHBondContact O-CD 3.27Å
144	T	53.6	Low	55.8	Low	132 Å²	132	132.8 Å²	132.8	81%	0.81	72%	0.717	S	S	*	*			trans	-68.6	114.3	160	-42.4	0	0	0	0	106.8	R142 C146	R142-T144 PolarHBondContact O-N 3.48Å; T144-C146 PolarHBondContact O-N 2.82Å
145	P	55.1	Low	54.2	Low	115 Å²	115	133.2 Å²	133.2	75%	0.747	73%	0.729	S	S	*	*			trans	-62.4	111.7	179.4	22.6	-29.6	0	0	0	108.5	F143 S147	F143-P145 VanDerWaalsContact O-CD 3.24Å; F143-P145 WeakPolarHBondContact O-CD 3.27Å; P145-S147 VanDerWaalsContact C-N 3.31Å; P145-S147 PolarHBondContact O-N 3.27Å
146	C	41.1	Very low	52.9	Low	115 Å²	115	135.4 Å²	135.4	78%	0.777	73%	0.732	S	S	*	*			trans	-67.6	96.9	169.4	-166.1	0	0	0	0	106.9	T144 T148	T144-C146 PolarHBondContact O-N 2.82Å; C146-T148 PolarHBondContact O-N 2.91Å
147	S	41	Very low	51.4	Low	103 Å²	103	136.7 Å²	136.7	72%	0.72	74%	0.735	S	S	*	*			trans	-66.7	77.4	178	-171.5	0	0	0	0	109.7	P145 K149	P145-S147 VanDerWaalsContact C-N 3.31Å; P145-S147 PolarHBondContact O-N 3.27Å; S147-K149 PolarHBondContact O-N 2.7Å
148	T	42.1	Very low	49.8	Very low	107 Å²	107	140 Å²	140	66%	0.656	74%	0.742	S	S	*	*			trans	-85.4	97.9	159	41.5	0	0	0	0	106.1	C146 T150	C146-T148 PolarHBondContact O-N 2.91Å; T148-T150 PolarHBondContact O-N 2.88Å
149	K	35.8	Very low	48.7	Very low	198 Å²	198	137.8 Å²	137.8	86%	0.861	74%	0.742	S	S	*	*			trans	-56.2	89.3	169.4	-68.2	-179.4	178.1	178.9	0	109	S147	S147-K149 PolarHBondContact O-N 2.7Å
150	T	43.1	Very low	47.2	Very low	124 Å²	124	143 Å²	143	76%	0.761	77%	0.77	S	S	*	*			trans	-127	113.5	156.4	55.5	0	0	0	0	106.7	T148	T148-T150 PolarHBondContact O-N 2.88Å
151	S	39.4	Very low	46	Very low	115 Å²	115	144.5 Å²	144.5	80%	0.804	78%	0.779	S	S	*	*			trans	-60.7	136.9	-179.2	50	0	0	0	0	111.6
152	H	38.9	Very low	44.6	Very low	185 Å²	185	140.5 Å²	140.5	86%	0.856	77%	0.771	S	S	*	*			trans	72	71.4	144.1	-140.7	-75.1	0	0	0	116.9
153	V	44.2	Very low	44.1	Very low	143 Å²	143	138.3 Å²	138.3	87%	0.867	77%	0.772	S	S	*	*			trans	-135.7	128.4	150.1	-172.8	0	0	0	0	109.6
154	S	39.4	Very low	43.8	Very low	92 Å²	92	138.8 Å²	138.8	64%	0.643	78%	0.776	S	S	*	*			trans	-41.5	143.2	178.6	-176.4	0	0	0	0	115.2	E156	S154-E156 PolarHBondContact O-N 3.4Å
155	S	37.3	Very low	43.8	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	78%	0.776	S	S	*	*			trans	-74	96.2	167.8	59.5	0	0	0	0	110.6
156	E	46.3	Very low	43.5	Very low	161 Å²	161	142.6 Å²	142.6	75%	0.752	78%	0.782	S	S	*	*			trans	-132.6	107.9	158.8	-87	-177.9	154.7	0	0	108.9	S154 H158	S154-E156 PolarHBondContact O-N 3.4Å; E156-H158 PolarHBondContact O-N 3.48Å
157	E	41.5	Very low	43.3	Very low	178 Å²	178	146.3 Å²	146.3	83%	0.832	79%	0.788	S	S	*	*			trans	12.3	88.9	156.5	-58.9	-178.9	153.2	0	0	117.5	N159	E157-N159 VanDerWaalsContact C-N 3.35Å; E157-N159 PolarHBondContact O-N 3.36Å; E157-N159 VanDerWaalsContact O-N 3.13Å
158	H	41.9	Very low	43.2	Very low	183 Å²	183	147.2 Å²	147.2	85%	0.847	79%	0.79	S	S	*	*			trans	-82.6	81.7	162.3	-66.7	-50.4	0	0	0	110.3	E156 L160	E156-H158 PolarHBondContact O-N 3.48Å; H158-L160 PolarHBondContact O-N 2.99Å; H158-L160 VanDerWaalsContact O-N 3.15Å
159	N	44.9	Very low	43.1	Very low	132 Å²	132	147.6 Å²	147.6	71%	0.706	79%	0.792	S	S	*	*			trans	-70.3	99.7	163.9	-75.1	-47.8	0	0	0	109.2	E157 T161	E157-N159 VanDerWaalsContact C-N 3.35Å; E157-N159 PolarHBondContact O-N 3.36Å; E157-N159 VanDerWaalsContact O-N 3.13Å; N159-T161 PolarHBondContact O-N 3.46Å; N159-T161 VanDerWaalsContact O-N 3.08Å
160	L	40.6	Very low	43.2	Very low	166 Å²	166	146.5 Å²	146.5	87%	0.869	79%	0.79	S	S	*	*			trans	-69.3	101	169.5	-77.9	165.5	0	0	0	109.1	H158 V162	H158-L160 PolarHBondContact O-N 2.99Å; H158-L160 VanDerWaalsContact O-N 3.15Å; L160-V162 PolarHBondContact O-N 3.39Å
161	T	46.6	Very low	42.7	Very low	126 Å²	126	149.2 Å²	149.2	77%	0.773	80%	0.796	S	S	*	*			trans	-78.9	111.4	170.8	1.3	0	0	0	0	108.8	N159 I163	N159-T161 PolarHBondContact O-N 3.46Å; N159-T161 VanDerWaalsContact O-N 3.08Å; T161-I163 PolarHBondContact O-N 3.47Å
162	V	44.8	Very low	42.6	Very low	113 Å²	113	153.5 Å²	153.5	69%	0.685	80%	0.8	S	S	*	*			trans	-72.9	106.5	169	178.1	0	0	0	0	107.8	L160 H164	L160-V162 PolarHBondContact O-N 3.39Å; V162-H164 PolarHBondContact O-N 3.19Å
163	I	51.5	Low	42.4	Very low	155 Å²	155	153.3 Å²	153.3	80%	0.795	80%	0.799	S	S	*	*			trans	-77.1	102.5	172.3	-58.3	175.6	0	0	0	107.5	T161	T161-I163 PolarHBondContact O-N 3.47Å
164	H	49.8	Very low	42.1	Very low	152 Å²	152	154.4 Å²	154.4	70%	0.704	80%	0.797	S	S	*	*			trans	-72.3	126.8	166.1	-70.5	-84.7	0	0	0	109.4	V162 K166	V162-H164 PolarHBondContact O-N 3.19Å; H164-K166 PolarHBondContact O-N 2.9Å; H164-K166 VanDerWaalsContact O-N 3.15Å
165	P	55.4	Low	41.7	Very low	123 Å²	123	154.9 Å²	154.9	80%	0.799	80%	0.797	S	S	*	*			trans	-67.7	114	171.8	25.3	-29.5	0	0	0	109.4	Q167	P165-Q167 PolarHBondContact O-N 3.07Å
166	K	47.2	Very low	41.8	Very low	203 Å²	203	156.2 Å²	156.2	88%	0.883	79%	0.794	S	S	*	*			trans	-65.9	114.2	172.2	-70.3	-178.7	177.6	179.4	0	109.4	H164 T168	H164-K166 PolarHBondContact O-N 2.9Å; H164-K166 VanDerWaalsContact O-N 3.15Å; K166-T168 PolarHBondContact O-N 3.29Å
167	Q	37.9	Very low	41.3	Very low	193 Å²	193	156 Å²	156	90%	0.902	79%	0.793	S	S	*	*			trans	-70.1	117.3	162.3	-79.4	178.6	-25.4	0	0	109.2	P165	P165-Q167 PolarHBondContact O-N 3.07Å
168	T	38.1	Very low	41.2	Very low	122 Å²	122	153 Å²	153	75%	0.748	79%	0.791	S	S	*	*			trans	-149.9	93.5	159.1	-49.4	0	0	0	0	109.4	K166	K166-T168 PolarHBondContact O-N 3.29Å
169	V	39.5	Very low	41	Very low	116 Å²	116	150.3 Å²	150.3	70%	0.703	78%	0.782	S	S	*	*				39.7	126.5	122.5	-174.7	0	0	0	0	119
170	Q	38.3	Very low	40.6	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.813	79%	0.787	S	S	*	*			trans	92.2	101.5	151.4	-80.8	174.6	93.6	0	0	120.9
171	M	33	Very low	40.4	Very low	181 Å²	181	150.6 Å²	150.6	89%	0.892	78%	0.784	S	S	*	*				47.8	101	128.8	-62.3	-79.4	-86.7	0	0	118.8
172	K	37.5	Very low	40.2	Very low	206 Å²	206	150.2 Å²	150.2	90%	0.896	78%	0.784	S	S	*	*				-163	118.2	125.6	-143.7	164.8	-179	175.7	0	111.8	M174	K172-M174 PolarHBondContact O-N 3.42Å
173	E	35.4	Very low	39.8	Very low	180 Å²	180	150 Å²	150	84%	0.841	79%	0.787	S	S	*	*			trans	-53.9	119.2	166.9	-174.5	174.8	-170.4	0	0	110.8
174	M	36.4	Very low	39.2	Very low	167 Å²	167	150 Å²	150	82%	0.823	79%	0.789	S	S	*	*			trans	-151.5	97.2	160.5	-152.5	159.9	161.1	0	0	110	K172 N176	K172-M174 PolarHBondContact O-N 3.42Å; M174-N176 PolarHBondContact O-N 2.99Å
175	T	32.5	Very low	38.7	Very low	102 Å²	102	149.6 Å²	149.6	63%	0.626	79%	0.79	S	S	*	*			trans	-47.7	114.9	168.9	-44.4	0	0	0	0	111.2	Q177	T175-Q177 HydrophobicContact CG2-CG 4.27Å
176	N	38.9	Very low	37.8	Very low	148 Å²	148	148.9 Å²	148.9	79%	0.791	79%	0.785	S	S	*	*			trans	-131	95.8	160	-84.9	-45.6	0	0	0	108.5	M174 S178	M174-N176 PolarHBondContact O-N 2.99Å; N176-S178 PolarHBondContact O-N 3.31Å
177	Q	36.3	Very low	37.5	Very low	157 Å²	157	146.8 Å²	146.8	73%	0.734	78%	0.783	S	S	*	*			trans	-68.8	112.5	169.3	-62.3	-176.7	38.2	0	0	108.4	T175 I179	T175-Q177 HydrophobicContact CG2-CG 4.27Å; Q177-I179 PolarHBondContact O-N 2.91Å
178	S	38.6	Very low	37.5	Very low	113 Å²	113	144.8 Å²	144.8	79%	0.79	78%	0.779	S	S	*	*			trans	-88.6	96.9	165.1	176.9	0	0	0	0	108.6	N176 C180	N176-S178 PolarHBondContact O-N 3.31Å; S178-C180 PolarHBondContact O-N 3.3Å
179	I	38.9	Very low	37.5	Very low	127 Å²	127	143.6 Å²	143.6	65%	0.651	78%	0.775	S	S	*	*			trans	-74.1	109.5	173.6	-64.4	163.8	0	0	0	108.4	Q177 K181	Q177-I179 PolarHBondContact O-N 2.91Å; I179-K181 HydrophobicContact CG2-CG 4.21Å; I179-K181 PolarHBondContact O-N 3.45Å
180	C	35.8	Very low	37.6	Very low	120 Å²	120	145.3 Å²	145.3	81%	0.811	78%	0.78	S	S	*	*			trans	-73.2	100.2	163	-67.9	0	0	0	0	108.5	S178	S178-C180 PolarHBondContact O-N 3.3Å
181	K	36.5	Very low	37.8	Very low	184 Å²	184	144.5 Å²	144.5	80%	0.8	78%	0.776	S	S	*	*			trans	-67.6	131	172.5	-69.9	177.4	177.3	176	0	110	I179 S183	I179-K181 HydrophobicContact CG2-CG 4.21Å; I179-K181 PolarHBondContact O-N 3.45Å; K181-S183 PolarHBondContact O-N 2.95Å
182	P	41	Very low	38	Very low	119 Å²	119	140.7 Å²	140.7	77%	0.773	77%	0.767	S	S	*	*			trans	-76.1	120.1	164.8	30.1	-28.4	0	0	0	108.8	N184	P182-N184 PolarHBondContact O-N 3.13Å
183	S	38.1	Very low	38.2	Very low	107 Å²	107	138.5 Å²	138.5	75%	0.748	77%	0.765	S	S	*	*			trans	-77.4	115.9	170.4	58.2	0	0	0	0	109.6	K181 I185	K181-S183 PolarHBondContact O-N 2.95Å; S183-I185 PolarHBondContact O-N 3.43Å
184	N	37.9	Very low	38.3	Very low	157 Å²	157	137 Å²	137	84%	0.84	76%	0.763	S	S	*	*			trans	-51.2	125	169.6	-70	-55.1	0	0	0	111.6	P182	P182-N184 PolarHBondContact O-N 3.13Å
185	I	39.5	Very low	38.8	Very low	142 Å²	142	137.8 Å²	137.8	73%	0.728	77%	0.767	S	S	*	*			trans	-113.2	113.8	157.2	-58.7	172.6	0	0	0	105.4	S183 L187	S183-I185 PolarHBondContact O-N 3.43Å; I185-L187 HydrophobicContact CG2-CD1 4.34Å
186	P	36	Very low	39.3	Very low	108 Å²	108	142 Å²	142	70%	0.701	78%	0.776	S	S	*	*			trans	-80.9	119.4	169.1	6.6	10.4	0	0	0	108.5
187	L	41.5	Very low	39.3	Very low	159 Å²	159	140.8 Å²	140.8	83%	0.832	78%	0.776	S	S	*	*			trans	-116.5	91.6	157	-122	90.4	0	0	0	107.2	I185	I185-L187 HydrophobicContact CG2-CD1 4.34Å
188	D	37.7	Very low	40	Very low	152 Å²	152	140 Å²	140	81%	0.813	78%	0.782	S	S	*	*			trans	-61.5	153.8	157.3	-83.6	-43.7	0	0	0	109.7
189	S	38.6	Very low	40.4	Very low	97 Å²	97	139.8 Å²	139.8	68%	0.678	78%	0.778	S	S	*	*			trans	82	99.4	171.2	-119.9	0	0	0	0	115.8
190	L	40.6	Very low	40.5	Very low	152 Å²	152	140 Å²	140	80%	0.796	79%	0.788	S	S	*	*				179.9	107.1	102.2	-87.8	166.2	0	0	0	110.4
191	H	43.1	Very low	40.8	Very low	157 Å²	157	142.6 Å²	142.6	73%	0.727	79%	0.788	S	S	*	*			trans	42.8	109.8	141.9	-58.2	109.6	0	0	0	120.3
192	S	37.3	Very low	40.9	Very low	101 Å²	101	141.1 Å²	141.1	71%	0.706	79%	0.788	S	S	*	*			trans	-40	134.2	139.2	49.6	0	0	0	0	113
193	D	41.1	Very low	40.9	Very low	160 Å²	160	143 Å²	143	86%	0.856	79%	0.788	S	S	*	*			trans	-157.5	133.2	135.3	-96.8	-33.8	0	0	0	111.9
194	N	38.5	Very low	40.8	Very low	149 Å²	149	144.3 Å²	144.3	80%	0.797	79%	0.787	S	S	*	*			trans	-51.3	150.7	168.5	-82	-53.7	0	0	0	111.8
195	M	45.6	Very low	40.9	Very low	183 Å²	183	143 Å²	143	90%	0.901	78%	0.776	S	S	*	*				179.2	145.5	119.5	-89.1	-47.7	-166	0	0	112.4
196	K	42.8	Very low	40.8	Very low	189 Å²	189	143.8 Å²	143.8	82%	0.822	77%	0.774	S	S	*	*			trans	-45.7	165.5	-175.9	-82.7	168.9	173	177	0	120.1
197	P	40.4	Very low	41	Very low	123 Å²	123	143.8 Å²	143.8	80%	0.799	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-79.4	155.9	-177.8	34	-35.5	0	0	0	114.1
198	V	50.8	Low	40.9	Very low	141 Å²	141	141.9 Å²	141.9	86%	0.855	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-103.8	131.2	179.3	178.6	0	0	0	0	111
199	P	46	Very low	41.1	Very low	109 Å²	109	143 Å²	143	71%	0.708	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-90.4	167.4	175.2	35.8	-32.4	0	0	0	113.3
200	P	41.9	Very low	41.6	Very low	132 Å²	132	143.4 Å²	143.4	86%	0.857	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-88.2	148.7	-166	35.2	-32.8	0	0	0	113.5
201	H	42.7	Very low	41.6	Very low	174 Å²	174	145.7 Å²	145.7	81%	0.806	79%	0.792	S	S	*	*			trans	-115.5	123.1	175.4	-160.4	-85	0	0	0	110.3
202	L	37.4	Very low	41.7	Very low	152 Å²	152	146.1 Å²	146.1	80%	0.796	80%	0.798	S	S	*	*			trans	-73.6	-170.4	167.3	-87.5	156.6	0	0	0	110.4
203	M	40.3	Very low	42	Very low	160 Å²	160	148.1 Å²	148.1	79%	0.788	80%	0.8	S	S	*	*			trans	92.6	89.6	174.3	-34.6	-108.1	112.7	0	0	112.3
204	N	36.8	Very low	42.3	Very low	134 Å²	134	146.6 Å²	146.6	72%	0.717	79%	0.792	S	S	*	*				86.1	112.7	76	-159.1	50	0	0	0	113.9
205	E	40.6	Very low	42.8	Very low	130 Å²	130	147.1 Å²	147.1	61%	0.607	79%	0.789	S	S	*	*			trans	67.7	131.7	143.2	-83.8	-173.1	145.7	0	0	124.3
206	K	38	Very low	43	Very low	158 Å²	158	143.1 Å²	143.1	69%	0.687	78%	0.78	S	S	*	*			trans	89.1	94.4	139.7	-72.9	163.2	-177.6	144.7	0	119.6
207	S	38.3	Very low	43.7	Very low	108 Å²	108	142.7 Å²	142.7	76%	0.755	79%	0.785	S	S	*	*				48.3	114.5	121.4	60.8	0	0	0	0	119.9
208	S	41.1	Very low	44.4	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	79%	0.787	S	S	*	*			trans	-174.9	129.5	131	42	0	0	0	0	111
209	N	40.5	Very low	44.9	Very low	174 Å²	174	146 Å²	146	93%	0.93	78%	0.783	S	S	*	*			trans	-67.8	141.9	176.5	-58.8	-34.1	0	0	0	111.5
210	S	50	Low	45.7	Very low	106 Å²	106	149.1 Å²	149.1	74%	0.741	79%	0.791	S	S	*	*			trans	-146.3	126	156.2	63.4	0	0	0	0	109.7
211	E	39.6	Very low	47.3	Very low	201 Å²	201	152.7 Å²	152.7	94%	0.939	79%	0.793	S	S	*	*			trans	-48.7	134.4	175.7	-68.2	161.9	130.3	0	0	112.1
212	I	46.3	Very low	49.1	Very low	166 Å²	166	154 Å²	154	85%	0.851	80%	0.796	S	S	*	*			trans	-117.9	123.7	163.2	-58.1	174.6	0	0	0	107.6
213	N	44.2	Very low	51.2	Low	142 Å²	142	156.7 Å²	156.7	76%	0.759	80%	0.796	S	S	*	*			trans	-61.1	145.9	-171.2	-155.9	5.4	0	0	0	112.9
214	D	46	Very low	53.3	Low	129 Å²	129	154.3 Å²	154.3	69%	0.69	79%	0.792	S	S	*	*			trans	-68.4	170	172.9	-149.3	-24.2	0	0	0	110.6
215	H	50.5	Low	55.6	Low	159 Å²	159	157.9 Å²	157.9	74%	0.736	80%	0.802	S	S	*	*			trans	88.1	84.2	174.3	-34.6	-43.9	0	0	0	117.9
216	S	47.9	Very low	57.5	Low	100 Å²	100	157.1 Å²	157.1	70%	0.699	80%	0.8	S	S	*	*			trans	-163	76.3	135.7	174.5	0	0	0	0	110.5	R218	S216-R218 PolarHBondContact O-N 3.46Å
217	L	58.5	Low	59.6	Low	179 Å²	179	155.2 Å²	155.2	94%	0.937	80%	0.798	S	S	*	*			trans	-68.2	87.8	155.1	-70	177	0	0	0	107.4	S219	L217-S219 PolarHBondContact O-N 3.28Å
218	R	55.8	Low	61.7	Low	222 Å²	222	159.1 Å²	159.1	84%	0.838	80%	0.796	S	S	*	*			trans	-56	110.5	168.1	-103	-179.3	169.2	-167.7	-1.3	107	S216 M220	S216-R218 PolarHBondContact O-N 3.46Å; R218-M220 PolarHBondContact O-N 3.35Å
219	S	59.7	Low	63.6	Low	111 Å²	111	158.6 Å²	158.6	78%	0.776	78%	0.784	S	S	*	*			trans	-55.5	115.6	173.5	70.3	0	0	0	0	108.4	L217 K221	L217-S219 PolarHBondContact O-N 3.28Å; S219-K221 PolarHBondContact O-N 2.99Å; S219-K221 VanDerWaalsContact O-N 3.17Å
220	M	64	Low	65.4	Low	176 Å²	176	156.8 Å²	156.8	87%	0.867	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-51.7	120.8	170.6	-74.9	-95.4	-56.4	0	0	109.1	R218 K222	R218-M220 PolarHBondContact O-N 3.35Å; M220-K222 PolarHBondContact O-N 3.48Å; M220-K222 VanDerWaalsContact O-N 3.11Å
221	K	75.5	Confident	66.6	Low	206 Å²	206	159.1 Å²	159.1	90%	0.896	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-57.2	116.9	171.4	-101.7	175.4	174.5	173.5	0	108.3	S219 R223	S219-K221 PolarHBondContact O-N 2.99Å; S219-K221 VanDerWaalsContact O-N 3.17Å; K221-R223 PolarHBondContact O-N 3Å
222	K	80.5	Confident	67.8	Low	201 Å²	201	155.1 Å²	155.1	87%	0.874	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-58.6	130.4	171.4	-75.6	-177.4	177.4	175.5	0	109.1	M220	M220-K222 PolarHBondContact O-N 3.48Å; M220-K222 VanDerWaalsContact O-N 3.11Å
223	R	81.7	Confident	68.7	Low	209 Å²	209	153.2 Å²	153.2	79%	0.789	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-62.6	138.7	172.5	-174.8	178.3	176	154.4	0.2	109.5	K221	K221-R223 PolarHBondContact O-N 3Å
224	P	83.9	Confident	69.9	Low	110 Å²	110	151 Å²	151	71%	0.714	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-55.6	141.6	170.6	-21	30.8	0	0	0	111.1	I226	P224-I226 PolarHBondContact O-N 3Å
225	K	84.7	Confident	70.6	Confident	210 Å²	210	151 Å²	151	91%	0.913	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-61.5	130.2	172.2	-79.3	-178.8	176.2	178.9	0	109	N227	K225-N227 PolarHBondContact O-N 3.3Å
226	I	81.6	Confident	70.9	Confident	113 Å²	113	151 Å²	151	58%	0.579	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-72.2	121.8	171.1	-60.3	170.2	0	0	0	107.1	P224 R228	P224-I226 PolarHBondContact O-N 3Å; I226-R228 PolarHBondContact O-N 3.45Å
227	N	82.2	Confident	71.1	Confident	118 Å²	118	157 Å²	157	63%	0.631	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-69.8	120.2	168.3	-171.8	-9.7	0	0	0	108.1	K225 N229	K225-N227 PolarHBondContact O-N 3.3Å; N227-N229 VanDerWaalsContact OD1-CB 3.23Å; N227-N229 WeakPolarHBondContact OD1-CB 3.34Å; N227-N229 PolarHBondContact OD1-N 3.45Å; N227-N229 PolarHBondContact OD1-OD1 3.45Å
228	R	82.3	Confident	71.7	Confident	191 Å²	191	155.9 Å²	155.9	72%	0.721	76%	0.758	S	S	*	*			trans	-98.8	17.9	177.2	-68.2	-173.5	178	127.8	-4.4	112.4	I226 F230	I226-R228 PolarHBondContact O-N 3.45Å; R228-F230 HydrophobicContact CB-CE2 4.37Å; R228-F230 HydrophobicContact CB-CZ 4.47Å; R228-F230 WeakPolarHBondContact O-CD2 3.38Å; R228-F230 WeakPolarHBondContact O-CE2 3.34Å; R228-F230 PolarHBondContact O-N 3.32Å
229	N	81	Confident	72.5	Confident	107 Å²	107	152.4 Å²	152.4	57%	0.572	75%	0.753	S	S	*	*			trans	-68	99.9	169.5	-67.1	-1.2	0	0	0	107.6	N227 E231	N227-N229 VanDerWaalsContact OD1-CB 3.23Å; N227-N229 WeakPolarHBondContact OD1-CB 3.34Å; N227-N229 PolarHBondContact OD1-N 3.45Å; N227-N229 PolarHBondContact OD1-OD1 3.45Å; N229-E231 PolarHBondContact O-N 3.47Å; N229-E231 VanDerWaalsContact O-N 3.15Å
230	F	77.7	Confident	73.2	Confident	137 Å²	137	154.7 Å²	154.7	60%	0.601	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-75.5	12.2	-179	-62.8	-70	0	0	0	113.4	R228 T232 L233	R228-F230 HydrophobicContact CB-CE2 4.37Å; R228-F230 HydrophobicContact CB-CZ 4.47Å; R228-F230 WeakPolarHBondContact O-CD2 3.38Å; R228-F230 WeakPolarHBondContact O-CE2 3.34Å; R228-F230 PolarHBondContact O-N 3.32Å; F230-T232 PolarHBondContact O-N 3.19Å; F230-T232 VanDerWaalsContact O-N 3.09Å; F230-L233 HydrophobicContact CB-CD1 4.17Å; F230-L233 HydrophobicContact CB-CG 4.41Å; F230-L233 HydrophobicContact CD1-CD1 3.31Å; F230-L233 HydrophobicContact CD1-CG 4.1Å; F230-L233 HydrophobicContact CE1-CD1 4.01Å; F230-L233 HydrophobicContact CG-CD1 4.13Å; F230-L233 WeakPolarHBondContact O-CB 3.25Å; F230-L233 PolarHBondContact O-N 3.44Å
231	E	74.7	Confident	73.8	Confident	155 Å²	155	153.4 Å²	153.4	72%	0.724	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-56.3	-28.5	-179.8	-77.1	-179.8	155.9	0	0	112.8	N229 T234	N229-E231 PolarHBondContact O-N 3.47Å; N229-E231 VanDerWaalsContact O-N 3.15Å; E231-T234 PolarHBondContact O-OG1 2.88Å
232	T	64.8	Low	73.7	Confident	117 Å²	117	150.1 Å²	150.1	72%	0.718	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-80.2	-12.1	175.4	45.5	0	0	0	0	114.5	F230 T234	F230-T232 PolarHBondContact O-N 3.19Å; F230-T232 VanDerWaalsContact O-N 3.09Å; T232-T234 VanDerWaalsContact C-N 3.33Å
233	L	66.7	Low	73.2	Confident	126 Å²	126	146.7 Å²	146.7	66%	0.66	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-77.3	-18.2	179.8	-70.3	-172.9	0	0	0	113.3	F230	F230-L233 HydrophobicContact CB-CD1 4.17Å; F230-L233 HydrophobicContact CB-CG 4.41Å; F230-L233 HydrophobicContact CD1-CD1 3.31Å; F230-L233 HydrophobicContact CD1-CG 4.1Å; F230-L233 HydrophobicContact CE1-CD1 4.01Å; F230-L233 HydrophobicContact CG-CD1 4.13Å; F230-L233 WeakPolarHBondContact O-CB 3.25Å; F230-L233 PolarHBondContact O-N 3.44Å
234	T	68.4	Low	72.6	Confident	96 Å²	96	142.3 Å²	142.3	59%	0.589	72%	0.722	S	S	*	*	G	3₁₀ helix	trans	-93.9	0.9	-174.3	49.6	0	0	0	0	114.7	E231 T232 N236	E231-T234 PolarHBondContact O-OG1 2.88Å; T232-T234 VanDerWaalsContact C-N 3.33Å; T234-N236 VanDerWaalsContact C-N 3.32Å; T234-N236 PolarHBondContact O-N 3.08Å
235	N	60.3	Low	71.7	Confident	128 Å²	128	144.8 Å²	144.8	68%	0.684	72%	0.723	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	10.5	-175	-73.7	-13	0	0	0	115.6
236	N	58.1	Low	70.7	Confident	160 Å²	160	139.3 Å²	139.3	86%	0.856	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127	33.2	-179.7	-75.7	-22.5	0	0	0	113.9	T234	T234-N236 VanDerWaalsContact C-N 3.32Å; T234-N236 PolarHBondContact O-N 3.08Å
237	I	50.3	Low	69.7	Low	224 Å²	224	141.7 Å²	141.7	100%	1.149	72%	0.719	S	S	*	*			trans	-96.5	0	163.8	-59.1	177.9	0	0	0	108.9

Retrieved 237 of 237 residues in 48.4 ms (Link to these results)

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