A0A5K4F7F3_SCHMA Loading...

DUF3480 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F7F3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 330 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	28.9	Very low	29.2	Very low	248 Å²	248	151.4 Å²	151.4	100%	1.222	73%	0.733	S	S	*	*				0	102.2	0	-81	164.8	125.1	0	0	106.5	S3	M1-S3 PolarHBondContact O-N 3.33Å
2	K	26.3	Very low	29	Very low	211 Å²	211	149.1 Å²	149.1	92%	0.917	74%	0.739	S	S	*	*			trans	-73.9	119.5	176.8	-77.2	-176.5	174	-175.9	0	107.1	N4	K2-N4 PolarHBondContact O-N 3.22Å
3	S	26.6	Very low	29	Very low	93 Å²	93	149.8 Å²	149.8	65%	0.65	74%	0.736	S	S	*	*			trans	-61.6	126.3	170.6	51	0	0	0	0	108	M1 D5	M1-S3 PolarHBondContact O-N 3.33Å; S3-D5 PolarHBondContact O-N 2.7Å
4	N	30.3	Very low	28.8	Very low	148 Å²	148	143.5 Å²	143.5	79%	0.791	73%	0.729	S	S	*	*			trans	-73.5	106.9	165.7	-74.8	-12.5	0	0	0	106.3	K2 I6	K2-N4 PolarHBondContact O-N 3.22Å; N4-I6 PolarHBondContact O-N 2.82Å; N4-I6 VanDerWaalsContact O-N 3.11Å
5	D	29.6	Very low	28.6	Very low	131 Å²	131	142.9 Å²	142.9	70%	0.701	74%	0.743	S	S	*	*			trans	-68.7	104.8	175.1	-73.1	-24.2	0	0	0	108.9	S3 Q7	S3-D5 PolarHBondContact O-N 2.7Å; D5-Q7 PolarHBondContact O-N 2.8Å
6	I	32.5	Very low	28.5	Very low	110 Å²	110	138.6 Å²	138.6	56%	0.564	74%	0.735	S	S	*	*			trans	-78.1	99.7	167	-60.9	172.8	0	0	0	106.3	N4 I8	N4-I6 PolarHBondContact O-N 2.82Å; N4-I6 VanDerWaalsContact O-N 3.11Å; I6-I8 HydrophobicContact CG2-CG1 4.25Å
7	Q	29.9	Very low	28.5	Very low	125 Å²	125	136.5 Å²	136.5	58%	0.584	73%	0.731	S	S	*	*			trans	-87.2	108	171.4	-73.4	-174.3	-1.6	0	0	109.6	D5 Y9	D5-Q7 PolarHBondContact O-N 2.8Å; Q7-Y9 HydrophobicContact CB-CD2 4.12Å; Q7-Y9 HydrophobicContact CB-CE2 3.77Å; Q7-Y9 PolarHBondContact O-N 3.4Å; Q7-Y9 VanDerWaalsContact OE1-CE2 3.29Å; Q7-Y9 PolarHBondContact OE1-OH 2.88Å
8	I	30.1	Very low	28.6	Very low	99 Å²	99	135.6 Å²	135.6	51%	0.508	72%	0.72	S	S	.	*			trans	-79.8	108.9	170.9	-57.5	174.1	0	0	0	107.1	I6 D321	I6-I8 HydrophobicContact CG2-CG1 4.25Å; I8-D321 HydrophobicContact CD1-CB 4.07Å
9	Y	27.9	Very low	28.9	Very low	165 Å²	165	137.5 Å²	137.5	65%	0.647	72%	0.716	S	S	*	*			trans	-94.9	95.2	174.9	-80.6	-78.4	0	0	0	110.7	Q7 R11	Q7-Y9 HydrophobicContact CB-CD2 4.12Å; Q7-Y9 HydrophobicContact CB-CE2 3.77Å; Q7-Y9 PolarHBondContact O-N 3.4Å; Q7-Y9 VanDerWaalsContact OE1-CE2 3.29Å; Q7-Y9 PolarHBondContact OE1-OH 2.88Å; Y9-R11 PolarHBondContact O-N 3.48Å
10	D	30.9	Very low	29.1	Very low	138 Å²	138	135.8 Å²	135.8	74%	0.738	72%	0.716	S	S	*	*			trans	-74.7	74.4	159.9	-84.8	-26.1	0	0	0	109.1
11	R	28.1	Very low	29.9	Very low	197 Å²	197	133.3 Å²	133.3	74%	0.743	70%	0.7	S	S	*	*			trans	-93.2	130.5	158.7	-83.1	-166.8	-172.2	-173	5.7	108.2	Y9 F13	Y9-R11 PolarHBondContact O-N 3.48Å; R11-F13 VanDerWaalsContact C-N 3.31Å; R11-F13 PolarHBondContact O-N 2.88Å
12	P	27	Very low	30.6	Very low	124 Å²	124	124.5 Å²	124.5	81%	0.805	66%	0.659	S	S	*	*			trans	-66.9	98.7	171	28.7	-29.8	0	0	0	106.8	G14	P12-G14 PolarHBondContact O-N 2.74Å
13	F	28.7	Very low	31.8	Very low	158 Å²	158	115.2 Å²	115.2	69%	0.693	62%	0.62	S	S	*	*			trans	-51.1	124.5	161.9	-88.2	-89.4	0	0	0	106.8	R11 S15	R11-F13 VanDerWaalsContact C-N 3.31Å; R11-F13 PolarHBondContact O-N 2.88Å; F13-S15 PolarHBondContact O-N 3.19Å
14	G	26.5	Very low	33.4	Very low	62 Å²	62	111 Å²	111	64%	0.639	59%	0.59	S	S	*	*	S	Bend	trans	-46	110.6	-164.2	0	0	0	0	0	113.8	P12 A16	P12-G14 PolarHBondContact O-N 2.74Å; G14-A16 PolarHBondContact O-N 3.18Å
15	S	25.9	Very low	34.9	Very low	134 Å²	134	105.5 Å²	105.5	94%	0.937	56%	0.559	S	S	*	*	S	Bend	trans	32.7	22.8	150.9	61.6	0	0	0	0	121.5	F13	F13-S15 PolarHBondContact O-N 3.19Å
16	A	26.6	Very low	36.2	Very low	75 Å²	75	104.1 Å²	104.1	62%	0.62	55%	0.548	S	S	*	.			trans	-129.5	124.3	168.4	0	0	0	0	0	109.3	G14 F18	G14-A16 PolarHBondContact O-N 3.18Å; A16-F18 PolarHBondContact O-N 3.02Å
17	P	28.1	Very low	37.8	Very low	103 Å²	103	103.6 Å²	103.6	67%	0.669	54%	0.542	S	S	*	.			trans	-63.7	127.5	175.6	26.5	-30.6	0	0	0	108.3	R19	P17-R19 WeakPolarHBondContact O-CG 3.15Å; P17-R19 PolarHBondContact O-N 3.02Å
18	F	31.3	Very low	39.4	Very low	120 Å²	120	98.9 Å²	98.9	53%	0.526	52%	0.521	S	S	.	.			trans	-43.9	113.9	169.2	-94.4	-95.5	0	0	0	108.7	A16 D22	A16-F18 PolarHBondContact O-N 3.02Å; F18-D22 WeakPolarHBondContact CA-OD2 3.22Å; F18-D22 HydrophobicContact CD1-CB 3.82Å; F18-D22 WeakPolarHBondContact CD1-OD2 2.82Å; F18-D22 HydrophobicContact CE1-CB 4.08Å
19	R	33.9	Very low	40.9	Very low	172 Å²	172	96.1 Å²	96.1	65%	0.649	50%	0.504	S	S	*	.			trans	-96.8	154.9	174.8	-66.8	-170.4	178.4	-163.6	-0.3	106.3	P17 H21 D22	P17-R19 WeakPolarHBondContact O-CG 3.15Å; P17-R19 PolarHBondContact O-N 3.02Å; R19-H21 VanDerWaalsContact CB-CD2 3.42Å; R19-H21 WeakPolarHBondContact CB-CD2 3.42Å; R19-H21 PolarHBondContact O-N 3Å; R19-D22 PolarHBondContact N-OD2 3.4Å; R19-D22 VanDerWaalsContact N-OD2 3.11Å; R19-D22 PolarHBondContact O-N 3.28Å; R19-D22 VanDerWaalsContact O-OD2 3.06Å
20	S	33.3	Very low	42.5	Very low	103 Å²	103	89.7 Å²	89.7	72%	0.72	48%	0.48	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-0.2	177.1	52.9	0	0	0	0	115.4
21	H	45	Very low	43.5	Very low	83 Å²	83	83.1 Å²	83.1	38%	0.384	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1	176	-41.1	-51.5	0	0	0	113.8	R19 C23 H74	R19-H21 VanDerWaalsContact CB-CD2 3.42Å; R19-H21 WeakPolarHBondContact CB-CD2 3.42Å; R19-H21 PolarHBondContact O-N 3Å; H21-C23 VanDerWaalsContact C-N 3.27Å; H21-C23 PolarHBondContact O-N 2.99Å; H21-H74 PolarHBondContact O-CD2 3.05Å
22	D	44.8	Very low	44.4	Very low	64 Å²	64	76.8 Å²	76.8	34%	0.342	43%	0.425	S	S	.	.			trans	-83.8	0.8	-178.1	-62.7	-40.1	0	0	0	113.3	F18 R19 Y183	F18-D22 WeakPolarHBondContact CA-OD2 3.22Å; F18-D22 HydrophobicContact CD1-CB 3.82Å; F18-D22 WeakPolarHBondContact CD1-OD2 2.82Å; F18-D22 HydrophobicContact CE1-CB 4.08Å; R19-D22 PolarHBondContact N-OD2 3.4Å; R19-D22 VanDerWaalsContact N-OD2 3.11Å; R19-D22 PolarHBondContact O-N 3.28Å; R19-D22 VanDerWaalsContact O-OD2 3.06Å; D22-Y183 PolarHBondContact O-OH 2.94Å
23	C	52	Low	45.1	Very low	15 Å²	15	75 Å²	75	10%	0.101	41%	0.409	C	S	.	.			trans	-84.5	126.2	174.9	-59.8	0	0	0	0	109.9	H21 F25 H74	H21-C23 VanDerWaalsContact C-N 3.27Å; H21-C23 PolarHBondContact O-N 2.99Å; C23-F25 VanDerWaalsContact C-N 3.28Å; C23-F25 WeakPolarHBondContact CB-O 3.19Å; C23-F25 PolarHBondContact O-N 2.86Å; C23-H74 PolarHBondContact O-CD2 2.8Å; C23-H74 VanDerWaalsContact O-CD2 3.3Å
24	F	59	Low	45.5	Very low	5 Å²	5	74.9 Å²	74.9	2%	0.022	40%	0.404	C	S	.	.	S	Bend	trans	-59.2	-41.9	176.7	179.8	-119.4	0	0	0	111.5	F73 H74 T76 L112 P123 T124 C241	F24-F73 HydrophobicContact CD2-CD2 4.35Å; F24-F73 AromaticContact CE2-CD2 3.83Å; F24-F73 HydrophobicContact CE2-CD2 3.83Å; F24-F73 HydrophobicContact CE2-CE2 4.28Å; F24-F73 HydrophobicContact CZ-CD2 4.2Å; F24-F73 CarbonylContact O-C 3.54Å; F24-F73 WeakPolarHBondContact O-CA 3.45Å; F24-F73 WeakPolarHBondContact O-CB 3.33Å; F24-H74 PolarHBondContact O-N 2.89Å; F24-T76 HydrophobicContact CD2-CG2 3.86Å; F24-T76 HydrophobicContact CE2-CG2 4.25Å; F24-L112 HydrophobicContact CD1-CB 4.46Å; F24-L112 HydrophobicContact CD1-CD1 3.64Å; F24-L112 HydrophobicContact CE1-CB 3.56Å; F24-L112 HydrophobicContact CE1-CD1 3.42Å; F24-L112 VanDerWaalsContact CE1-CD1 3.42Å; F24-L112 HydrophobicContact CE1-CG 4.09Å; F24-L112 HydrophobicContact CZ-CB 4.24Å; F24-L112 HydrophobicContact CZ-CD1 4.22Å; F24-P123 HydrophobicContact CE2-CB 4.47Å; F24-P123 HydrophobicContact CE2-CG 3.53Å; F24-P123 HydrophobicContact CZ-CB 4.1Å; F24-P123 HydrophobicContact CZ-CG 3.57Å; F24-T124 HydrophobicContact CE2-CG2 4.43Å; F24-T124 HydrophobicContact CZ-CG2 3.73Å; F24-C241 HydrophobicContact CB-CB 3.71Å; F24-C241 HydrophobicContact CD1-CB 3.34Å; F24-C241 HydrophobicContact CD2-CB 4.38Å; F24-C241 HydrophobicContact CE1-CB 3.94Å; F24-C241 HydrophobicContact CG-CB 3.58Å
25	F	61.5	Low	45.8	Very low	32 Å²	32	74.1 Å²	74.1	14%	0.14	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	138.3	173.2	167.6	-100.1	0	0	0	111.4	C23 K27 L28 V71 F72 P108 L112	C23-F25 VanDerWaalsContact C-N 3.28Å; C23-F25 WeakPolarHBondContact CB-O 3.19Å; C23-F25 PolarHBondContact O-N 2.86Å; F25-K27 VanDerWaalsContact CE2-O 3.26Å; F25-K27 WeakPolarHBondContact CE2-O 3.07Å; F25-L28 HydrophobicContact CE2-CB 4.23Å; F25-L28 HydrophobicContact CZ-CB 3.93Å; F25-V71 HydrophobicContact CD2-CG1 3.56Å; F25-V71 HydrophobicContact CE2-CB 4.46Å; F25-V71 HydrophobicContact CE2-CG1 3.69Å; F25-V71 HydrophobicContact CE2-CG2 4.45Å; F25-F72 WeakPolarHBondContact CD2-O 3.48Å; F25-P108 HydrophobicContact CB-CB 3.89Å; F25-P108 HydrophobicContact CB-CG 3.95Å; F25-P108 HydrophobicContact CD1-CB 3.61Å; F25-P108 HydrophobicContact CD1-CG 3.28Å; F25-P108 HydrophobicContact CD2-CB 3.29Å; F25-P108 HydrophobicContact CD2-CG 3.98Å; F25-P108 HydrophobicContact CE1-CB 3.8Å; F25-P108 HydrophobicContact CE1-CG 3.56Å; F25-P108 HydrophobicContact CE2-CB 3.49Å; F25-P108 VanDerWaalsContact CE2-CB 3.49Å; F25-P108 HydrophobicContact CE2-CG 4.22Å; F25-P108 HydrophobicContact CG-CB 3.3Å; F25-P108 HydrophobicContact CG-CG 3.46Å; F25-P108 VanDerWaalsContact CG-CG 3.46Å; F25-P108 HydrophobicContact CZ-CB 3.71Å; F25-P108 HydrophobicContact CZ-CG 4Å; F25-L112 HydrophobicContact CB-CD1 4.24Å
26	E	58.3	Low	46.1	Very low	102 Å²	102	71.2 Å²	71.2	48%	0.477	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	-50.3	175.9	-169.2	172.7	148.2	0	0	112.5	F72 H74 L91	E26-F72 PolarHBondContact N-O 2.97Å; E26-H74 IonicContact OE2-CE1 3.1Å; E26-H74 PolarHBondContact OE2-CE1 2.75Å; E26-H74 VanDerWaalsContact OE2-CE1 3.31Å; E26-H74 IonicContact OE2-NE2 2.69Å; E26-H74 PolarHBondContact OE2-NE2 3.12Å; E26-L91 HydrophobicContact CB-CD1 4.25Å; E26-L91 HydrophobicContact CB-CD2 3.97Å; E26-L91 VanDerWaalsContact CD-CD1 3.47Å; E26-L91 HydrophobicContact CG-CD1 4.29Å; E26-L91 WeakPolarHBondContact OE2-CD1 3.33Å; E26-L91 WeakPolarHBondContact OE2-CD2 3.27Å; E26-L91 WeakPolarHBondContact OE2-CG 3.37Å
27	K	65	Low	46.6	Very low	100 Å²	100	74.1 Å²	74.1	44%	0.435	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	151.5	-172.3	-158.3	154.3	178	-175.5	0	114.3	F25 Y29 F72	F25-K27 VanDerWaalsContact CE2-O 3.26Å; F25-K27 WeakPolarHBondContact CE2-O 3.07Å; K27-Y29 HydrophobicContact CB-CD2 4.35Å; K27-Y29 HydrophobicContact CB-CE2 3.97Å; K27-Y29 HydrophobicContact CD-CD2 4.35Å; K27-Y29 HydrophobicContact CD-CE1 4.4Å; K27-Y29 HydrophobicContact CD-CE2 3.44Å; K27-Y29 VanDerWaalsContact CD-CE2 3.44Å; K27-Y29 VanDerWaalsContact CD-CZ 3.46Å; K27-Y29 VanDerWaalsContact CD-OH 3.29Å; K27-Y29 WeakPolarHBondContact CD-OH 3.44Å; K27-Y29 WeakPolarHBondContact CE-OH 3.19Å; K27-Y29 HydrophobicContact CG-CD2 3.98Å; K27-Y29 HydrophobicContact CG-CE2 3.53Å; K27-Y29 PolarHBondContact NZ-OH 3.36Å; K27-F72 PolarHBondContact N-O 3.11Å; K27-F72 PolarHBondContact O-N 3.28Å
28	L	62.7	Low	46.9	Very low	26 Å²	26	71.9 Å²	71.9	14%	0.136	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.1	171.3	176.2	66.9	0	0	0	109.6	F25 F30 F70 V71 A104	F25-L28 HydrophobicContact CE2-CB 4.23Å; F25-L28 HydrophobicContact CZ-CB 3.93Å; L28-F30 HydrophobicContact CD1-CE1 4.45Å; L28-F30 HydrophobicContact CD1-CE2 3.83Å; L28-F30 HydrophobicContact CD1-CZ 3.61Å; L28-F30 HydrophobicContact CD2-CD2 4.48Å; L28-F30 HydrophobicContact CD2-CE2 3.39Å; L28-F30 HydrophobicContact CD2-CZ 3.74Å; L28-F30 HydrophobicContact CG-CD2 4.29Å; L28-F30 HydrophobicContact CG-CE2 3.49Å; L28-F30 VanDerWaalsContact CG-CE2 3.49Å; L28-F30 HydrophobicContact CG-CZ 3.83Å; L28-F70 WeakPolarHBondContact CA-O 3.41Å; L28-V71 HydrophobicContact CD1-CG2 3.47Å; L28-V71 VanDerWaalsContact CD1-CG2 3.47Å; L28-A104 HydrophobicContact CD1-CB 3.88Å; L28-A104 HydrophobicContact CD2-CB 3.67Å; L28-A104 HydrophobicContact CG-CB 4.43Å
29	Y	63	Low	47.3	Very low	41 Å²	41	71.5 Å²	71.5	16%	0.161	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	136.3	174	-74.4	-83.6	0	0	0	110.9	K27 Y49 G69 F70 F72	K27-Y29 HydrophobicContact CB-CD2 4.35Å; K27-Y29 HydrophobicContact CB-CE2 3.97Å; K27-Y29 HydrophobicContact CD-CD2 4.35Å; K27-Y29 HydrophobicContact CD-CE1 4.4Å; K27-Y29 HydrophobicContact CD-CE2 3.44Å; K27-Y29 VanDerWaalsContact CD-CE2 3.44Å; K27-Y29 VanDerWaalsContact CD-CZ 3.46Å; K27-Y29 VanDerWaalsContact CD-OH 3.29Å; K27-Y29 WeakPolarHBondContact CD-OH 3.44Å; K27-Y29 WeakPolarHBondContact CE-OH 3.19Å; K27-Y29 HydrophobicContact CG-CD2 3.98Å; K27-Y29 HydrophobicContact CG-CE2 3.53Å; K27-Y29 PolarHBondContact NZ-OH 3.36Å; Y29-Y49 HydrophobicContact CD1-CD2 4.22Å; Y29-Y49 HydrophobicContact CD1-CE2 4.34Å; Y29-Y49 HydrophobicContact CD1-CG 4.5Å; Y29-Y49 AromaticContact CE1-CD2 3.68Å; Y29-Y49 HydrophobicContact CE1-CD2 3.68Å; Y29-Y49 HydrophobicContact CE1-CE1 4.41Å; Y29-Y49 AromaticContact CE1-CE2 3.43Å; Y29-Y49 HydrophobicContact CE1-CE2 3.43Å; Y29-Y49 VanDerWaalsContact CE1-CE2 3.43Å; Y29-Y49 HydrophobicContact CE1-CG 4.33Å; Y29-Y49 AromaticContact CE1-CZ 3.84Å; Y29-Y49 HydrophobicContact CE2-CE1 4.03Å; Y29-Y49 HydrophobicContact CE2-CE2 4.24Å; Y29-Y49 AromaticContact CE2-CZ 3.77Å; Y29-Y49 AromaticContact CZ-CE1 3.95Å; Y29-Y49 AromaticContact CZ-CE2 3.34Å; Y29-Y49 AromaticContact CZ-CZ 3.29Å; Y29-Y49 WeakPolarHBondContact OH-CE2 3.49Å; Y29-Y49 PolarHBondContact OH-OH 3.26Å; Y29-G69 CarbonylContact O-C 3.51Å; Y29-G69 WeakPolarHBondContact O-CA 3.29Å; Y29-F70 PolarHBondContact N-O 2.66Å; Y29-F70 PolarHBondContact O-N 3.22Å; Y29-F72 AromaticContact CD2-CD2 3.69Å; Y29-F72 HydrophobicContact CD2-CD2 3.69Å; Y29-F72 AromaticContact CD2-CE2 3.41Å; Y29-F72 HydrophobicContact CD2-CE2 3.41Å; Y29-F72 VanDerWaalsContact CD2-CE2 3.41Å; Y29-F72 HydrophobicContact CD2-CZ 4.26Å; Y29-F72 HydrophobicContact CE2-CD2 4.34Å; Y29-F72 HydrophobicContact CE2-CE2 4.23Å; Y29-F72 HydrophobicContact CG-CE2 4.19Å
30	F	60	Low	47.6	Very low	30 Å²	30	67.3 Å²	67.3	13%	0.132	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	141.5	167.7	-69.9	-76.4	0	0	0	110.4	L28 N32 G69 I98 A101 F160	L28-F30 HydrophobicContact CD1-CE1 4.45Å; L28-F30 HydrophobicContact CD1-CE2 3.83Å; L28-F30 HydrophobicContact CD1-CZ 3.61Å; L28-F30 HydrophobicContact CD2-CD2 4.48Å; L28-F30 HydrophobicContact CD2-CE2 3.39Å; L28-F30 HydrophobicContact CD2-CZ 3.74Å; L28-F30 HydrophobicContact CG-CD2 4.29Å; L28-F30 HydrophobicContact CG-CE2 3.49Å; L28-F30 VanDerWaalsContact CG-CE2 3.49Å; L28-F30 HydrophobicContact CG-CZ 3.83Å; F30-N32 PolarHBondContact O-N 3.5Å; F30-G69 VanDerWaalsContact CD1-CA 3.42Å; F30-I98 HydrophobicContact CD1-CD1 3.9Å; F30-I98 HydrophobicContact CE1-CD1 4.15Å; F30-A101 HydrophobicContact CD1-CB 4.35Å; F30-A101 HydrophobicContact CE1-CB 3.41Å; F30-A101 VanDerWaalsContact CE1-CB 3.41Å; F30-A101 HydrophobicContact CE2-CB 3.65Å; F30-A101 VanDerWaalsContact CZ-CA 3.47Å; F30-A101 HydrophobicContact CZ-CB 3.02Å; F30-F160 HydrophobicContact CB-CZ 4.25Å
31	A	53.1	Low	47.8	Very low	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.366	C	S	.	.			trans	-67	115.3	172.5	0	0	0	0	0	110.1	L52 L57 Y157	A31-L52 WeakPolarHBondContact CA-O 3.19Å; A31-L52 HydrophobicContact CB-CB 4.27Å; A31-L52 WeakPolarHBondContact CB-O 3.35Å; A31-L57 HydrophobicContact CB-CD1 3.34Å; A31-Y157 PolarHBondContact O-OH 3.36Å; A31-Y157 VanDerWaalsContact O-OH 3.08Å
32	N	47.6	Very low	47.6	Very low	64 Å²	64	69.7 Å²	69.7	34%	0.342	39%	0.387	S	S	.	.			trans	-92	137.2	174.8	-78.7	-19.8	0	0	0	110.3	F30 R34 F160	F30-N32 PolarHBondContact O-N 3.5Å; N32-R34 PolarHBondContact O-N 3.19Å; N32-F160 WeakPolarHBondContact OD1-CD2 3.42Å; N32-F160 WeakPolarHBondContact OD1-CE2 3.34Å
33	D	41.7	Very low	47.6	Very low	85 Å²	85	70.4 Å²	70.4	46%	0.455	40%	0.396	S	S	.	.	S	Bend	trans	-69.1	7.5	176.7	-95.5	-50.4	0	0	0	114.4	C35 S54	D33-C35 PolarHBondContact O-N 3.49Å; D33-S54 VanDerWaalsContact CG-CB 3.45Å; D33-S54 VanDerWaalsContact OD1-CB 3.28Å; D33-S54 WeakPolarHBondContact OD1-CB 3.03Å; D33-S54 PolarHBondContact OD1-OG 3.28Å; D33-S54 WeakPolarHBondContact OD2-CB 3.41Å; D33-S54 PolarHBondContact OD2-OG 3.01Å
34	R	37	Very low	47	Very low	157 Å²	157	73.7 Å²	73.7	59%	0.592	41%	0.413	S	S	*	.			trans	-82.9	56.5	176.1	-67	-164.7	-173.5	-179	5.4	112	N32 S36 D159 F160	N32-R34 PolarHBondContact O-N 3.19Å; R34-S36 PolarHBondContact O-N 2.8Å; R34-D159 IonicContact NH2-OD1 2.73Å; R34-F160 PolarHBondContact NH2-O 3.3Å
35	C	33.2	Very low	45.9	Very low	46 Å²	46	78.1 Å²	78.1	31%	0.311	44%	0.435	S	S	.	.			trans	-81.9	98.6	142	-83.6	0	0	0	0	105.7	D33 N53	D33-C35 PolarHBondContact O-N 3.49Å; C35-N53 WeakPolarHBondContact CB-ND2 3.39Å; C35-N53 PolarHBondContact SG-ND2 2.73Å
36	S	30.4	Very low	44.6	Very low	73 Å²	73	80.9 Å²	80.9	51%	0.51	46%	0.463	S	S	.	.			trans	-51.7	145.7	164	87	0	0	0	0	107.7	R34 S38	R34-S36 PolarHBondContact O-N 2.8Å; S36-S38 PolarHBondContact O-N 3.23Å; S36-S38 PolarHBondContact OG-N 3.04Å; S36-S38 PolarHBondContact OG-OG 3.39Å
37	S	37.1	Very low	43.8	Very low	135 Å²	135	82.5 Å²	82.5	94%	0.944	48%	0.476	S	S	*	.	S	Bend	trans	-63.6	16	175.8	48.6	0	0	0	0	113.7
38	S	34.9	Very low	42.5	Very low	56 Å²	56	78.9 Å²	78.9	39%	0.392	47%	0.467	S	S	.	.	S	Bend	trans	-84.5	141.4	169.3	75.1	0	0	0	0	110.3	S36 C40	S36-S38 PolarHBondContact O-N 3.23Å; S36-S38 PolarHBondContact OG-N 3.04Å; S36-S38 PolarHBondContact OG-OG 3.39Å; S38-C40 PolarHBondContact O-N 2.77Å
39	P	41	Very low	41.7	Very low	112 Å²	112	82.4 Å²	82.4	73%	0.727	48%	0.479	S	S	*	.			trans	-56.5	130.5	165.2	25.3	-30	0	0	0	107.7	T41	P39-T41 PolarHBondContact O-N 2.85Å
40	C	39.2	Very low	40.4	Very low	84 Å²	84	82.6 Å²	82.6	57%	0.568	49%	0.485	S	S	*	.			trans	-52.4	109	176	-54.1	0	0	0	0	108.4	S38	S38-C40 PolarHBondContact O-N 2.77Å
41	T	38.3	Very low	39.6	Very low	84 Å²	84	89.1 Å²	89.1	52%	0.515	51%	0.509	S	S	.	.			trans	-77.9	145.3	165.9	48.8	0	0	0	0	107.6	P39 S43 D44	P39-T41 PolarHBondContact O-N 2.85Å; T41-S43 PolarHBondContact O-N 2.96Å; T41-S43 PolarHBondContact OG1-OG 3.45Å; T41-D44 PolarHBondContact O-N 3.27Å
42	D	40.5	Very low	39.4	Very low	153 Å²	153	90.1 Å²	90.1	82%	0.818	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-50.3	-17.8	-175.7	-74.8	-37.3	0	0	0	114.7	M45	D42-M45 WeakPolarHBondContact O-CB 3.37Å; D42-M45 PolarHBondContact O-N 2.85Å
43	S	44.1	Very low	39.4	Very low	78 Å²	78	88.5 Å²	88.5	55%	0.545	51%	0.506	S	S	.	.	G	3₁₀ helix	trans	-68.7	-28.6	173.6	58.2	0	0	0	0	114.8	T41 M45 A46	T41-S43 PolarHBondContact O-N 2.96Å; T41-S43 PolarHBondContact OG1-OG 3.45Å; S43-M45 PolarHBondContact O-N 3.01Å; S43-A46 WeakPolarHBondContact O-CB 3.26Å; S43-A46 PolarHBondContact O-N 3.14Å; S43-A46 VanDerWaalsContact O-N 3.11Å
44	D	38.7	Very low	39.7	Very low	84 Å²	84	84.8 Å²	84.8	45%	0.449	49%	0.486	S	S	.	.	G	3₁₀ helix	trans	-74.8	-14.6	179.7	-74.4	-13.9	0	0	0	112.2	T41 A46 N47	T41-D44 PolarHBondContact O-N 3.27Å; D44-A46 PolarHBondContact O-N 3.33Å; D44-N47 PolarHBondContact O-N 3.1Å
45	M	35.8	Very low	40.2	Very low	99 Å²	99	85.6 Å²	85.6	49%	0.488	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-64.6	-16.7	167.6	-72.3	-83.1	153	0	0	112.6	D42 S43 N47 G48 C50	D42-M45 WeakPolarHBondContact O-CB 3.37Å; D42-M45 PolarHBondContact O-N 2.85Å; S43-M45 PolarHBondContact O-N 3.01Å; M45-N47 PolarHBondContact O-N 3.46Å; M45-G48 PolarHBondContact O-N 3.44Å; M45-C50 WeakPolarHBondContact CE-SG 3.47Å
46	A	35.6	Very low	40.9	Very low	89 Å²	89	87.5 Å²	87.5	74%	0.736	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-63.5	-23.5	179.7	0	0	0	0	0	113.1	S43 D44	S43-A46 WeakPolarHBondContact O-CB 3.26Å; S43-A46 PolarHBondContact O-N 3.14Å; S43-A46 VanDerWaalsContact O-N 3.11Å; D44-A46 PolarHBondContact O-N 3.33Å
47	N	40.3	Very low	41.9	Very low	137 Å²	137	84.6 Å²	84.6	73%	0.733	48%	0.482	S	S	*	.	G	3₁₀ helix	trans	-96.2	10.9	173.1	-78.9	-17.8	0	0	0	113.5	D44 M45 Y49	D44-N47 PolarHBondContact O-N 3.1Å; M45-N47 PolarHBondContact O-N 3.46Å; N47-Y49 WeakPolarHBondContact O-CD2 3.4Å; N47-Y49 WeakPolarHBondContact O-CE2 3.37Å; N47-Y49 PolarHBondContact O-N 2.89Å
48	G	38.4	Very low	42.4	Very low	24 Å²	24	79.2 Å²	79.2	25%	0.247	44%	0.444	C	S	.	.	S	Bend	trans	56.4	4.2	160.6	0	0	0	0	0	118.9	M45 W51	M45-G48 PolarHBondContact O-N 3.44Å; G48-W51 WeakPolarHBondContact O-CZ2 3.48Å
49	Y	46.5	Very low	42.8	Very low	100 Å²	100	78.8 Å²	78.8	39%	0.392	44%	0.44	S	S	.	.			trans	-132.9	15.2	-169.4	-56.7	-60	0	0	0	113.5	Y29 N47 W51 L52	Y29-Y49 HydrophobicContact CD1-CD2 4.22Å; Y29-Y49 HydrophobicContact CD1-CE2 4.34Å; Y29-Y49 HydrophobicContact CD1-CG 4.5Å; Y29-Y49 AromaticContact CE1-CD2 3.68Å; Y29-Y49 HydrophobicContact CE1-CD2 3.68Å; Y29-Y49 HydrophobicContact CE1-CE1 4.41Å; Y29-Y49 AromaticContact CE1-CE2 3.43Å; Y29-Y49 HydrophobicContact CE1-CE2 3.43Å; Y29-Y49 VanDerWaalsContact CE1-CE2 3.43Å; Y29-Y49 HydrophobicContact CE1-CG 4.33Å; Y29-Y49 AromaticContact CE1-CZ 3.84Å; Y29-Y49 HydrophobicContact CE2-CE1 4.03Å; Y29-Y49 HydrophobicContact CE2-CE2 4.24Å; Y29-Y49 AromaticContact CE2-CZ 3.77Å; Y29-Y49 AromaticContact CZ-CE1 3.95Å; Y29-Y49 AromaticContact CZ-CE2 3.34Å; Y29-Y49 AromaticContact CZ-CZ 3.29Å; Y29-Y49 WeakPolarHBondContact OH-CE2 3.49Å; Y29-Y49 PolarHBondContact OH-OH 3.26Å; N47-Y49 WeakPolarHBondContact O-CD2 3.4Å; N47-Y49 WeakPolarHBondContact O-CE2 3.37Å; N47-Y49 PolarHBondContact O-N 2.89Å; Y49-W51 PolarHBondContact O-N 3.2Å; Y49-W51 VanDerWaalsContact O-N 3.13Å; Y49-L52 HydrophobicContact CD1-CD1 4.31Å; Y49-L52 WeakPolarHBondContact O-CB 3.29Å; Y49-L52 PolarHBondContact O-N 2.87Å
50	C	36.2	Very low	42.8	Very low	44 Å²	44	85.2 Å²	85.2	30%	0.297	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-21.6	-177.9	63.6	0	0	0	0	113.9	M45 L52	M45-C50 WeakPolarHBondContact CE-SG 3.47Å; C50-L52 PolarHBondContact O-N 3.16Å
51	W	43	Very low	43	Very low	168 Å²	168	88 Å²	88	64%	0.636	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-16.4	172.3	39.6	70.2	0	0	0	113.6	G48 Y49 N53	G48-W51 WeakPolarHBondContact O-CZ2 3.48Å; Y49-W51 PolarHBondContact O-N 3.2Å; Y49-W51 VanDerWaalsContact O-N 3.13Å; W51-N53 PolarHBondContact O-N 2.68Å; W51-N53 VanDerWaalsContact O-N 3.09Å
52	L	49	Very low	43	Very low	21 Å²	21	92.9 Å²	92.9	11%	0.11	47%	0.468	C	S	.	.			trans	-83.1	44.9	172.4	-58.2	-179.7	0	0	0	111.4	A31 Y49 C50 S54 L57 F70	A31-L52 WeakPolarHBondContact CA-O 3.19Å; A31-L52 HydrophobicContact CB-CB 4.27Å; A31-L52 WeakPolarHBondContact CB-O 3.35Å; Y49-L52 HydrophobicContact CD1-CD1 4.31Å; Y49-L52 WeakPolarHBondContact O-CB 3.29Å; Y49-L52 PolarHBondContact O-N 2.87Å; C50-L52 PolarHBondContact O-N 3.16Å; L52-S54 PolarHBondContact O-N 2.9Å; L52-L57 HydrophobicContact CD2-CD1 4.49Å; L52-F70 HydrophobicContact CD1-CD2 4.47Å; L52-F70 HydrophobicContact CD2-CD2 3.42Å; L52-F70 VanDerWaalsContact CD2-CD2 3.42Å; L52-F70 HydrophobicContact CD2-CE2 3.38Å; L52-F70 HydrophobicContact CD2-CG 4.46Å; L52-F70 HydrophobicContact CD2-CZ 4.38Å
53	N	46.7	Very low	42.9	Very low	29 Å²	29	89.9 Å²	89.9	16%	0.155	47%	0.474	C	S	.	.			trans	-73.8	125.4	171.8	-176.1	-13	0	0	0	108.9	C35 W51 R55 S56 L57	C35-N53 WeakPolarHBondContact CB-ND2 3.39Å; C35-N53 PolarHBondContact SG-ND2 2.73Å; W51-N53 PolarHBondContact O-N 2.68Å; W51-N53 VanDerWaalsContact O-N 3.09Å; N53-R55 PolarHBondContact O-N 3.36Å; N53-R55 WeakPolarHBondContact OD1-CB 3.48Å; N53-R55 PolarHBondContact OD1-N 3.25Å; N53-S56 WeakPolarHBondContact O-CA 3.47Å; N53-S56 WeakPolarHBondContact O-CB 3.28Å; N53-S56 PolarHBondContact O-N 3.44Å; N53-L57 PolarHBondContact O-N 2.85Å; N53-L57 VanDerWaalsContact O-N 3.14Å
54	S	47.9	Very low	42.8	Very low	7 Å²	7	90.8 Å²	90.8	5%	0.049	48%	0.48	C	S	.	.	H	α-helix	trans	-51.8	-37.2	174.8	163	0	0	0	0	111.1	D33 L52 S56 L57 T58	D33-S54 VanDerWaalsContact CG-CB 3.45Å; D33-S54 VanDerWaalsContact OD1-CB 3.28Å; D33-S54 WeakPolarHBondContact OD1-CB 3.03Å; D33-S54 PolarHBondContact OD1-OG 3.28Å; D33-S54 WeakPolarHBondContact OD2-CB 3.41Å; D33-S54 PolarHBondContact OD2-OG 3.01Å; L52-S54 PolarHBondContact O-N 2.9Å; S54-S56 VanDerWaalsContact C-N 3.27Å; S54-S56 PolarHBondContact O-N 3.08Å; S54-L57 PolarHBondContact O-N 3.38Å; S54-T58 VanDerWaalsContact O-CB 3.3Å; S54-T58 WeakPolarHBondContact O-CB 3.14Å; S54-T58 VanDerWaalsContact O-CG2 3.27Å; S54-T58 WeakPolarHBondContact O-CG2 3.02Å; S54-T58 PolarHBondContact O-N 3.38Å; S54-T58 PolarHBondContact O-OG1 2.95Å
55	R	46.9	Very low	43.4	Very low	174 Å²	174	89.7 Å²	89.7	66%	0.657	48%	0.479	S	S	*	.	H	α-helix	trans	-61.9	-26.6	174.1	-63.2	-172.6	-174.9	175.6	3.1	115.3	N53 T58	N53-R55 PolarHBondContact O-N 3.36Å; N53-R55 WeakPolarHBondContact OD1-CB 3.48Å; N53-R55 PolarHBondContact OD1-N 3.25Å; R55-T58 WeakPolarHBondContact CA-OG1 3.16Å; R55-T58 VanDerWaalsContact O-O 3.14Å
56	S	49.5	Very low	44.3	Very low	86 Å²	86	87.6 Å²	87.6	60%	0.601	47%	0.47	S	S	*	.	H	α-helix	trans	-84.2	-35.3	176.6	-175.2	0	0	0	0	111.2	N53 S54 T58	N53-S56 WeakPolarHBondContact O-CA 3.47Å; N53-S56 WeakPolarHBondContact O-CB 3.28Å; N53-S56 PolarHBondContact O-N 3.44Å; S54-S56 VanDerWaalsContact C-N 3.27Å; S54-S56 PolarHBondContact O-N 3.08Å; S56-T58 VanDerWaalsContact C-N 3.33Å
57	L	51.4	Low	45.7	Very low	13 Å²	13	84.7 Å²	84.7	7%	0.068	44%	0.443	C	S	.	.	H	α-helix	trans	-78.3	-21.9	177.5	-72	155.7	0	0	0	112.6	A31 L52 N53 S54 F70	A31-L57 HydrophobicContact CB-CD1 3.34Å; L52-L57 HydrophobicContact CD2-CD1 4.49Å; N53-L57 PolarHBondContact O-N 2.85Å; N53-L57 VanDerWaalsContact O-N 3.14Å; S54-L57 PolarHBondContact O-N 3.38Å; L57-F70 HydrophobicContact CD1-CE2 4.04Å; L57-F70 HydrophobicContact CD2-CE2 3.72Å; L57-F70 HydrophobicContact CD2-CZ 3.8Å
58	T	46.8	Very low	47.2	Very low	22 Å²	22	79.5 Å²	79.5	14%	0.135	41%	0.414	C	S	.	.	S	Bend	trans	-94.1	96.4	172.1	55.3	0	0	0	0	109.3	S54 R55 S56 R60 S65	S54-T58 VanDerWaalsContact O-CB 3.3Å; S54-T58 WeakPolarHBondContact O-CB 3.14Å; S54-T58 VanDerWaalsContact O-CG2 3.27Å; S54-T58 WeakPolarHBondContact O-CG2 3.02Å; S54-T58 PolarHBondContact O-N 3.38Å; S54-T58 PolarHBondContact O-OG1 2.95Å; R55-T58 WeakPolarHBondContact CA-OG1 3.16Å; R55-T58 VanDerWaalsContact O-O 3.14Å; S56-T58 VanDerWaalsContact C-N 3.33Å; T58-R60 PolarHBondContact O-N 3.28Å; T58-S65 WeakPolarHBondContact CB-OG 3.34Å; T58-S65 VanDerWaalsContact CG2-CB 3.45Å; T58-S65 WeakPolarHBondContact CG2-OG 3.33Å
59	S	42.8	Very low	48.9	Very low	46 Å²	46	78.4 Å²	78.4	32%	0.322	40%	0.402	S	S	.	.			trans	-62.1	112	168.5	173.6	0	0	0	0	108.9	I61 Y62	S59-I61 PolarHBondContact O-N 3.04Å; S59-I61 WeakPolarHBondContact OG-CB 3.4Å; S59-I61 PolarHBondContact OG-N 3.04Å; S59-Y62 PolarHBondContact O-N 3.27Å
60	R	41.3	Very low	50.7	Low	248 Å²	248	75 Å²	75	94%	0.936	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-10.6	169.6	-103.7	-177.5	-170.3	-132.2	-0.5	113.6	T58	T58-R60 PolarHBondContact O-N 3.28Å
61	I	42.3	Very low	52.9	Low	143 Å²	143	73 Å²	73	73%	0.733	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-18.8	-172.8	-56.7	176.6	0	0	0	111.7	S59	S59-I61 PolarHBondContact O-N 3.04Å; S59-I61 WeakPolarHBondContact OG-CB 3.4Å; S59-I61 PolarHBondContact OG-N 3.04Å
62	Y	39.6	Very low	54.9	Low	185 Å²	185	66.6 Å²	66.6	73%	0.725	35%	0.352	S	S	*	.	S	Bend	trans	-118.5	107.4	175.4	-64.7	-79	0	0	0	109.5	S59 S64	S59-Y62 PolarHBondContact O-N 3.27Å; Y62-S64 PolarHBondContact O-N 3.5Å
63	G	37.1	Very low	56.6	Low	91 Å²	91	65.6 Å²	65.6	94%	0.938	35%	0.347	S	S	*	.	S	Bend	trans	-66.7	38.8	-162.6	0	0	0	0	0	118.7
64	S	42.3	Very low	58.5	Low	97 Å²	97	65.2 Å²	65.2	68%	0.678	34%	0.344	S	S	*	.			trans	-157.2	74.7	165.7	65	0	0	0	0	110.1	Y62 N66	Y62-S64 PolarHBondContact O-N 3.5Å; S64-N66 PolarHBondContact O-N 2.93Å; S64-N66 VanDerWaalsContact O-N 3.1Å
65	S	51.1	Low	60.3	Low	61 Å²	61	66.5 Å²	66.5	43%	0.427	35%	0.353	S	S	.	.			trans	-83.2	91.7	-175	70	0	0	0	0	111.3	T58	T58-S65 WeakPolarHBondContact CB-OG 3.34Å; T58-S65 VanDerWaalsContact CG2-CB 3.45Å; T58-S65 WeakPolarHBondContact CG2-OG 3.33Å
66	N	55.1	Low	62	Low	54 Å²	54	60.5 Å²	60.5	29%	0.289	34%	0.335	S	S	.	.			trans	-68.3	132	167.3	-75.6	-36.4	0	0	0	108.6	S64 Y68	S64-N66 PolarHBondContact O-N 2.93Å; S64-N66 VanDerWaalsContact O-N 3.1Å; N66-Y68 VanDerWaalsContact O-CD2 3.24Å; N66-Y68 WeakPolarHBondContact O-CD2 3.43Å; N66-Y68 VanDerWaalsContact O-CE2 3.25Å; N66-Y68 WeakPolarHBondContact O-CE2 3.21Å
67	P	65.9	Low	63.6	Low	28 Å²	28	60.3 Å²	60.3	18%	0.182	33%	0.325	C	S	.	.			trans	-62.2	147.5	175.4	20.9	-26.3	0	0	0	110.2	I98 Y157	P67-I98 HydrophobicContact CB-CB 4.45Å; P67-I98 HydrophobicContact CG-CB 3.83Å; P67-I98 HydrophobicContact CG-CG1 4.02Å; P67-I98 HydrophobicContact CG-CG2 3.78Å; P67-I98 VanDerWaalsContact O-CB 3.3Å; P67-I98 WeakPolarHBondContact O-CB 3.5Å; P67-I98 PolarHBondContact O-N 3.13Å; P67-Y157 HydrophobicContact CB-CE2 4.11Å; P67-Y157 HydrophobicContact CG-CD2 4.41Å; P67-Y157 HydrophobicContact CG-CE2 3.75Å
68	Y	70.5	Confident	65.3	Low	29 Å²	29	60.1 Å²	60.1	11%	0.114	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	150.9	-179.8	-63.7	-80.6	0	0	0	110.3	N66 L95 V96 H97 R130	N66-Y68 VanDerWaalsContact O-CD2 3.24Å; N66-Y68 WeakPolarHBondContact O-CD2 3.43Å; N66-Y68 VanDerWaalsContact O-CE2 3.25Å; N66-Y68 WeakPolarHBondContact O-CE2 3.21Å; Y68-L95 HydrophobicContact CD1-CD1 3.82Å; Y68-L95 HydrophobicContact CD1-CD2 3.23Å; Y68-L95 HydrophobicContact CD1-CG 3.58Å; Y68-L95 HydrophobicContact CD2-CD1 4.33Å; Y68-L95 HydrophobicContact CE1-CD1 4.29Å; Y68-L95 HydrophobicContact CE1-CD2 3.44Å; Y68-L95 VanDerWaalsContact CE1-CD2 3.44Å; Y68-L95 HydrophobicContact CE1-CG 4.2Å; Y68-L95 HydrophobicContact CG-CD1 3.81Å; Y68-L95 HydrophobicContact CG-CD2 4.09Å; Y68-L95 HydrophobicContact CG-CG 3.95Å; Y68-V96 CarbonylContact C-O 3.49Å; Y68-V96 WeakPolarHBondContact CA-O 2.84Å; Y68-H97 AromaticContact CD1-ND1 3.91Å; Y68-H97 AromaticContact CE1-CE1 3.42Å; Y68-H97 VanDerWaalsContact CE1-CE1 3.42Å; Y68-H97 WeakPolarHBondContact CE1-CE1 3.08Å; Y68-H97 AromaticContact CE1-ND1 3.29Å; Y68-H97 VanDerWaalsContact CE1-ND1 3.29Å; Y68-H97 WeakPolarHBondContact CE1-ND1 3.09Å; Y68-R130 PolarHBondContact OH-O 3.22Å
69	G	75.2	Confident	67.2	Low	0 Å²	0	62.7 Å²	62.7	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	179.2	165.3	0	0	0	0	0	111.4	Y29 F30 L95 V96	Y29-G69 CarbonylContact O-C 3.51Å; Y29-G69 WeakPolarHBondContact O-CA 3.29Å; F30-G69 VanDerWaalsContact CD1-CA 3.42Å; G69-L95 WeakPolarHBondContact O-CA 3.24Å; G69-V96 PolarHBondContact N-O 2.8Å; G69-V96 PolarHBondContact O-N 2.95Å
70	F	83.7	Confident	69.4	Low	30 Å²	30	62.8 Å²	62.8	13%	0.132	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	126.6	177.1	-71.9	-84.2	0	0	0	110.8	L28 Y29 L52 L57 F72 A93 L94 L95	L28-F70 WeakPolarHBondContact CA-O 3.41Å; Y29-F70 PolarHBondContact N-O 2.66Å; Y29-F70 PolarHBondContact O-N 3.22Å; L52-F70 HydrophobicContact CD1-CD2 4.47Å; L52-F70 HydrophobicContact CD2-CD2 3.42Å; L52-F70 VanDerWaalsContact CD2-CD2 3.42Å; L52-F70 HydrophobicContact CD2-CE2 3.38Å; L52-F70 HydrophobicContact CD2-CG 4.46Å; L52-F70 HydrophobicContact CD2-CZ 4.38Å; L57-F70 HydrophobicContact CD1-CE2 4.04Å; L57-F70 HydrophobicContact CD2-CE2 3.72Å; L57-F70 HydrophobicContact CD2-CZ 3.8Å; F70-F72 HydrophobicContact CB-CD2 4.27Å; F70-F72 HydrophobicContact CB-CE2 3.56Å; F70-F72 HydrophobicContact CB-CZ 4.05Å; F70-A93 HydrophobicContact CB-CB 4.34Å; F70-A93 HydrophobicContact CD1-CB 3.82Å; F70-A93 HydrophobicContact CG-CB 4.39Å; F70-L94 CarbonylContact C-O 3.44Å; F70-L94 VanDerWaalsContact CA-O 3.26Å; F70-L94 WeakPolarHBondContact CA-O 3.3Å; F70-L95 HydrophobicContact CE1-CB 4.13Å
71	V	82.7	Confident	71.7	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	124.2	167.7	169.1	0	0	0	0	107.7	F25 L28 A93 L94 V96 A104 L112	F25-V71 HydrophobicContact CD2-CG1 3.56Å; F25-V71 HydrophobicContact CE2-CB 4.46Å; F25-V71 HydrophobicContact CE2-CG1 3.69Å; F25-V71 HydrophobicContact CE2-CG2 4.45Å; L28-V71 HydrophobicContact CD1-CG2 3.47Å; L28-V71 VanDerWaalsContact CD1-CG2 3.47Å; V71-A93 WeakPolarHBondContact O-CA 3.34Å; V71-L94 PolarHBondContact N-O 3.41Å; V71-L94 PolarHBondContact O-N 2.93Å; V71-V96 HydrophobicContact CB-CG2 4.02Å; V71-V96 HydrophobicContact CG2-CB 4.37Å; V71-V96 HydrophobicContact CG2-CG2 3.45Å; V71-V96 VanDerWaalsContact CG2-CG2 3.45Å; V71-A104 HydrophobicContact CG2-CB 4.01Å; V71-L112 HydrophobicContact CB-CD2 4.44Å; V71-L112 HydrophobicContact CG1-CD1 3.97Å; V71-L112 HydrophobicContact CG1-CD2 3.56Å; V71-L112 HydrophobicContact CG1-CG 3.82Å
72	F	85.3	Confident	73.9	Confident	34 Å²	34	55.1 Å²	55.1	15%	0.149	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	131.3	179.1	-67.1	-100.4	0	0	0	109.9	F25 E26 K27 Y29 F70 L91 I92 A93	F25-F72 WeakPolarHBondContact CD2-O 3.48Å; E26-F72 PolarHBondContact N-O 2.97Å; K27-F72 PolarHBondContact N-O 3.11Å; K27-F72 PolarHBondContact O-N 3.28Å; Y29-F72 AromaticContact CD2-CD2 3.69Å; Y29-F72 HydrophobicContact CD2-CD2 3.69Å; Y29-F72 AromaticContact CD2-CE2 3.41Å; Y29-F72 HydrophobicContact CD2-CE2 3.41Å; Y29-F72 VanDerWaalsContact CD2-CE2 3.41Å; Y29-F72 HydrophobicContact CD2-CZ 4.26Å; Y29-F72 HydrophobicContact CE2-CD2 4.34Å; Y29-F72 HydrophobicContact CE2-CE2 4.23Å; Y29-F72 HydrophobicContact CG-CE2 4.19Å; F70-F72 HydrophobicContact CB-CD2 4.27Å; F70-F72 HydrophobicContact CB-CE2 3.56Å; F70-F72 HydrophobicContact CB-CZ 4.05Å; F72-L91 HydrophobicContact CB-CB 4.36Å; F72-L91 HydrophobicContact CB-CD1 4.06Å; F72-L91 HydrophobicContact CD1-CB 4.07Å; F72-L91 HydrophobicContact CD1-CD1 4.33Å; F72-I92 VanDerWaalsContact CA-O 3.32Å; F72-I92 WeakPolarHBondContact CA-O 3.36Å; F72-A93 HydrophobicContact CD1-CB 3.86Å; F72-A93 HydrophobicContact CE1-CB 3.53Å; F72-A93 HydrophobicContact CE2-CB 4.46Å; F72-A93 HydrophobicContact CG-CB 4.48Å; F72-A93 HydrophobicContact CZ-CB 3.87Å
73	F	85.5	Confident	76.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	153	-174.8	83.2	-91.8	0	0	0	110.5	F24 L91 I92 L94 L112 T124 L126	F24-F73 HydrophobicContact CD2-CD2 4.35Å; F24-F73 AromaticContact CE2-CD2 3.83Å; F24-F73 HydrophobicContact CE2-CD2 3.83Å; F24-F73 HydrophobicContact CE2-CE2 4.28Å; F24-F73 HydrophobicContact CZ-CD2 4.2Å; F24-F73 CarbonylContact O-C 3.54Å; F24-F73 WeakPolarHBondContact O-CA 3.45Å; F24-F73 WeakPolarHBondContact O-CB 3.33Å; F73-L91 WeakPolarHBondContact O-CD2 3.3Å; F73-I92 HydrophobicContact CD1-CB 4.06Å; F73-I92 HydrophobicContact CD1-CG2 4.23Å; F73-I92 WeakPolarHBondContact CD1-O 3.48Å; F73-I92 HydrophobicContact CE1-CB 3.55Å; F73-I92 HydrophobicContact CE1-CD1 4.45Å; F73-I92 HydrophobicContact CE1-CG2 3.38Å; F73-I92 HydrophobicContact CE2-CB 4.41Å; F73-I92 HydrophobicContact CE2-CD1 3.98Å; F73-I92 HydrophobicContact CZ-CB 3.76Å; F73-I92 HydrophobicContact CZ-CD1 3.78Å; F73-I92 HydrophobicContact CZ-CG1 4.42Å; F73-I92 HydrophobicContact CZ-CG2 3.72Å; F73-I92 PolarHBondContact N-O 3.4Å; F73-I92 PolarHBondContact O-N 2.77Å; F73-L94 HydrophobicContact CD1-CD1 3.96Å; F73-L94 HydrophobicContact CD1-CG 4.16Å; F73-L94 HydrophobicContact CE1-CD1 3.46Å; F73-L94 VanDerWaalsContact CE1-CD1 3.46Å; F73-L94 HydrophobicContact CE1-CG 3.65Å; F73-L94 HydrophobicContact CZ-CD1 4.32Å; F73-L112 HydrophobicContact CB-CD1 3.81Å; F73-L112 HydrophobicContact CB-CD2 4.37Å; F73-L112 HydrophobicContact CD1-CD2 3.98Å; F73-L112 HydrophobicContact CG-CD1 4.39Å; F73-L112 HydrophobicContact CG-CD2 4.28Å; F73-T124 HydrophobicContact CD1-CG2 4.3Å; F73-T124 HydrophobicContact CD2-CG2 4.05Å; F73-T124 HydrophobicContact CE1-CG2 3.78Å; F73-T124 HydrophobicContact CE2-CG2 3.55Å; F73-T124 HydrophobicContact CG-CG2 4.42Å; F73-T124 HydrophobicContact CZ-CG2 3.37Å; F73-L126 HydrophobicContact CZ-CD2 4.27Å
74	H	84.8	Confident	78.8	Confident	21 Å²	21	56 Å²	56	10%	0.097	32%	0.322	C	S	.	.			trans	-82.4	132.9	175.1	-74.7	-56.3	0	0	0	110.6	H21 C23 F24 E26 T76 F90 L91	H21-H74 PolarHBondContact O-CD2 3.05Å; C23-H74 PolarHBondContact O-CD2 2.8Å; C23-H74 VanDerWaalsContact O-CD2 3.3Å; F24-H74 PolarHBondContact O-N 2.89Å; E26-H74 IonicContact OE2-CE1 3.1Å; E26-H74 PolarHBondContact OE2-CE1 2.75Å; E26-H74 VanDerWaalsContact OE2-CE1 3.31Å; E26-H74 IonicContact OE2-NE2 2.69Å; E26-H74 PolarHBondContact OE2-NE2 3.12Å; H74-T76 PolarHBondContact O-N 3.02Å; H74-F90 PolarHBondContact ND1-O 2.77Å; H74-L91 WeakPolarHBondContact ND1-CD2 3.42Å
75	P	86.6	Confident	81.1	Confident	35 Å²	35	55 Å²	55	23%	0.227	31%	0.308	C	S	.	.			trans	-59.4	136.7	173.6	22	-29.3	0	0	0	110.8	L80 F90 I92	P75-L80 HydrophobicContact CB-CD1 3.98Å; P75-L80 HydrophobicContact CB-CD2 4.48Å; P75-L80 HydrophobicContact CG-CD1 4.25Å; P75-F90 HydrophobicContact CG-CE2 3.72Å; P75-F90 HydrophobicContact CG-CZ 3.82Å; P75-I92 HydrophobicContact CB-CD1 3.56Å; P75-I92 HydrophobicContact CG-CD1 4.01Å
76	T	82.8	Confident	82.9	Confident	47 Å²	47	56 Å²	56	29%	0.288	31%	0.314	S	S	.	.	S	Bend	trans	-120.1	-92.7	175.9	56	0	0	0	0	109.9	F24 H74 P123 P243	F24-T76 HydrophobicContact CD2-CG2 3.86Å; F24-T76 HydrophobicContact CE2-CG2 4.25Å; H74-T76 PolarHBondContact O-N 3.02Å; T76-P123 WeakPolarHBondContact OG1-CG 3.5Å; T76-P243 HydrophobicContact CG2-CB 3.87Å
77	H	82.6	Confident	84.4	Confident	82 Å²	82	60.7 Å²	60.7	38%	0.38	34%	0.339	S	S	.	.	S	Bend	trans	-88.5	-2.4	-176.1	-64.2	105.7	0	0	0	114.1	Y122 P243	H77-Y122 HydrophobicContact CB-CD1 4.15Å; H77-Y122 AromaticContact ND1-CE1 3.55Å; H77-P243 PolarHBondContact CE1-O 2.75Å; H77-P243 PolarHBondContact NE2-O 2.95Å
78	Q	86.5	Confident	85.3	Confident	10 Å²	10	64.3 Å²	64.3	5%	0.047	36%	0.363	C	S	.	.	S	Bend	trans	-70.2	141.8	-174.9	-60.9	89	-11.6	0	0	112.6	L80 Y121 T124 L126	Q78-L80 PolarHBondContact O-N 3.01Å; Q78-Y121 HydrophobicContact CB-CE1 3.66Å; Q78-Y121 HydrophobicContact CG-CD1 3.92Å; Q78-Y121 HydrophobicContact CG-CE1 3.5Å; Q78-Y121 VanDerWaalsContact CG-CE1 3.5Å; Q78-T124 WeakPolarHBondContact CG-O 3.4Å; Q78-T124 VanDerWaalsContact NE2-CG2 3.34Å; Q78-T124 PolarHBondContact NE2-O 2.86Å; Q78-L126 HydrophobicContact CB-CD1 3.89Å; Q78-L126 HydrophobicContact CB-CD2 3.61Å; Q78-L126 HydrophobicContact CB-CG 3.74Å; Q78-L126 HydrophobicContact CG-CD2 3.77Å; Q78-L126 HydrophobicContact CG-CG 4.01Å
79	C	86.7	Confident	85.9	Confident	75 Å²	75	67.6 Å²	67.6	51%	0.507	39%	0.387	S	S	.	.			trans	-70.8	113.1	175	-174.6	0	0	0	0	110	Y121 L126	C79-Y121 VanDerWaalsContact CB-OH 3.24Å; C79-Y121 WeakPolarHBondContact CB-OH 3.29Å; C79-Y121 PolarHBondContact N-OH 3.22Å; C79-L126 VanDerWaalsContact O-CD1 3.3Å; C79-L126 WeakPolarHBondContact O-CD1 3.46Å
80	L	89.8	Confident	86.4	Confident	48 Å²	48	69.6 Å²	69.6	25%	0.251	40%	0.396	S	S	.	.			trans	-99.8	7.6	175.4	-58.4	176.6	0	0	0	113.1	P75 Q78 G82 L83 L85 F90 L126	P75-L80 HydrophobicContact CB-CD1 3.98Å; P75-L80 HydrophobicContact CB-CD2 4.48Å; P75-L80 HydrophobicContact CG-CD1 4.25Å; Q78-L80 PolarHBondContact O-N 3.01Å; L80-G82 PolarHBondContact O-N 2.74Å; L80-L83 HydrophobicContact CD2-CD1 4.1Å; L80-L83 PolarHBondContact O-N 2.93Å; L80-L85 HydrophobicContact CB-CD1 4.07Å; L80-L85 HydrophobicContact CD1-CD1 3.96Å; L80-F90 HydrophobicContact CD1-CZ 4.06Å; L80-L126 HydrophobicContact CD2-CD1 3.7Å; L80-L126 HydrophobicContact CD2-CD2 4.14Å
81	L	89.7	Confident	86.5	Confident	159 Å²	159	70.8 Å²	70.8	83%	0.832	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	128.4	-175.9	-174.3	67.4	0	0	0	110.9	L83	L81-L83 VanDerWaalsContact C-N 3.33Å
82	G	88.9	Confident	86.8	Confident	72 Å²	72	71.9 Å²	71.9	74%	0.742	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.1	2.4	178.2	0	0	0	0	0	115.1	L80	L80-G82 PolarHBondContact O-N 2.74Å
83	L	89.1	Confident	87	Confident	96 Å²	96	71.9 Å²	71.9	50%	0.503	42%	0.416	S	S	.	.			trans	-88.5	137.9	173	-61.2	178.1	0	0	0	111.1	L80 L81 L85 L126	L80-L83 HydrophobicContact CD2-CD1 4.1Å; L80-L83 PolarHBondContact O-N 2.93Å; L81-L83 VanDerWaalsContact C-N 3.33Å; L83-L85 HydrophobicContact CB-CD2 3.94Å; L83-L85 HydrophobicContact CB-CG 4.21Å; L83-L85 PolarHBondContact O-N 2.75Å; L83-L126 HydrophobicContact CD1-CD1 4.19Å
84	H	91.2	Very high	87.1	Confident	197 Å²	197	72 Å²	72	91%	0.912	42%	0.416	S	S	*	.			trans	-81.9	99.1	169.7	-65.4	92	0	0	0	108.8
85	L	89.1	Confident	87.3	Confident	76 Å²	76	71.2 Å²	71.2	40%	0.398	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-95.7	147.4	-174.9	-59.5	172.4	0	0	0	111.9	L80 L83 F90	L80-L85 HydrophobicContact CB-CD1 4.07Å; L80-L85 HydrophobicContact CD1-CD1 3.96Å; L83-L85 HydrophobicContact CB-CD2 3.94Å; L83-L85 HydrophobicContact CB-CG 4.21Å; L83-L85 PolarHBondContact O-N 2.75Å; L85-F90 HydrophobicContact CB-CE1 4.38Å; L85-F90 HydrophobicContact CB-CZ 4.48Å; L85-F90 HydrophobicContact CD1-CE1 4.2Å; L85-F90 HydrophobicContact CD1-CZ 3.82Å; L85-F90 HydrophobicContact CD2-CE2 4.12Å; L85-F90 HydrophobicContact CD2-CZ 4.08Å; L85-F90 HydrophobicContact CG-CZ 4.36Å
86	P	89.7	Confident	87.2	Confident	83 Å²	83	69.6 Å²	69.6	54%	0.539	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-68.2	164.5	168.2	31.2	-35.6	0	0	0	111.3	F90	P86-F90 HydrophobicContact CG-CB 3.59Å; P86-F90 HydrophobicContact CG-CD1 4.34Å; P86-F90 HydrophobicContact CG-CG 3.93Å
87	N	86	Confident	87.1	Confident	152 Å²	152	67.8 Å²	67.8	81%	0.813	39%	0.39	S	S	*	.	S	Bend	trans	-61.4	134.4	173.4	-69.5	-28.7	0	0	0	110
88	P	84.9	Confident	86.7	Confident	105 Å²	105	64.5 Å²	64.5	68%	0.682	38%	0.376	S	S	*	.	S	Bend	trans	-65.4	153.2	178.4	27.8	-34.7	0	0	0	111.9	F90	P88-F90 HydrophobicContact CB-CD1 4.37Å
89	P	83.7	Confident	86.1	Confident	98 Å²	98	65.1 Å²	65.1	64%	0.636	38%	0.378	S	S	*	.	S	Bend	cis	-77.5	141.7	0.7	32	-34.3	0	0	0	112.1
90	F	84.5	Confident	85.8	Confident	41 Å²	41	61.5 Å²	61.5	18%	0.18	35%	0.354	C	S	.	.			trans	-135.3	162.7	173.6	69.8	-93.9	0	0	0	110.8	H74 P75 L80 L85 P86 P88	H74-F90 PolarHBondContact ND1-O 2.77Å; P75-F90 HydrophobicContact CG-CE2 3.72Å; P75-F90 HydrophobicContact CG-CZ 3.82Å; L80-F90 HydrophobicContact CD1-CZ 4.06Å; L85-F90 HydrophobicContact CB-CE1 4.38Å; L85-F90 HydrophobicContact CB-CZ 4.48Å; L85-F90 HydrophobicContact CD1-CE1 4.2Å; L85-F90 HydrophobicContact CD1-CZ 3.82Å; L85-F90 HydrophobicContact CD2-CE2 4.12Å; L85-F90 HydrophobicContact CD2-CZ 4.08Å; L85-F90 HydrophobicContact CG-CZ 4.36Å; P86-F90 HydrophobicContact CG-CB 3.59Å; P86-F90 HydrophobicContact CG-CD1 4.34Å; P86-F90 HydrophobicContact CG-CG 3.93Å; P88-F90 HydrophobicContact CB-CD1 4.37Å
91	L	86.7	Confident	85	Confident	56 Å²	56	59.3 Å²	59.3	29%	0.293	34%	0.343	S	S	.	.			trans	-123.3	151.1	-179.1	-71	166.5	0	0	0	110.5	E26 F72 F73 H74	E26-L91 HydrophobicContact CB-CD1 4.25Å; E26-L91 HydrophobicContact CB-CD2 3.97Å; E26-L91 VanDerWaalsContact CD-CD1 3.47Å; E26-L91 HydrophobicContact CG-CD1 4.29Å; E26-L91 WeakPolarHBondContact OE2-CD1 3.33Å; E26-L91 WeakPolarHBondContact OE2-CD2 3.27Å; E26-L91 WeakPolarHBondContact OE2-CG 3.37Å; F72-L91 HydrophobicContact CB-CB 4.36Å; F72-L91 HydrophobicContact CB-CD1 4.06Å; F72-L91 HydrophobicContact CD1-CB 4.07Å; F72-L91 HydrophobicContact CD1-CD1 4.33Å; F73-L91 WeakPolarHBondContact O-CD2 3.3Å; H74-L91 WeakPolarHBondContact ND1-CD2 3.42Å
92	I	88.8	Confident	84.1	Confident	22 Å²	22	52 Å²	52	11%	0.113	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	133.8	168.8	-63.4	148.5	0	0	0	107.7	F72 F73 P75 L126	F72-I92 VanDerWaalsContact CA-O 3.32Å; F72-I92 WeakPolarHBondContact CA-O 3.36Å; F73-I92 HydrophobicContact CD1-CB 4.06Å; F73-I92 HydrophobicContact CD1-CG2 4.23Å; F73-I92 WeakPolarHBondContact CD1-O 3.48Å; F73-I92 HydrophobicContact CE1-CB 3.55Å; F73-I92 HydrophobicContact CE1-CD1 4.45Å; F73-I92 HydrophobicContact CE1-CG2 3.38Å; F73-I92 HydrophobicContact CE2-CB 4.41Å; F73-I92 HydrophobicContact CE2-CD1 3.98Å; F73-I92 HydrophobicContact CZ-CB 3.76Å; F73-I92 HydrophobicContact CZ-CD1 3.78Å; F73-I92 HydrophobicContact CZ-CG1 4.42Å; F73-I92 HydrophobicContact CZ-CG2 3.72Å; F73-I92 PolarHBondContact N-O 3.4Å; F73-I92 PolarHBondContact O-N 2.77Å; P75-I92 HydrophobicContact CB-CD1 3.56Å; P75-I92 HydrophobicContact CG-CD1 4.01Å; I92-L126 HydrophobicContact CD1-CD2 3.27Å; I92-L126 HydrophobicContact CG1-CD2 4.17Å; I92-L126 HydrophobicContact CG2-CD2 4.32Å
93	A	88.7	Confident	83.5	Confident	35 Å²	35	48.7 Å²	48.7	29%	0.289	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	121.4	177.9	0	0	0	0	0	110	F70 V71 F72 S128	F70-A93 HydrophobicContact CB-CB 4.34Å; F70-A93 HydrophobicContact CD1-CB 3.82Å; F70-A93 HydrophobicContact CG-CB 4.39Å; V71-A93 WeakPolarHBondContact O-CA 3.34Å; F72-A93 HydrophobicContact CD1-CB 3.86Å; F72-A93 HydrophobicContact CE1-CB 3.53Å; F72-A93 HydrophobicContact CE2-CB 4.46Å; F72-A93 HydrophobicContact CG-CB 4.48Å; F72-A93 HydrophobicContact CZ-CB 3.87Å; A93-S128 PolarHBondContact O-OG 3.36Å
94	L	89.4	Confident	83	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	133.9	173.2	-71.7	174.7	0	0	0	111.9	F70 V71 F73 L112 L115 T124 T125	F70-L94 CarbonylContact C-O 3.44Å; F70-L94 VanDerWaalsContact CA-O 3.26Å; F70-L94 WeakPolarHBondContact CA-O 3.3Å; V71-L94 PolarHBondContact N-O 3.41Å; V71-L94 PolarHBondContact O-N 2.93Å; F73-L94 HydrophobicContact CD1-CD1 3.96Å; F73-L94 HydrophobicContact CD1-CG 4.16Å; F73-L94 HydrophobicContact CE1-CD1 3.46Å; F73-L94 VanDerWaalsContact CE1-CD1 3.46Å; F73-L94 HydrophobicContact CE1-CG 3.65Å; F73-L94 HydrophobicContact CZ-CD1 4.32Å; L94-L112 HydrophobicContact CD1-CD2 3.72Å; L94-L115 HydrophobicContact CB-CD1 4.25Å; L94-L115 HydrophobicContact CD1-CD1 3.97Å; L94-T124 HydrophobicContact CD1-CG2 3.99Å; L94-T125 HydrophobicContact CD1-CG2 4.29Å; L94-T125 WeakPolarHBondContact CD1-O 3.25Å; L94-T125 HydrophobicContact CD2-CG2 3.95Å
95	L	88.4	Confident	82.2	Confident	5 Å²	5	42.6 Å²	42.6	3%	0.026	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	128.2	178.1	178.3	145.5	0	0	0	111.8	Y68 G69 F70 S128 R130 R132	Y68-L95 HydrophobicContact CD1-CD1 3.82Å; Y68-L95 HydrophobicContact CD1-CD2 3.23Å; Y68-L95 HydrophobicContact CD1-CG 3.58Å; Y68-L95 HydrophobicContact CD2-CD1 4.33Å; Y68-L95 HydrophobicContact CE1-CD1 4.29Å; Y68-L95 HydrophobicContact CE1-CD2 3.44Å; Y68-L95 VanDerWaalsContact CE1-CD2 3.44Å; Y68-L95 HydrophobicContact CE1-CG 4.2Å; Y68-L95 HydrophobicContact CG-CD1 3.81Å; Y68-L95 HydrophobicContact CG-CD2 4.09Å; Y68-L95 HydrophobicContact CG-CG 3.95Å; G69-L95 WeakPolarHBondContact O-CA 3.24Å; F70-L95 HydrophobicContact CE1-CB 4.13Å; L95-S128 WeakPolarHBondContact CB-OG 3.08Å; L95-S128 PolarHBondContact N-OG 3.37Å; L95-R130 HydrophobicContact CD1-CG 3.82Å; L95-R132 PolarHBondContact O-NH2 3.38Å
96	V	84	Confident	81.2	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	135.7	-178.9	175.7	0	0	0	0	109.3	Y68 G69 V71 E100 A104 I111	Y68-V96 CarbonylContact C-O 3.49Å; Y68-V96 WeakPolarHBondContact CA-O 2.84Å; G69-V96 PolarHBondContact N-O 2.8Å; G69-V96 PolarHBondContact O-N 2.95Å; V71-V96 HydrophobicContact CB-CG2 4.02Å; V71-V96 HydrophobicContact CG2-CB 4.37Å; V71-V96 HydrophobicContact CG2-CG2 3.45Å; V71-V96 VanDerWaalsContact CG2-CG2 3.45Å; V96-E100 HydrophobicContact CG1-CB 3.56Å; V96-E100 WeakPolarHBondContact CG1-OE2 3.43Å; V96-A104 HydrophobicContact CG1-CB 4.08Å; V96-I111 HydrophobicContact CG2-CG2 3.94Å
97	H	80.4	Confident	80.6	Confident	9 Å²	9	37.3 Å²	37.3	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	149.3	176.8	-67.5	-87.9	0	0	0	110.3	Y68 Q99 E100 A101 R132 I134	Y68-H97 AromaticContact CD1-ND1 3.91Å; Y68-H97 AromaticContact CE1-CE1 3.42Å; Y68-H97 VanDerWaalsContact CE1-CE1 3.42Å; Y68-H97 WeakPolarHBondContact CE1-CE1 3.08Å; Y68-H97 AromaticContact CE1-ND1 3.29Å; Y68-H97 VanDerWaalsContact CE1-ND1 3.29Å; Y68-H97 WeakPolarHBondContact CE1-ND1 3.09Å; H97-Q99 PolarHBondContact O-N 2.89Å; H97-Q99 VanDerWaalsContact O-N 3.11Å; H97-E100 HydrophobicContact CB-CG 4.27Å; H97-E100 IonicContact CD2-OE1 3.7Å; H97-E100 IonicContact CD2-OE2 3.94Å; H97-E100 PolarHBondContact N-OE2 3.03Å; H97-E100 WeakPolarHBondContact O-CA 3.18Å; H97-E100 WeakPolarHBondContact O-CB 3.38Å; H97-E100 PolarHBondContact O-N 3.13Å; H97-A101 PolarHBondContact O-N 2.95Å; H97-R132 PolarHBondContact CD2-NH1 3.39Å; H97-R132 PolarHBondContact NE2-O 3.34Å; H97-I134 HydrophobicContact CB-CG1 4.18Å
98	I	74.5	Confident	80.4	Confident	14 Å²	14	30.3 Å²	30.3	7%	0.072	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-57.1	-29.7	177.2	-166.3	64.5	0	0	0	113.5	F30 P67 E100 A101 F155 Y157	F30-I98 HydrophobicContact CD1-CD1 3.9Å; F30-I98 HydrophobicContact CE1-CD1 4.15Å; P67-I98 HydrophobicContact CB-CB 4.45Å; P67-I98 HydrophobicContact CG-CB 3.83Å; P67-I98 HydrophobicContact CG-CG1 4.02Å; P67-I98 HydrophobicContact CG-CG2 3.78Å; P67-I98 VanDerWaalsContact O-CB 3.3Å; P67-I98 WeakPolarHBondContact O-CB 3.5Å; P67-I98 PolarHBondContact O-N 3.13Å; I98-E100 PolarHBondContact O-N 3.39Å; I98-A101 HydrophobicContact CD1-CB 4.06Å; I98-A101 WeakPolarHBondContact O-CB 3.48Å; I98-A101 PolarHBondContact O-N 3.21Å; I98-A101 VanDerWaalsContact O-N 3.12Å; I98-F155 HydrophobicContact CD1-CB 4.35Å; I98-F155 HydrophobicContact CD1-CD1 3.62Å; I98-F155 HydrophobicContact CD1-CE1 4.32Å; I98-F155 HydrophobicContact CD1-CG 4.09Å; I98-F155 HydrophobicContact CG1-CB 4.48Å; I98-F155 HydrophobicContact CG1-CD1 4.24Å; I98-Y157 HydrophobicContact CD1-CD2 4.31Å; I98-Y157 HydrophobicContact CD1-CE2 3.51Å; I98-Y157 HydrophobicContact CG1-CD2 4.35Å; I98-Y157 HydrophobicContact CG1-CE2 3.86Å
99	Q	74.6	Confident	80.3	Confident	22 Å²	22	26 Å²	26	10%	0.103	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-65.5	-27.4	176.1	-67.5	84.1	-12.2	0	0	112.4	H97 A101 I134 F136 C138	H97-Q99 PolarHBondContact O-N 2.89Å; H97-Q99 VanDerWaalsContact O-N 3.11Å; Q99-A101 VanDerWaalsContact C-N 3.34Å; Q99-I134 HydrophobicContact CB-CD1 4.19Å; Q99-I134 HydrophobicContact CB-CG2 4.01Å; Q99-I134 HydrophobicContact CG-CD1 3.99Å; Q99-F136 CarbonylContact C-O 3.54Å; Q99-C138 PolarHBondContact O-SG 3.1Å
100	E	78.8	Confident	80.3	Confident	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-87.9	-8.6	177.5	-58.9	166.4	156.5	0	0	111.4	V96 H97 I98 W103 A104 I111 R132 I134 L135 F136	V96-E100 HydrophobicContact CG1-CB 3.56Å; V96-E100 WeakPolarHBondContact CG1-OE2 3.43Å; H97-E100 HydrophobicContact CB-CG 4.27Å; H97-E100 IonicContact CD2-OE1 3.7Å; H97-E100 IonicContact CD2-OE2 3.94Å; H97-E100 PolarHBondContact N-OE2 3.03Å; H97-E100 WeakPolarHBondContact O-CA 3.18Å; H97-E100 WeakPolarHBondContact O-CB 3.38Å; H97-E100 PolarHBondContact O-N 3.13Å; I98-E100 PolarHBondContact O-N 3.39Å; E100-W103 WeakPolarHBondContact O-CB 3.45Å; E100-W103 PolarHBondContact O-N 2.76Å; E100-A104 PolarHBondContact O-N 2.88Å; E100-I111 HydrophobicContact CB-CD1 4.21Å; E100-R132 IonicContact OE1-CZ 3.94Å; E100-R132 IonicContact OE1-NH1 2.71Å; E100-R132 PolarHBondContact OE1-NH1 3.22Å; E100-R132 IonicContact OE1-NH2 3.48Å; E100-R132 IonicContact OE2-CZ 2.64Å; E100-R132 IonicContact OE2-NH1 3.66Å; E100-R132 PolarHBondContact OE2-NH1 3.1Å; E100-R132 IonicContact OE2-NH2 2.72Å; E100-R132 PolarHBondContact OE2-NH2 3.03Å; E100-I134 HydrophobicContact CG-CG2 3.91Å; E100-L135 WeakPolarHBondContact OE1-CB 3.47Å; E100-L135 PolarHBondContact OE1-N 2.77Å; E100-F136 WeakPolarHBondContact CG-O 3.2Å
101	A	73.3	Confident	80.4	Confident	1 Å²	1	20.4 Å²	20.4	1%	0.008	10%	0.1	C	C	.	.	H	α-helix	trans	-55.2	-45.2	-172.8	0	0	0	0	0	114.6	F30 H97 I98 Q99 W103 A104 Y105 F155	F30-A101 HydrophobicContact CD1-CB 4.35Å; F30-A101 HydrophobicContact CE1-CB 3.41Å; F30-A101 VanDerWaalsContact CE1-CB 3.41Å; F30-A101 HydrophobicContact CE2-CB 3.65Å; F30-A101 VanDerWaalsContact CZ-CA 3.47Å; F30-A101 HydrophobicContact CZ-CB 3.02Å; H97-A101 PolarHBondContact O-N 2.95Å; I98-A101 HydrophobicContact CD1-CB 4.06Å; I98-A101 WeakPolarHBondContact O-CB 3.48Å; I98-A101 PolarHBondContact O-N 3.21Å; I98-A101 VanDerWaalsContact O-N 3.12Å; Q99-A101 VanDerWaalsContact C-N 3.34Å; A101-W103 VanDerWaalsContact C-N 3.31Å; A101-W103 PolarHBondContact O-N 3.14Å; A101-A104 PolarHBondContact O-N 2.66Å; A101-Y105 WeakPolarHBondContact O-CB 3.09Å; A101-Y105 PolarHBondContact O-N 3Å; A101-F155 HydrophobicContact CB-CB 4.06Å; A101-F155 HydrophobicContact CB-CD2 4.39Å; A101-F155 HydrophobicContact CB-CG 4.25Å
102	P	72	Confident	80.5	Confident	7 Å²	7	17.7 Å²	17.7	5%	0.045	9%	0.086	C	C	.	.	H	α-helix	trans	-63.4	-40.2	177.4	-24.9	39	0	0	0	111.8	Y105 H106 C138 I152 K153 F155	P102-Y105 PolarHBondContact O-N 2.87Å; P102-H106 PolarHBondContact O-CD2 3.05Å; P102-H106 PolarHBondContact O-N 3.17Å; P102-H106 VanDerWaalsContact O-N 3.12Å; P102-C138 HydrophobicContact CB-CB 4.41Å; P102-C138 HydrophobicContact CG-CB 4.09Å; P102-I152 HydrophobicContact CB-CG2 3.73Å; P102-K153 WeakPolarHBondContact CB-O 3.48Å; P102-K153 WeakPolarHBondContact CG-O 3.28Å; P102-F155 HydrophobicContact CG-CB 4.03Å
103	W	76.1	Confident	80.6	Confident	1 Å²	1	17.3 Å²	17.3	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-66	-42	176.5	-71.2	108	0	0	0	112.1	E100 A101 Y105 H106 L107 R110 I111 F136 L146 I152	E100-W103 WeakPolarHBondContact O-CB 3.45Å; E100-W103 PolarHBondContact O-N 2.76Å; A101-W103 VanDerWaalsContact C-N 3.31Å; A101-W103 PolarHBondContact O-N 3.14Å; W103-Y105 PolarHBondContact O-N 3.25Å; W103-H106 PolarHBondContact O-N 2.8Å; W103-L107 HydrophobicContact CE3-CD1 4.27Å; W103-L107 HydrophobicContact CZ3-CD1 4.12Å; W103-L107 CarbonylContact O-C 3.46Å; W103-L107 WeakPolarHBondContact O-CA 3.33Å; W103-L107 PolarHBondContact O-N 3.19Å; W103-R110 VanDerWaalsContact CE3-NH1 3.35Å; W103-I111 HydrophobicContact CB-CD1 3.8Å; W103-I111 HydrophobicContact CB-CG1 4.44Å; W103-F136 HydrophobicContact CB-CB 4.34Å; W103-F136 HydrophobicContact CD2-CB 4.47Å; W103-F136 HydrophobicContact CG-CB 3.79Å; W103-F136 HydrophobicContact CG-CG 4.18Å; W103-L146 HydrophobicContact CH2-CB 4.25Å; W103-L146 HydrophobicContact CZ3-CB 4.08Å; W103-L146 HydrophobicContact CZ3-CD1 4.15Å; W103-I152 HydrophobicContact CD2-CD1 4.1Å; W103-I152 HydrophobicContact CE3-CD1 3.49Å; W103-I152 VanDerWaalsContact CE3-CD1 3.49Å; W103-I152 HydrophobicContact CH2-CD1 3.69Å; W103-I152 HydrophobicContact CZ2-CD1 4.31Å; W103-I152 HydrophobicContact CZ3-CD1 3.21Å
104	A	78.1	Confident	80.6	Confident	0 Å²	0	16 Å²	16	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-63.5	-31.4	176	0	0	0	0	0	112.4	L28 V71 V96 E100 A101 P108 I111	L28-A104 HydrophobicContact CD1-CB 3.88Å; L28-A104 HydrophobicContact CD2-CB 3.67Å; L28-A104 HydrophobicContact CG-CB 4.43Å; V71-A104 HydrophobicContact CG2-CB 4.01Å; V96-A104 HydrophobicContact CG1-CB 4.08Å; E100-A104 PolarHBondContact O-N 2.88Å; A101-A104 PolarHBondContact O-N 2.66Å; A104-P108 WeakPolarHBondContact O-CB 3.2Å; A104-I111 HydrophobicContact CB-CG1 3.88Å
105	Y	73.7	Confident	80.7	Confident	166 Å²	166	16.1 Å²	16.1	65%	0.651	7%	0.073	S	C	*	.	H	α-helix	trans	-72.2	-47.5	178.9	-179	-93.2	0	0	0	112	A101 P102 W103	A101-Y105 WeakPolarHBondContact O-CB 3.09Å; A101-Y105 PolarHBondContact O-N 3Å; P102-Y105 PolarHBondContact O-N 2.87Å; W103-Y105 PolarHBondContact O-N 3.25Å
106	H	69.9	Low	80.9	Confident	27 Å²	27	15.9 Å²	15.9	13%	0.125	7%	0.072	C	C	.	.	H	α-helix	trans	-86.3	-32.6	-177.1	-67.1	-81.1	0	0	0	113.5	P102 W103 T150 I152 E174	P102-H106 PolarHBondContact O-CD2 3.05Å; P102-H106 PolarHBondContact O-N 3.17Å; P102-H106 VanDerWaalsContact O-N 3.12Å; W103-H106 PolarHBondContact O-N 2.8Å; H106-T150 HydrophobicContact CB-CG2 4.48Å; H106-I152 HydrophobicContact CB-CD1 4.27Å; H106-I152 HydrophobicContact CB-CG1 4.2Å; H106-I152 WeakPolarHBondContact CD2-CG1 3.49Å; H106-E174 IonicContact CE1-OE1 4Å; H106-E174 PolarHBondContact CE1-OE1 3.12Å; H106-E174 VanDerWaalsContact CE1-OE1 3.22Å; H106-E174 IonicContact ND1-OE1 3.22Å; H106-E174 PolarHBondContact ND1-OE1 3.11Å
107	L	77	Confident	81.1	Confident	20 Å²	20	18.8 Å²	18.8	11%	0.105	9%	0.085	C	C	.	.			trans	-141.5	67.5	-172.5	-68.3	172	0	0	0	111.3	W103 S109 R110 L146 L176	W103-L107 HydrophobicContact CE3-CD1 4.27Å; W103-L107 HydrophobicContact CZ3-CD1 4.12Å; W103-L107 CarbonylContact O-C 3.46Å; W103-L107 WeakPolarHBondContact O-CA 3.33Å; W103-L107 PolarHBondContact O-N 3.19Å; L107-S109 VanDerWaalsContact C-N 3.34Å; L107-S109 PolarHBondContact O-N 3.35Å; L107-R110 HydrophobicContact CB-CB 3.95Å; L107-R110 WeakPolarHBondContact O-CB 3.28Å; L107-R110 PolarHBondContact O-N 3.12Å; L107-L146 HydrophobicContact CD1-CB 4.45Å; L107-L146 HydrophobicContact CD1-CD1 3.38Å; L107-L146 HydrophobicContact CD1-CD2 4.08Å; L107-L146 HydrophobicContact CD1-CG 4.16Å; L107-L176 HydrophobicContact CD2-CD2 3.8Å; L107-L176 HydrophobicContact CG-CD2 4.14Å
108	P	80.2	Confident	81.6	Confident	5 Å²	5	21.6 Å²	21.6	3%	0.032	10%	0.098	C	C	.	.	H	α-helix	trans	-59.4	-40.7	-176.1	22.4	-33.9	0	0	0	113.4	F25 A104 R110 I111 L112	F25-P108 HydrophobicContact CB-CB 3.89Å; F25-P108 HydrophobicContact CB-CG 3.95Å; F25-P108 HydrophobicContact CD1-CB 3.61Å; F25-P108 HydrophobicContact CD1-CG 3.28Å; F25-P108 HydrophobicContact CD2-CB 3.29Å; F25-P108 HydrophobicContact CD2-CG 3.98Å; F25-P108 HydrophobicContact CE1-CB 3.8Å; F25-P108 HydrophobicContact CE1-CG 3.56Å; F25-P108 HydrophobicContact CE2-CB 3.49Å; F25-P108 VanDerWaalsContact CE2-CB 3.49Å; F25-P108 HydrophobicContact CE2-CG 4.22Å; F25-P108 HydrophobicContact CG-CB 3.3Å; F25-P108 HydrophobicContact CG-CG 3.46Å; F25-P108 VanDerWaalsContact CG-CG 3.46Å; F25-P108 HydrophobicContact CZ-CB 3.71Å; F25-P108 HydrophobicContact CZ-CG 4Å; A104-P108 WeakPolarHBondContact O-CB 3.2Å; P108-R110 PolarHBondContact O-N 2.9Å; P108-I111 WeakPolarHBondContact O-CB 3.38Å; P108-I111 PolarHBondContact O-N 3.09Å; P108-L112 PolarHBondContact O-N 3.2Å
109	S	83.5	Confident	82.3	Confident	14 Å²	14	23 Å²	23	10%	0.098	11%	0.109	C	C	.	.	H	α-helix	trans	-56.3	-35	175.9	-58.8	0	0	0	0	112	L107 I111 L112 L113	L107-S109 VanDerWaalsContact C-N 3.34Å; L107-S109 PolarHBondContact O-N 3.35Å; S109-I111 VanDerWaalsContact C-N 3.32Å; S109-I111 PolarHBondContact O-N 2.8Å; S109-L112 PolarHBondContact O-N 3.43Å; S109-L113 WeakPolarHBondContact O-CB 3.49Å; S109-L113 VanDerWaalsContact O-CG 3.22Å; S109-L113 WeakPolarHBondContact O-CG 3.34Å; S109-L113 PolarHBondContact O-N 2.83Å
110	R	84.5	Confident	83	Confident	22 Å²	22	30.6 Å²	30.6	8%	0.083	14%	0.144	C	C	.	.	H	α-helix	trans	-62.9	-39.2	177.5	-169.6	-179.1	-175.4	177.2	2.7	111.7	W103 L107 P108 N114 F136 C251	W103-R110 VanDerWaalsContact CE3-NH1 3.35Å; L107-R110 HydrophobicContact CB-CB 3.95Å; L107-R110 WeakPolarHBondContact O-CB 3.28Å; L107-R110 PolarHBondContact O-N 3.12Å; P108-R110 PolarHBondContact O-N 2.9Å; R110-N114 WeakPolarHBondContact O-CB 2.86Å; R110-N114 PolarHBondContact O-N 2.81Å; R110-N114 PolarHBondContact O-ND2 3.24Å; R110-F136 HydrophobicContact CG-CE1 4.44Å; R110-F136 HydrophobicContact CG-CE2 3.92Å; R110-F136 HydrophobicContact CG-CZ 3.63Å; R110-F136 VanDerWaalsContact NE-CZ 3.26Å; R110-C251 PolarHBondContact NH2-SG 2.99Å
111	I	86.2	Confident	83.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.4	-51.6	175.8	-58.6	-55.6	0	0	0	110.2	V96 E100 W103 A104 P108 S109 L113 N114 L115 F136	V96-I111 HydrophobicContact CG2-CG2 3.94Å; E100-I111 HydrophobicContact CB-CD1 4.21Å; W103-I111 HydrophobicContact CB-CD1 3.8Å; W103-I111 HydrophobicContact CB-CG1 4.44Å; A104-I111 HydrophobicContact CB-CG1 3.88Å; P108-I111 WeakPolarHBondContact O-CB 3.38Å; P108-I111 PolarHBondContact O-N 3.09Å; S109-I111 VanDerWaalsContact C-N 3.32Å; S109-I111 PolarHBondContact O-N 2.8Å; I111-L113 PolarHBondContact O-N 3.32Å; I111-N114 PolarHBondContact O-N 2.96Å; I111-L115 HydrophobicContact CG2-CD1 3.97Å; I111-L115 HydrophobicContact CG2-CG 4.34Å; I111-L115 WeakPolarHBondContact O-CG 3.31Å; I111-L115 PolarHBondContact O-N 3.33Å; I111-F136 HydrophobicContact CD1-CD2 3.38Å; I111-F136 HydrophobicContact CD1-CE2 3.83Å; I111-F136 HydrophobicContact CD1-CG 4.4Å
112	L	89.1	Confident	84.2	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.9	-46.2	-176.2	-68.4	173.2	0	0	0	112.3	F24 F25 V71 F73 L94 P108 S109 N114 L115 G116 T124	F24-L112 HydrophobicContact CD1-CB 4.46Å; F24-L112 HydrophobicContact CD1-CD1 3.64Å; F24-L112 HydrophobicContact CE1-CB 3.56Å; F24-L112 HydrophobicContact CE1-CD1 3.42Å; F24-L112 VanDerWaalsContact CE1-CD1 3.42Å; F24-L112 HydrophobicContact CE1-CG 4.09Å; F24-L112 HydrophobicContact CZ-CB 4.24Å; F24-L112 HydrophobicContact CZ-CD1 4.22Å; F25-L112 HydrophobicContact CB-CD1 4.24Å; V71-L112 HydrophobicContact CB-CD2 4.44Å; V71-L112 HydrophobicContact CG1-CD1 3.97Å; V71-L112 HydrophobicContact CG1-CD2 3.56Å; V71-L112 HydrophobicContact CG1-CG 3.82Å; F73-L112 HydrophobicContact CB-CD1 3.81Å; F73-L112 HydrophobicContact CB-CD2 4.37Å; F73-L112 HydrophobicContact CD1-CD2 3.98Å; F73-L112 HydrophobicContact CG-CD1 4.39Å; F73-L112 HydrophobicContact CG-CD2 4.28Å; L94-L112 HydrophobicContact CD1-CD2 3.72Å; P108-L112 PolarHBondContact O-N 3.2Å; S109-L112 PolarHBondContact O-N 3.43Å; L112-N114 VanDerWaalsContact C-N 3.34Å; L112-N114 PolarHBondContact O-N 2.88Å; L112-L115 WeakPolarHBondContact O-CB 3.13Å; L112-L115 PolarHBondContact O-N 3.06Å; L112-G116 PolarHBondContact O-N 2.96Å; L112-T124 HydrophobicContact CD2-CG2 4.27Å; L112-T124 WeakPolarHBondContact O-CB 3.47Å; L112-T124 PolarHBondContact O-OG1 3.31Å
113	L	89.3	Confident	84.9	Confident	14 Å²	14	35.2 Å²	35.2	7%	0.073	16%	0.162	C	C	.	.	H	α-helix	trans	-65.8	-36.1	178.8	-67.6	172.7	0	0	0	112.5	S109 I111 G116 K117 P123 H248 V250 I299	S109-L113 WeakPolarHBondContact O-CB 3.49Å; S109-L113 VanDerWaalsContact O-CG 3.22Å; S109-L113 WeakPolarHBondContact O-CG 3.34Å; S109-L113 PolarHBondContact O-N 2.83Å; I111-L113 PolarHBondContact O-N 3.32Å; L113-G116 PolarHBondContact O-N 3.49Å; L113-K117 PolarHBondContact O-N 3.12Å; L113-P123 HydrophobicContact CD2-CB 4.04Å; L113-H248 HydrophobicContact CD1-CB 4.02Å; L113-H248 HydrophobicContact CD2-CB 3.77Å; L113-V250 HydrophobicContact CB-CG1 4.49Å; L113-V250 HydrophobicContact CB-CG2 3.99Å; L113-I299 HydrophobicContact CB-CD1 4.44Å; L113-I299 HydrophobicContact CD2-CD1 3.87Å
114	N	90.2	Very high	85.6	Confident	7 Å²	7	35.1 Å²	35.1	4%	0.037	16%	0.161	C	C	.	.	H	α-helix	trans	-70.2	-35.7	174.8	-89	-84.3	0	0	0	112.5	R110 I111 L112 G116 K117 M118 L135 F136 V250 C251	R110-N114 WeakPolarHBondContact O-CB 2.86Å; R110-N114 PolarHBondContact O-N 2.81Å; R110-N114 PolarHBondContact O-ND2 3.24Å; I111-N114 PolarHBondContact O-N 2.96Å; L112-N114 VanDerWaalsContact C-N 3.34Å; L112-N114 PolarHBondContact O-N 2.88Å; N114-G116 VanDerWaalsContact C-N 3.28Å; N114-K117 PolarHBondContact O-N 2.75Å; N114-M118 VanDerWaalsContact O-CB 3.3Å; N114-M118 WeakPolarHBondContact O-CB 3.21Å; N114-M118 PolarHBondContact O-N 2.8Å; N114-L135 HydrophobicContact CB-CD1 3.59Å; N114-L135 HydrophobicContact CB-CD2 4.05Å; N114-L135 HydrophobicContact CB-CG 4.26Å; N114-F136 HydrophobicContact CB-CE2 4.24Å; N114-F136 WeakPolarHBondContact ND2-CZ 3.32Å; N114-V250 HydrophobicContact CB-CG1 4.31Å; N114-V250 VanDerWaalsContact CG-CG1 3.43Å; N114-V250 VanDerWaalsContact ND2-CG1 3.32Å; N114-V250 WeakPolarHBondContact ND2-CG1 3.26Å; N114-V250 WeakPolarHBondContact OD1-CG1 3.16Å; N114-C251 PolarHBondContact ND2-O 2.82Å; N114-C251 PolarHBondContact OD1-O 3.26Å
115	L	91.7	Very high	86.3	Confident	4 Å²	4	36 Å²	36	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-62.4	-39.4	170.8	-69.9	172.8	0	0	0	111	L94 I111 L112 M118 S119 T125 R132 L135	L94-L115 HydrophobicContact CB-CD1 4.25Å; L94-L115 HydrophobicContact CD1-CD1 3.97Å; I111-L115 HydrophobicContact CG2-CD1 3.97Å; I111-L115 HydrophobicContact CG2-CG 4.34Å; I111-L115 WeakPolarHBondContact O-CG 3.31Å; I111-L115 PolarHBondContact O-N 3.33Å; L112-L115 WeakPolarHBondContact O-CB 3.13Å; L112-L115 PolarHBondContact O-N 3.06Å; L115-M118 HydrophobicContact CD2-CE 4.27Å; L115-M118 PolarHBondContact O-N 3.45Å; L115-S119 WeakPolarHBondContact O-CB 3.39Å; L115-S119 PolarHBondContact O-N 3.11Å; L115-S119 PolarHBondContact O-OG 2.73Å; L115-T125 HydrophobicContact CB-CG2 4.41Å; L115-R132 VanDerWaalsContact CD2-CZ 3.45Å; L115-L135 HydrophobicContact CD2-CD1 3.65Å; L115-L135 HydrophobicContact CG-CD1 3.73Å
116	G	90.9	Very high	87.1	Confident	1 Å²	1	29.7 Å²	29.7	1%	0.01	14%	0.144	C	C	.	.	H	α-helix	trans	-60.4	-51.7	172.4	0	0	0	0	0	112.8	L112 L113 N114 M118 S119 H120 Y121 P123	L112-G116 PolarHBondContact O-N 2.96Å; L113-G116 PolarHBondContact O-N 3.49Å; N114-G116 VanDerWaalsContact C-N 3.28Å; G116-M118 VanDerWaalsContact C-N 3.34Å; G116-M118 PolarHBondContact O-N 3.1Å; G116-S119 CarbonylContact O-C 3.56Å; G116-S119 PolarHBondContact O-N 3.2Å; G116-S119 PolarHBondContact O-OG 3.1Å; G116-S119 VanDerWaalsContact O-OG 3.11Å; G116-H120 PolarHBondContact O-N 3.43Å; G116-Y121 CarbonylContact C-O 3.5Å; G116-Y121 VanDerWaalsContact C-O 3.25Å; G116-Y121 WeakPolarHBondContact CA-O 3.42Å; G116-Y121 PolarHBondContact O-N 3.43Å; G116-P123 WeakPolarHBondContact CA-O 3.47Å
117	K	90	Very high	88.1	Confident	61 Å²	61	34.9 Å²	34.9	27%	0.265	17%	0.172	S	C	.	.	H	α-helix	trans	-53	-51.2	174.4	-178.6	-168	151.8	-175.9	0	111.7	L113 N114 S119 H120 V250 S252 E297 I299	L113-K117 PolarHBondContact O-N 3.12Å; N114-K117 PolarHBondContact O-N 2.75Å; K117-S119 VanDerWaalsContact C-N 3.3Å; K117-S119 PolarHBondContact O-N 3.33Å; K117-H120 PolarHBondContact O-N 3.37Å; K117-V250 HydrophobicContact CB-CG1 4.39Å; K117-V250 HydrophobicContact CD-CG1 4.19Å; K117-S252 PolarHBondContact NZ-OG 3.25Å; K117-E297 WeakPolarHBondContact CD-OE2 3.34Å; K117-E297 WeakPolarHBondContact CE-OE2 3.46Å; K117-E297 IonicContact NZ-OE1 3.27Å; K117-E297 PolarHBondContact NZ-OE1 3.27Å; K117-E297 IonicContact NZ-OE2 3.38Å; K117-E297 PolarHBondContact NZ-OE2 2.79Å; K117-I299 HydrophobicContact CB-CG2 3.69Å; K117-I299 HydrophobicContact CG-CG2 4.05Å
118	M	90.2	Very high	88.7	Confident	68 Å²	68	36.5 Å²	36.5	34%	0.335	19%	0.185	S	C	.	.	H	α-helix	trans	-64.5	-33.9	-175.9	-171.5	-165.9	67.9	0	0	112.8	N114 L115 G116 R132 L135	N114-M118 VanDerWaalsContact O-CB 3.3Å; N114-M118 WeakPolarHBondContact O-CB 3.21Å; N114-M118 PolarHBondContact O-N 2.8Å; L115-M118 HydrophobicContact CD2-CE 4.27Å; L115-M118 PolarHBondContact O-N 3.45Å; G116-M118 VanDerWaalsContact C-N 3.34Å; G116-M118 PolarHBondContact O-N 3.1Å; M118-R132 HydrophobicContact CE-CB 3.6Å; M118-R132 VanDerWaalsContact CE-CD 3.45Å; M118-R132 HydrophobicContact CE-CG 4.15Å; M118-R132 HydrophobicContact SD-CB 3.83Å; M118-R132 HydrophobicContact SD-CG 4.49Å; M118-L135 HydrophobicContact CB-CD2 4.48Å; M118-L135 HydrophobicContact SD-CD2 4.15Å
119	S	89.2	Confident	89	Confident	43 Å²	43	40 Å²	40	30%	0.301	20%	0.204	S	C	.	.	H	α-helix	trans	-92	1.8	179.2	60.5	0	0	0	0	113.7	L115 G116 K117 Y121 T125	L115-S119 WeakPolarHBondContact O-CB 3.39Å; L115-S119 PolarHBondContact O-N 3.11Å; L115-S119 PolarHBondContact O-OG 2.73Å; G116-S119 CarbonylContact O-C 3.56Å; G116-S119 PolarHBondContact O-N 3.2Å; G116-S119 PolarHBondContact O-OG 3.1Å; G116-S119 VanDerWaalsContact O-OG 3.11Å; K117-S119 VanDerWaalsContact C-N 3.3Å; K117-S119 PolarHBondContact O-N 3.33Å; S119-Y121 PolarHBondContact O-N 3.03Å; S119-Y121 WeakPolarHBondContact OG-CB 3.42Å; S119-T125 WeakPolarHBondContact OG-CB 3.39Å
120	H	89.1	Confident	89	Confident	181 Å²	181	45.3 Å²	45.3	84%	0.838	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	38.7	-171.2	-59.7	-72.3	0	0	0	113.1	G116 K117	G116-H120 PolarHBondContact O-N 3.43Å; K117-H120 PolarHBondContact O-N 3.37Å
121	Y	89	Confident	88.8	Confident	80 Å²	80	51.6 Å²	51.6	31%	0.314	26%	0.257	S	S	.	.			trans	-127.8	130.5	-176.1	-149	-80.9	0	0	0	111.1	Q78 C79 G116 S119 P123 T124	Q78-Y121 HydrophobicContact CB-CE1 3.66Å; Q78-Y121 HydrophobicContact CG-CD1 3.92Å; Q78-Y121 HydrophobicContact CG-CE1 3.5Å; Q78-Y121 VanDerWaalsContact CG-CE1 3.5Å; C79-Y121 VanDerWaalsContact CB-OH 3.24Å; C79-Y121 WeakPolarHBondContact CB-OH 3.29Å; C79-Y121 PolarHBondContact N-OH 3.22Å; G116-Y121 CarbonylContact C-O 3.5Å; G116-Y121 VanDerWaalsContact C-O 3.25Å; G116-Y121 WeakPolarHBondContact CA-O 3.42Å; G116-Y121 PolarHBondContact O-N 3.43Å; S119-Y121 PolarHBondContact O-N 3.03Å; S119-Y121 WeakPolarHBondContact OG-CB 3.42Å; Y121-P123 CarbonylContact O-C 3.58Å; Y121-T124 VanDerWaalsContact CD1-O 3.31Å; Y121-T124 WeakPolarHBondContact CD1-O 3.31Å
122	Y	88.4	Confident	88.9	Confident	24 Å²	24	52.4 Å²	52.4	9%	0.094	26%	0.26	C	S	.	.	S	Bend	trans	-102.1	141.7	-175.5	-175.5	-83.9	0	0	0	112.8	H77 T124 S245 D246 S247 H248 I299 S300 I301	H77-Y122 HydrophobicContact CB-CD1 4.15Å; H77-Y122 AromaticContact ND1-CE1 3.55Å; Y122-T124 VanDerWaalsContact C-N 3.29Å; Y122-S245 PolarHBondContact OH-O 3.28Å; Y122-D246 VanDerWaalsContact OH-C 3.27Å; Y122-S247 PolarHBondContact OH-N 3.27Å; Y122-S247 VanDerWaalsContact OH-N 3.1Å; Y122-H248 AromaticContact CE2-ND1 3.65Å; Y122-H248 AromaticContact CZ-CE1 3.82Å; Y122-H248 AromaticContact CZ-ND1 3.4Å; Y122-H248 PolarHBondContact OH-CE1 3.23Å; Y122-H248 PolarHBondContact OH-ND1 3.43Å; Y122-I299 HydrophobicContact CD2-CB 4.31Å; Y122-I299 HydrophobicContact CD2-CD1 3.97Å; Y122-I299 HydrophobicContact CD2-CG1 3.9Å; Y122-I299 HydrophobicContact CE2-CD1 4.31Å; Y122-I299 HydrophobicContact CE2-CG1 4.01Å; Y122-S300 VanDerWaalsContact CD2-C 3.49Å; Y122-I301 HydrophobicContact CD1-CB 4.33Å; Y122-I301 HydrophobicContact CD1-CD1 4.14Å; Y122-I301 HydrophobicContact CD1-CG1 3.25Å; Y122-I301 HydrophobicContact CD2-CG1 4.37Å; Y122-I301 HydrophobicContact CE1-CB 4.47Å; Y122-I301 HydrophobicContact CE1-CD1 3.68Å; Y122-I301 HydrophobicContact CE1-CG1 3.12Å; Y122-I301 HydrophobicContact CE2-CG1 4.28Å; Y122-I301 HydrophobicContact CG-CG1 3.88Å
123	P	87.3	Confident	88.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.006	29%	0.287	C	S	.	.	S	Bend	cis	-75.4	-18.7	-18	31.1	-36.1	0	0	0	112	F24 T76 L113 G116 Y121 I299	F24-P123 HydrophobicContact CE2-CB 4.47Å; F24-P123 HydrophobicContact CE2-CG 3.53Å; F24-P123 HydrophobicContact CZ-CB 4.1Å; F24-P123 HydrophobicContact CZ-CG 3.57Å; T76-P123 WeakPolarHBondContact OG1-CG 3.5Å; L113-P123 HydrophobicContact CD2-CB 4.04Å; G116-P123 WeakPolarHBondContact CA-O 3.47Å; Y121-P123 CarbonylContact O-C 3.58Å; P123-I299 WeakPolarHBondContact O-CD1 3.48Å
124	T	91	Very high	88.4	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.295	C	S	.	.			trans	-148.4	160.3	174.9	-160.4	0	0	0	0	111.6	F24 F73 Q78 L94 L112 Y121 Y122	F24-T124 HydrophobicContact CE2-CG2 4.43Å; F24-T124 HydrophobicContact CZ-CG2 3.73Å; F73-T124 HydrophobicContact CD1-CG2 4.3Å; F73-T124 HydrophobicContact CD2-CG2 4.05Å; F73-T124 HydrophobicContact CE1-CG2 3.78Å; F73-T124 HydrophobicContact CE2-CG2 3.55Å; F73-T124 HydrophobicContact CG-CG2 4.42Å; F73-T124 HydrophobicContact CZ-CG2 3.37Å; Q78-T124 WeakPolarHBondContact CG-O 3.4Å; Q78-T124 VanDerWaalsContact NE2-CG2 3.34Å; Q78-T124 PolarHBondContact NE2-O 2.86Å; L94-T124 HydrophobicContact CD1-CG2 3.99Å; L112-T124 HydrophobicContact CD2-CG2 4.27Å; L112-T124 WeakPolarHBondContact O-CB 3.47Å; L112-T124 PolarHBondContact O-OG1 3.31Å; Y121-T124 VanDerWaalsContact CD1-O 3.31Å; Y121-T124 WeakPolarHBondContact CD1-O 3.31Å; Y122-T124 VanDerWaalsContact C-N 3.29Å
125	T	91.9	Very high	88.2	Confident	19 Å²	19	61.2 Å²	61.2	12%	0.117	30%	0.3	C	S	.	.			trans	-69.2	158.1	176.7	-177.3	0	0	0	0	112.7	L94 L115 S119 L127	L94-T125 HydrophobicContact CD1-CG2 4.29Å; L94-T125 WeakPolarHBondContact CD1-O 3.25Å; L94-T125 HydrophobicContact CD2-CG2 3.95Å; L115-T125 HydrophobicContact CB-CG2 4.41Å; S119-T125 WeakPolarHBondContact OG-CB 3.39Å; T125-L127 VanDerWaalsContact CG2-O 3.25Å; T125-L127 WeakPolarHBondContact CG2-O 3.39Å; T125-L127 PolarHBondContact OG1-N 3.31Å; T125-L127 PolarHBondContact OG1-O 3.12Å
126	L	91.2	Very high	87.6	Confident	33 Å²	33	61 Å²	61	17%	0.173	30%	0.299	C	S	.	.	S	Bend	trans	-90.4	-17.8	167.5	-62.7	179.3	0	0	0	112.7	F73 Q78 C79 L80 L83 I92	F73-L126 HydrophobicContact CZ-CD2 4.27Å; Q78-L126 HydrophobicContact CB-CD1 3.89Å; Q78-L126 HydrophobicContact CB-CD2 3.61Å; Q78-L126 HydrophobicContact CB-CG 3.74Å; Q78-L126 HydrophobicContact CG-CD2 3.77Å; Q78-L126 HydrophobicContact CG-CG 4.01Å; C79-L126 VanDerWaalsContact O-CD1 3.3Å; C79-L126 WeakPolarHBondContact O-CD1 3.46Å; L80-L126 HydrophobicContact CD2-CD1 3.7Å; L80-L126 HydrophobicContact CD2-CD2 4.14Å; L83-L126 HydrophobicContact CD1-CD1 4.19Å; I92-L126 HydrophobicContact CD1-CD2 3.27Å; I92-L126 HydrophobicContact CG1-CD2 4.17Å; I92-L126 HydrophobicContact CG2-CD2 4.32Å
127	L	90.6	Very high	86.8	Confident	136 Å²	136	62.3 Å²	62.3	71%	0.712	31%	0.306	S	S	*	.	S	Bend	trans	-103.1	130.6	-170.9	-61.2	178	0	0	0	111	T125 D129	T125-L127 VanDerWaalsContact CG2-O 3.25Å; T125-L127 WeakPolarHBondContact CG2-O 3.39Å; T125-L127 PolarHBondContact OG1-N 3.31Å; T125-L127 PolarHBondContact OG1-O 3.12Å; L127-D129 PolarHBondContact O-N 3.34Å
128	S	88.8	Confident	85.6	Confident	54 Å²	54	59.9 Å²	59.9	38%	0.378	30%	0.296	S	S	.	.			trans	-80.8	112.9	171.8	-73.8	0	0	0	0	110.5	A93 L95	A93-S128 PolarHBondContact O-OG 3.36Å; L95-S128 WeakPolarHBondContact CB-OG 3.08Å; L95-S128 PolarHBondContact N-OG 3.37Å
129	D	86.1	Confident	84.1	Confident	79 Å²	79	62.3 Å²	62.3	42%	0.422	31%	0.305	S	S	.	.			trans	-94.2	123.3	170.2	-175.9	-1.8	0	0	0	109.9	L127 D131 R132	L127-D129 PolarHBondContact O-N 3.34Å; D129-D131 PolarHBondContact OD1-N 3.17Å; D129-R132 HydrophobicContact CB-CB 4.12Å; D129-R132 HydrophobicContact CB-CG 4.43Å; D129-R132 WeakPolarHBondContact O-CD 3.43Å; D129-R132 WeakPolarHBondContact O-CG 3.26Å; D129-R132 PolarHBondContact OD1-N 3.1Å
130	R	83.8	Confident	82.4	Confident	125 Å²	125	62.2 Å²	62.2	47%	0.472	30%	0.301	S	S	.	.	S	Bend	trans	-85.1	-26.3	-179.6	-71.2	-178.9	178.6	-178	-1.4	113.2	Y68 L95	Y68-R130 PolarHBondContact OH-O 3.22Å; L95-R130 HydrophobicContact CD1-CG 3.82Å
131	D	81.3	Confident	80.5	Confident	154 Å²	154	61.8 Å²	61.8	82%	0.824	31%	0.305	S	S	*	.	S	Bend	trans	-98.6	-0.1	-172.5	-62	-38.2	0	0	0	111.9	D129	D129-D131 PolarHBondContact OD1-N 3.17Å
132	R	87.1	Confident	78.6	Confident	16 Å²	16	58.3 Å²	58.3	6%	0.06	29%	0.294	C	S	.	.	S	Bend	trans	-59.3	157.4	175.3	69.7	178.8	-179.9	79.5	-5	112.6	L95 H97 E100 L115 M118 D129	L95-R132 PolarHBondContact O-NH2 3.38Å; H97-R132 PolarHBondContact CD2-NH1 3.39Å; H97-R132 PolarHBondContact NE2-O 3.34Å; E100-R132 IonicContact OE1-CZ 3.94Å; E100-R132 IonicContact OE1-NH1 2.71Å; E100-R132 PolarHBondContact OE1-NH1 3.22Å; E100-R132 IonicContact OE1-NH2 3.48Å; E100-R132 IonicContact OE2-CZ 2.64Å; E100-R132 IonicContact OE2-NH1 3.66Å; E100-R132 PolarHBondContact OE2-NH1 3.1Å; E100-R132 IonicContact OE2-NH2 2.72Å; E100-R132 PolarHBondContact OE2-NH2 3.03Å; L115-R132 VanDerWaalsContact CD2-CZ 3.45Å; M118-R132 HydrophobicContact CE-CB 3.6Å; M118-R132 VanDerWaalsContact CE-CD 3.45Å; M118-R132 HydrophobicContact CE-CG 4.15Å; M118-R132 HydrophobicContact SD-CB 3.83Å; M118-R132 HydrophobicContact SD-CG 4.49Å; D129-R132 HydrophobicContact CB-CB 4.12Å; D129-R132 HydrophobicContact CB-CG 4.43Å; D129-R132 WeakPolarHBondContact O-CD 3.43Å; D129-R132 WeakPolarHBondContact O-CG 3.26Å; D129-R132 PolarHBondContact OD1-N 3.1Å
133	K	85.5	Confident	77.2	Confident	131 Å²	131	65.7 Å²	65.7	57%	0.57	33%	0.329	S	S	*	.	P	Polyproline II helix	trans	-68.1	143.7	171.1	-169.9	-176.9	172.5	-172.3	0	110.3	L135	K133-L135 PolarHBondContact O-N 3Å
134	I	84.2	Confident	76	Confident	50 Å²	50	66 Å²	66	26%	0.256	33%	0.331	S	S	.	.	P	Polyproline II helix	trans	-61.9	124	168	-62.7	169.6	0	0	0	108.7	H97 Q99 E100 F136 D137	H97-I134 HydrophobicContact CB-CG1 4.18Å; Q99-I134 HydrophobicContact CB-CD1 4.19Å; Q99-I134 HydrophobicContact CB-CG2 4.01Å; Q99-I134 HydrophobicContact CG-CD1 3.99Å; E100-I134 HydrophobicContact CG-CG2 3.91Å; I134-F136 VanDerWaalsContact CG2-O 3.31Å; I134-F136 WeakPolarHBondContact CG2-O 3.49Å; I134-D137 HydrophobicContact CG2-CB 4.33Å
135	L	85.4	Confident	74.8	Confident	25 Å²	25	70.9 Å²	70.9	13%	0.131	35%	0.352	C	S	.	.	S	Bend	trans	-76.1	-44.3	-179.3	-64.5	173	0	0	0	111.7	E100 N114 L115 M118 K133	E100-L135 WeakPolarHBondContact OE1-CB 3.47Å; E100-L135 PolarHBondContact OE1-N 2.77Å; N114-L135 HydrophobicContact CB-CD1 3.59Å; N114-L135 HydrophobicContact CB-CD2 4.05Å; N114-L135 HydrophobicContact CB-CG 4.26Å; L115-L135 HydrophobicContact CD2-CD1 3.65Å; L115-L135 HydrophobicContact CG-CD1 3.73Å; M118-L135 HydrophobicContact CB-CD2 4.48Å; M118-L135 HydrophobicContact SD-CD2 4.15Å; K133-L135 PolarHBondContact O-N 3Å
136	F	78.8	Confident	73.6	Confident	0 Å²	0	72 Å²	72	0%	0	36%	0.358	C	S	.	.			trans	-133.2	124.9	179.6	-58.9	-82.1	0	0	0	111.3	Q99 E100 W103 R110 I111 N114 I134 C251 Q253 F294	Q99-F136 CarbonylContact C-O 3.54Å; E100-F136 WeakPolarHBondContact CG-O 3.2Å; W103-F136 HydrophobicContact CB-CB 4.34Å; W103-F136 HydrophobicContact CD2-CB 4.47Å; W103-F136 HydrophobicContact CG-CB 3.79Å; W103-F136 HydrophobicContact CG-CG 4.18Å; R110-F136 HydrophobicContact CG-CE1 4.44Å; R110-F136 HydrophobicContact CG-CE2 3.92Å; R110-F136 HydrophobicContact CG-CZ 3.63Å; R110-F136 VanDerWaalsContact NE-CZ 3.26Å; I111-F136 HydrophobicContact CD1-CD2 3.38Å; I111-F136 HydrophobicContact CD1-CE2 3.83Å; I111-F136 HydrophobicContact CD1-CG 4.4Å; N114-F136 HydrophobicContact CB-CE2 4.24Å; N114-F136 WeakPolarHBondContact ND2-CZ 3.32Å; I134-F136 VanDerWaalsContact CG2-O 3.31Å; I134-F136 WeakPolarHBondContact CG2-O 3.49Å; F136-C251 WeakPolarHBondContact CZ-O 3.33Å; F136-Q253 HydrophobicContact CD1-CB 3.89Å; F136-Q253 HydrophobicContact CE1-CB 4.09Å; F136-F294 HydrophobicContact CD1-CE1 4.32Å; F136-F294 HydrophobicContact CE1-CE1 4.38Å
137	D	73.7	Confident	72.3	Confident	28 Å²	28	73.6 Å²	73.6	15%	0.15	36%	0.364	C	S	.	.			trans	-111.9	107.2	174.8	-175.2	-0	0	0	0	109.3	I134 K139 L140	I134-D137 HydrophobicContact CG2-CB 4.33Å; D137-K139 VanDerWaalsContact C-N 3.28Å; D137-K139 WeakPolarHBondContact OD1-CB 3.45Å; D137-K139 PolarHBondContact OD1-N 3Å; D137-L140 HydrophobicContact CB-CD1 3.75Å; D137-L140 HydrophobicContact CB-CG 4.45Å; D137-L140 WeakPolarHBondContact OD2-CD1 3.41Å
138	C	64.4	Low	71	Confident	11 Å²	11	72.6 Å²	72.6	7%	0.074	36%	0.359	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-10.9	178.6	62.7	0	0	0	0	114	Q99 P102 L140 P154	Q99-C138 PolarHBondContact O-SG 3.1Å; P102-C138 HydrophobicContact CB-CB 4.41Å; P102-C138 HydrophobicContact CG-CB 4.09Å; C138-L140 VanDerWaalsContact C-N 3.35Å; C138-P154 VanDerWaalsContact SG-CA 3.59Å
139	K	59	Low	69.7	Low	119 Å²	119	71.1 Å²	71.1	52%	0.517	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-11.9	-179.6	-67.8	-174	176.7	-177.5	0	113.3	D137 P154	D137-K139 VanDerWaalsContact C-N 3.28Å; D137-K139 WeakPolarHBondContact OD1-CB 3.45Å; D137-K139 PolarHBondContact OD1-N 3Å; K139-P154 HydrophobicContact CG-CB 3.93Å
140	L	52.8	Low	68.6	Low	40 Å²	40	67.6 Å²	67.6	21%	0.209	33%	0.327	C	S	.	.	S	Bend	trans	-86.6	137.5	176.6	-72.5	160.1	0	0	0	108.6	D137 C138 G142 K255	D137-L140 HydrophobicContact CB-CD1 3.75Å; D137-L140 HydrophobicContact CB-CG 4.45Å; D137-L140 WeakPolarHBondContact OD2-CD1 3.41Å; C138-L140 VanDerWaalsContact C-N 3.35Å; L140-G142 PolarHBondContact O-N 3.03Å; L140-K255 HydrophobicContact CD1-CD 4.27Å
141	D	49.5	Very low	67.4	Low	172 Å²	172	64.2 Å²	64.2	92%	0.92	32%	0.318	S	S	*	.			trans	-69.7	37.4	-176.3	-59.4	-43.2	0	0	0	113.7
142	G	50.9	Low	66.3	Low	8 Å²	8	57.6 Å²	57.6	8%	0.082	28%	0.283	C	S	.	.			trans	-86.3	120.4	174.9	0	0	0	0	0	111.5	L140 S144 Q147	L140-G142 PolarHBondContact O-N 3.03Å; G142-S144 PolarHBondContact O-N 3.49Å; G142-Q147 PolarHBondContact O-NE2 3.02Å; G142-Q147 PolarHBondContact O-OE1 2.87Å
143	E	57.8	Low	65	Low	179 Å²	179	63.6 Å²	63.6	84%	0.836	31%	0.309	S	S	*	.			trans	-74.5	86.9	173.6	-64.5	-167.9	157.6	0	0	110.4	F145 Q147	E143-F145 PolarHBondContact O-N 3.46Å; E143-Q147 VanDerWaalsContact CA-OE1 3.28Å
144	S	62.8	Low	63.5	Low	6 Å²	6	59.9 Å²	59.9	4%	0.042	30%	0.299	C	S	.	.			trans	-65.8	134.6	164.5	-165.7	0	0	0	0	108.2	G142 L146 Q147 F294	G142-S144 PolarHBondContact O-N 3.49Å; S144-L146 PolarHBondContact O-N 2.84Å; S144-Q147 VanDerWaalsContact O-CB 3.28Å; S144-Q147 WeakPolarHBondContact O-CB 3.2Å; S144-Q147 PolarHBondContact O-N 2.88Å; S144-F294 VanDerWaalsContact CB-CZ 3.46Å
145	F	65.4	Low	62	Low	103 Å²	103	60.3 Å²	60.3	45%	0.452	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-50.5	-30.5	173.7	177.5	-101.1	0	0	0	112.7	E143 Q147 L148 F149	E143-F145 PolarHBondContact O-N 3.46Å; F145-Q147 VanDerWaalsContact C-N 3.26Å; F145-Q147 PolarHBondContact O-N 2.71Å; F145-L148 HydrophobicContact CD2-CD1 3.5Å; F145-L148 HydrophobicContact CE2-CD1 3.68Å; F145-L148 HydrophobicContact CG-CD1 4.32Å; F145-L148 WeakPolarHBondContact O-CB 3.42Å; F145-L148 WeakPolarHBondContact O-CG 3.4Å; F145-L148 PolarHBondContact O-N 2.84Å; F145-F149 HydrophobicContact CD1-CD2 4.33Å; F145-F149 AromaticContact CD1-CE2 3.78Å; F145-F149 HydrophobicContact CD1-CE2 3.78Å; F145-F149 HydrophobicContact CE1-CD2 4.08Å; F145-F149 AromaticContact CE1-CE2 3.18Å; F145-F149 HydrophobicContact CE1-CE2 3.18Å; F145-F149 AromaticContact CE1-CZ 3.86Å; F145-F149 HydrophobicContact CE1-CZ 3.86Å; F145-F149 HydrophobicContact CE2-CE2 4.06Å; F145-F149 HydrophobicContact CG-CE2 4.46Å; F145-F149 AromaticContact CZ-CE2 3.35Å; F145-F149 HydrophobicContact CZ-CE2 3.35Å; F145-F149 AromaticContact CZ-CZ 3.7Å; F145-F149 HydrophobicContact CZ-CZ 3.7Å
146	L	65.6	Low	60.1	Low	44 Å²	44	64.8 Å²	64.8	23%	0.23	32%	0.322	C	S	.	.	G	3₁₀ helix	trans	-66.3	-22.9	176.9	-73	163.1	0	0	0	114	W103 L107 S144 L148 F149 T150	W103-L146 HydrophobicContact CH2-CB 4.25Å; W103-L146 HydrophobicContact CZ3-CB 4.08Å; W103-L146 HydrophobicContact CZ3-CD1 4.15Å; L107-L146 HydrophobicContact CD1-CB 4.45Å; L107-L146 HydrophobicContact CD1-CD1 3.38Å; L107-L146 HydrophobicContact CD1-CD2 4.08Å; L107-L146 HydrophobicContact CD1-CG 4.16Å; S144-L146 PolarHBondContact O-N 2.84Å; L146-L148 PolarHBondContact O-N 3.02Å; L146-F149 PolarHBondContact O-N 3.41Å; L146-T150 WeakPolarHBondContact O-CB 3.19Å; L146-T150 PolarHBondContact O-N 3.33Å; L146-T150 PolarHBondContact O-OG1 3.03Å
147	Q	65.2	Low	58.2	Low	66 Å²	66	68.7 Å²	68.7	31%	0.308	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-65.7	-17.8	171.3	-68.9	172.3	-18	0	0	112.2	G142 E143 S144 F145 F149	G142-Q147 PolarHBondContact O-NE2 3.02Å; G142-Q147 PolarHBondContact O-OE1 2.87Å; E143-Q147 VanDerWaalsContact CA-OE1 3.28Å; S144-Q147 VanDerWaalsContact O-CB 3.28Å; S144-Q147 WeakPolarHBondContact O-CB 3.2Å; S144-Q147 PolarHBondContact O-N 2.88Å; F145-Q147 VanDerWaalsContact C-N 3.26Å; F145-Q147 PolarHBondContact O-N 2.71Å; Q147-F149 VanDerWaalsContact C-N 3.26Å; Q147-F149 PolarHBondContact O-N 3.38Å
148	L	62.4	Low	56.3	Low	114 Å²	114	70.4 Å²	70.4	60%	0.597	35%	0.349	S	S	*	.	G	3₁₀ helix	trans	-69.6	-26.6	170.2	-59.6	173.5	0	0	0	112.2	F145 L146	F145-L148 HydrophobicContact CD2-CD1 3.5Å; F145-L148 HydrophobicContact CE2-CD1 3.68Å; F145-L148 HydrophobicContact CG-CD1 4.32Å; F145-L148 WeakPolarHBondContact O-CB 3.42Å; F145-L148 WeakPolarHBondContact O-CG 3.4Å; F145-L148 PolarHBondContact O-N 2.84Å; L146-L148 PolarHBondContact O-N 3.02Å
149	F	62	Low	54.7	Low	23 Å²	23	74.4 Å²	74.4	10%	0.101	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.6	-14.5	-177.2	-60.1	-85.4	0	0	0	113.4	F145 L146 Q147 L175 L176 T234 A236	F145-F149 HydrophobicContact CD1-CD2 4.33Å; F145-F149 AromaticContact CD1-CE2 3.78Å; F145-F149 HydrophobicContact CD1-CE2 3.78Å; F145-F149 HydrophobicContact CE1-CD2 4.08Å; F145-F149 AromaticContact CE1-CE2 3.18Å; F145-F149 HydrophobicContact CE1-CE2 3.18Å; F145-F149 AromaticContact CE1-CZ 3.86Å; F145-F149 HydrophobicContact CE1-CZ 3.86Å; F145-F149 HydrophobicContact CE2-CE2 4.06Å; F145-F149 HydrophobicContact CG-CE2 4.46Å; F145-F149 AromaticContact CZ-CE2 3.35Å; F145-F149 HydrophobicContact CZ-CE2 3.35Å; F145-F149 AromaticContact CZ-CZ 3.7Å; F145-F149 HydrophobicContact CZ-CZ 3.7Å; L146-F149 PolarHBondContact O-N 3.41Å; Q147-F149 VanDerWaalsContact C-N 3.26Å; Q147-F149 PolarHBondContact O-N 3.38Å; F149-L175 HydrophobicContact CB-CB 4.34Å; F149-L175 HydrophobicContact CD1-CB 3.91Å; F149-L175 CarbonylContact O-C 3.6Å; F149-L175 PolarHBondContact O-N 3.04Å; F149-L176 HydrophobicContact CB-CB 4.19Å; F149-L176 PolarHBondContact O-N 3.2Å; F149-T234 HydrophobicContact CE1-CG2 3.84Å; F149-T234 HydrophobicContact CZ-CG2 4.18Å; F149-A236 HydrophobicContact CB-CB 4.06Å; F149-A236 HydrophobicContact CD1-CB 3.41Å; F149-A236 VanDerWaalsContact CD1-CB 3.41Å; F149-A236 HydrophobicContact CD2-CB 4.4Å; F149-A236 HydrophobicContact CE1-CB 3.94Å; F149-A236 HydrophobicContact CG-CB 3.67Å
150	T	62.6	Low	53.7	Low	5 Å²	5	72.6 Å²	72.6	3%	0.031	36%	0.362	C	S	.	.			trans	-129.4	140.9	-171.6	60.6	0	0	0	0	110	H106 L146 I152 L176	H106-T150 HydrophobicContact CB-CG2 4.48Å; L146-T150 WeakPolarHBondContact O-CB 3.19Å; L146-T150 PolarHBondContact O-N 3.33Å; L146-T150 PolarHBondContact O-OG1 3.03Å; T150-I152 HydrophobicContact CG2-CD1 4.28Å; T150-I152 HydrophobicContact CG2-CG1 4.49Å; T150-I152 PolarHBondContact O-N 3.01Å; T150-I152 WeakPolarHBondContact OG1-CD1 3.36Å; T150-I152 WeakPolarHBondContact OG1-CG1 3.12Å; T150-L176 HydrophobicContact CG2-CB 3.67Å; T150-L176 HydrophobicContact CG2-CD2 3.32Å; T150-L176 HydrophobicContact CG2-CG 4.09Å
151	N	59.1	Low	52.8	Low	54 Å²	54	78.7 Å²	78.7	29%	0.289	39%	0.392	S	S	.	.			trans	-82.8	47.1	168.1	-71.7	-44.3	0	0	0	110.8	K153 L172	N151-K153 PolarHBondContact O-N 2.9Å; N151-L172 PolarHBondContact ND2-O 2.95Å
152	I	57.8	Low	51.8	Low	16 Å²	16	74.4 Å²	74.4	8%	0.082	37%	0.372	C	S	.	.			trans	-62.4	107.4	178.5	-74	167.6	0	0	0	108.4	P102 W103 H106 T150	P102-I152 HydrophobicContact CB-CG2 3.73Å; W103-I152 HydrophobicContact CD2-CD1 4.1Å; W103-I152 HydrophobicContact CE3-CD1 3.49Å; W103-I152 VanDerWaalsContact CE3-CD1 3.49Å; W103-I152 HydrophobicContact CH2-CD1 3.69Å; W103-I152 HydrophobicContact CZ2-CD1 4.31Å; W103-I152 HydrophobicContact CZ3-CD1 3.21Å; H106-I152 HydrophobicContact CB-CD1 4.27Å; H106-I152 HydrophobicContact CB-CG1 4.2Å; H106-I152 WeakPolarHBondContact CD2-CG1 3.49Å; T150-I152 HydrophobicContact CG2-CD1 4.28Å; T150-I152 HydrophobicContact CG2-CG1 4.49Å; T150-I152 PolarHBondContact O-N 3.01Å; T150-I152 WeakPolarHBondContact OG1-CD1 3.36Å; T150-I152 WeakPolarHBondContact OG1-CG1 3.12Å
153	K	59.3	Low	50.9	Low	142 Å²	142	82.1 Å²	82.1	62%	0.617	40%	0.403	S	S	*	.			trans	-110.8	144.4	173.5	-69.9	179.1	-177.5	177.6	0	109.4	P102 N151 F155	P102-K153 WeakPolarHBondContact CB-O 3.48Å; P102-K153 WeakPolarHBondContact CG-O 3.28Å; N151-K153 PolarHBondContact O-N 2.9Å; K153-F155 PolarHBondContact O-N 3.27Å
154	P	55.1	Low	49.7	Very low	53 Å²	53	77.9 Å²	77.9	34%	0.344	39%	0.39	S	S	.	.			trans	-56.5	137.2	177.1	22.5	-32.1	0	0	0	110.3	C138 K139 I156	C138-P154 VanDerWaalsContact SG-CA 3.59Å; K139-P154 HydrophobicContact CG-CB 3.93Å; P154-I156 VanDerWaalsContact C-N 3.31Å; P154-I156 PolarHBondContact O-N 3.31Å
155	F	52.3	Low	48.4	Very low	58 Å²	58	82.3 Å²	82.3	25%	0.254	42%	0.419	S	S	.	.			trans	-69.5	92.5	176.8	-156.9	-82.8	0	0	0	108.4	I98 A101 P102 K153 Y157 F160	I98-F155 HydrophobicContact CD1-CB 4.35Å; I98-F155 HydrophobicContact CD1-CD1 3.62Å; I98-F155 HydrophobicContact CD1-CE1 4.32Å; I98-F155 HydrophobicContact CD1-CG 4.09Å; I98-F155 HydrophobicContact CG1-CB 4.48Å; I98-F155 HydrophobicContact CG1-CD1 4.24Å; A101-F155 HydrophobicContact CB-CB 4.06Å; A101-F155 HydrophobicContact CB-CD2 4.39Å; A101-F155 HydrophobicContact CB-CG 4.25Å; P102-F155 HydrophobicContact CG-CB 4.03Å; K153-F155 PolarHBondContact O-N 3.27Å; F155-Y157 HydrophobicContact CD1-CD2 4.2Å; F155-Y157 HydrophobicContact CD1-CE2 4.3Å; F155-Y157 HydrophobicContact CE1-CD1 4.37Å; F155-Y157 HydrophobicContact CE1-CD2 4.22Å; F155-Y157 HydrophobicContact CE1-CE1 4.39Å; F155-Y157 HydrophobicContact CE1-CE2 4.25Å; F155-Y157 HydrophobicContact CE1-CG 4.28Å; F155-F160 HydrophobicContact CE1-CD2 4.4Å; F155-F160 AromaticContact CE1-CE2 3.5Å; F155-F160 HydrophobicContact CE1-CE2 3.5Å; F155-F160 AromaticContact CE1-CZ 3.74Å; F155-F160 HydrophobicContact CE1-CZ 3.74Å; F155-F160 HydrophobicContact CE2-CE1 4.21Å; F155-F160 HydrophobicContact CE2-CE2 4.36Å; F155-F160 AromaticContact CE2-CZ 3.75Å; F155-F160 HydrophobicContact CE2-CZ 3.75Å; F155-F160 HydrophobicContact CZ-CD1 4.49Å; F155-F160 HydrophobicContact CZ-CD2 4.11Å; F155-F160 AromaticContact CZ-CE1 3.69Å; F155-F160 HydrophobicContact CZ-CE1 3.69Å; F155-F160 AromaticContact CZ-CE2 3.23Å; F155-F160 HydrophobicContact CZ-CE2 3.23Å; F155-F160 AromaticContact CZ-CZ 3Å; F155-F160 HydrophobicContact CZ-CZ 3Å
156	I	46.2	Very low	46.9	Very low	120 Å²	120	86.8 Å²	86.8	62%	0.615	44%	0.438	S	S	*	.			trans	-82.3	128.5	166.7	-53.1	177.3	0	0	0	104.5	P154 P158	P154-I156 VanDerWaalsContact C-N 3.31Å; P154-I156 PolarHBondContact O-N 3.31Å; I156-P158 HydrophobicContact CG2-CG 4.35Å; I156-P158 WeakPolarHBondContact O-CD 3.42Å
157	Y	38.5	Very low	45.4	Very low	82 Å²	82	92.4 Å²	92.4	32%	0.322	46%	0.463	S	S	.	.			trans	-74.2	104.5	161.3	-89.1	-86.1	0	0	0	107.5	A31 P67 I98 F155 F160	A31-Y157 PolarHBondContact O-OH 3.36Å; A31-Y157 VanDerWaalsContact O-OH 3.08Å; P67-Y157 HydrophobicContact CB-CE2 4.11Å; P67-Y157 HydrophobicContact CG-CD2 4.41Å; P67-Y157 HydrophobicContact CG-CE2 3.75Å; I98-Y157 HydrophobicContact CD1-CD2 4.31Å; I98-Y157 HydrophobicContact CD1-CE2 3.51Å; I98-Y157 HydrophobicContact CG1-CD2 4.35Å; I98-Y157 HydrophobicContact CG1-CE2 3.86Å; F155-Y157 HydrophobicContact CD1-CD2 4.2Å; F155-Y157 HydrophobicContact CD1-CE2 4.3Å; F155-Y157 HydrophobicContact CE1-CD1 4.37Å; F155-Y157 HydrophobicContact CE1-CD2 4.22Å; F155-Y157 HydrophobicContact CE1-CE1 4.39Å; F155-Y157 HydrophobicContact CE1-CE2 4.25Å; F155-Y157 HydrophobicContact CE1-CG 4.28Å; Y157-F160 HydrophobicContact CD1-CD2 4.39Å; Y157-F160 HydrophobicContact CD1-CE2 4.36Å; Y157-F160 HydrophobicContact CE1-CD2 4.09Å; Y157-F160 AromaticContact CE1-CE2 3.8Å; Y157-F160 HydrophobicContact CE1-CE2 3.8Å
158	P	33.4	Very low	43.5	Very low	63 Å²	63	100.9 Å²	100.9	41%	0.409	49%	0.492	S	S	.	.	S	Bend	trans	-131.7	106.1	140.9	35.1	-21.5	0	0	0	107.4	I156 F163	I156-P158 HydrophobicContact CG2-CG 4.35Å; I156-P158 WeakPolarHBondContact O-CD 3.42Å; P158-F163 HydrophobicContact CG-CE2 4.39Å
159	D	31.2	Very low	42.2	Very low	96 Å²	96	99.7 Å²	99.7	51%	0.513	49%	0.492	S	S	.	.			trans	45.4	90	170.4	-71.1	-45.2	0	0	0	114.7	R34 M161 T162	R34-D159 IonicContact NH2-OD1 2.73Å; D159-M161 VanDerWaalsContact C-N 3.28Å; D159-M161 PolarHBondContact O-N 3.01Å; D159-T162 HydrophobicContact CB-CG2 4.44Å; D159-T162 WeakPolarHBondContact CB-OG1 3.38Å; D159-T162 PolarHBondContact O-N 3.3Å
160	F	37.9	Very low	41	Very low	81 Å²	81	106 Å²	106	36%	0.355	53%	0.526	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.8	103.6	152.3	-82	-90.2	0	0	0	107.1	F30 N32 R34 F155 Y157	F30-F160 HydrophobicContact CB-CZ 4.25Å; N32-F160 WeakPolarHBondContact OD1-CD2 3.42Å; N32-F160 WeakPolarHBondContact OD1-CE2 3.34Å; R34-F160 PolarHBondContact NH2-O 3.3Å; F155-F160 HydrophobicContact CE1-CD2 4.4Å; F155-F160 AromaticContact CE1-CE2 3.5Å; F155-F160 HydrophobicContact CE1-CE2 3.5Å; F155-F160 AromaticContact CE1-CZ 3.74Å; F155-F160 HydrophobicContact CE1-CZ 3.74Å; F155-F160 HydrophobicContact CE2-CE1 4.21Å; F155-F160 HydrophobicContact CE2-CE2 4.36Å; F155-F160 AromaticContact CE2-CZ 3.75Å; F155-F160 HydrophobicContact CE2-CZ 3.75Å; F155-F160 HydrophobicContact CZ-CD1 4.49Å; F155-F160 HydrophobicContact CZ-CD2 4.11Å; F155-F160 AromaticContact CZ-CE1 3.69Å; F155-F160 HydrophobicContact CZ-CE1 3.69Å; F155-F160 AromaticContact CZ-CE2 3.23Å; F155-F160 HydrophobicContact CZ-CE2 3.23Å; F155-F160 AromaticContact CZ-CZ 3Å; F155-F160 HydrophobicContact CZ-CZ 3Å; Y157-F160 HydrophobicContact CD1-CD2 4.39Å; Y157-F160 HydrophobicContact CD1-CE2 4.36Å; Y157-F160 HydrophobicContact CE1-CD2 4.09Å; Y157-F160 AromaticContact CE1-CE2 3.8Å; Y157-F160 HydrophobicContact CE1-CE2 3.8Å
161	M	33.6	Very low	40.3	Very low	167 Å²	167	110.4 Å²	110.4	82%	0.823	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	111.1	-2.7	-174.2	-63.4	-174	51.1	0	0	120	D159	D159-M161 VanDerWaalsContact C-N 3.28Å; D159-M161 PolarHBondContact O-N 3.01Å
162	T	29.6	Very low	39.6	Very low	83 Å²	83	113.5 Å²	113.5	51%	0.509	57%	0.57	S	S	.	*			trans	-128	45.2	168.2	69.2	0	0	0	0	114.1	D159 T164	D159-T162 HydrophobicContact CB-CG2 4.44Å; D159-T162 WeakPolarHBondContact CB-OG1 3.38Å; D159-T162 PolarHBondContact O-N 3.3Å; T162-T164 PolarHBondContact O-N 2.82Å
163	F	31.8	Very low	39.3	Very low	169 Å²	169	115.5 Å²	115.5	74%	0.741	58%	0.584	S	S	*	*			trans	-86	76.5	147.4	-122.2	-89.5	0	0	0	108.3	P158 P165	P158-F163 HydrophobicContact CG-CE2 4.39Å; F163-P165 WeakPolarHBondContact O-CD 3.31Å
164	T	32	Very low	39.4	Very low	90 Å²	90	113 Å²	113	55%	0.552	58%	0.575	S	S	*	*			trans	-65.9	120.4	148.2	51.7	0	0	0	0	105	T162 K166	T162-T164 PolarHBondContact O-N 2.82Å; T164-K166 PolarHBondContact O-N 2.8Å
165	P	34.9	Very low	39.7	Very low	100 Å²	100	111.6 Å²	111.6	65%	0.649	56%	0.564	S	S	*	*			trans	-69.2	83.9	177.8	29.6	-32.1	0	0	0	107.4	F163 Q167	F163-P165 WeakPolarHBondContact O-CD 3.31Å; P165-Q167 PolarHBondContact O-N 3.14Å
166	K	34.4	Very low	40.5	Very low	197 Å²	197	109.6 Å²	109.6	86%	0.857	56%	0.556	S	S	*	*	S	Bend	trans	-75.9	5.1	174.9	-78	-172	178.5	-179.5	0	112.2	T164	T164-K166 PolarHBondContact O-N 2.8Å
167	Q	34.8	Very low	41.7	Very low	161 Å²	161	106.3 Å²	106.3	75%	0.752	54%	0.538	S	S	*	.	S	Bend	trans	-138.8	115	165.6	-149.3	152.5	0.3	0	0	107.8	P165 C169	P165-Q167 PolarHBondContact O-N 3.14Å; Q167-C169 PolarHBondContact O-N 3.43Å
168	R	26	Very low	43.4	Very low	244 Å²	244	105.1 Å²	105.1	92%	0.921	54%	0.535	S	S	*	.			trans	-65.9	77.8	168.6	-79.1	180	174.8	167.4	-2.8	108.1
169	C	34.5	Very low	45.2	Very low	89 Å²	89	102.2 Å²	102.2	60%	0.601	52%	0.516	S	S	*	.			trans	-75.2	119	153.5	-66.3	0	0	0	0	105.3	Q167 P171	Q167-C169 PolarHBondContact O-N 3.43Å; C169-P171 VanDerWaalsContact O-CD 3.22Å; C169-P171 WeakPolarHBondContact O-CD 3.14Å
170	I	36.5	Very low	47.2	Very low	156 Å²	156	102.3 Å²	102.3	80%	0.8	52%	0.516	S	S	*	.			trans	-57.6	113	169.7	-56.6	164.7	0	0	0	104.9	L172	I170-L172 PolarHBondContact O-N 3.07Å
171	P	47	Very low	48.6	Very low	98 Å²	98	98.7 Å²	98.7	64%	0.636	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-61.6	125.3	172.3	26.4	-29.2	0	0	0	105.7	C169	C169-P171 VanDerWaalsContact O-CD 3.22Å; C169-P171 WeakPolarHBondContact O-CD 3.14Å
172	L	46.2	Very low	50.7	Low	118 Å²	118	91.1 Å²	91.1	62%	0.618	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-51.7	136.1	164.8	-90.5	118.2	0	0	0	106.6	N151 I170 E174	N151-L172 PolarHBondContact ND2-O 2.95Å; I170-L172 PolarHBondContact O-N 3.07Å; L172-E174 PolarHBondContact O-N 2.97Å; L172-E174 VanDerWaalsContact O-N 3.12Å
173	P	50.4	Low	53	Low	59 Å²	59	87.9 Å²	87.9	38%	0.383	44%	0.443	S	S	.	.	P	Polyproline II helix	trans	-51.8	128.3	175.4	21.3	-30.7	0	0	0	107.3	L175	P173-L175 VanDerWaalsContact C-N 3.32Å; P173-L175 HydrophobicContact CB-CD2 4.44Å; P173-L175 HydrophobicContact CG-CD2 4.21Å; P173-L175 WeakPolarHBondContact O-CG 3.41Å; P173-L175 PolarHBondContact O-N 3.11Å
174	E	60.4	Low	55.1	Low	88 Å²	88	82 Å²	82	41%	0.411	43%	0.426	S	S	.	.			trans	-65.5	101.9	176.4	-168.3	170.7	-171.9	0	0	106.4	H106 L172 L176	H106-E174 IonicContact CE1-OE1 4Å; H106-E174 PolarHBondContact CE1-OE1 3.12Å; H106-E174 VanDerWaalsContact CE1-OE1 3.22Å; H106-E174 IonicContact ND1-OE1 3.22Å; H106-E174 PolarHBondContact ND1-OE1 3.11Å; L172-E174 PolarHBondContact O-N 2.97Å; L172-E174 VanDerWaalsContact O-N 3.12Å; E174-L176 HydrophobicContact CG-CB 4.42Å; E174-L176 PolarHBondContact O-N 2.69Å
175	L	62.5	Low	57.2	Low	25 Å²	25	80.1 Å²	80.1	13%	0.131	41%	0.41	C	S	.	.			trans	-76.6	-3.4	-177.7	-61.2	176.2	0	0	0	111.2	F149 P173 S232 A236	F149-L175 HydrophobicContact CB-CB 4.34Å; F149-L175 HydrophobicContact CD1-CB 3.91Å; F149-L175 CarbonylContact O-C 3.6Å; F149-L175 PolarHBondContact O-N 3.04Å; P173-L175 VanDerWaalsContact C-N 3.32Å; P173-L175 HydrophobicContact CB-CD2 4.44Å; P173-L175 HydrophobicContact CG-CD2 4.21Å; P173-L175 WeakPolarHBondContact O-CG 3.41Å; P173-L175 PolarHBondContact O-N 3.11Å; L175-S232 VanDerWaalsContact CD2-OG 3.26Å; L175-S232 WeakPolarHBondContact CD2-OG 3.42Å; L175-A236 PolarHBondContact O-N 3.01Å
176	L	69.2	Low	59	Low	15 Å²	15	78.1 Å²	78.1	8%	0.079	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	117.7	172.7	-173.6	68.4	0	0	0	110.5	L107 F149 T150 E174 A236	L107-L176 HydrophobicContact CD2-CD2 3.8Å; L107-L176 HydrophobicContact CG-CD2 4.14Å; F149-L176 HydrophobicContact CB-CB 4.19Å; F149-L176 PolarHBondContact O-N 3.2Å; T150-L176 HydrophobicContact CG2-CB 3.67Å; T150-L176 HydrophobicContact CG2-CD2 3.32Å; T150-L176 HydrophobicContact CG2-CG 4.09Å; E174-L176 HydrophobicContact CG-CB 4.42Å; E174-L176 PolarHBondContact O-N 2.69Å; L176-A236 WeakPolarHBondContact CA-O 3.2Å; L176-A236 HydrophobicContact CD1-CB 3.71Å
177	F	71.3	Confident	60.8	Low	52 Å²	52	70.9 Å²	70.9	23%	0.228	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	119.1	171.3	-172.6	-118.3	0	0	0	110.5	I179 V221 F224 A236 L237 S238	F177-I179 HydrophobicContact CD1-CD1 4.14Å; F177-I179 HydrophobicContact CD1-CG1 3.5Å; F177-I179 VanDerWaalsContact CD1-CG1 3.5Å; F177-I179 HydrophobicContact CE1-CD1 4.37Å; F177-I179 HydrophobicContact CE1-CG1 3.52Å; F177-V221 HydrophobicContact CE1-CG2 4.26Å; F177-F224 HydrophobicContact CB-CD1 3.68Å; F177-F224 HydrophobicContact CB-CD2 3.65Å; F177-F224 HydrophobicContact CB-CE1 3.59Å; F177-F224 HydrophobicContact CB-CE2 3.58Å; F177-F224 HydrophobicContact CB-CG 3.7Å; F177-F224 HydrophobicContact CB-CZ 3.54Å; F177-F224 HydrophobicContact CD1-CB 3.93Å; F177-F224 AromaticContact CD1-CD1 3.97Å; F177-F224 HydrophobicContact CD1-CD1 3.97Å; F177-F224 HydrophobicContact CD1-CD2 4.47Å; F177-F224 AromaticContact CD1-CG 3.85Å; F177-F224 HydrophobicContact CD1-CG 3.85Å; F177-F224 HydrophobicContact CD2-CB 4.15Å; F177-F224 AromaticContact CD2-CD2 3.8Å; F177-F224 HydrophobicContact CD2-CD2 3.8Å; F177-F224 HydrophobicContact CD2-CE2 4.42Å; F177-F224 AromaticContact CD2-CG 3.95Å; F177-F224 HydrophobicContact CD2-CG 3.95Å; F177-F224 HydrophobicContact CE1-CB 4.06Å; F177-F224 HydrophobicContact CE1-CG 4.46Å; F177-F224 HydrophobicContact CE2-CB 4.28Å; F177-F224 HydrophobicContact CG-CB 3.99Å; F177-F224 AromaticContact CG-CD1 3.89Å; F177-F224 HydrophobicContact CG-CD1 3.89Å; F177-F224 AromaticContact CG-CD2 3.74Å; F177-F224 HydrophobicContact CG-CD2 3.74Å; F177-F224 HydrophobicContact CG-CE1 4.32Å; F177-F224 HydrophobicContact CG-CE2 4.2Å; F177-F224 AromaticContact CG-CG 3.57Å; F177-F224 HydrophobicContact CG-CG 3.57Å; F177-F224 HydrophobicContact CG-CZ 4.46Å; F177-F224 HydrophobicContact CZ-CB 4.25Å; F177-A236 PolarHBondContact N-O 3.48Å; F177-L237 HydrophobicContact CB-CD2 3.99Å; F177-L237 HydrophobicContact CD1-CD2 4.12Å; F177-L237 WeakPolarHBondContact O-CA 3.48Å; F177-S238 PolarHBondContact O-N 2.64Å; F177-S238 VanDerWaalsContact O-N 3.1Å
178	H	73.1	Confident	62.3	Low	56 Å²	56	66.2 Å²	66.2	26%	0.259	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	126.2	172.2	-178.6	-86.7	0	0	0	110.1	N180 S238 D240	H178-N180 PolarHBondContact CE1-OD1 3.43Å; H178-N180 PolarHBondContact ND1-OD1 3.41Å; H178-S238 WeakPolarHBondContact CA-OG 3.46Å; H178-S238 WeakPolarHBondContact CB-OG 3.47Å; H178-S238 PolarHBondContact CD2-OG 2.72Å; H178-D240 IonicContact CD2-OD1 2.73Å; H178-D240 IonicContact CE1-OD1 3.66Å; H178-D240 PolarHBondContact CE1-OD1 3.42Å; H178-D240 IonicContact CE1-OD2 2.8Å; H178-D240 IonicContact NE2-OD1 3.75Å; H178-D240 PolarHBondContact NE2-OD1 3.42Å; H178-D240 IonicContact NE2-OD2 3.33Å
179	I	72.9	Confident	64.2	Low	3 Å²	3	57.6 Å²	57.6	2%	0.015	32%	0.321	C	S	.	.			trans	-111.6	112.3	177.2	-59.3	160	0	0	0	107.1	F177 G181 F182 S217 V221 L237	F177-I179 HydrophobicContact CD1-CD1 4.14Å; F177-I179 HydrophobicContact CD1-CG1 3.5Å; F177-I179 VanDerWaalsContact CD1-CG1 3.5Å; F177-I179 HydrophobicContact CE1-CD1 4.37Å; F177-I179 HydrophobicContact CE1-CG1 3.52Å; I179-G181 PolarHBondContact O-N 3.28Å; I179-F182 HydrophobicContact CB-CB 3.53Å; I179-F182 HydrophobicContact CB-CG 4.3Å; I179-F182 HydrophobicContact CD1-CB 4.32Å; I179-F182 HydrophobicContact CD1-CD1 4.39Å; I179-F182 HydrophobicContact CD1-CG 4.26Å; I179-F182 HydrophobicContact CG2-CB 3.67Å; I179-F182 VanDerWaalsContact O-CB 3.31Å; I179-F182 WeakPolarHBondContact O-CB 3.02Å; I179-F182 PolarHBondContact O-N 3.11Å; I179-S217 VanDerWaalsContact CG2-CB 3.46Å; I179-V221 HydrophobicContact CD1-CG2 3.4Å; I179-V221 HydrophobicContact CG1-CG2 3.84Å; I179-V221 HydrophobicContact CG2-CG2 4.48Å; I179-L237 HydrophobicContact CD1-CB 4.48Å; I179-L237 HydrophobicContact CD1-CD1 3.96Å; I179-L237 HydrophobicContact CD1-CD2 3.86Å; I179-L237 HydrophobicContact CD1-CG 4.31Å
180	N	71.5	Confident	65.4	Low	97 Å²	97	60.9 Å²	60.9	52%	0.519	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	124.9	172.6	-74.4	0.7	0	0	0	110.7	H178 F182 S217 D240	H178-N180 PolarHBondContact CE1-OD1 3.43Å; H178-N180 PolarHBondContact ND1-OD1 3.41Å; N180-F182 VanDerWaalsContact C-N 3.28Å; N180-F182 PolarHBondContact O-N 3.48Å; N180-S217 PolarHBondContact O-OG 3.27Å; N180-D240 WeakPolarHBondContact CA-OD2 3.25Å
181	G	69	Low	66.1	Low	5 Å²	5	56.4 Å²	56.4	5%	0.052	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	8.7	-180	0	0	0	0	0	115.2	I179 Y183 P214 D240	I179-G181 PolarHBondContact O-N 3.28Å; G181-Y183 WeakPolarHBondContact O-CD2 3.44Å; G181-Y183 WeakPolarHBondContact O-CE2 3.41Å; G181-P214 VanDerWaalsContact C-CG 3.45Å; G181-P214 VanDerWaalsContact O-CD 3.31Å; G181-P214 WeakPolarHBondContact O-CD 3.47Å; G181-P214 WeakPolarHBondContact O-CG 3.49Å; G181-D240 PolarHBondContact N-OD2 3Å
182	F	77.1	Confident	66.2	Low	8 Å²	8	60.4 Å²	60.4	4%	0.035	32%	0.318	C	S	.	.			trans	-74	126.4	170.9	166.9	-123.6	0	0	0	110.3	I179 N180 L211 L212 I213 L237 A239 D240	I179-F182 HydrophobicContact CB-CB 3.53Å; I179-F182 HydrophobicContact CB-CG 4.3Å; I179-F182 HydrophobicContact CD1-CB 4.32Å; I179-F182 HydrophobicContact CD1-CD1 4.39Å; I179-F182 HydrophobicContact CD1-CG 4.26Å; I179-F182 HydrophobicContact CG2-CB 3.67Å; I179-F182 VanDerWaalsContact O-CB 3.31Å; I179-F182 WeakPolarHBondContact O-CB 3.02Å; I179-F182 PolarHBondContact O-N 3.11Å; N180-F182 VanDerWaalsContact C-N 3.28Å; N180-F182 PolarHBondContact O-N 3.48Å; F182-L211 HydrophobicContact CE2-CB 4.03Å; F182-L211 HydrophobicContact CE2-CD2 4.19Å; F182-L211 HydrophobicContact CZ-CD2 3.99Å; F182-L212 WeakPolarHBondContact CA-O 3.37Å; F182-L212 WeakPolarHBondContact CD2-O 3.39Å; F182-I213 HydrophobicContact CD2-CG1 3.63Å; F182-I213 HydrophobicContact CE2-CG1 3.93Å; F182-L237 HydrophobicContact CD1-CB 4.27Å; F182-L237 HydrophobicContact CE1-CB 3.7Å; F182-L237 HydrophobicContact CZ-CB 4.31Å; F182-L237 HydrophobicContact CZ-CD1 4.46Å; F182-A239 VanDerWaalsContact CD1-CA 3.46Å; F182-A239 HydrophobicContact CD1-CB 3.74Å; F182-A239 HydrophobicContact CE1-CB 3.8Å; F182-A239 HydrophobicContact CG-CB 4.48Å; F182-A239 CarbonylContact O-C 3.25Å; F182-A239 VanDerWaalsContact O-CA 3.28Å; F182-A239 WeakPolarHBondContact O-CA 3.3Å; F182-A239 WeakPolarHBondContact O-CB 3.37Å; F182-D240 PolarHBondContact O-N 3.41Å
183	Y	77.4	Confident	66	Low	16 Å²	16	60 Å²	60	6%	0.063	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	137	177.3	-53.5	-58.5	0	0	0	110.6	D22 G181 L212 D240 N242	D22-Y183 PolarHBondContact O-OH 2.94Å; G181-Y183 WeakPolarHBondContact O-CD2 3.44Å; G181-Y183 WeakPolarHBondContact O-CE2 3.41Å; Y183-L212 PolarHBondContact N-O 3.46Å; Y183-L212 PolarHBondContact O-N 3.29Å; Y183-D240 HydrophobicContact CD1-CB 4.25Å; Y183-D240 WeakPolarHBondContact CD1-O 3.34Å; Y183-D240 HydrophobicContact CE1-CB 3.82Å; Y183-N242 HydrophobicContact CD1-CB 3.56Å; Y183-N242 VanDerWaalsContact CE1-CA 3.44Å; Y183-N242 HydrophobicContact CE1-CB 4.11Å; Y183-N242 HydrophobicContact CG-CB 3.82Å
184	A	77.1	Confident	65.5	Low	46 Å²	46	64 Å²	64	38%	0.38	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	117.5	165.8	0	0	0	0	0	108	L211 A239	A184-L211 HydrophobicContact CB-CD2 3.79Å; A184-A239 HydrophobicContact CB-CB 4.28Å
185	H	74.8	Confident	64.3	Low	49 Å²	49	65.1 Å²	65.1	23%	0.227	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.3	-177	-171	-138.2	0	0	0	109.6	N187 V209 E210	H185-N187 PolarHBondContact CE1-OD1 2.92Å; H185-N187 PolarHBondContact ND1-ND2 2.85Å; H185-N187 PolarHBondContact ND1-OD1 3.06Å; H185-V209 WeakPolarHBondContact O-CA 3.49Å; H185-E210 HydrophobicContact CB-CB 4.27Å; H185-E210 PolarHBondContact N-O 2.91Å; H185-E210 IonicContact ND1-OE2 3.31Å; H185-E210 PolarHBondContact O-N 3.37Å
186	L	74	Confident	62.9	Low	58 Å²	58	71.2 Å²	71.2	30%	0.304	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	107.7	177.3	-71.9	88.7	0	0	0	108.7	V209 V308 I310	L186-V209 HydrophobicContact CG-CG2 4.31Å; L186-V308 HydrophobicContact CD2-CB 4.27Å; L186-V308 HydrophobicContact CD2-CG1 3.89Å; L186-I310 HydrophobicContact CD2-CD1 3.92Å; L186-I310 HydrophobicContact CD2-CG1 4.16Å
187	N	70.8	Confident	61.5	Low	45 Å²	45	76.4 Å²	76.4	24%	0.241	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	120.9	176.5	-80.6	-29.3	0	0	0	110	H185 V189 I208 E210	H185-N187 PolarHBondContact CE1-OD1 2.92Å; H185-N187 PolarHBondContact ND1-ND2 2.85Å; H185-N187 PolarHBondContact ND1-OD1 3.06Å; N187-V189 PolarHBondContact O-N 3.35Å; N187-I208 HydrophobicContact CB-CB 4.48Å; N187-I208 PolarHBondContact N-O 3.19Å; N187-I208 PolarHBondContact O-N 3.45Å; N187-E210 PolarHBondContact ND2-OE1 3.4Å; N187-E210 PolarHBondContact ND2-OE2 2.92Å
188	V	67	Low	59.7	Low	63 Å²	63	81 Å²	81	38%	0.382	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	108	169.4	-176.2	0	0	0	0	108.2	E205 V207 V308	V188-E205 HydrophobicContact CG1-CB 3.92Å; V188-E205 HydrophobicContact CG1-CG 4.34Å; V188-V207 HydrophobicContact CG2-CG2 4.38Å; V188-V308 HydrophobicContact CG2-CG2 4.38Å
189	V	65.7	Low	58	Low	64 Å²	64	82.9 Å²	82.9	39%	0.388	47%	0.47	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	116.6	176.1	-177.5	0	0	0	0	108.3	N187 S191 D206 I208	N187-V189 PolarHBondContact O-N 3.35Å; V189-S191 PolarHBondContact O-N 3.41Å; V189-D206 PolarHBondContact N-O 3.44Å; V189-D206 PolarHBondContact O-N 2.78Å; V189-D206 VanDerWaalsContact O-N 3.12Å; V189-I208 HydrophobicContact CB-CD1 4.35Å; V189-I208 HydrophobicContact CG2-CD1 3.54Å; V189-I208 HydrophobicContact CG2-CG1 3.94Å
190	K	58.6	Low	56.5	Low	157 Å²	157	92.5 Å²	92.5	68%	0.683	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74	118.9	166.2	-70.1	-179.9	-178.4	174.3	0	107.1	E192	K190-E192 PolarHBondContact O-N 2.76Å
191	S	51.6	Low	55	Low	62 Å²	62	94.3 Å²	94.3	43%	0.434	52%	0.524	S	S	.	.			trans	-61.4	109.7	169.3	63.1	0	0	0	0	108.1	V189 S193	V189-S191 PolarHBondContact O-N 3.41Å; S191-S193 VanDerWaalsContact C-N 3.28Å; S191-S193 PolarHBondContact O-N 2.88Å
192	E	49	Very low	54	Low	182 Å²	182	101.7 Å²	101.7	85%	0.85	56%	0.562	S	S	*	*			trans	-67.2	94.6	163.7	-74	-176.2	162.5	0	0	106.6	K190 D194	K190-E192 PolarHBondContact O-N 2.76Å; E192-D194 PolarHBondContact O-N 3.23Å; E192-D194 VanDerWaalsContact O-N 3.12Å
193	S	43.2	Very low	52.7	Low	109 Å²	109	104.2 Å²	104.2	76%	0.762	59%	0.591	S	S	*	*			trans	-71.1	105.1	165.7	58.5	0	0	0	0	107.2	S191 T195	S191-S193 VanDerWaalsContact C-N 3.28Å; S191-S193 PolarHBondContact O-N 2.88Å; S193-T195 PolarHBondContact O-N 2.7Å
194	D	39.2	Very low	51.6	Low	143 Å²	143	109.5 Å²	109.5	77%	0.765	62%	0.619	S	S	*	*			trans	-42.6	120.4	169.1	-73.8	-41.7	0	0	0	111.1	E192	E192-D194 PolarHBondContact O-N 3.23Å; E192-D194 VanDerWaalsContact O-N 3.12Å
195	T	35	Very low	50.9	Low	112 Å²	112	111.2 Å²	111.2	69%	0.687	62%	0.619	S	S	*	*	S	Bend	trans	37.9	120.5	147.7	61.3	0	0	0	0	119.4	S193	S193-T195 PolarHBondContact O-N 2.7Å
196	N	34.4	Very low	50.5	Low	153 Å²	153	113.3 Å²	113.3	82%	0.818	63%	0.632	S	S	*	*			trans	74.1	65.4	150.9	-54.2	-19.9	0	0	0	118.2
197	T	38	Very low	50.1	Low	124 Å²	124	113.3 Å²	113.3	76%	0.761	63%	0.634	S	S	*	*			trans	-153.5	115.8	140.7	26.9	0	0	0	0	110.2	T199	T197-T199 VanDerWaalsContact C-N 3.29Å; T197-T199 PolarHBondContact O-N 2.92Å
198	T	33.4	Very low	50.3	Low	150 Å²	150	115 Å²	115	92%	0.92	64%	0.642	S	S	*	*			trans	-64	86.9	168.5	42.8	0	0	0	0	109.7
199	T	37.3	Very low	50.7	Low	95 Å²	95	113.9 Å²	113.9	58%	0.583	64%	0.635	S	S	*	*			trans	-137.7	124	160.8	45.6	0	0	0	0	108.4	T197 N201	T197-T199 VanDerWaalsContact C-N 3.29Å; T197-T199 PolarHBondContact O-N 2.92Å; T199-N201 PolarHBondContact O-N 2.73Å
200	H	41.7	Very low	51.3	Low	205 Å²	205	114.5 Å²	114.5	95%	0.949	63%	0.634	S	S	*	*			trans	-61.4	78.5	173	-92.5	-89.5	0	0	0	110.1
201	N	41.5	Very low	52.4	Low	134 Å²	134	110.5 Å²	110.5	72%	0.717	62%	0.62	S	S	*	*			trans	-106	117.6	167.8	-70.7	-18.3	0	0	0	106.8	T199 G203	T199-N201 PolarHBondContact O-N 2.73Å; N201-G203 PolarHBondContact O-N 2.77Å
202	N	47.1	Very low	53.6	Low	160 Å²	160	110.4 Å²	110.4	86%	0.856	61%	0.614	S	S	*	*			trans	-47.6	110.9	171.6	-77	-22	0	0	0	108.4	I204	N202-I204 PolarHBondContact O-N 3.24Å; N202-I204 VanDerWaalsContact O-N 3.13Å
203	G	49.2	Very low	55	Low	62 Å²	62	103.9 Å²	103.9	64%	0.639	58%	0.584	S	S	*	*			trans	-53.8	121.4	179.8	0	0	0	0	0	109.3	N201 E205	N201-G203 PolarHBondContact O-N 2.77Å; G203-E205 PolarHBondContact O-N 2.91Å; G203-E205 VanDerWaalsContact O-N 3.15Å
204	I	55.3	Low	56.7	Low	127 Å²	127	99.5 Å²	99.5	65%	0.651	55%	0.553	S	S	*	*			trans	-72.5	107.3	173.5	-61.9	174.8	0	0	0	105.3	N202 D206	N202-I204 PolarHBondContact O-N 3.24Å; N202-I204 VanDerWaalsContact O-N 3.13Å; I204-D206 PolarHBondContact O-N 2.95Å
205	E	61.6	Low	58.7	Low	81 Å²	81	98.5 Å²	98.5	38%	0.379	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	113.2	170.3	-70.2	177.3	167.5	0	0	107.2	V188 G203 K307	V188-E205 HydrophobicContact CG1-CB 3.92Å; V188-E205 HydrophobicContact CG1-CG 4.34Å; G203-E205 PolarHBondContact O-N 2.91Å; G203-E205 VanDerWaalsContact O-N 3.15Å; E205-K307 VanDerWaalsContact CD-NZ 3.31Å; E205-K307 IonicContact OE1-NZ 3.59Å; E205-K307 PolarHBondContact OE1-NZ 3.1Å; E205-K307 VanDerWaalsContact OE1-NZ 3.1Å; E205-K307 IonicContact OE2-NZ 3.61Å; E205-K307 PolarHBondContact OE2-NZ 3.15Å
206	D	66.4	Low	60.9	Low	94 Å²	94	97.9 Å²	97.9	50%	0.503	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.4	174.6	-77.7	-24.4	0	0	0	108.9	V189 I204	V189-D206 PolarHBondContact N-O 3.44Å; V189-D206 PolarHBondContact O-N 2.78Å; V189-D206 VanDerWaalsContact O-N 3.12Å; I204-D206 PolarHBondContact O-N 2.95Å
207	V	67.2	Low	62.9	Low	57 Å²	57	91.3 Å²	91.3	35%	0.345	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	119.6	177.3	-173.3	0	0	0	0	108.8	V188 V308 I310	V188-V207 HydrophobicContact CG2-CG2 4.38Å; V207-V308 HydrophobicContact CG1-CG1 4.16Å; V207-V308 HydrophobicContact CG1-CG2 4.34Å; V207-V308 HydrophobicContact CG2-CG1 4.44Å; V207-V308 HydrophobicContact CG2-CG2 3.72Å; V207-I310 HydrophobicContact CG1-CD1 4.14Å
208	I	74.6	Confident	65	Low	81 Å²	81	86.3 Å²	86.3	42%	0.415	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	131.6	174.7	-55.9	-174.9	0	0	0	108.2	N187 V189 E210	N187-I208 HydrophobicContact CB-CB 4.48Å; N187-I208 PolarHBondContact N-O 3.19Å; N187-I208 PolarHBondContact O-N 3.45Å; V189-I208 HydrophobicContact CB-CD1 4.35Å; V189-I208 HydrophobicContact CG2-CD1 3.54Å; V189-I208 HydrophobicContact CG2-CG1 3.94Å; I208-E210 HydrophobicContact CG2-CG 4.28Å
209	V	74.5	Confident	67.3	Low	39 Å²	39	81.9 Å²	81.9	24%	0.236	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	117	170.6	-174.6	0	0	0	0	108.6	H185 L186 L211 I310 F312	H185-V209 WeakPolarHBondContact O-CA 3.49Å; L186-V209 HydrophobicContact CG-CG2 4.31Å; V209-L211 HydrophobicContact CG1-CD2 3.97Å; V209-I310 HydrophobicContact CG2-CD1 3.35Å; V209-F312 HydrophobicContact CB-CE2 4.41Å; V209-F312 HydrophobicContact CB-CZ 4.03Å; V209-F312 HydrophobicContact CG1-CE2 3.99Å; V209-F312 HydrophobicContact CG1-CZ 4.04Å; V209-F312 HydrophobicContact CG2-CE2 4.35Å; V209-F312 HydrophobicContact CG2-CZ 4.07Å
210	E	79.4	Confident	69.3	Low	77 Å²	77	79.2 Å²	79.2	36%	0.36	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	125.2	173.7	-71.4	169.7	-166.9	0	0	109.3	H185 N187 I208	H185-E210 HydrophobicContact CB-CB 4.27Å; H185-E210 PolarHBondContact N-O 2.91Å; H185-E210 IonicContact ND1-OE2 3.31Å; H185-E210 PolarHBondContact O-N 3.37Å; N187-E210 PolarHBondContact ND2-OE1 3.4Å; N187-E210 PolarHBondContact ND2-OE2 2.92Å; I208-E210 HydrophobicContact CG2-CG 4.28Å
211	L	80	Confident	71	Confident	74 Å²	74	69.6 Å²	69.6	39%	0.387	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	106	176.6	-63.3	-174.8	0	0	0	108.2	F182 A184 V209	F182-L211 HydrophobicContact CE2-CB 4.03Å; F182-L211 HydrophobicContact CE2-CD2 4.19Å; F182-L211 HydrophobicContact CZ-CD2 3.99Å; A184-L211 HydrophobicContact CB-CD2 3.79Å; V209-L211 HydrophobicContact CG1-CD2 3.97Å
212	L	77	Confident	72.9	Confident	60 Å²	60	65.3 Å²	65.3	31%	0.314	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	103	-176.5	-56.3	176.8	0	0	0	109.1	F182 Y183	F182-L212 WeakPolarHBondContact CA-O 3.37Å; F182-L212 WeakPolarHBondContact CD2-O 3.39Å; Y183-L212 PolarHBondContact N-O 3.46Å; Y183-L212 PolarHBondContact O-N 3.29Å
213	I	79.8	Confident	74.5	Confident	44 Å²	44	65 Å²	65	23%	0.226	37%	0.371	C	S	.	.			trans	-101.9	125.1	177.1	-59.2	172.8	0	0	0	108.5	F182 M215 V221	F182-I213 HydrophobicContact CD2-CG1 3.63Å; F182-I213 HydrophobicContact CE2-CG1 3.93Å; I213-M215 PolarHBondContact O-N 2.96Å; I213-V221 HydrophobicContact CG2-CG2 4.24Å
214	P	79.2	Confident	75.7	Confident	17 Å²	17	63 Å²	63	11%	0.11	35%	0.345	C	S	.	.			trans	-60.8	137.2	173.8	-23.9	34	0	0	0	111.4	G181 S216 S217	G181-P214 VanDerWaalsContact C-CG 3.45Å; G181-P214 VanDerWaalsContact O-CD 3.31Å; G181-P214 WeakPolarHBondContact O-CD 3.47Å; G181-P214 WeakPolarHBondContact O-CG 3.49Å; P214-S216 PolarHBondContact O-N 3.25Å; P214-S216 VanDerWaalsContact O-N 3.12Å; P214-S217 WeakPolarHBondContact O-CA 3.46Å; P214-S217 WeakPolarHBondContact O-CB 3.2Å; P214-S217 PolarHBondContact O-N 2.67Å
215	M	80.9	Confident	76.6	Confident	122 Å²	122	59 Å²	59	60%	0.601	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-57.3	-30.1	177.6	-71.8	-59.5	-64	0	0	113	I213 S217 C218	I213-M215 PolarHBondContact O-N 2.96Å; M215-S217 PolarHBondContact O-N 3.37Å; M215-C218 PolarHBondContact O-N 2.83Å
216	S	79.7	Confident	77.3	Confident	99 Å²	99	60.6 Å²	60.6	69%	0.692	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-63.6	-24.3	174.3	50.7	0	0	0	0	113.6	P214	P214-S216 PolarHBondContact O-N 3.25Å; P214-S216 VanDerWaalsContact O-N 3.12Å
217	S	77.6	Confident	77.4	Confident	16 Å²	16	59.5 Å²	59.5	11%	0.112	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-93.6	-12.9	-177.4	-66.3	0	0	0	0	113.3	I179 N180 P214 M215 A219 S220 V221	I179-S217 VanDerWaalsContact CG2-CB 3.46Å; N180-S217 PolarHBondContact O-OG 3.27Å; P214-S217 WeakPolarHBondContact O-CA 3.46Å; P214-S217 WeakPolarHBondContact O-CB 3.2Å; P214-S217 PolarHBondContact O-N 2.67Å; M215-S217 PolarHBondContact O-N 3.37Å; S217-A219 VanDerWaalsContact C-N 3.31Å; S217-A219 PolarHBondContact O-N 2.91Å; S217-S220 WeakPolarHBondContact O-CB 3.36Å; S217-S220 PolarHBondContact O-N 3.46Å; S217-V221 WeakPolarHBondContact O-CG2 3.39Å; S217-V221 PolarHBondContact O-N 3.4Å
218	C	81.2	Confident	77.1	Confident	19 Å²	19	57.3 Å²	57.3	13%	0.128	32%	0.323	C	S	.	.	H	α-helix	trans	-52	-44.5	-176.9	-71.2	0	0	0	0	113.4	M215 S220 V221 A222	M215-C218 PolarHBondContact O-N 2.83Å; C218-S220 VanDerWaalsContact C-N 3.31Å; C218-S220 PolarHBondContact O-N 2.99Å; C218-V221 PolarHBondContact O-N 3.38Å; C218-A222 WeakPolarHBondContact O-CB 3.39Å; C218-A222 PolarHBondContact O-N 3.37Å
219	A	82.2	Confident	76.2	Confident	56 Å²	56	57.4 Å²	57.4	46%	0.463	34%	0.335	S	S	.	.	H	α-helix	trans	-66.3	-31.9	179.1	0	0	0	0	0	113.2	S217 R223	S217-A219 VanDerWaalsContact C-N 3.31Å; S217-A219 PolarHBondContact O-N 2.91Å; A219-R223 WeakPolarHBondContact O-CB 3.46Å; A219-R223 WeakPolarHBondContact O-CG 3.39Å; A219-R223 PolarHBondContact O-N 2.8Å; A219-R223 VanDerWaalsContact O-N 3.16Å; A219-R223 PolarHBondContact O-NE 2.81Å
220	S	78.8	Confident	75	Confident	40 Å²	40	63.2 Å²	63.2	28%	0.28	36%	0.362	S	S	.	.	H	α-helix	trans	-76.9	-38.5	177.9	-61.1	0	0	0	0	111.2	S217 C218 R223 F224	S217-S220 WeakPolarHBondContact O-CB 3.36Å; S217-S220 PolarHBondContact O-N 3.46Å; C218-S220 VanDerWaalsContact C-N 3.31Å; C218-S220 PolarHBondContact O-N 2.99Å; S220-R223 PolarHBondContact O-N 3.43Å; S220-F224 WeakPolarHBondContact O-CB 3.17Å; S220-F224 PolarHBondContact O-N 3.23Å
221	V	77.9	Confident	73.8	Confident	3 Å²	3	66.7 Å²	66.7	2%	0.018	38%	0.378	C	S	.	.	H	α-helix	trans	-62.9	-47.8	172.4	177.7	0	0	0	0	110.7	F177 I179 I213 S217 C218 R223 F224 L225 I320	F177-V221 HydrophobicContact CE1-CG2 4.26Å; I179-V221 HydrophobicContact CD1-CG2 3.4Å; I179-V221 HydrophobicContact CG1-CG2 3.84Å; I179-V221 HydrophobicContact CG2-CG2 4.48Å; I213-V221 HydrophobicContact CG2-CG2 4.24Å; S217-V221 WeakPolarHBondContact O-CG2 3.39Å; S217-V221 PolarHBondContact O-N 3.4Å; C218-V221 PolarHBondContact O-N 3.38Å; V221-R223 VanDerWaalsContact C-N 3.35Å; V221-R223 PolarHBondContact O-N 3.18Å; V221-F224 PolarHBondContact O-N 3.4Å; V221-F224 VanDerWaalsContact O-N 3.14Å; V221-L225 HydrophobicContact CG1-CD1 3.92Å; V221-L225 HydrophobicContact CG1-CG 4.23Å; V221-L225 WeakPolarHBondContact O-CG 3.43Å; V221-L225 PolarHBondContact O-N 3.01Å; V221-I320 HydrophobicContact CG1-CD1 3.9Å
222	A	81.1	Confident	72.6	Confident	43 Å²	43	64.7 Å²	64.7	36%	0.355	37%	0.371	S	S	.	.	H	α-helix	trans	-56.2	-48.8	176.6	0	0	0	0	0	111.4	C218 F224 L225 D226	C218-A222 WeakPolarHBondContact O-CB 3.39Å; C218-A222 PolarHBondContact O-N 3.37Å; A222-F224 VanDerWaalsContact C-N 3.31Å; A222-F224 PolarHBondContact O-N 3.27Å; A222-L225 PolarHBondContact O-N 2.83Å; A222-D226 WeakPolarHBondContact O-CB 3.09Å; A222-D226 VanDerWaalsContact O-CG 3.24Å; A222-D226 PolarHBondContact O-N 3.2Å
223	R	80.4	Confident	71.9	Confident	155 Å²	155	71.1 Å²	71.1	59%	0.585	40%	0.401	S	S	*	.	H	α-helix	trans	-58.2	-39.8	175.8	-80.3	-176.2	-98.4	116.7	-2.4	113.4	A219 S220 V221 S227	A219-R223 WeakPolarHBondContact O-CB 3.46Å; A219-R223 WeakPolarHBondContact O-CG 3.39Å; A219-R223 PolarHBondContact O-N 2.8Å; A219-R223 VanDerWaalsContact O-N 3.16Å; A219-R223 PolarHBondContact O-NE 2.81Å; S220-R223 PolarHBondContact O-N 3.43Å; V221-R223 VanDerWaalsContact C-N 3.35Å; V221-R223 PolarHBondContact O-N 3.18Å; R223-S227 PolarHBondContact O-N 2.81Å; R223-S227 VanDerWaalsContact O-N 3.1Å; R223-S227 PolarHBondContact O-OG 2.9Å
224	F	74.7	Confident	71.1	Confident	18 Å²	18	72.3 Å²	72.3	8%	0.079	41%	0.411	C	S	.	.	H	α-helix	trans	-69.7	-40.3	177.3	171.8	-103	0	0	0	112.6	F177 S220 V221 A222 S227 S228 F235 L237	F177-F224 HydrophobicContact CB-CD1 3.68Å; F177-F224 HydrophobicContact CB-CD2 3.65Å; F177-F224 HydrophobicContact CB-CE1 3.59Å; F177-F224 HydrophobicContact CB-CE2 3.58Å; F177-F224 HydrophobicContact CB-CG 3.7Å; F177-F224 HydrophobicContact CB-CZ 3.54Å; F177-F224 HydrophobicContact CD1-CB 3.93Å; F177-F224 AromaticContact CD1-CD1 3.97Å; F177-F224 HydrophobicContact CD1-CD1 3.97Å; F177-F224 HydrophobicContact CD1-CD2 4.47Å; F177-F224 AromaticContact CD1-CG 3.85Å; F177-F224 HydrophobicContact CD1-CG 3.85Å; F177-F224 HydrophobicContact CD2-CB 4.15Å; F177-F224 AromaticContact CD2-CD2 3.8Å; F177-F224 HydrophobicContact CD2-CD2 3.8Å; F177-F224 HydrophobicContact CD2-CE2 4.42Å; F177-F224 AromaticContact CD2-CG 3.95Å; F177-F224 HydrophobicContact CD2-CG 3.95Å; F177-F224 HydrophobicContact CE1-CB 4.06Å; F177-F224 HydrophobicContact CE1-CG 4.46Å; F177-F224 HydrophobicContact CE2-CB 4.28Å; F177-F224 HydrophobicContact CG-CB 3.99Å; F177-F224 AromaticContact CG-CD1 3.89Å; F177-F224 HydrophobicContact CG-CD1 3.89Å; F177-F224 AromaticContact CG-CD2 3.74Å; F177-F224 HydrophobicContact CG-CD2 3.74Å; F177-F224 HydrophobicContact CG-CE1 4.32Å; F177-F224 HydrophobicContact CG-CE2 4.2Å; F177-F224 AromaticContact CG-CG 3.57Å; F177-F224 HydrophobicContact CG-CG 3.57Å; F177-F224 HydrophobicContact CG-CZ 4.46Å; F177-F224 HydrophobicContact CZ-CB 4.25Å; S220-F224 WeakPolarHBondContact O-CB 3.17Å; S220-F224 PolarHBondContact O-N 3.23Å; V221-F224 PolarHBondContact O-N 3.4Å; V221-F224 VanDerWaalsContact O-N 3.14Å; A222-F224 VanDerWaalsContact C-N 3.31Å; A222-F224 PolarHBondContact O-N 3.27Å; F224-S227 PolarHBondContact O-N 2.7Å; F224-S227 PolarHBondContact O-OG 2.88Å; F224-S228 WeakPolarHBondContact CE2-OG 3.35Å; F224-S228 WeakPolarHBondContact CZ-OG 3.26Å; F224-S228 VanDerWaalsContact O-CB 3.29Å; F224-S228 WeakPolarHBondContact O-CB 3.22Å; F224-S228 PolarHBondContact O-N 3.15Å; F224-S228 PolarHBondContact O-OG 2.72Å; F224-F235 HydrophobicContact CE1-CB 3.73Å; F224-F235 AromaticContact CE1-CD2 3.78Å; F224-F235 HydrophobicContact CE1-CD2 3.78Å; F224-F235 AromaticContact CE1-CG 3.88Å; F224-F235 HydrophobicContact CE1-CG 3.88Å; F224-F235 HydrophobicContact CZ-CB 3.79Å; F224-F235 HydrophobicContact CZ-CG 4.45Å; F224-L237 HydrophobicContact CD1-CD2 4.32Å; F224-L237 HydrophobicContact CE1-CD2 4.12Å
225	L	75.3	Confident	70.7	Confident	44 Å²	44	75.2 Å²	75.2	23%	0.23	42%	0.422	C	S	.	.	H	α-helix	trans	-65.2	-42.7	175.7	-67.8	175.8	0	0	0	110.9	V221 A222 S227 S228 A229 F235 I320	V221-L225 HydrophobicContact CG1-CD1 3.92Å; V221-L225 HydrophobicContact CG1-CG 4.23Å; V221-L225 WeakPolarHBondContact O-CG 3.43Å; V221-L225 PolarHBondContact O-N 3.01Å; A222-L225 PolarHBondContact O-N 2.83Å; L225-S227 VanDerWaalsContact C-N 3.33Å; L225-S227 PolarHBondContact O-N 3.01Å; L225-S228 PolarHBondContact O-N 3.35Å; L225-A229 WeakPolarHBondContact O-CB 3.32Å; L225-A229 PolarHBondContact O-N 3.47Å; L225-F235 HydrophobicContact CD2-CD1 4.12Å; L225-F235 HydrophobicContact CD2-CD2 4.35Å; L225-F235 HydrophobicContact CD2-CE1 3.53Å; L225-F235 HydrophobicContact CD2-CE2 3.79Å; L225-F235 HydrophobicContact CD2-CZ 3.34Å; L225-I320 HydrophobicContact CD1-CD1 4.35Å
226	D	75.7	Confident	70.2	Confident	115 Å²	115	70.4 Å²	70.4	62%	0.615	40%	0.401	S	S	*	.	H	α-helix	trans	-62.6	-39.4	177.3	-69.9	-20.7	0	0	0	112	A222	A222-D226 WeakPolarHBondContact O-CB 3.09Å; A222-D226 VanDerWaalsContact O-CG 3.24Å; A222-D226 PolarHBondContact O-N 3.2Å
227	S	69	Low	70	Confident	71 Å²	71	68.1 Å²	68.1	50%	0.497	38%	0.381	S	S	.	.	H	α-helix	trans	-70.3	-39.2	176.3	66.7	0	0	0	0	112.5	R223 F224 L225	R223-S227 PolarHBondContact O-N 2.81Å; R223-S227 VanDerWaalsContact O-N 3.1Å; R223-S227 PolarHBondContact O-OG 2.9Å; F224-S227 PolarHBondContact O-N 2.7Å; F224-S227 PolarHBondContact O-OG 2.88Å; L225-S227 VanDerWaalsContact C-N 3.33Å; L225-S227 PolarHBondContact O-N 3.01Å
228	S	60.7	Low	69.9	Low	11 Å²	11	67.9 Å²	67.9	8%	0.077	38%	0.38	C	S	.	.	H	α-helix	trans	-77.5	-32.8	-175.7	-57.2	0	0	0	0	112.2	F224 L225 M230 E231 S232	F224-S228 WeakPolarHBondContact CE2-OG 3.35Å; F224-S228 WeakPolarHBondContact CZ-OG 3.26Å; F224-S228 VanDerWaalsContact O-CB 3.29Å; F224-S228 WeakPolarHBondContact O-CB 3.22Å; F224-S228 PolarHBondContact O-N 3.15Å; F224-S228 PolarHBondContact O-OG 2.72Å; L225-S228 PolarHBondContact O-N 3.35Å; S228-M230 PolarHBondContact O-N 2.88Å; S228-E231 PolarHBondContact O-N 3.37Å; S228-S232 PolarHBondContact O-N 3.47Å; S228-S232 VanDerWaalsContact O-O 3.13Å
229	A	54.7	Low	69.6	Low	82 Å²	82	68.7 Å²	68.7	68%	0.678	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.5	-17.4	177.3	0	0	0	0	0	113.5	L225	L225-A229 WeakPolarHBondContact O-CB 3.32Å; L225-A229 PolarHBondContact O-N 3.47Å
230	M	50.2	Low	69.2	Low	161 Å²	161	66.4 Å²	66.4	79%	0.793	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-22.9	177.1	-66.5	-108.8	70.2	0	0	113.7	S228	S228-M230 PolarHBondContact O-N 2.88Å
231	E	54.2	Low	69	Low	151 Å²	151	64.6 Å²	64.6	71%	0.706	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.2	-22.5	-166.2	-67.5	-172.8	169.8	0	0	115.4	S228	S228-E231 PolarHBondContact O-N 3.37Å
232	S	55.1	Low	69.1	Low	32 Å²	32	65.3 Å²	65.3	22%	0.224	36%	0.359	C	S	.	.			trans	-148.9	143.1	177	103.7	0	0	0	0	112.8	L175 S228 T234	L175-S232 VanDerWaalsContact CD2-OG 3.26Å; L175-S232 WeakPolarHBondContact CD2-OG 3.42Å; S228-S232 PolarHBondContact O-N 3.47Å; S228-S232 VanDerWaalsContact O-O 3.13Å; S232-T234 PolarHBondContact O-N 3.29Å; S232-T234 PolarHBondContact OG-N 3.39Å; S232-T234 PolarHBondContact OG-O 2.76Å
233	M	61.1	Low	68.7	Low	194 Å²	194	64.7 Å²	64.7	96%	0.956	35%	0.351	S	S	*	.	S	Bend	trans	-81.7	5.8	172.2	-72.3	-158	-76.4	0	0	112.9
234	T	64.4	Low	68.4	Low	69 Å²	69	64.8 Å²	64.8	42%	0.423	36%	0.36	S	S	.	.			trans	-141.3	116.9	-173.1	-46	0	0	0	0	110.3	F149 S232	F149-T234 HydrophobicContact CE1-CG2 3.84Å; F149-T234 HydrophobicContact CZ-CG2 4.18Å; S232-T234 PolarHBondContact O-N 3.29Å; S232-T234 PolarHBondContact OG-N 3.39Å; S232-T234 PolarHBondContact OG-O 2.76Å
235	F	69.4	Low	68.6	Low	78 Å²	78	64.5 Å²	64.5	34%	0.342	36%	0.36	S	S	.	.			trans	-124.4	160.9	172.6	63	-90.4	0	0	0	109.6	F224 L225 L237	F224-F235 HydrophobicContact CE1-CB 3.73Å; F224-F235 AromaticContact CE1-CD2 3.78Å; F224-F235 HydrophobicContact CE1-CD2 3.78Å; F224-F235 AromaticContact CE1-CG 3.88Å; F224-F235 HydrophobicContact CE1-CG 3.88Å; F224-F235 HydrophobicContact CZ-CB 3.79Å; F224-F235 HydrophobicContact CZ-CG 4.45Å; L225-F235 HydrophobicContact CD2-CD1 4.12Å; L225-F235 HydrophobicContact CD2-CD2 4.35Å; L225-F235 HydrophobicContact CD2-CE1 3.53Å; L225-F235 HydrophobicContact CD2-CE2 3.79Å; L225-F235 HydrophobicContact CD2-CZ 3.34Å; F235-L237 HydrophobicContact CD2-CD2 4.1Å; F235-L237 HydrophobicContact CD2-CG 4.11Å; F235-L237 HydrophobicContact CE2-CD1 4.22Å; F235-L237 HydrophobicContact CE2-CD2 4.23Å; F235-L237 HydrophobicContact CE2-CG 3.98Å
236	A	71.3	Confident	68.8	Low	21 Å²	21	66.6 Å²	66.6	17%	0.174	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	140.6	172.5	0	0	0	0	0	109.6	F149 L175 L176 F177	F149-A236 HydrophobicContact CB-CB 4.06Å; F149-A236 HydrophobicContact CD1-CB 3.41Å; F149-A236 VanDerWaalsContact CD1-CB 3.41Å; F149-A236 HydrophobicContact CD2-CB 4.4Å; F149-A236 HydrophobicContact CE1-CB 3.94Å; F149-A236 HydrophobicContact CG-CB 3.67Å; L175-A236 PolarHBondContact O-N 3.01Å; L176-A236 WeakPolarHBondContact CA-O 3.2Å; L176-A236 HydrophobicContact CD1-CB 3.71Å; F177-A236 PolarHBondContact N-O 3.48Å
237	L	75.6	Confident	69.1	Low	52 Å²	52	62.2 Å²	62.2	27%	0.272	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	129.2	169.2	-59	179.5	0	0	0	108	F177 I179 F182 F224 F235	F177-L237 HydrophobicContact CB-CD2 3.99Å; F177-L237 HydrophobicContact CD1-CD2 4.12Å; F177-L237 WeakPolarHBondContact O-CA 3.48Å; I179-L237 HydrophobicContact CD1-CB 4.48Å; I179-L237 HydrophobicContact CD1-CD1 3.96Å; I179-L237 HydrophobicContact CD1-CD2 3.86Å; I179-L237 HydrophobicContact CD1-CG 4.31Å; F182-L237 HydrophobicContact CD1-CB 4.27Å; F182-L237 HydrophobicContact CE1-CB 3.7Å; F182-L237 HydrophobicContact CZ-CB 4.31Å; F182-L237 HydrophobicContact CZ-CD1 4.46Å; F224-L237 HydrophobicContact CD1-CD2 4.32Å; F224-L237 HydrophobicContact CE1-CD2 4.12Å; F235-L237 HydrophobicContact CD2-CD2 4.1Å; F235-L237 HydrophobicContact CD2-CG 4.11Å; F235-L237 HydrophobicContact CE2-CD1 4.22Å; F235-L237 HydrophobicContact CE2-CD2 4.23Å; F235-L237 HydrophobicContact CE2-CG 3.98Å
238	S	74.5	Confident	69.9	Low	11 Å²	11	60 Å²	60	8%	0.077	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	125.3	170.8	55.4	0	0	0	0	110.3	F177 H178	F177-S238 PolarHBondContact O-N 2.64Å; F177-S238 VanDerWaalsContact O-N 3.1Å; H178-S238 WeakPolarHBondContact CA-OG 3.46Å; H178-S238 WeakPolarHBondContact CB-OG 3.47Å; H178-S238 PolarHBondContact CD2-OG 2.72Å
239	A	75.2	Confident	71	Confident	35 Å²	35	62.9 Å²	62.9	29%	0.289	35%	0.346	S	S	.	.	P	Polyproline II helix	trans	-83.4	148.8	173.2	0	0	0	0	0	112.1	F182 A184	F182-A239 VanDerWaalsContact CD1-CA 3.46Å; F182-A239 HydrophobicContact CD1-CB 3.74Å; F182-A239 HydrophobicContact CE1-CB 3.8Å; F182-A239 HydrophobicContact CG-CB 4.48Å; F182-A239 CarbonylContact O-C 3.25Å; F182-A239 VanDerWaalsContact O-CA 3.28Å; F182-A239 WeakPolarHBondContact O-CA 3.3Å; F182-A239 WeakPolarHBondContact O-CB 3.37Å; A184-A239 HydrophobicContact CB-CB 4.28Å
240	D	74.2	Confident	72.4	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.043	31%	0.314	C	S	.	.	P	Polyproline II helix	trans	-78	163.5	166.8	-80.2	-32.2	0	0	0	111.6	H178 N180 G181 F182 Y183 N242	H178-D240 IonicContact CD2-OD1 2.73Å; H178-D240 IonicContact CE1-OD1 3.66Å; H178-D240 PolarHBondContact CE1-OD1 3.42Å; H178-D240 IonicContact CE1-OD2 2.8Å; H178-D240 IonicContact NE2-OD1 3.75Å; H178-D240 PolarHBondContact NE2-OD1 3.42Å; H178-D240 IonicContact NE2-OD2 3.33Å; N180-D240 WeakPolarHBondContact CA-OD2 3.25Å; G181-D240 PolarHBondContact N-OD2 3Å; F182-D240 PolarHBondContact O-N 3.41Å; Y183-D240 HydrophobicContact CD1-CB 4.25Å; Y183-D240 WeakPolarHBondContact CD1-O 3.34Å; Y183-D240 HydrophobicContact CE1-CB 3.82Å; D240-N242 PolarHBondContact O-N 2.88Å
241	C	75.5	Confident	73.9	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.02	29%	0.286	C	S	.	.			trans	-70.4	109.8	172.3	177.2	0	0	0	0	109.1	F24 P243 H248	F24-C241 HydrophobicContact CB-CB 3.71Å; F24-C241 HydrophobicContact CD1-CB 3.34Å; F24-C241 HydrophobicContact CD2-CB 4.38Å; F24-C241 HydrophobicContact CE1-CB 3.94Å; F24-C241 HydrophobicContact CG-CB 3.58Å; C241-P243 VanDerWaalsContact O-CD 3.26Å; C241-P243 WeakPolarHBondContact O-CD 3.37Å; C241-H248 PolarHBondContact SG-CE1 2.68Å; C241-H248 PolarHBondContact SG-NE2 3.11Å; C241-H248 VanDerWaalsContact SG-NE2 3.4Å
242	N	78.4	Confident	75.3	Confident	18 Å²	18	46.2 Å²	46.2	10%	0.096	26%	0.257	C	S	.	.			trans	-63.8	114.1	175.9	-177.2	-1.5	0	0	0	110.5	Y183 D240 M244 S245 H248	Y183-N242 HydrophobicContact CD1-CB 3.56Å; Y183-N242 VanDerWaalsContact CE1-CA 3.44Å; Y183-N242 HydrophobicContact CE1-CB 4.11Å; Y183-N242 HydrophobicContact CG-CB 3.82Å; D240-N242 PolarHBondContact O-N 2.88Å; N242-M244 PolarHBondContact O-N 2.9Å; N242-M244 WeakPolarHBondContact OD1-CB 3.45Å; N242-M244 PolarHBondContact OD1-N 2.87Å; N242-S245 PolarHBondContact O-N 2.8Å; N242-H248 PolarHBondContact N-NE2 3.29Å; N242-H248 PolarHBondContact O-CE1 2.92Å; N242-H248 PolarHBondContact O-NE2 3.31Å; N242-H248 VanDerWaalsContact O-NE2 3.08Å
243	P	74.2	Confident	76.4	Confident	30 Å²	30	46 Å²	46	20%	0.195	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.7	-11.5	-179.6	31.2	-36.7	0	0	0	112.9	T76 H77 C241	T76-P243 HydrophobicContact CG2-CB 3.87Å; H77-P243 PolarHBondContact CE1-O 2.75Å; H77-P243 PolarHBondContact NE2-O 2.95Å; C241-P243 VanDerWaalsContact O-CD 3.26Å; C241-P243 WeakPolarHBondContact O-CD 3.37Å
244	M	73.8	Confident	76.9	Confident	157 Å²	157	38.2 Å²	38.2	77%	0.773	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.3	-6.3	178	-59.1	-65.2	106.7	0	0	112.9	N242	N242-M244 PolarHBondContact O-N 2.9Å; N242-M244 WeakPolarHBondContact OD1-CB 3.45Å; N242-M244 PolarHBondContact OD1-N 2.87Å
245	S	78.1	Confident	77	Confident	12 Å²	12	39.7 Å²	39.7	8%	0.084	22%	0.217	C	C	.	.			trans	-78.8	147.6	178.4	-164.6	0	0	0	0	110.4	Y122 N242 S247	Y122-S245 PolarHBondContact OH-O 3.28Å; N242-S245 PolarHBondContact O-N 2.8Å; S245-S247 VanDerWaalsContact C-N 3.28Å; S245-S247 PolarHBondContact OG-N 3.08Å; S245-S247 PolarHBondContact OG-O 3.21Å
246	D	79.4	Confident	76.3	Confident	87 Å²	87	37 Å²	37	47%	0.465	21%	0.206	S	C	.	.	S	Bend	trans	-82.5	-10.5	172.2	61.6	2.1	0	0	0	112.5	Y122 S300 I301	Y122-D246 VanDerWaalsContact OH-C 3.27Å; D246-S300 CarbonylContact O-C 3.53Å; D246-S300 VanDerWaalsContact O-CA 3.32Å; D246-S300 WeakPolarHBondContact O-CA 3.22Å; D246-S300 PolarHBondContact O-OG 2.93Å; D246-I301 HydrophobicContact CB-CD1 4.49Å; D246-I301 PolarHBondContact O-N 2.64Å
247	S	83.2	Confident	75.3	Confident	24 Å²	24	40.7 Å²	40.7	17%	0.168	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.1	152.7	-170.1	53.6	0	0	0	0	113.9	Y122 S245 I299 L306	Y122-S247 PolarHBondContact OH-N 3.27Å; Y122-S247 VanDerWaalsContact OH-N 3.1Å; S245-S247 VanDerWaalsContact C-N 3.28Å; S245-S247 PolarHBondContact OG-N 3.08Å; S245-S247 PolarHBondContact OG-O 3.21Å; S247-I299 CarbonylContact C-O 3.56Å; S247-I299 VanDerWaalsContact CA-O 3.22Å; S247-I299 WeakPolarHBondContact CA-O 3.24Å; S247-I299 WeakPolarHBondContact CB-O 3.24Å; S247-L306 WeakPolarHBondContact OG-CD2 3.21Å
248	H	84	Confident	73.7	Confident	25 Å²	25	41.3 Å²	41.3	12%	0.116	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	143.3	176.7	-66.1	93.5	0	0	0	111.3	L113 Y122 C241 N242 A298 I299	L113-H248 HydrophobicContact CD1-CB 4.02Å; L113-H248 HydrophobicContact CD2-CB 3.77Å; Y122-H248 AromaticContact CE2-ND1 3.65Å; Y122-H248 AromaticContact CZ-CE1 3.82Å; Y122-H248 AromaticContact CZ-ND1 3.4Å; Y122-H248 PolarHBondContact OH-CE1 3.23Å; Y122-H248 PolarHBondContact OH-ND1 3.43Å; C241-H248 PolarHBondContact SG-CE1 2.68Å; C241-H248 PolarHBondContact SG-NE2 3.11Å; C241-H248 VanDerWaalsContact SG-NE2 3.4Å; N242-H248 PolarHBondContact N-NE2 3.29Å; N242-H248 PolarHBondContact O-CE1 2.92Å; N242-H248 PolarHBondContact O-NE2 3.31Å; N242-H248 VanDerWaalsContact O-NE2 3.08Å; H248-A298 CarbonylContact O-C 3.51Å; H248-A298 VanDerWaalsContact O-CA 3.24Å; H248-A298 WeakPolarHBondContact O-CA 2.91Å; H248-I299 HydrophobicContact CB-CG1 4.37Å; H248-I299 PolarHBondContact N-O 2.8Å; H248-I299 PolarHBondContact O-N 2.88Å
249	L	83.7	Confident	71.9	Confident	71 Å²	71	49.1 Å²	49.1	37%	0.372	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	137.3	168.2	-64.3	179.4	0	0	0	110.2	T296 E297 A298 F309	L249-T296 HydrophobicContact CB-CG2 4.47Å; L249-E297 CarbonylContact C-O 3.21Å; L249-E297 WeakPolarHBondContact CA-O 3.39Å; L249-A298 HydrophobicContact CD2-CB 4.05Å; L249-F309 HydrophobicContact CD2-CD1 4.11Å; L249-F309 HydrophobicContact CD2-CE1 4.03Å
250	V	84.7	Confident	70	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.012	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	128.3	180	-174.5	0	0	0	0	108.4	L113 N114 K117 E297 I299	L113-V250 HydrophobicContact CB-CG1 4.49Å; L113-V250 HydrophobicContact CB-CG2 3.99Å; N114-V250 HydrophobicContact CB-CG1 4.31Å; N114-V250 VanDerWaalsContact CG-CG1 3.43Å; N114-V250 VanDerWaalsContact ND2-CG1 3.32Å; N114-V250 WeakPolarHBondContact ND2-CG1 3.26Å; N114-V250 WeakPolarHBondContact OD1-CG1 3.16Å; K117-V250 HydrophobicContact CB-CG1 4.39Å; K117-V250 HydrophobicContact CD-CG1 4.19Å; V250-E297 PolarHBondContact N-O 3.12Å; V250-E297 PolarHBondContact O-N 3.41Å; V250-I299 HydrophobicContact CG2-CB 4.23Å; V250-I299 HydrophobicContact CG2-CD1 4.05Å; V250-I299 HydrophobicContact CG2-CG1 3.7Å; V250-I299 HydrophobicContact CG2-CG2 3.79Å
251	C	82.9	Confident	68	Low	30 Å²	30	58.3 Å²	58.3	20%	0.203	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.9	172.6	-178.2	0	0	0	0	109.9	R110 N114 F136 E295	R110-C251 PolarHBondContact NH2-SG 2.99Å; N114-C251 PolarHBondContact ND2-O 2.82Å; N114-C251 PolarHBondContact OD1-O 3.26Å; F136-C251 WeakPolarHBondContact CZ-O 3.33Å; C251-E295 CarbonylContact C-O 3.56Å; C251-E295 WeakPolarHBondContact CA-O 3.19Å
252	S	81.9	Confident	66	Low	12 Å²	12	67.8 Å²	67.8	8%	0.084	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	140.7	178.1	-59.9	0	0	0	0	110.8	K117 F294 E295 E297	K117-S252 PolarHBondContact NZ-OG 3.25Å; S252-F294 WeakPolarHBondContact O-CA 3.3Å; S252-E295 PolarHBondContact N-O 2.81Å; S252-E295 PolarHBondContact O-N 3.49Å; S252-E297 PolarHBondContact OG-OE1 3.35Å
253	Q	78.9	Confident	64.1	Low	28 Å²	28	73.5 Å²	73.5	13%	0.131	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118.8	172.6	-169.8	-177.6	41.6	0	0	109.6	F136 Q292 F294	F136-Q253 HydrophobicContact CD1-CB 3.89Å; F136-Q253 HydrophobicContact CE1-CB 4.09Å; Q253-Q292 VanDerWaalsContact NE2-NE2 3.16Å; Q253-F294 HydrophobicContact CB-CD1 4.17Å; Q253-F294 HydrophobicContact CB-CE1 3.88Å; Q253-F294 HydrophobicContact CG-CD1 4.29Å; Q253-F294 HydrophobicContact CG-CE1 3.74Å; Q253-F294 HydrophobicContact CG-CZ 4.07Å
254	S	72.5	Confident	62.1	Low	29 Å²	29	79.6 Å²	79.6	20%	0.203	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	142.9	173.3	50.2	0	0	0	0	110.5	T293 E295	S254-T293 PolarHBondContact N-O 2.94Å; S254-T293 PolarHBondContact O-N 2.81Å; S254-T293 PolarHBondContact OG-O 3.1Å; S254-T293 PolarHBondContact OG-OG1 3.2Å; S254-E295 PolarHBondContact OG-OE1 2.8Å
255	K	66.2	Low	60.6	Low	100 Å²	100	80.5 Å²	80.5	44%	0.435	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	123	174.3	-68	-169.9	-172.9	-167.7	0	108.1	L140	L140-K255 HydrophobicContact CD1-CD 4.27Å
256	I	54.9	Low	58.3	Low	21 Å²	21	88.5 Å²	88.5	11%	0.108	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	119.6	170.8	-56.9	179.9	0	0	0	107.7	C290 S291 T293	I256-C290 WeakPolarHBondContact O-CA 3.37Å; I256-C290 PolarHBondContact O-SG 3.36Å; I256-S291 WeakPolarHBondContact CA-O 2.98Å; I256-S291 WeakPolarHBondContact CB-O 3.44Å; I256-S291 PolarHBondContact N-O 2.81Å; I256-S291 PolarHBondContact O-N 3.19Å; I256-T293 HydrophobicContact CD1-CG2 3.51Å; I256-T293 WeakPolarHBondContact CD1-OG1 3.46Å; I256-T293 HydrophobicContact CG1-CG2 4.41Å
257	L	49.8	Very low	56	Low	100 Å²	100	92.2 Å²	92.2	52%	0.524	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	115	170.4	-82.7	153.8	0	0	0	108.8	K259	L257-K259 PolarHBondContact O-N 2.79Å
258	L	41.9	Very low	53.6	Low	65 Å²	65	97.3 Å²	97.3	34%	0.34	49%	0.485	S	S	.	.			trans	-79.9	115.2	171.1	-63	170.6	0	0	0	108.4	N289	L258-N289 WeakPolarHBondContact CB-O 2.95Å; L258-N289 PolarHBondContact N-O 3.26Å
259	K	37.4	Very low	51.2	Low	175 Å²	175	102.3 Å²	102.3	76%	0.761	51%	0.512	S	S	*	.			trans	-90.4	124.5	165	-86.9	-178	176.6	175.3	0	109.1	L257 S261	L257-K259 PolarHBondContact O-N 2.79Å; K259-S261 PolarHBondContact O-N 3.04Å
260	E	34.2	Very low	48.8	Very low	163 Å²	163	103 Å²	103	76%	0.762	52%	0.522	S	S	*	.			trans	-67.6	114	163.8	-69.7	-176.9	155	0	0	109.1	K262	E260-K262 PolarHBondContact O-N 2.85Å
261	S	31.9	Very low	46.2	Very low	72 Å²	72	109.7 Å²	109.7	50%	0.503	55%	0.553	S	S	.	*			trans	-78.7	116.3	164.7	57.5	0	0	0	0	108.7	K259 D263	K259-S261 PolarHBondContact O-N 3.04Å; S261-D263 PolarHBondContact O-N 2.88Å
262	K	34.4	Very low	43.8	Very low	202 Å²	202	114.3 Å²	114.3	88%	0.878	58%	0.576	S	S	*	*			trans	-69.1	74.8	161.1	-70.9	-179.4	177.4	178.4	0	109	E260	E260-K262 PolarHBondContact O-N 2.85Å
263	D	37.5	Very low	41.7	Very low	139 Å²	139	118 Å²	118	74%	0.743	60%	0.598	S	S	*	*	S	Bend	trans	-149.7	129.6	162.7	-94	-34.2	0	0	0	109.7	S261 H265	S261-D263 PolarHBondContact O-N 2.88Å; D263-H265 PolarHBondContact O-N 2.84Å
264	N	32.8	Very low	39.5	Very low	157 Å²	157	123.1 Å²	123.1	84%	0.84	63%	0.631	S	S	*	*	S	Bend	trans	-53.3	131.2	179.7	-71.9	-41	0	0	0	110.2
265	H	42.2	Very low	37.7	Very low	177 Å²	177	126.9 Å²	126.9	82%	0.819	65%	0.648	S	S	*	*	S	Bend	trans	97.6	94.9	-172.2	-60.4	-68.5	0	0	0	114.8	D263 K267	D263-H265 PolarHBondContact O-N 2.84Å; H265-K267 PolarHBondContact O-N 3.02Å
266	N	30.5	Very low	35.8	Very low	179 Å²	179	126.7 Å²	126.7	96%	0.957	66%	0.66	S	S	*	*			trans	-29.4	91.9	168.3	-64.1	-12.5	0	0	0	113.9
267	K	31.2	Very low	34.6	Very low	165 Å²	165	134.1 Å²	134.1	72%	0.717	69%	0.694	S	S	*	*			trans	-145.8	99.4	165.9	-150.6	174.2	-175.7	-179.1	0	109.7	H265	H265-K267 PolarHBondContact O-N 3.02Å
268	L	31.5	Very low	33.6	Very low	131 Å²	131	138.2 Å²	138.2	69%	0.686	71%	0.713	S	S	*	*			trans	-70	128.9	171.3	-72.5	156.6	0	0	0	108.8
269	I	34.3	Very low	33	Very low	131 Å²	131	141.2 Å²	141.2	67%	0.672	73%	0.734	S	S	*	*			trans	-110.6	117.9	176	-60	175.9	0	0	0	107.9
270	C	32.1	Very low	32.4	Very low	86 Å²	86	138.3 Å²	138.3	58%	0.581	74%	0.735	S	S	*	*			trans	-83.5	135	175.6	-57.6	0	0	0	0	110.6
271	Q	31.8	Very low	32.1	Very low	142 Å²	142	136.9 Å²	136.9	66%	0.664	73%	0.733	S	S	*	*			trans	-128.4	125.1	165.1	-78.1	-175	-23.7	0	0	109.6
272	N	32.1	Very low	32	Very low	127 Å²	127	138.4 Å²	138.4	68%	0.679	74%	0.741	S	S	*	*			trans	-76.1	120.6	169.6	-74.8	-4	0	0	0	108.6
273	V	36.8	Very low	31.7	Very low	90 Å²	90	135 Å²	135	55%	0.545	73%	0.732	S	S	.	*			trans	-112.7	118.1	172.9	-176.9	0	0	0	0	109.1	N275	V273-N275 PolarHBondContact O-N 3.26Å; V273-N275 VanDerWaalsContact O-N 3.15Å
274	T	32.9	Very low	31.1	Very low	135 Å²	135	137.8 Å²	137.8	83%	0.828	73%	0.734	S	S	*	*			trans	-69.7	98.1	163.2	35.5	0	0	0	0	108.2	S276	T274-S276 VanDerWaalsContact C-N 3.33Å; T274-S276 PolarHBondContact O-N 3.38Å
275	N	34.5	Very low	30.9	Very low	107 Å²	107	139 Å²	139	57%	0.572	73%	0.732	S	S	*	*			trans	-66.9	89.7	176.9	-85.6	1	0	0	0	111	V273	V273-N275 PolarHBondContact O-N 3.26Å; V273-N275 VanDerWaalsContact O-N 3.15Å
276	S	28	Very low	30.3	Very low	96 Å²	96	135.5 Å²	135.5	67%	0.671	72%	0.723	S	S	*	*			trans	-96.7	135.3	141.7	70.5	0	0	0	0	106.8	T274	T274-S276 VanDerWaalsContact C-N 3.33Å; T274-S276 PolarHBondContact O-N 3.38Å
277	Q	28.2	Very low	30.4	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	71%	0.712	S	S	*	*			trans	92.9	102.3	-176.1	-53.8	176.8	-11	0	0	115.7
278	M	29	Very low	30.9	Very low	186 Å²	186	133.6 Å²	133.6	92%	0.916	72%	0.715	S	S	*	*			trans	-174.9	99.3	133	-101.6	-173.6	165.9	0	0	106.1
279	V	29.2	Very low	31.2	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	70%	0.703	S	S	*	*				49.4	107	79.4	-172.9	0	0	0	0	111.2	N281	V279-N281 PolarHBondContact O-N 3.2Å
280	S	26.3	Very low	31.7	Very low	114 Å²	114	126.6 Å²	126.6	80%	0.797	68%	0.683	S	S	*	*			trans	-46.7	116.7	176.4	49.1	0	0	0	0	114.1
281	N	27.6	Very low	32.7	Very low	132 Å²	132	125.2 Å²	125.2	71%	0.706	67%	0.674	S	S	*	*			trans	-154.9	121	149.4	-138.9	-2.7	0	0	0	110.5	V279 N283	V279-N281 PolarHBondContact O-N 3.2Å; N281-N283 PolarHBondContact O-N 3.3Å; N281-N283 VanDerWaalsContact O-N 3.17Å
282	P	28.7	Very low	34.1	Very low	105 Å²	105	119.5 Å²	119.5	68%	0.682	65%	0.647	S	S	*	*			trans	-88.1	82.2	-179.9	34.9	-29	0	0	0	109.1
283	N	28.1	Very low	35.8	Very low	130 Å²	130	115.6 Å²	115.6	70%	0.695	63%	0.628	S	S	*	*			trans	-110.3	100	167.4	-79.5	-18.9	0	0	0	109.7	N281 F285	N281-N283 PolarHBondContact O-N 3.3Å; N281-N283 VanDerWaalsContact O-N 3.17Å; N283-F285 VanDerWaalsContact C-N 3.29Å; N283-F285 PolarHBondContact O-N 2.89Å
284	Y	26.5	Very low	37.6	Very low	198 Å²	198	114 Å²	114	78%	0.776	61%	0.614	S	S	*	*			trans	-69.2	73.3	168.3	-85.6	-97.2	0	0	0	110.7
285	F	28.6	Very low	39.7	Very low	181 Å²	181	111.2 Å²	111.2	79%	0.794	59%	0.592	S	S	*	*			trans	-152.4	105.7	168.4	-79.5	-73.9	0	0	0	111.7	N283	N283-F285 VanDerWaalsContact C-N 3.29Å; N283-F285 PolarHBondContact O-N 2.89Å
286	T	28.1	Very low	41.9	Very low	105 Å²	105	109.5 Å²	109.5	64%	0.644	59%	0.585	S	S	*	*			trans	37.6	86.5	150	58.4	0	0	0	0	118.4	Q288	T286-Q288 VanDerWaalsContact C-N 3.26Å; T286-Q288 PolarHBondContact O-N 2.98Å; T286-Q288 VanDerWaalsContact O-N 3.1Å
287	D	33.6	Very low	44.4	Very low	134 Å²	134	107.9 Å²	107.9	72%	0.717	57%	0.567	S	S	*	*			trans	-79.7	78	155.7	-84.9	-25.8	0	0	0	109	N289	D287-N289 PolarHBondContact O-N 2.88Å; D287-N289 VanDerWaalsContact O-N 3.1Å
288	Q	41.5	Very low	47	Very low	169 Å²	169	101.4 Å²	101.4	79%	0.79	54%	0.543	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	0.6	179.9	-88.8	178.8	-17.4	0	0	114.7	T286	T286-Q288 VanDerWaalsContact C-N 3.26Å; T286-Q288 PolarHBondContact O-N 2.98Å; T286-Q288 VanDerWaalsContact O-N 3.1Å
289	N	37.9	Very low	49.7	Very low	79 Å²	79	93.5 Å²	93.5	42%	0.422	51%	0.505	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	26.3	-174.5	-73.5	-5.7	0	0	0	114.1	L258 D287	L258-N289 WeakPolarHBondContact CB-O 2.95Å; L258-N289 PolarHBondContact N-O 3.26Å; D287-N289 PolarHBondContact O-N 2.88Å; D287-N289 VanDerWaalsContact O-N 3.1Å
290	C	44.9	Very low	52.3	Low	36 Å²	36	88.1 Å²	88.1	24%	0.243	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	116.2	176.3	-167.7	0	0	0	0	111.3	I256	I256-C290 WeakPolarHBondContact O-CA 3.37Å; I256-C290 PolarHBondContact O-SG 3.36Å
291	S	51.9	Low	54.9	Low	58 Å²	58	86.5 Å²	86.5	41%	0.406	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	140.4	167.4	-177	0	0	0	0	109	I256	I256-S291 WeakPolarHBondContact CA-O 2.98Å; I256-S291 WeakPolarHBondContact CB-O 3.44Å; I256-S291 PolarHBondContact N-O 2.81Å; I256-S291 PolarHBondContact O-N 3.19Å
292	Q	62.3	Low	57.1	Low	22 Å²	22	86.8 Å²	86.8	10%	0.103	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	140.1	177	-64.5	-167.7	-22.9	0	0	110.8	Q253	Q253-Q292 VanDerWaalsContact NE2-NE2 3.16Å
293	T	67.8	Low	58.6	Low	45 Å²	45	90 Å²	90	28%	0.276	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	140.1	171.7	41.4	0	0	0	0	109.4	S254 I256	S254-T293 PolarHBondContact N-O 2.94Å; S254-T293 PolarHBondContact O-N 2.81Å; S254-T293 PolarHBondContact OG-O 3.1Å; S254-T293 PolarHBondContact OG-OG1 3.2Å; I256-T293 HydrophobicContact CD1-CG2 3.51Å; I256-T293 WeakPolarHBondContact CD1-OG1 3.46Å; I256-T293 HydrophobicContact CG1-CG2 4.41Å
294	F	75	Confident	59.7	Low	55 Å²	55	87.2 Å²	87.2	24%	0.241	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	122.1	171.5	-69.8	-80.7	0	0	0	107.7	F136 S144 S252 Q253	F136-F294 HydrophobicContact CD1-CE1 4.32Å; F136-F294 HydrophobicContact CE1-CE1 4.38Å; S144-F294 VanDerWaalsContact CB-CZ 3.46Å; S252-F294 WeakPolarHBondContact O-CA 3.3Å; Q253-F294 HydrophobicContact CB-CD1 4.17Å; Q253-F294 HydrophobicContact CB-CE1 3.88Å; Q253-F294 HydrophobicContact CG-CD1 4.29Å; Q253-F294 HydrophobicContact CG-CE1 3.74Å; Q253-F294 HydrophobicContact CG-CZ 4.07Å
295	E	76.5	Confident	60.5	Low	78 Å²	78	89.1 Å²	89.1	36%	0.364	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	139.4	178.4	-70.6	168	-138.5	0	0	108	C251 S252 S254	C251-E295 CarbonylContact C-O 3.56Å; C251-E295 WeakPolarHBondContact CA-O 3.19Å; S252-E295 PolarHBondContact N-O 2.81Å; S252-E295 PolarHBondContact O-N 3.49Å; S254-E295 PolarHBondContact OG-OE1 2.8Å
296	T	80	Confident	61.3	Low	70 Å²	70	83.6 Å²	83.6	43%	0.429	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	133	171.8	-40.5	0	0	0	0	107.5	L249 F309	L249-T296 HydrophobicContact CB-CG2 4.47Å; T296-F309 VanDerWaalsContact C-CE1 3.43Å; T296-F309 VanDerWaalsContact C-CZ 3.47Å; T296-F309 VanDerWaalsContact CB-CD1 3.42Å; T296-F309 HydrophobicContact CG2-CD1 3.27Å; T296-F309 HydrophobicContact CG2-CE1 3.14Å; T296-F309 HydrophobicContact CG2-CG 4.48Å; T296-F309 HydrophobicContact CG2-CZ 4.23Å; T296-F309 WeakPolarHBondContact O-CE1 3.31Å; T296-F309 WeakPolarHBondContact O-CZ 3.45Å
297	E	81.1	Confident	61.5	Low	62 Å²	62	84.5 Å²	84.5	29%	0.29	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	-174.4	-180	-64.5	-178	-150	0	0	108.1	K117 L249 V250 S252	K117-E297 WeakPolarHBondContact CD-OE2 3.34Å; K117-E297 WeakPolarHBondContact CE-OE2 3.46Å; K117-E297 IonicContact NZ-OE1 3.27Å; K117-E297 PolarHBondContact NZ-OE1 3.27Å; K117-E297 IonicContact NZ-OE2 3.38Å; K117-E297 PolarHBondContact NZ-OE2 2.79Å; L249-E297 CarbonylContact C-O 3.21Å; L249-E297 WeakPolarHBondContact CA-O 3.39Å; V250-E297 PolarHBondContact N-O 3.12Å; V250-E297 PolarHBondContact O-N 3.41Å; S252-E297 PolarHBondContact OG-OE1 3.35Å
298	A	82.9	Confident	61.5	Low	41 Å²	41	80.5 Å²	80.5	34%	0.339	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	149.6	175.7	0	0	0	0	0	111.5	H248 L249 L306	H248-A298 CarbonylContact O-C 3.51Å; H248-A298 VanDerWaalsContact O-CA 3.24Å; H248-A298 WeakPolarHBondContact O-CA 2.91Å; L249-A298 HydrophobicContact CD2-CB 4.05Å; A298-L306 HydrophobicContact CB-CB 4.04Å; A298-L306 HydrophobicContact CB-CD1 3.36Å; A298-L306 HydrophobicContact CB-CG 4.36Å
299	I	85.5	Confident	60.8	Low	20 Å²	20	78.2 Å²	78.2	10%	0.103	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	150.4	170.7	61.4	174.2	0	0	0	108.9	L113 K117 Y122 P123 S247 H248 V250 L306	L113-I299 HydrophobicContact CB-CD1 4.44Å; L113-I299 HydrophobicContact CD2-CD1 3.87Å; K117-I299 HydrophobicContact CB-CG2 3.69Å; K117-I299 HydrophobicContact CG-CG2 4.05Å; Y122-I299 HydrophobicContact CD2-CB 4.31Å; Y122-I299 HydrophobicContact CD2-CD1 3.97Å; Y122-I299 HydrophobicContact CD2-CG1 3.9Å; Y122-I299 HydrophobicContact CE2-CD1 4.31Å; Y122-I299 HydrophobicContact CE2-CG1 4.01Å; P123-I299 WeakPolarHBondContact O-CD1 3.48Å; S247-I299 CarbonylContact C-O 3.56Å; S247-I299 VanDerWaalsContact CA-O 3.22Å; S247-I299 WeakPolarHBondContact CA-O 3.24Å; S247-I299 WeakPolarHBondContact CB-O 3.24Å; H248-I299 HydrophobicContact CB-CG1 4.37Å; H248-I299 PolarHBondContact N-O 2.8Å; H248-I299 PolarHBondContact O-N 2.88Å; V250-I299 HydrophobicContact CG2-CB 4.23Å; V250-I299 HydrophobicContact CG2-CD1 4.05Å; V250-I299 HydrophobicContact CG2-CG1 3.7Å; V250-I299 HydrophobicContact CG2-CG2 3.79Å; I299-L306 WeakPolarHBondContact O-CD1 3.32Å
300	S	83.9	Confident	60.6	Low	17 Å²	17	77.8 Å²	77.8	12%	0.119	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	151.5	-175.6	-163.3	0	0	0	0	110.5	Y122 D246 E302	Y122-S300 VanDerWaalsContact CD2-C 3.49Å; D246-S300 CarbonylContact O-C 3.53Å; D246-S300 VanDerWaalsContact O-CA 3.32Å; D246-S300 WeakPolarHBondContact O-CA 3.22Å; D246-S300 PolarHBondContact O-OG 2.93Å; S300-E302 WeakPolarHBondContact CB-O 3.43Å; S300-E302 PolarHBondContact OG-O 3.13Å
301	I	80.8	Confident	59.9	Low	80 Å²	80	82.3 Å²	82.3	41%	0.41	42%	0.415	S	S	.	.	S	Bend	trans	-61.9	-51.1	172.2	-64.8	176	0	0	0	109.7	Y122 D246	Y122-I301 HydrophobicContact CD1-CB 4.33Å; Y122-I301 HydrophobicContact CD1-CD1 4.14Å; Y122-I301 HydrophobicContact CD1-CG1 3.25Å; Y122-I301 HydrophobicContact CD2-CG1 4.37Å; Y122-I301 HydrophobicContact CE1-CB 4.47Å; Y122-I301 HydrophobicContact CE1-CD1 3.68Å; Y122-I301 HydrophobicContact CE1-CG1 3.12Å; Y122-I301 HydrophobicContact CE2-CG1 4.28Å; Y122-I301 HydrophobicContact CG-CG1 3.88Å; D246-I301 HydrophobicContact CB-CD1 4.49Å; D246-I301 PolarHBondContact O-N 2.64Å
302	E	73.2	Confident	59	Low	138 Å²	138	86.3 Å²	86.3	65%	0.645	43%	0.426	S	S	*	.	S	Bend	trans	-105.5	136.4	173.8	-59	-176.2	169.5	0	0	106.1	S300 T304	S300-E302 WeakPolarHBondContact CB-O 3.43Å; S300-E302 PolarHBondContact OG-O 3.13Å; E302-T304 HydrophobicContact CB-CG2 3.91Å; E302-T304 PolarHBondContact O-N 3.07Å; E302-T304 PolarHBondContact O-OG1 2.62Å; E302-T304 VanDerWaalsContact O-OG1 3.13Å
303	N	60.5	Low	57.5	Low	173 Å²	173	91.4 Å²	91.4	93%	0.925	45%	0.453	S	S	*	.			trans	-65.4	34.6	179.5	-83.7	-27.6	0	0	0	114
304	T	51.1	Low	55.7	Low	71 Å²	71	91.9 Å²	91.9	44%	0.436	47%	0.466	S	S	.	.			trans	-66.9	145.9	172.6	54.3	0	0	0	0	109.8	E302 L306	E302-T304 HydrophobicContact CB-CG2 3.91Å; E302-T304 PolarHBondContact O-N 3.07Å; E302-T304 PolarHBondContact O-OG1 2.62Å; E302-T304 VanDerWaalsContact O-OG1 3.13Å; T304-L306 PolarHBondContact O-N 2.69Å; T304-L306 VanDerWaalsContact O-N 3.07Å
305	R	43.4	Very low	53.5	Low	238 Å²	238	100.6 Å²	100.6	90%	0.898	50%	0.499	S	S	*	.			trans	-64	111.2	-175.1	-79.8	-179.7	160	-173.2	-5.5	110.4
306	L	45.5	Very low	51.4	Low	65 Å²	65	100.9 Å²	100.9	34%	0.34	52%	0.515	S	S	.	.			trans	-83.5	132.7	168.8	-60.4	176.1	0	0	0	110.4	S247 A298 I299 T304	S247-L306 WeakPolarHBondContact OG-CD2 3.21Å; A298-L306 HydrophobicContact CB-CB 4.04Å; A298-L306 HydrophobicContact CB-CD1 3.36Å; A298-L306 HydrophobicContact CB-CG 4.36Å; I299-L306 WeakPolarHBondContact O-CD1 3.32Å; T304-L306 PolarHBondContact O-N 2.69Å; T304-L306 VanDerWaalsContact O-N 3.07Å
307	K	33.3	Very low	48.8	Very low	123 Å²	123	104.5 Å²	104.5	54%	0.535	53%	0.525	S	S	.	.			trans	-118.3	143.4	171.7	-68.6	176.5	174.3	177.2	0	107.2	E205	E205-K307 VanDerWaalsContact CD-NZ 3.31Å; E205-K307 IonicContact OE1-NZ 3.59Å; E205-K307 PolarHBondContact OE1-NZ 3.1Å; E205-K307 VanDerWaalsContact OE1-NZ 3.1Å; E205-K307 IonicContact OE2-NZ 3.61Å; E205-K307 PolarHBondContact OE2-NZ 3.15Å
308	V	33.1	Very low	46.4	Very low	50 Å²	50	106.5 Å²	106.5	30%	0.303	54%	0.537	S	S	.	.			trans	106.2	127	157.1	-167	0	0	0	0	116.9	L186 V188 V207 I310	L186-V308 HydrophobicContact CD2-CB 4.27Å; L186-V308 HydrophobicContact CD2-CG1 3.89Å; V188-V308 HydrophobicContact CG2-CG2 4.38Å; V207-V308 HydrophobicContact CG1-CG1 4.16Å; V207-V308 HydrophobicContact CG1-CG2 4.34Å; V207-V308 HydrophobicContact CG2-CG1 4.44Å; V207-V308 HydrophobicContact CG2-CG2 3.72Å; V308-I310 HydrophobicContact CG1-CD1 4.06Å; V308-I310 HydrophobicContact CG1-CG1 3.83Å
309	F	25.9	Very low	43.6	Very low	121 Å²	121	108 Å²	108	53%	0.531	54%	0.541	S	S	.	.			trans	-111.4	137	162.4	-62.9	-60.1	0	0	0	109.1	L249 T296	L249-F309 HydrophobicContact CD2-CD1 4.11Å; L249-F309 HydrophobicContact CD2-CE1 4.03Å; T296-F309 VanDerWaalsContact C-CE1 3.43Å; T296-F309 VanDerWaalsContact C-CZ 3.47Å; T296-F309 VanDerWaalsContact CB-CD1 3.42Å; T296-F309 HydrophobicContact CG2-CD1 3.27Å; T296-F309 HydrophobicContact CG2-CE1 3.14Å; T296-F309 HydrophobicContact CG2-CG 4.48Å; T296-F309 HydrophobicContact CG2-CZ 4.23Å; T296-F309 WeakPolarHBondContact O-CE1 3.31Å; T296-F309 WeakPolarHBondContact O-CZ 3.45Å
310	I	33.5	Very low	41	Very low	70 Å²	70	110.1 Å²	110.1	36%	0.359	55%	0.553	S	S	.	*			trans	-136	130.7	166.9	-61.8	173.9	0	0	0	109.5	L186 V207 V209 V308 F312	L186-I310 HydrophobicContact CD2-CD1 3.92Å; L186-I310 HydrophobicContact CD2-CG1 4.16Å; V207-I310 HydrophobicContact CG1-CD1 4.14Å; V209-I310 HydrophobicContact CG2-CD1 3.35Å; V308-I310 HydrophobicContact CG1-CD1 4.06Å; V308-I310 HydrophobicContact CG1-CG1 3.83Å; I310-F312 HydrophobicContact CG2-CD2 4.07Å; I310-F312 HydrophobicContact CG2-CE2 3.78Å; I310-F312 HydrophobicContact CG2-CZ 4.14Å
311	I	30.7	Very low	38.1	Very low	131 Å²	131	114.6 Å²	114.6	67%	0.672	58%	0.575	S	S	*	*			trans	-109.7	127.7	166.7	-62.5	173.9	0	0	0	106.1	I313	I311-I313 HydrophobicContact CG2-CG1 4.2Å
312	F	33.8	Very low	35.5	Very low	143 Å²	143	113.4 Å²	113.4	63%	0.627	57%	0.573	S	S	*	*			trans	-90.1	120.6	168.9	-74.1	-87.6	0	0	0	109.8	V209 I310	V209-F312 HydrophobicContact CB-CE2 4.41Å; V209-F312 HydrophobicContact CB-CZ 4.03Å; V209-F312 HydrophobicContact CG1-CE2 3.99Å; V209-F312 HydrophobicContact CG1-CZ 4.04Å; V209-F312 HydrophobicContact CG2-CE2 4.35Å; V209-F312 HydrophobicContact CG2-CZ 4.07Å; I310-F312 HydrophobicContact CG2-CD2 4.07Å; I310-F312 HydrophobicContact CG2-CE2 3.78Å; I310-F312 HydrophobicContact CG2-CZ 4.14Å
313	I	31	Very low	33.3	Very low	129 Å²	129	110 Å²	110	66%	0.662	56%	0.563	S	S	*	*			trans	-114.1	114	160.8	-60.6	175.1	0	0	0	105	I311	I311-I313 HydrophobicContact CG2-CG1 4.2Å
314	G	28.9	Very low	32.1	Very low	55 Å²	55	110.5 Å²	110.5	57%	0.567	56%	0.558	S	S	*	*			trans	-69.1	138.2	-165	0	0	0	0	0	115.1
315	Y	30.3	Very low	31	Very low	238 Å²	238	115 Å²	115	93%	0.933	57%	0.573	S	S	*	*			trans	-146.8	61.2	143.4	-72.4	-80.6	0	0	0	107.6
316	A	30.7	Very low	30.2	Very low	83 Å²	83	109.5 Å²	109.5	69%	0.686	57%	0.568	S	S	*	*			trans	-147.9	125.3	174.9	0	0	0	0	0	111	L318	A316-L318 PolarHBondContact O-N 3.37Å
317	K	27.1	Very low	29.1	Very low	147 Å²	147	111.4 Å²	111.4	64%	0.639	58%	0.583	S	S	*	*			trans	-67.6	112.6	170.2	-173.9	173.5	-178.8	174.4	0	107.8	T319 F330	K317-T319 PolarHBondContact O-N 3.01Å; K317-F330 WeakPolarHBondContact CE-O 2.97Å; K317-F330 PolarHBondContact NZ-O 2.78Å; K317-F330 PolarHBondContact NZ-OXT 2.87Å
318	L	29.6	Very low	28.7	Very low	104 Å²	104	115.1 Å²	115.1	55%	0.545	60%	0.595	S	S	.	*			trans	-86.8	94.9	176.6	-139.9	139.1	0	0	0	107.2	A316 I320	A316-L318 PolarHBondContact O-N 3.37Å; L318-I320 HydrophobicContact CD2-CD1 4.42Å; L318-I320 HydrophobicContact CD2-CG1 3.9Å; L318-I320 PolarHBondContact O-N 3.12Å
319	T	24.6	Very low	28.1	Very low	71 Å²	71	121.8 Å²	121.8	44%	0.436	62%	0.623	S	S	.	*			trans	-79.9	106.5	174.9	-38.8	0	0	0	0	107.9	K317 D321	K317-T319 PolarHBondContact O-N 3.01Å; T319-D321 PolarHBondContact O-N 2.95Å
320	I	29.5	Very low	28	Very low	66 Å²	66	126.5 Å²	126.5	34%	0.338	64%	0.643	S	S	.	*			trans	-88.4	92.7	173.2	-56.6	174.3	0	0	0	107.1	V221 L225 L318 C322	V221-I320 HydrophobicContact CG1-CD1 3.9Å; L225-I320 HydrophobicContact CD1-CD1 4.35Å; L318-I320 HydrophobicContact CD2-CD1 4.42Å; L318-I320 HydrophobicContact CD2-CG1 3.9Å; L318-I320 PolarHBondContact O-N 3.12Å; I320-C322 PolarHBondContact O-N 2.96Å; I320-C322 VanDerWaalsContact O-N 3.13Å
321	D	24.5	Very low	27.7	Very low	111 Å²	111	129.3 Å²	129.3	59%	0.594	66%	0.657	S	S	*	*			trans	-74.5	97.9	169.1	-81.3	-31.3	0	0	0	108.8	I8 T319	I8-D321 HydrophobicContact CD1-CB 4.07Å; T319-D321 PolarHBondContact O-N 2.95Å
322	C	24.6	Very low	27.6	Very low	55 Å²	55	129.2 Å²	129.2	37%	0.372	66%	0.657	S	S	.	*			trans	-78.3	123.8	167.7	-77.9	0	0	0	0	109.2	I320 F324	I320-C322 PolarHBondContact O-N 2.96Å; I320-C322 VanDerWaalsContact O-N 3.13Å; C322-F324 PolarHBondContact O-N 3.13Å
323	P	28.2	Very low	27.2	Very low	67 Å²	67	128.4 Å²	128.4	44%	0.435	66%	0.658	S	S	.	*	S	Bend	trans	-80.3	40.2	-177.4	34.1	-35.3	0	0	0	112.3
324	F	34.5	Very low	27	Very low	183 Å²	183	128.4 Å²	128.4	80%	0.803	66%	0.658	S	S	*	*	S	Bend	trans	-153.5	48	175.2	-77.7	-74.7	0	0	0	112.9	C322	C322-F324 PolarHBondContact O-N 3.13Å
325	H	28.3	Very low	26.9	Very low	166 Å²	166	133 Å²	133	77%	0.769	66%	0.664	S	S	*	*			trans	-178.7	126.3	145.4	-115	-79.2	0	0	0	109.9	T327	H325-T327 PolarHBondContact O-N 3.21Å
326	P	26	Very low	26.6	Very low	122 Å²	122	126 Å²	126	79%	0.792	65%	0.646	S	S	*	*			trans	-89.6	87.4	178.8	34	-28.1	0	0	0	108.9
327	T	23.6	Very low	26.4	Very low	104 Å²	104	129.1 Å²	129.1	64%	0.638	64%	0.643	S	S	*	*			trans	-173.9	144.4	157.1	3.9	0	0	0	0	111.9	H325	H325-T327 PolarHBondContact O-N 3.21Å
328	Y	24.7	Very low	26.3	Very low	201 Å²	201	127.7 Å²	127.7	79%	0.788	64%	0.643	S	S	*	*			trans	95.6	94.4	176.7	-51.3	-68.2	0	0	0	116.8
329	Q	19.7	Very low	26	Very low	191 Å²	191	129.7 Å²	129.7	89%	0.893	65%	0.651	S	S	*	*			trans	-75.1	128.7	154.4	-74.6	176.2	-38.7	0	0	109.1
330	F	24.2	Very low	26.2	Very low	219 Å²	219	135 Å²	135	96%	0.961	67%	0.671	S	S	*	*			trans	-140.4	0	154.4	-79.4	-73.6	0	0	0	110.3	K317	K317-F330 WeakPolarHBondContact CE-O 2.97Å; K317-F330 PolarHBondContact NZ-O 2.78Å; K317-F330 PolarHBondContact NZ-OXT 2.87Å

Retrieved 330 of 330 residues in 701.2 ms (Link to these results)

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