X6RCW6_HUMAN Loading...

N-terminal EF-hand calcium binding protein 3

AlphaFold DB , UniProt , Accession X6RCW6, Species HUMAN (Homo sapiens, Human), Gene NECAB3, Length 289 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	49.2	Very low	53.7	Low	169 Å²	169	38.3 Å²	38.3	83%	0.833	23%	0.228	S	C	*	.				0	120.8	0	-67.2	-91.5	-90.9	0	0	107.5	C3 E254	M1-C3 PolarHBondContact O-N 3.19Å; M1-E254 PolarHBondContact N-OE1 2.96Å; M1-E254 WeakPolarHBondContact O-CG 3.35Å
2	A	52.3	Low	53.2	Low	47 Å²	47	39 Å²	39	39%	0.388	23%	0.229	S	C	.	.			trans	-80.2	114.8	-173.5	0	0	0	0	0	110.2	V252	A2-V252 CarbonylContact C-O 3.58Å; A2-V252 WeakPolarHBondContact CA-O 3.47Å
3	C	53.3	Low	52.9	Low	23 Å²	23	45.8 Å²	45.8	16%	0.155	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	130.8	-179.8	-69.5	0	0	0	0	110.8	M1 V252 L257	M1-C3 PolarHBondContact O-N 3.19Å; C3-V252 PolarHBondContact N-O 2.67Å; C3-V252 VanDerWaalsContact N-O 3.13Å; C3-V252 PolarHBondContact O-N 3.2Å; C3-L257 HydrophobicContact CB-CD1 4Å
4	A	52.6	Low	52.5	Low	21 Å²	21	48.5 Å²	48.5	17%	0.174	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	131.9	169.6	0	0	0	0	0	111.7	V250 M285	A4-V250 CarbonylContact C-O 3.55Å; A4-V250 WeakPolarHBondContact CA-O 3.48Å; A4-M285 HydrophobicContact CB-CB 3.98Å; A4-M285 WeakPolarHBondContact O-CA 3.2Å; A4-M285 VanDerWaalsContact O-CB 3.3Å; A4-M285 WeakPolarHBondContact O-CB 3.38Å; A4-M285 PolarHBondContact O-N 2.72Å
5	G	51.3	Low	51.7	Low	11 Å²	11	54 Å²	54	11%	0.113	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	138.7	171.1	0	0	0	0	0	111.1	Q249 V250	G5-Q249 CarbonylContact O-C 3.55Å; G5-Q249 VanDerWaalsContact O-CA 3.31Å; G5-Q249 WeakPolarHBondContact O-CA 3.39Å; G5-V250 PolarHBondContact N-O 3.1Å; G5-V250 PolarHBondContact O-N 2.97Å
6	L	49	Very low	51	Low	20 Å²	20	54.2 Å²	54.2	11%	0.105	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	124.7	171.8	-173	73.9	0	0	0	109.5	Q247 Q249 A282 Q283 M285	L6-Q247 HydrophobicContact CD1-CG 3.66Å; L6-Q247 HydrophobicContact CG-CG 4.34Å; L6-Q249 HydrophobicContact CD1-CG 3.57Å; L6-A282 CarbonylContact O-C 3.56Å; L6-A282 VanDerWaalsContact O-CA 3.31Å; L6-A282 WeakPolarHBondContact O-CA 3.38Å; L6-Q283 PolarHBondContact N-O 3.43Å; L6-Q283 PolarHBondContact O-N 3.44Å; L6-M285 HydrophobicContact CB-CG 4.02Å; L6-M285 HydrophobicContact CB-SD 4.12Å; L6-M285 HydrophobicContact CD2-SD 4.48Å
7	L	60.9	Low	50.5	Low	25 Å²	25	58.1 Å²	58.1	13%	0.131	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	125	171.9	-178.9	107.3	0	0	0	108.8	V9 Q247 R248 L264 Y267 V268	L7-V9 HydrophobicContact CD2-CG2 3.59Å; L7-V9 HydrophobicContact CG-CG2 4Å; L7-Q247 CarbonylContact O-C 3.55Å; L7-Q247 WeakPolarHBondContact O-CA 3.4Å; L7-R248 PolarHBondContact N-O 3.27Å; L7-R248 PolarHBondContact O-N 2.99Å; L7-L264 HydrophobicContact CD1-CD1 3.47Å; L7-L264 VanDerWaalsContact CD1-CD1 3.47Å; L7-Y267 HydrophobicContact CD1-CD1 3.73Å; L7-Y267 HydrophobicContact CD1-CE1 3.74Å; L7-Y267 HydrophobicContact CD2-CD1 4.45Å; L7-Y267 HydrophobicContact CD2-CE1 3.71Å; L7-Y267 HydrophobicContact CG-CE1 4.29Å; L7-V268 HydrophobicContact CD1-CG2 4.32Å
8	T	50.5	Low	49.7	Very low	23 Å²	23	65.3 Å²	65.3	14%	0.141	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	127.4	173.2	-56.6	0	0	0	0	109.3	A246 V280 S281	T8-A246 CarbonylContact C-O 3.57Å; T8-A246 WeakPolarHBondContact CA-O 3.49Å; T8-V280 WeakPolarHBondContact O-CA 3.5Å; T8-S281 PolarHBondContact N-O 3.37Å; T8-S281 PolarHBondContact O-N 3.28Å
9	V	60.8	Low	48.9	Very low	6 Å²	6	67.7 Å²	67.7	4%	0.036	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	126.7	-179.8	-173.3	0	0	0	0	108.9	L7 L11 A246 Y267 V280	L7-V9 HydrophobicContact CD2-CG2 3.59Å; L7-V9 HydrophobicContact CG-CG2 4Å; V9-L11 HydrophobicContact CG1-CD1 4.23Å; V9-L11 HydrophobicContact CG1-CD2 3.63Å; V9-L11 HydrophobicContact CG1-CG 3.73Å; V9-A246 PolarHBondContact N-O 3.3Å; V9-A246 PolarHBondContact O-N 3.19Å; V9-Y267 HydrophobicContact CG2-CE1 4.07Å; V9-V280 HydrophobicContact CB-CG2 4.47Å; V9-V280 HydrophobicContact CG1-CG2 3.89Å; V9-V280 HydrophobicContact CG2-CG1 4.2Å; V9-V280 HydrophobicContact CG2-CG2 4.35Å
10	C	51.8	Low	48.3	Very low	20 Å²	20	73 Å²	73	14%	0.135	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.6	174.2	-57.1	0	0	0	0	108.8	L244 L278 H279	C10-L244 CarbonylContact C-O 3.57Å; C10-L244 VanDerWaalsContact CA-O 3.31Å; C10-L244 WeakPolarHBondContact CA-O 3.37Å; C10-L278 HydrophobicContact CB-CB 4.11Å; C10-L278 PolarHBondContact O-N 3.03Å; C10-H279 HydrophobicContact CB-CB 4.03Å; C10-H279 PolarHBondContact N-O 3.04Å; C10-H279 PolarHBondContact O-N 3.45Å
11	L	58.6	Low	47.6	Very low	56 Å²	56	75.8 Å²	75.8	29%	0.293	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	140.6	-179.6	-55.8	177.8	0	0	0	110.9	V9 L244 H276 C277	V9-L11 HydrophobicContact CG1-CD1 4.23Å; V9-L11 HydrophobicContact CG1-CD2 3.63Å; V9-L11 HydrophobicContact CG1-CG 3.73Å; L11-L244 PolarHBondContact N-O 3.13Å; L11-L244 PolarHBondContact O-N 2.94Å; L11-H276 CarbonylContact C-O 3.47Å; L11-H276 VanDerWaalsContact CA-O 3.3Å; L11-H276 WeakPolarHBondContact CA-O 3.38Å; L11-C277 HydrophobicContact CD2-CB 3.67Å
12	L	48.5	Very low	46.9	Very low	47 Å²	47	76.5 Å²	76.5	25%	0.246	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	128.7	157.1	-76.7	158.1	0	0	0	108.3	P14 K241 H276 L278	L12-P14 WeakPolarHBondContact O-CD 3.3Å; L12-K241 HydrophobicContact CD2-CB 4.02Å; L12-K241 HydrophobicContact CD2-CD 4.42Å; L12-K241 HydrophobicContact CD2-CG 4.21Å; L12-H276 HydrophobicContact CB-CB 4.28Å; L12-H276 PolarHBondContact N-O 2.99Å; L12-H276 WeakPolarHBondContact O-CB 3.44Å; L12-L278 HydrophobicContact CD1-CD2 3.45Å; L12-L278 VanDerWaalsContact CD1-CD2 3.45Å; L12-L278 HydrophobicContact CD1-CG 4.01Å; L12-L278 HydrophobicContact CD2-CD1 4.29Å; L12-L278 HydrophobicContact CD2-CD2 4.4Å; L12-L278 HydrophobicContact CG-CD1 3.93Å; L12-L278 HydrophobicContact CG-CD2 3.7Å; L12-L278 HydrophobicContact CG-CG 3.73Å
13	R	49.1	Very low	46.1	Very low	128 Å²	128	80.8 Å²	80.8	48%	0.483	46%	0.458	S	S	.	.	P	Polyproline II helix	trans	-70.5	124.2	171.6	-169.2	176.5	179.1	131.7	-1.3	109.3	H242 L244	R13-H242 HydrophobicContact CB-CB 4.44Å; R13-H242 PolarHBondContact N-O 3.01Å; R13-L244 HydrophobicContact CB-CD1 4.32Å
14	P	46.9	Very low	45.2	Very low	83 Å²	83	85.3 Å²	85.3	54%	0.539	49%	0.487	S	S	.	.	P	Polyproline II helix	trans	-64.2	151	166.8	24.5	-29.9	0	0	0	109.9	L12 A16	L12-P14 WeakPolarHBondContact O-CD 3.3Å; P14-A16 PolarHBondContact O-N 2.95Å
15	P	40.8	Very low	44.3	Very low	131 Å²	131	96.1 Å²	96.1	85%	0.851	52%	0.524	S	S	*	.			trans	-62.1	106.7	178.7	25.2	-31.7	0	0	0	108.6
16	A	41.2	Very low	43.3	Very low	57 Å²	57	104.1 Å²	104.1	47%	0.471	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-77.7	140.7	178	0	0	0	0	0	109.2	P14 Q18	P14-A16 PolarHBondContact O-N 2.95Å; A16-Q18 PolarHBondContact O-N 3.4Å
17	P	41.7	Very low	42.7	Very low	120 Å²	120	109.1 Å²	109.1	78%	0.779	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-57	136.5	159.9	-15.2	28.2	0	0	0	108.8	P19	P17-P19 WeakPolarHBondContact O-CD 3.44Å
18	Q	35.7	Very low	41.7	Very low	188 Å²	188	116.6 Å²	116.6	88%	0.879	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-48.8	125.1	-178.6	-67.8	-170.8	-8.7	0	0	111.7	A16	A16-Q18 PolarHBondContact O-N 3.4Å
19	P	34.3	Very low	40.8	Very low	111 Å²	111	123.8 Å²	123.8	72%	0.721	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-76.7	130.9	168.2	-7.8	24.4	0	0	0	109.8	P17	P17-P19 WeakPolarHBondContact O-CD 3.44Å
20	Q	38.5	Very low	39.4	Very low	173 Å²	173	127.8 Å²	127.8	81%	0.808	70%	0.696	S	S	*	*	P	Polyproline II helix	trans	-54.4	144.8	163.6	-68.9	177.6	-30.2	0	0	110.4	Q22	Q20-Q22 PolarHBondContact O-N 3.42Å
21	P	33.7	Very low	38.9	Very low	133 Å²	133	132.4 Å²	132.4	86%	0.864	73%	0.726	S	S	*	*			trans	-68.1	109.2	-175.5	26.2	-32.2	0	0	0	110.5
22	Q	33.7	Very low	38	Very low	184 Å²	184	137.5 Å²	137.5	86%	0.86	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-89.3	126.6	163.5	-69.6	-172	-10.5	0	0	109	Q20	Q20-Q22 PolarHBondContact O-N 3.42Å
23	T	36.1	Very low	37.7	Very low	137 Å²	137	139.1 Å²	139.1	84%	0.84	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-54.3	126.8	175.5	8.2	0	0	0	0	111.8
24	P	33.3	Very low	37.6	Very low	118 Å²	118	135.7 Å²	135.7	77%	0.766	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-75.5	128.2	170.6	-10	26	0	0	0	110.3	H26	P24-H26 PolarHBondContact O-N 3.39Å
25	R	32.9	Very low	37.8	Very low	248 Å²	248	136.2 Å²	136.2	94%	0.936	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.4	127	163.2	-91	-172.9	166.1	162.5	-2.9	109.5
26	H	30.8	Very low	38.3	Very low	179 Å²	179	133 Å²	133	83%	0.829	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-55.5	140.3	173.4	-76.2	-87.2	0	0	0	113.3	P24	P24-H26 PolarHBondContact O-N 3.39Å
27	P	35.9	Very low	38.8	Very low	124 Å²	124	130.6 Å²	130.6	81%	0.805	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-81	121.2	144.8	3.9	15.1	0	0	0	108.8
28	Q	41.1	Very low	39.5	Very low	182 Å²	182	127.4 Å²	127.4	85%	0.85	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-71.1	126.8	165.4	-79.4	179	-81.1	0	0	109.7
29	L	31.6	Very low	40.8	Very low	175 Å²	175	121.5 Å²	121.5	92%	0.916	69%	0.691	S	S	*	*				-179.4	141.5	126.8	-108.8	134.9	0	0	0	112.8
30	A	31.2	Very low	42.2	Very low	90 Å²	90	117.8 Å²	117.8	74%	0.744	67%	0.665	S	S	*	*	S	Bend	trans	94.8	146.2	166.6	0	0	0	0	0	117.6
31	P	41.4	Very low	43.5	Very low	117 Å²	117	110.2 Å²	110.2	76%	0.76	63%	0.629	S	S	*	*			trans	-83	155.7	-135	33.8	-35.3	0	0	0	113.7	P33	P31-P33 WeakPolarHBondContact O-CD 3.46Å
32	D	39.7	Very low	45.1	Very low	163 Å²	163	109 Å²	109	87%	0.872	61%	0.612	S	S	*	*			trans	-38.2	115.2	177.4	-91.3	-32.6	0	0	0	112.5
33	P	41.3	Very low	46.8	Very low	80 Å²	80	102.5 Å²	102.5	52%	0.519	58%	0.583	S	S	.	*			trans	-75.1	137.4	154.8	29.9	-21.8	0	0	0	107	P31	P31-P33 WeakPolarHBondContact O-CD 3.46Å
34	G	48	Very low	48.5	Very low	57 Å²	57	97.3 Å²	97.3	59%	0.588	55%	0.551	S	S	*	*	S	Bend	trans	-49.2	164.6	168.8	0	0	0	0	0	112	A36	G34-A36 PolarHBondContact O-N 2.94Å
35	P	50.3	Low	50.3	Low	94 Å²	94	92 Å²	92	61%	0.61	52%	0.516	S	S	*	.	S	Bend	trans	-49.2	111.1	-162.8	20.3	-32.2	0	0	0	111.4	G37 H38	P35-G37 PolarHBondContact O-N 3.03Å; P35-H38 VanDerWaalsContact CB-CD2 3.46Å; P35-H38 WeakPolarHBondContact CB-CD2 3.33Å; P35-H38 WeakPolarHBondContact CG-CD2 3.19Å; P35-H38 WeakPolarHBondContact CG-NE2 3.31Å; P35-H38 PolarHBondContact O-CD2 2.91Å; P35-H38 VanDerWaalsContact O-CD2 3.22Å; P35-H38 PolarHBondContact O-N 3.45Å
36	A	51.6	Low	52.1	Low	64 Å²	64	87.9 Å²	87.9	53%	0.529	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	131.3	-177.5	0	0	0	0	0	109.7	G34	G34-A36 PolarHBondContact O-N 2.94Å
37	G	51.3	Low	54.3	Low	5 Å²	5	85.2 Å²	85.2	5%	0.052	48%	0.483	C	S	.	.	T	Hydrogen-bonded Turn	trans	113.5	-29	-176	0	0	0	0	0	114.2	P35 T39 L40 F41 E114	P35-G37 PolarHBondContact O-N 3.03Å; G37-T39 VanDerWaalsContact C-N 3.28Å; G37-T39 PolarHBondContact O-N 2.86Å; G37-L40 PolarHBondContact O-N 2.88Å; G37-L40 VanDerWaalsContact O-N 3.07Å; G37-F41 WeakPolarHBondContact O-CD2 3.32Å; G37-F41 PolarHBondContact O-N 2.84Å; G37-E114 WeakPolarHBondContact CA-OE2 3.31Å; G37-E114 PolarHBondContact N-OE2 3.46Å
38	H	57.9	Low	56.2	Low	54 Å²	54	79.4 Å²	79.4	25%	0.25	45%	0.446	C	S	.	.	H	α-helix	trans	-59.1	-35.5	-173.1	-84.1	-104.7	0	0	0	113.6	P35 F41 Q42	P35-H38 VanDerWaalsContact CB-CD2 3.46Å; P35-H38 WeakPolarHBondContact CB-CD2 3.33Å; P35-H38 WeakPolarHBondContact CG-CD2 3.19Å; P35-H38 WeakPolarHBondContact CG-NE2 3.31Å; P35-H38 PolarHBondContact O-CD2 2.91Å; P35-H38 VanDerWaalsContact O-CD2 3.22Å; P35-H38 PolarHBondContact O-N 3.45Å; H38-F41 PolarHBondContact O-N 2.79Å; H38-Q42 WeakPolarHBondContact O-CG 3.3Å; H38-Q42 PolarHBondContact O-N 3.27Å
39	T	62	Low	58	Low	64 Å²	64	71.4 Å²	71.4	39%	0.393	41%	0.409	S	S	.	.	H	α-helix	trans	-71	-33.5	179.7	60.9	0	0	0	0	112.4	G37 F41 Q42 D43 E114	G37-T39 VanDerWaalsContact C-N 3.28Å; G37-T39 PolarHBondContact O-N 2.86Å; T39-F41 VanDerWaalsContact C-N 3.32Å; T39-Q42 PolarHBondContact O-N 3.08Å; T39-D43 PolarHBondContact O-N 3.38Å; T39-D43 VanDerWaalsContact O-N 3.16Å; T39-E114 PolarHBondContact OG1-OE1 3.46Å
40	L	64.6	Low	60.2	Low	33 Å²	33	70.8 Å²	70.8	17%	0.173	40%	0.399	C	S	.	.	H	α-helix	trans	-71.7	-32.5	178.2	-143.9	106.2	0	0	0	110.9	G37 D43 V44 L110 L113 E114	G37-L40 PolarHBondContact O-N 2.88Å; G37-L40 VanDerWaalsContact O-N 3.07Å; L40-D43 WeakPolarHBondContact O-CB 3.45Å; L40-D43 PolarHBondContact O-N 3.34Å; L40-V44 WeakPolarHBondContact O-CG2 3.44Å; L40-V44 PolarHBondContact O-N 3.25Å; L40-V44 VanDerWaalsContact O-N 3.08Å; L40-L110 HydrophobicContact CD2-CB 4.3Å; L40-L110 HydrophobicContact CD2-CD2 3.71Å; L40-L110 HydrophobicContact CD2-CG 4.43Å; L40-L113 HydrophobicContact CD1-CB 4.43Å; L40-E114 HydrophobicContact CD1-CB 4.35Å
41	F	65.1	Low	62.5	Low	14 Å²	14	70.8 Å²	70.8	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-69.5	-43	173.1	-70.7	-66.6	0	0	0	112.1	G37 H38 T39 D43 V44 F45 F99 L103 L110	G37-F41 WeakPolarHBondContact O-CD2 3.32Å; G37-F41 PolarHBondContact O-N 2.84Å; H38-F41 PolarHBondContact O-N 2.79Å; T39-F41 VanDerWaalsContact C-N 3.32Å; F41-D43 PolarHBondContact O-N 3.02Å; F41-V44 WeakPolarHBondContact O-CA 3.3Å; F41-V44 WeakPolarHBondContact O-CB 3.38Å; F41-V44 PolarHBondContact O-N 2.86Å; F41-F45 HydrophobicContact CB-CD2 4.33Å; F41-F45 HydrophobicContact CB-CE2 3.69Å; F41-F45 HydrophobicContact CB-CZ 4.41Å; F41-F45 WeakPolarHBondContact O-CD2 3.44Å; F41-F45 WeakPolarHBondContact O-CE2 3.19Å; F41-F45 WeakPolarHBondContact O-CG 3.34Å; F41-F45 PolarHBondContact O-N 2.83Å; F41-F99 HydrophobicContact CD1-CB 4.36Å; F41-F99 HydrophobicContact CE1-CB 4.12Å; F41-L103 HydrophobicContact CE1-CD1 4.22Å; F41-L103 HydrophobicContact CE1-CD2 4.13Å; F41-L103 HydrophobicContact CE1-CG 4.46Å; F41-L103 HydrophobicContact CE2-CD1 3.56Å; F41-L103 HydrophobicContact CZ-CD1 3.2Å; F41-L103 HydrophobicContact CZ-CD2 3.61Å; F41-L103 HydrophobicContact CZ-CG 3.78Å; F41-L110 HydrophobicContact CE1-CD1 3.99Å; F41-L110 HydrophobicContact CE2-CD1 4.13Å; F41-L110 HydrophobicContact CZ-CD1 3.34Å
42	Q	67.1	Low	64.1	Low	107 Å²	107	71.2 Å²	71.2	50%	0.5	38%	0.382	S	S	.	.	H	α-helix	trans	-55.8	-33.6	171.4	-71.7	172.5	5	0	0	112.2	H38 T39 F45 R46	H38-Q42 WeakPolarHBondContact O-CG 3.3Å; H38-Q42 PolarHBondContact O-N 3.27Å; T39-Q42 PolarHBondContact O-N 3.08Å; Q42-F45 PolarHBondContact O-N 2.86Å; Q42-R46 PolarHBondContact O-N 2.6Å
43	D	69.1	Low	65.9	Low	48 Å²	48	67.3 Å²	67.3	26%	0.257	36%	0.361	S	S	.	.	H	α-helix	trans	-73	-34.2	174	-75.2	5.9	0	0	0	113.5	T39 L40 F41 F45 R46 R47	T39-D43 PolarHBondContact O-N 3.38Å; T39-D43 VanDerWaalsContact O-N 3.16Å; L40-D43 WeakPolarHBondContact O-CB 3.45Å; L40-D43 PolarHBondContact O-N 3.34Å; F41-D43 PolarHBondContact O-N 3.02Å; D43-F45 VanDerWaalsContact C-N 3.31Å; D43-R46 VanDerWaalsContact CG-NH2 3.3Å; D43-R46 IonicContact OD1-CZ 3.46Å; D43-R46 IonicContact OD1-NE 3.59Å; D43-R46 IonicContact OD1-NH2 2.63Å; D43-R46 PolarHBondContact OD1-NH2 3.26Å; D43-R46 IonicContact OD2-NH2 3.66Å; D43-R47 WeakPolarHBondContact O-CG 3.33Å; D43-R47 PolarHBondContact O-N 3.41Å
44	V	71.5	Confident	67.5	Low	28 Å²	28	65.1 Å²	65.1	17%	0.17	35%	0.353	C	S	.	.	H	α-helix	trans	-62.2	-42.9	169.1	174	0	0	0	0	109.7	L40 F41 R47 A48 Y64	L40-V44 WeakPolarHBondContact O-CG2 3.44Å; L40-V44 PolarHBondContact O-N 3.25Å; L40-V44 VanDerWaalsContact O-N 3.08Å; F41-V44 WeakPolarHBondContact O-CA 3.3Å; F41-V44 WeakPolarHBondContact O-CB 3.38Å; F41-V44 PolarHBondContact O-N 2.86Å; V44-R47 WeakPolarHBondContact O-CB 3.34Å; V44-R47 PolarHBondContact O-N 3.03Å; V44-R47 VanDerWaalsContact O-N 3.16Å; V44-A48 PolarHBondContact O-N 3.45Å; V44-A48 VanDerWaalsContact O-N 3.15Å; V44-Y64 HydrophobicContact CG1-CE1 3.66Å
45	F	71.1	Confident	69.1	Low	7 Å²	7	66.4 Å²	66.4	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-68.5	-43.8	179.8	-60.2	-49.4	0	0	0	112.7	F41 Q42 D43 R47 A48 D49 L56 T92 L95 C96 F99	F41-F45 HydrophobicContact CB-CD2 4.33Å; F41-F45 HydrophobicContact CB-CE2 3.69Å; F41-F45 HydrophobicContact CB-CZ 4.41Å; F41-F45 WeakPolarHBondContact O-CD2 3.44Å; F41-F45 WeakPolarHBondContact O-CE2 3.19Å; F41-F45 WeakPolarHBondContact O-CG 3.34Å; F41-F45 PolarHBondContact O-N 2.83Å; Q42-F45 PolarHBondContact O-N 2.86Å; D43-F45 VanDerWaalsContact C-N 3.31Å; F45-R47 PolarHBondContact O-N 2.87Å; F45-R47 VanDerWaalsContact O-N 3.1Å; F45-A48 PolarHBondContact O-N 3.18Å; F45-D49 VanDerWaalsContact O-CB 3.26Å; F45-D49 WeakPolarHBondContact O-CB 3.3Å; F45-D49 PolarHBondContact O-N 3.41Å; F45-L56 HydrophobicContact CD1-CD1 4.1Å; F45-T92 HydrophobicContact CB-CG2 4.1Å; F45-T92 HydrophobicContact CG-CG2 4.29Å; F45-L95 HydrophobicContact CD1-CD2 3.88Å; F45-L95 HydrophobicContact CD1-CG 4.49Å; F45-L95 HydrophobicContact CE1-CB 4.07Å; F45-L95 HydrophobicContact CE1-CD2 3.21Å; F45-L95 HydrophobicContact CE1-CG 3.47Å; F45-L95 VanDerWaalsContact CE1-CG 3.47Å; F45-L95 HydrophobicContact CZ-CB 4.07Å; F45-L95 HydrophobicContact CZ-CD2 4.01Å; F45-L95 HydrophobicContact CZ-CG 3.73Å; F45-C96 HydrophobicContact CE2-CB 4.22Å; F45-C96 WeakPolarHBondContact CE2-SG 3.5Å; F45-F99 HydrophobicContact CZ-CD2 4.19Å
46	R	72.6	Confident	70.5	Confident	160 Å²	160	61.9 Å²	61.9	60%	0.604	31%	0.314	S	S	*	.	H	α-helix	trans	-58.3	-22.7	170.8	-81.4	-166.3	-60.5	135.2	-6.2	114.1	Q42 D43	Q42-R46 PolarHBondContact O-N 2.6Å; D43-R46 VanDerWaalsContact CG-NH2 3.3Å; D43-R46 IonicContact OD1-CZ 3.46Å; D43-R46 IonicContact OD1-NE 3.59Å; D43-R46 IonicContact OD1-NH2 2.63Å; D43-R46 PolarHBondContact OD1-NH2 3.26Å; D43-R46 IonicContact OD2-NH2 3.66Å
47	R	75.3	Confident	72	Confident	124 Å²	124	60.4 Å²	60.4	47%	0.468	30%	0.299	S	S	.	.	H	α-helix	trans	-83.6	-31.1	175.7	-73	-174.4	-65.6	-106	2.4	112.7	D43 V44 F45 K50 Y64	D43-R47 WeakPolarHBondContact O-CG 3.33Å; D43-R47 PolarHBondContact O-N 3.41Å; V44-R47 WeakPolarHBondContact O-CB 3.34Å; V44-R47 PolarHBondContact O-N 3.03Å; V44-R47 VanDerWaalsContact O-N 3.16Å; F45-R47 PolarHBondContact O-N 2.87Å; F45-R47 VanDerWaalsContact O-N 3.1Å; R47-K50 PolarHBondContact O-NZ 3.27Å; R47-K50 VanDerWaalsContact O-NZ 3.11Å; R47-Y64 HydrophobicContact CB-CE2 3.67Å; R47-Y64 PolarHBondContact NE-OH 3.16Å
48	A	76.1	Confident	73.3	Confident	2 Å²	2	62.4 Å²	62.4	2%	0.017	31%	0.307	C	S	.	.	H	α-helix	trans	-83.2	-41.6	-179.8	0	0	0	0	0	112.4	V44 F45 K50 L56 Y64	V44-A48 PolarHBondContact O-N 3.45Å; V44-A48 VanDerWaalsContact O-N 3.15Å; F45-A48 PolarHBondContact O-N 3.18Å; A48-K50 PolarHBondContact O-N 3.37Å; A48-L56 HydrophobicContact CB-CD1 4.34Å; A48-L56 HydrophobicContact CB-CD2 3.83Å; A48-Y64 HydrophobicContact CB-CD1 3.78Å; A48-Y64 HydrophobicContact CB-CD2 3.72Å; A48-Y64 HydrophobicContact CB-CE1 4.29Å; A48-Y64 HydrophobicContact CB-CE2 4.24Å; A48-Y64 HydrophobicContact CB-CG 3.46Å; A48-Y64 VanDerWaalsContact CB-CG 3.46Å
49	D	79.8	Confident	74.3	Confident	13 Å²	13	66.4 Å²	66.4	7%	0.07	33%	0.325	C	S	.	.			trans	-71.6	102.3	173.8	-179.6	-5.7	0	0	0	108.3	F45 N51 D52 D53 G54 L56	F45-D49 VanDerWaalsContact O-CB 3.26Å; F45-D49 WeakPolarHBondContact O-CB 3.3Å; F45-D49 PolarHBondContact O-N 3.41Å; D49-N51 PolarHBondContact OD1-N 3.4Å; D49-N51 PolarHBondContact OD1-OD1 3.29Å; D49-D52 VanDerWaalsContact OD1-CA 3.26Å; D49-D52 WeakPolarHBondContact OD1-CA 3.39Å; D49-D52 PolarHBondContact OD1-N 2.91Å; D49-D53 PolarHBondContact OD1-N 3.27Å; D49-D53 PolarHBondContact OD2-N 3.27Å; D49-G54 WeakPolarHBondContact OD2-CA 3.08Å; D49-G54 PolarHBondContact OD2-N 2.85Å; D49-L56 HydrophobicContact CB-CD2 3.87Å
50	K	78.2	Confident	75.3	Confident	163 Å²	163	64.2 Å²	64.2	71%	0.709	31%	0.311	S	S	*	.	S	Bend	trans	-88	-21.4	-174.4	-72.4	-62.6	-176.9	-156.8	0	112.4	R47 A48 E60	R47-K50 PolarHBondContact O-NZ 3.27Å; R47-K50 VanDerWaalsContact O-NZ 3.11Å; A48-K50 PolarHBondContact O-N 3.37Å; K50-E60 PolarHBondContact N-OE1 3.14Å; K50-E60 VanDerWaalsContact N-OE1 3.08Å
51	N	78	Confident	76	Confident	90 Å²	90	62.7 Å²	62.7	48%	0.481	30%	0.303	S	S	.	.	S	Bend	trans	-102.5	-1.4	-177.2	70	2.3	0	0	0	112.8	D49 D53	D49-N51 PolarHBondContact OD1-N 3.4Å; D49-N51 PolarHBondContact OD1-OD1 3.29Å; N51-D53 PolarHBondContact ND2-OD2 2.89Å; N51-D53 PolarHBondContact O-N 2.87Å; N51-D53 VanDerWaalsContact OD1-CB 3.3Å; N51-D53 WeakPolarHBondContact OD1-CB 3.17Å; N51-D53 PolarHBondContact OD1-N 3.17Å; N51-D53 VanDerWaalsContact OD1-N 3.08Å; N51-D53 PolarHBondContact OD1-OD2 2.89Å
52	D	75.1	Confident	76.7	Confident	126 Å²	126	65.1 Å²	65.1	67%	0.674	31%	0.314	S	S	*	.			trans	55.6	32.7	-178.6	-67.1	-60.3	0	0	0	112.4	D49 G54	D49-D52 VanDerWaalsContact OD1-CA 3.26Å; D49-D52 WeakPolarHBondContact OD1-CA 3.39Å; D49-D52 PolarHBondContact OD1-N 2.91Å; D52-G54 VanDerWaalsContact C-N 3.32Å
53	D	78.6	Confident	77.3	Confident	80 Å²	80	65.8 Å²	65.8	43%	0.428	32%	0.321	S	S	.	.	S	Bend	trans	-84.5	-6.5	-178.4	81.1	16.1	0	0	0	113.8	D49 N51 K55	D49-D53 PolarHBondContact OD1-N 3.27Å; D49-D53 PolarHBondContact OD2-N 3.27Å; N51-D53 PolarHBondContact ND2-OD2 2.89Å; N51-D53 PolarHBondContact O-N 2.87Å; N51-D53 VanDerWaalsContact OD1-CB 3.3Å; N51-D53 WeakPolarHBondContact OD1-CB 3.17Å; N51-D53 PolarHBondContact OD1-N 3.17Å; N51-D53 VanDerWaalsContact OD1-N 3.08Å; N51-D53 PolarHBondContact OD1-OD2 2.89Å; D53-K55 VanDerWaalsContact C-N 3.32Å; D53-K55 WeakPolarHBondContact OD1-CA 3.47Å; D53-K55 WeakPolarHBondContact OD1-CB 3.3Å; D53-K55 PolarHBondContact OD1-N 3.42Å
54	G	74.1	Confident	77.8	Confident	35 Å²	35	67.5 Å²	67.5	36%	0.361	33%	0.325	S	S	.	.	S	Bend	trans	82.7	4.7	177.7	0	0	0	0	0	114.3	D49 D52 T92	D49-G54 WeakPolarHBondContact OD2-CA 3.08Å; D49-G54 PolarHBondContact OD2-N 2.85Å; D52-G54 VanDerWaalsContact C-N 3.32Å; G54-T92 WeakPolarHBondContact O-CG2 3.39Å; G54-T92 PolarHBondContact O-OG1 3.4Å; G54-T92 VanDerWaalsContact O-OG1 3.12Å
55	K	82.1	Confident	78.1	Confident	83 Å²	83	68.3 Å²	68.3	36%	0.361	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	159.7	175.9	-54	-174.4	178.1	-169.3	0	109.6	D53 N89	D53-K55 VanDerWaalsContact C-N 3.32Å; D53-K55 WeakPolarHBondContact OD1-CA 3.47Å; D53-K55 WeakPolarHBondContact OD1-CB 3.3Å; D53-K55 PolarHBondContact OD1-N 3.42Å; K55-N89 HydrophobicContact CB-CB 3.87Å; K55-N89 HydrophobicContact CD-CB 3.96Å
56	L	79.4	Confident	78.3	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	118.1	174.7	-66.9	174.5	0	0	0	109.7	F45 A48 D49 E60 F65 N89 L90 L95	F45-L56 HydrophobicContact CD1-CD1 4.1Å; A48-L56 HydrophobicContact CB-CD1 4.34Å; A48-L56 HydrophobicContact CB-CD2 3.83Å; D49-L56 HydrophobicContact CB-CD2 3.87Å; L56-E60 HydrophobicContact CD2-CB 4.26Å; L56-F65 HydrophobicContact CD1-CE2 4.43Å; L56-N89 WeakPolarHBondContact O-CA 3.48Å; L56-L90 HydrophobicContact CB-CB 4.4Å; L56-L90 PolarHBondContact N-O 3.12Å; L56-L90 PolarHBondContact O-N 3.21Å; L56-L95 HydrophobicContact CD1-CD2 3.61Å
57	S	82.6	Confident	78.4	Confident	33 Å²	33	67.3 Å²	67.3	23%	0.231	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	159.3	164.7	64	0	0	0	0	110.5	E59 E60 F61	S57-E59 PolarHBondContact O-N 2.93Å; S57-E60 WeakPolarHBondContact CB-OE2 3.34Å; S57-E60 PolarHBondContact N-OE2 2.95Å; S57-E60 PolarHBondContact O-N 2.8Å; S57-E60 VanDerWaalsContact OG-CG 3.32Å; S57-E60 WeakPolarHBondContact OG-CG 3.4Å; S57-E60 PolarHBondContact OG-N 2.85Å; S57-E60 PolarHBondContact OG-OE2 3.15Å; S57-F61 WeakPolarHBondContact O-CB 3.47Å; S57-F61 PolarHBondContact O-N 3.44Å
58	F	78.9	Confident	77.9	Confident	46 Å²	46	64.2 Å²	64.2	20%	0.202	35%	0.348	C	S	.	.	H	α-helix	trans	-59.5	-33.7	175.7	-179	-108.2	0	0	0	112.5	F61 Q62 L72 Q76 F79	F58-F61 PolarHBondContact O-N 3.21Å; F58-Q62 VanDerWaalsContact O-CB 3.22Å; F58-Q62 WeakPolarHBondContact O-CB 3.35Å; F58-Q62 PolarHBondContact O-N 3.32Å; F58-L72 HydrophobicContact CE1-CD1 3.94Å; F58-L72 HydrophobicContact CZ-CD1 3.8Å; F58-Q76 HydrophobicContact CE2-CB 3.79Å; F58-Q76 HydrophobicContact CE2-CG 3.94Å; F58-Q76 HydrophobicContact CZ-CB 3.78Å; F58-Q76 HydrophobicContact CZ-CG 4.02Å; F58-F79 HydrophobicContact CB-CE1 4.26Å; F58-F79 HydrophobicContact CB-CE2 4.5Å; F58-F79 HydrophobicContact CB-CZ 4.23Å; F58-F79 HydrophobicContact CD2-CB 3.98Å; F58-F79 HydrophobicContact CD2-CD1 4.02Å; F58-F79 HydrophobicContact CD2-CD2 4.15Å; F58-F79 AromaticContact CD2-CG 3.79Å; F58-F79 HydrophobicContact CD2-CG 3.79Å; F58-F79 HydrophobicContact CE2-CB 4.21Å
59	E	80.1	Confident	77.6	Confident	138 Å²	138	66.5 Å²	66.5	65%	0.645	36%	0.362	S	S	*	.	H	α-helix	trans	-67.5	-41.4	177.6	-174	173	-169.6	0	0	111.9	S57 Q62 N63	S57-E59 PolarHBondContact O-N 2.93Å; E59-Q62 PolarHBondContact O-N 3.48Å; E59-N63 VanDerWaalsContact O-CB 3.31Å; E59-N63 WeakPolarHBondContact O-CB 3.14Å; E59-N63 PolarHBondContact O-N 3.48Å; E59-N63 PolarHBondContact O-ND2 2.72Å
60	E	81.8	Confident	77.1	Confident	19 Å²	19	69.7 Å²	69.7	9%	0.089	38%	0.378	C	S	.	.	H	α-helix	trans	-68	-41.2	174.8	-73.1	165.5	135.1	0	0	112	K50 L56 S57 N63 Y64	K50-E60 PolarHBondContact N-OE1 3.14Å; K50-E60 VanDerWaalsContact N-OE1 3.08Å; L56-E60 HydrophobicContact CD2-CB 4.26Å; S57-E60 WeakPolarHBondContact CB-OE2 3.34Å; S57-E60 PolarHBondContact N-OE2 2.95Å; S57-E60 PolarHBondContact O-N 2.8Å; S57-E60 VanDerWaalsContact OG-CG 3.32Å; S57-E60 WeakPolarHBondContact OG-CG 3.4Å; S57-E60 PolarHBondContact OG-N 2.85Å; S57-E60 PolarHBondContact OG-OE2 3.15Å; E60-N63 PolarHBondContact O-N 3.32Å; E60-Y64 WeakPolarHBondContact O-CB 3.33Å; E60-Y64 PolarHBondContact O-N 3.45Å
61	F	79.8	Confident	77.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-46.4	174.3	-173	-94.5	0	0	0	110.9	S57 F58 Y64 F65 L75 L78 F79 L90 L95	S57-F61 WeakPolarHBondContact O-CB 3.47Å; S57-F61 PolarHBondContact O-N 3.44Å; F58-F61 PolarHBondContact O-N 3.21Å; F61-Y64 PolarHBondContact O-N 3.36Å; F61-F65 HydrophobicContact CB-CD2 4.47Å; F61-F65 HydrophobicContact CD1-CD2 4.31Å; F61-F65 AromaticContact CD2-CD2 3.32Å; F61-F65 HydrophobicContact CD2-CD2 3.32Å; F61-F65 AromaticContact CD2-CE2 3.48Å; F61-F65 HydrophobicContact CD2-CE2 3.48Å; F61-F65 VanDerWaalsContact CD2-CE2 3.48Å; F61-F65 HydrophobicContact CD2-CG 4.29Å; F61-F65 HydrophobicContact CE1-CB 4.38Å; F61-F65 HydrophobicContact CE1-CD2 4.41Å; F61-F65 AromaticContact CE2-CD2 3.44Å; F61-F65 HydrophobicContact CE2-CD2 3.44Å; F61-F65 VanDerWaalsContact CE2-CD2 3.44Å; F61-F65 AromaticContact CE2-CE2 3.58Å; F61-F65 HydrophobicContact CE2-CE2 3.58Å; F61-F65 HydrophobicContact CE2-CG 4.03Å; F61-F65 HydrophobicContact CE2-CZ 4.26Å; F61-F65 AromaticContact CG-CD2 3.79Å; F61-F65 HydrophobicContact CG-CD2 3.79Å; F61-F65 HydrophobicContact CG-CE2 4.34Å; F61-F65 HydrophobicContact CZ-CB 4.41Å; F61-F65 HydrophobicContact CZ-CD2 4Å; F61-F65 HydrophobicContact CZ-CG 4.19Å; F61-F65 WeakPolarHBondContact O-CB 3.24Å; F61-F65 VanDerWaalsContact O-CD2 3.3Å; F61-F65 WeakPolarHBondContact O-CD2 3.37Å; F61-F65 PolarHBondContact O-N 3.34Å; F61-L75 HydrophobicContact CD1-CD1 4.3Å; F61-L75 HydrophobicContact CD1-CG 4.15Å; F61-L75 HydrophobicContact CE1-CD1 3.64Å; F61-L75 HydrophobicContact CE1-CG 3.88Å; F61-L78 HydrophobicContact CE1-CD2 4.39Å; F61-L78 HydrophobicContact CZ-CD2 4.01Å; F61-L78 HydrophobicContact CZ-CG 4.32Å; F61-F79 HydrophobicContact CB-CD2 3.83Å; F61-F79 HydrophobicContact CB-CE2 3.96Å; F61-F79 HydrophobicContact CD1-CB 4.23Å; F61-F79 AromaticContact CD1-CD2 3.83Å; F61-F79 HydrophobicContact CD1-CD2 3.83Å; F61-F79 HydrophobicContact CD1-CG 4.49Å; F61-F79 HydrophobicContact CD2-CD2 4.04Å; F61-F79 HydrophobicContact CE1-CB 4.21Å; F61-F79 HydrophobicContact CE1-CD2 4.39Å; F61-F79 AromaticContact CG-CD2 3.63Å; F61-F79 HydrophobicContact CG-CD2 3.63Å; F61-F79 HydrophobicContact CG-CE2 4.21Å; F61-L90 HydrophobicContact CD2-CD2 4.06Å; F61-L90 HydrophobicContact CE2-CD2 4.09Å; F61-L95 HydrophobicContact CD2-CD2 4.46Å; F61-L95 HydrophobicContact CE2-CD1 4.35Å; F61-L95 HydrophobicContact CE2-CD2 4.24Å
62	Q	79.4	Confident	76.9	Confident	65 Å²	65	64.5 Å²	64.5	30%	0.304	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-48.1	177	-177.8	-177	1.8	0	0	111.5	F58 E59 Y64 A66 L72 L75	F58-Q62 VanDerWaalsContact O-CB 3.22Å; F58-Q62 WeakPolarHBondContact O-CB 3.35Å; F58-Q62 PolarHBondContact O-N 3.32Å; E59-Q62 PolarHBondContact O-N 3.48Å; Q62-Y64 PolarHBondContact O-N 2.87Å; Q62-A66 WeakPolarHBondContact O-CB 3.34Å; Q62-A66 PolarHBondContact O-N 2.83Å; Q62-L72 VanDerWaalsContact CD-CD1 3.49Å; Q62-L72 HydrophobicContact CG-CD1 4.28Å; Q62-L72 VanDerWaalsContact NE2-CD1 3.28Å; Q62-L75 HydrophobicContact CB-CD2 4.18Å; Q62-L75 HydrophobicContact CG-CD2 4.05Å
63	N	80.8	Confident	76.8	Confident	122 Å²	122	60.4 Å²	60.4	65%	0.652	35%	0.349	S	S	*	.	H	α-helix	trans	-65	-28.6	-177.3	-74.6	-34.7	0	0	0	113.2	E59 E60	E59-N63 VanDerWaalsContact O-CB 3.31Å; E59-N63 WeakPolarHBondContact O-CB 3.14Å; E59-N63 PolarHBondContact O-N 3.48Å; E59-N63 PolarHBondContact O-ND2 2.72Å; E60-N63 PolarHBondContact O-N 3.32Å
64	Y	79.4	Confident	76.8	Confident	83 Å²	83	61 Å²	61	33%	0.325	35%	0.349	S	S	.	.	H	α-helix	trans	-92.5	-38.1	-178.8	-169	-91.4	0	0	0	113.6	V44 R47 A48 E60 F61 Q62	V44-Y64 HydrophobicContact CG1-CE1 3.66Å; R47-Y64 HydrophobicContact CB-CE2 3.67Å; R47-Y64 PolarHBondContact NE-OH 3.16Å; A48-Y64 HydrophobicContact CB-CD1 3.78Å; A48-Y64 HydrophobicContact CB-CD2 3.72Å; A48-Y64 HydrophobicContact CB-CE1 4.29Å; A48-Y64 HydrophobicContact CB-CE2 4.24Å; A48-Y64 HydrophobicContact CB-CG 3.46Å; A48-Y64 VanDerWaalsContact CB-CG 3.46Å; E60-Y64 WeakPolarHBondContact O-CB 3.33Å; E60-Y64 PolarHBondContact O-N 3.45Å; F61-Y64 PolarHBondContact O-N 3.36Å; Q62-Y64 PolarHBondContact O-N 2.87Å
65	F	76.8	Confident	77.1	Confident	45 Å²	45	59.6 Å²	59.6	20%	0.197	33%	0.334	C	S	.	.	H	α-helix	trans	-101.4	-7.5	-173.5	-66.3	-82.5	0	0	0	114.2	L56 F61 D67 L75 L95 F99	L56-F65 HydrophobicContact CD1-CE2 4.43Å; F61-F65 HydrophobicContact CB-CD2 4.47Å; F61-F65 HydrophobicContact CD1-CD2 4.31Å; F61-F65 AromaticContact CD2-CD2 3.32Å; F61-F65 HydrophobicContact CD2-CD2 3.32Å; F61-F65 AromaticContact CD2-CE2 3.48Å; F61-F65 HydrophobicContact CD2-CE2 3.48Å; F61-F65 VanDerWaalsContact CD2-CE2 3.48Å; F61-F65 HydrophobicContact CD2-CG 4.29Å; F61-F65 HydrophobicContact CE1-CB 4.38Å; F61-F65 HydrophobicContact CE1-CD2 4.41Å; F61-F65 AromaticContact CE2-CD2 3.44Å; F61-F65 HydrophobicContact CE2-CD2 3.44Å; F61-F65 VanDerWaalsContact CE2-CD2 3.44Å; F61-F65 AromaticContact CE2-CE2 3.58Å; F61-F65 HydrophobicContact CE2-CE2 3.58Å; F61-F65 HydrophobicContact CE2-CG 4.03Å; F61-F65 HydrophobicContact CE2-CZ 4.26Å; F61-F65 AromaticContact CG-CD2 3.79Å; F61-F65 HydrophobicContact CG-CD2 3.79Å; F61-F65 HydrophobicContact CG-CE2 4.34Å; F61-F65 HydrophobicContact CZ-CB 4.41Å; F61-F65 HydrophobicContact CZ-CD2 4Å; F61-F65 HydrophobicContact CZ-CG 4.19Å; F61-F65 WeakPolarHBondContact O-CB 3.24Å; F61-F65 VanDerWaalsContact O-CD2 3.3Å; F61-F65 WeakPolarHBondContact O-CD2 3.37Å; F61-F65 PolarHBondContact O-N 3.34Å; F65-D67 PolarHBondContact O-N 2.9Å; F65-L75 HydrophobicContact CB-CD1 4.35Å; F65-L95 HydrophobicContact CE2-CD2 4.46Å; F65-L95 HydrophobicContact CZ-CD2 4.38Å; F65-F99 HydrophobicContact CD1-CZ 4.26Å; F65-F99 AromaticContact CE1-CE2 3.88Å; F65-F99 HydrophobicContact CE1-CE2 3.88Å; F65-F99 AromaticContact CE1-CZ 3.62Å; F65-F99 HydrophobicContact CE1-CZ 3.62Å; F65-F99 AromaticContact CZ-CE2 3.99Å; F65-F99 HydrophobicContact CZ-CE2 3.99Å; F65-F99 HydrophobicContact CZ-CZ 4.18Å
66	A	75.4	Confident	76.9	Confident	59 Å²	59	60.8 Å²	60.8	49%	0.488	34%	0.34	S	S	.	.			trans	-65.5	106.9	173.8	0	0	0	0	0	110.3	Q62 G68 L75	Q62-A66 WeakPolarHBondContact O-CB 3.34Å; Q62-A66 PolarHBondContact O-N 2.83Å; A66-G68 VanDerWaalsContact C-N 3.35Å; A66-L75 HydrophobicContact CB-CD2 4.44Å
67	D	74.9	Confident	76.9	Confident	87 Å²	87	67.6 Å²	67.6	47%	0.465	37%	0.372	S	S	.	.			trans	-89.8	-2.5	174.9	65.2	-4.2	0	0	0	112.6	F65 V69 L70	F65-D67 PolarHBondContact O-N 2.9Å; D67-V69 PolarHBondContact O-N 2.9Å; D67-V69 WeakPolarHBondContact OD1-CA 3.44Å; D67-V69 WeakPolarHBondContact OD1-CB 3.38Å; D67-V69 PolarHBondContact OD1-N 3.36Å; D67-L70 PolarHBondContact OD1-N 2.97Å
68	G	64.1	Low	76.8	Confident	59 Å²	59	68.3 Å²	68.3	61%	0.608	37%	0.373	S	S	*	.	S	Bend	trans	72.6	0.6	-175.2	0	0	0	0	0	114.5	A66	A66-G68 VanDerWaalsContact C-N 3.35Å
69	V	69.6	Low	76.7	Confident	51 Å²	51	66.8 Å²	66.8	31%	0.309	37%	0.367	S	S	.	.	S	Bend	trans	-94.7	-46	175.9	-177.4	0	0	0	0	109.6	D67 A171	D67-V69 PolarHBondContact O-N 2.9Å; D67-V69 WeakPolarHBondContact OD1-CA 3.44Å; D67-V69 WeakPolarHBondContact OD1-CB 3.38Å; D67-V69 PolarHBondContact OD1-N 3.36Å; V69-A171 HydrophobicContact CG1-CB 4.14Å; V69-A171 HydrophobicContact CG2-CB 3.67Å
70	L	71.1	Confident	76.5	Confident	80 Å²	80	61.8 Å²	61.8	42%	0.419	35%	0.347	S	S	.	.	S	Bend	trans	-76.2	137.1	175.7	-64.8	176.6	0	0	0	111.7	D67 E74 L75	D67-L70 PolarHBondContact OD1-N 2.97Å; L70-E74 HydrophobicContact CD2-CB 4.46Å; L70-L75 HydrophobicContact CD1-CD1 4.3Å
71	S	76.2	Confident	76.2	Confident	50 Å²	50	63.4 Å²	63.4	35%	0.35	37%	0.368	S	S	.	.			trans	-74.3	158.1	171.6	68.8	0	0	0	0	111.4	G73 E74 L75	S71-G73 PolarHBondContact O-N 3.39Å; S71-G73 VanDerWaalsContact O-N 3.16Å; S71-E74 VanDerWaalsContact CB-OE2 3.29Å; S71-E74 WeakPolarHBondContact CB-OE2 3.41Å; S71-E74 PolarHBondContact N-OE2 3.22Å; S71-E74 PolarHBondContact O-N 3.11Å; S71-E74 VanDerWaalsContact O-N 3.11Å; S71-E74 VanDerWaalsContact OG-CD 3.24Å; S71-E74 WeakPolarHBondContact OG-CG 3.46Å; S71-E74 PolarHBondContact OG-N 2.66Å; S71-E74 PolarHBondContact OG-OE2 2.84Å; S71-L75 PolarHBondContact O-N 3.48Å
72	L	74.9	Confident	76	Confident	93 Å²	93	64.3 Å²	64.3	49%	0.487	37%	0.373	S	S	.	.	H	α-helix	trans	-55.4	-35.4	179.1	-174.3	59.7	0	0	0	112.8	F58 Q62 Q76	F58-L72 HydrophobicContact CE1-CD1 3.94Å; F58-L72 HydrophobicContact CZ-CD1 3.8Å; Q62-L72 VanDerWaalsContact CD-CD1 3.49Å; Q62-L72 HydrophobicContact CG-CD1 4.28Å; Q62-L72 VanDerWaalsContact NE2-CD1 3.28Å; L72-Q76 WeakPolarHBondContact O-CB 3.37Å; L72-Q76 PolarHBondContact O-N 2.75Å; L72-Q76 VanDerWaalsContact O-N 3.07Å
73	G	73.4	Confident	75.5	Confident	40 Å²	40	61.6 Å²	61.6	41%	0.412	36%	0.361	S	S	.	.	H	α-helix	trans	-69.6	-43.1	177.6	0	0	0	0	0	112.9	S71 L75 Q76 E77	S71-G73 PolarHBondContact O-N 3.39Å; S71-G73 VanDerWaalsContact O-N 3.16Å; G73-L75 VanDerWaalsContact C-N 3.33Å; G73-L75 PolarHBondContact O-N 2.82Å; G73-Q76 PolarHBondContact O-N 2.84Å; G73-E77 PolarHBondContact O-N 2.91Å
74	E	78.5	Confident	74.7	Confident	93 Å²	93	57.8 Å²	57.8	44%	0.435	35%	0.35	S	S	.	.	H	α-helix	trans	-66	-37.3	177.3	-69.2	161.7	142.4	0	0	111.5	L70 S71 Q76 E77 L78	L70-E74 HydrophobicContact CD2-CB 4.46Å; S71-E74 VanDerWaalsContact CB-OE2 3.29Å; S71-E74 WeakPolarHBondContact CB-OE2 3.41Å; S71-E74 PolarHBondContact N-OE2 3.22Å; S71-E74 PolarHBondContact O-N 3.11Å; S71-E74 VanDerWaalsContact O-N 3.11Å; S71-E74 VanDerWaalsContact OG-CD 3.24Å; S71-E74 WeakPolarHBondContact OG-CG 3.46Å; S71-E74 PolarHBondContact OG-N 2.66Å; S71-E74 PolarHBondContact OG-OE2 2.84Å; E74-Q76 VanDerWaalsContact C-N 3.32Å; E74-E77 PolarHBondContact O-N 3.46Å; E74-L78 PolarHBondContact O-N 2.85Å
75	L	80	Confident	73.7	Confident	5 Å²	5	60.7 Å²	60.7	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-68.2	-33.8	175.5	-164.1	66.6	0	0	0	112	F61 Q62 F65 A66 L70 S71 G73 L78 F79	F61-L75 HydrophobicContact CD1-CD1 4.3Å; F61-L75 HydrophobicContact CD1-CG 4.15Å; F61-L75 HydrophobicContact CE1-CD1 3.64Å; F61-L75 HydrophobicContact CE1-CG 3.88Å; Q62-L75 HydrophobicContact CB-CD2 4.18Å; Q62-L75 HydrophobicContact CG-CD2 4.05Å; F65-L75 HydrophobicContact CB-CD1 4.35Å; A66-L75 HydrophobicContact CB-CD2 4.44Å; L70-L75 HydrophobicContact CD1-CD1 4.3Å; S71-L75 PolarHBondContact O-N 3.48Å; G73-L75 VanDerWaalsContact C-N 3.33Å; G73-L75 PolarHBondContact O-N 2.82Å; L75-L78 HydrophobicContact CD1-CD2 4.4Å; L75-L78 PolarHBondContact O-N 2.93Å; L75-F79 WeakPolarHBondContact O-CB 3.27Å; L75-F79 PolarHBondContact O-N 2.65Å
76	Q	77.3	Confident	72.7	Confident	108 Å²	108	66.1 Å²	66.1	51%	0.505	40%	0.397	S	S	.	.	H	α-helix	trans	-72.8	-36.1	174.8	-164.8	172.4	11.2	0	0	112.5	F58 L72 G73 E74 F79 S80	F58-Q76 HydrophobicContact CE2-CB 3.79Å; F58-Q76 HydrophobicContact CE2-CG 3.94Å; F58-Q76 HydrophobicContact CZ-CB 3.78Å; F58-Q76 HydrophobicContact CZ-CG 4.02Å; L72-Q76 WeakPolarHBondContact O-CB 3.37Å; L72-Q76 PolarHBondContact O-N 2.75Å; L72-Q76 VanDerWaalsContact O-N 3.07Å; G73-Q76 PolarHBondContact O-N 2.84Å; E74-Q76 VanDerWaalsContact C-N 3.32Å; Q76-F79 PolarHBondContact O-N 3.29Å; Q76-S80 VanDerWaalsContact O-CB 3.31Å; Q76-S80 WeakPolarHBondContact O-CB 3.48Å; Q76-S80 PolarHBondContact O-N 3.38Å; Q76-S80 PolarHBondContact O-OG 3.43Å
77	E	79.8	Confident	71.9	Confident	143 Å²	143	66.1 Å²	66.1	67%	0.668	39%	0.391	S	S	*	.	H	α-helix	trans	-63.2	-41.1	169.9	-75.3	-177.1	-178.9	0	0	111.5	G73 E74 S80 G81	G73-E77 PolarHBondContact O-N 2.91Å; E74-E77 PolarHBondContact O-N 3.46Å; E77-S80 WeakPolarHBondContact CA-OG 3.3Å; E77-S80 PolarHBondContact O-N 3Å; E77-S80 PolarHBondContact O-OG 3.42Å; E77-G81 PolarHBondContact O-N 3.25Å
78	L	80.8	Confident	71.5	Confident	48 Å²	48	69 Å²	69	25%	0.251	41%	0.406	S	S	.	.	H	α-helix	trans	-62	-49	173.9	-177.8	66.1	0	0	0	111.6	F61 E74 L75 S80 G81 I82 Y98	F61-L78 HydrophobicContact CE1-CD2 4.39Å; F61-L78 HydrophobicContact CZ-CD2 4.01Å; F61-L78 HydrophobicContact CZ-CG 4.32Å; E74-L78 PolarHBondContact O-N 2.85Å; L75-L78 HydrophobicContact CD1-CD2 4.4Å; L75-L78 PolarHBondContact O-N 2.93Å; L78-S80 VanDerWaalsContact C-N 3.34Å; L78-S80 PolarHBondContact O-N 3.16Å; L78-G81 PolarHBondContact O-N 2.93Å; L78-I82 HydrophobicContact CD1-CD1 3.9Å; L78-I82 HydrophobicContact CD1-CG1 4.38Å; L78-I82 HydrophobicContact CG-CD1 3.94Å; L78-I82 WeakPolarHBondContact O-CD1 3.33Å; L78-I82 WeakPolarHBondContact O-CG1 3.5Å; L78-I82 PolarHBondContact O-N 3.48Å; L78-I82 VanDerWaalsContact O-N 3.12Å; L78-Y98 HydrophobicContact CD1-CE1 3.94Å; L78-Y98 VanDerWaalsContact CD1-OH 3.24Å; L78-Y98 WeakPolarHBondContact CD1-OH 3.49Å
79	F	76.9	Confident	71.8	Confident	15 Å²	15	68.8 Å²	68.8	7%	0.066	39%	0.391	C	S	.	.	H	α-helix	trans	-58.1	-46.9	178.9	-176.8	-95.2	0	0	0	111.9	F58 F61 L75 Q76 I82 D83 L90	F58-F79 HydrophobicContact CB-CE1 4.26Å; F58-F79 HydrophobicContact CB-CE2 4.5Å; F58-F79 HydrophobicContact CB-CZ 4.23Å; F58-F79 HydrophobicContact CD2-CB 3.98Å; F58-F79 HydrophobicContact CD2-CD1 4.02Å; F58-F79 HydrophobicContact CD2-CD2 4.15Å; F58-F79 AromaticContact CD2-CG 3.79Å; F58-F79 HydrophobicContact CD2-CG 3.79Å; F58-F79 HydrophobicContact CE2-CB 4.21Å; F61-F79 HydrophobicContact CB-CD2 3.83Å; F61-F79 HydrophobicContact CB-CE2 3.96Å; F61-F79 HydrophobicContact CD1-CB 4.23Å; F61-F79 AromaticContact CD1-CD2 3.83Å; F61-F79 HydrophobicContact CD1-CD2 3.83Å; F61-F79 HydrophobicContact CD1-CG 4.49Å; F61-F79 HydrophobicContact CD2-CD2 4.04Å; F61-F79 HydrophobicContact CE1-CB 4.21Å; F61-F79 HydrophobicContact CE1-CD2 4.39Å; F61-F79 AromaticContact CG-CD2 3.63Å; F61-F79 HydrophobicContact CG-CD2 3.63Å; F61-F79 HydrophobicContact CG-CE2 4.21Å; L75-F79 WeakPolarHBondContact O-CB 3.27Å; L75-F79 PolarHBondContact O-N 2.65Å; Q76-F79 PolarHBondContact O-N 3.29Å; F79-I82 PolarHBondContact O-N 3.48Å; F79-D83 PolarHBondContact O-N 2.96Å; F79-L90 HydrophobicContact CD2-CB 4.2Å; F79-L90 HydrophobicContact CD2-CD2 3.9Å; F79-L90 HydrophobicContact CE2-CB 3.48Å; F79-L90 VanDerWaalsContact CE2-CB 3.48Å; F79-L90 HydrophobicContact CE2-CD2 3.97Å; F79-L90 HydrophobicContact CE2-CG 4.41Å; F79-L90 HydrophobicContact CZ-CB 3.79Å
80	S	75.8	Confident	72.1	Confident	32 Å²	32	66.4 Å²	66.4	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-74.5	-30.6	-177.4	62.1	0	0	0	0	113.4	Q76 E77 L78 G84 H85	Q76-S80 VanDerWaalsContact O-CB 3.31Å; Q76-S80 WeakPolarHBondContact O-CB 3.48Å; Q76-S80 PolarHBondContact O-N 3.38Å; Q76-S80 PolarHBondContact O-OG 3.43Å; E77-S80 WeakPolarHBondContact CA-OG 3.3Å; E77-S80 PolarHBondContact O-N 3Å; E77-S80 PolarHBondContact O-OG 3.42Å; L78-S80 VanDerWaalsContact C-N 3.34Å; L78-S80 PolarHBondContact O-N 3.16Å; S80-G84 PolarHBondContact O-N 3.16Å; S80-H85 PolarHBondContact O-N 3.35Å
81	G	75	Confident	72.2	Confident	53 Å²	53	66.1 Å²	66.1	55%	0.546	37%	0.373	S	S	.	.	H	α-helix	trans	-69.4	-31.3	174.2	0	0	0	0	0	113.8	E77 L78	E77-G81 PolarHBondContact O-N 3.25Å; L78-G81 PolarHBondContact O-N 2.93Å
82	I	75	Confident	71.8	Confident	19 Å²	19	65.5 Å²	65.5	10%	0.097	37%	0.367	C	S	.	.	H	α-helix	trans	-79.5	-39.9	177.4	-59.5	166.5	0	0	0	111.3	L78 F79 G84 L90 L95 Y98	L78-I82 HydrophobicContact CD1-CD1 3.9Å; L78-I82 HydrophobicContact CD1-CG1 4.38Å; L78-I82 HydrophobicContact CG-CD1 3.94Å; L78-I82 WeakPolarHBondContact O-CD1 3.33Å; L78-I82 WeakPolarHBondContact O-CG1 3.5Å; L78-I82 PolarHBondContact O-N 3.48Å; L78-I82 VanDerWaalsContact O-N 3.12Å; F79-I82 PolarHBondContact O-N 3.48Å; I82-G84 VanDerWaalsContact C-N 3.33Å; I82-G84 PolarHBondContact O-N 2.98Å; I82-L90 HydrophobicContact CB-CD1 4.11Å; I82-L90 HydrophobicContact CG2-CD1 3.72Å; I82-L95 HydrophobicContact CD1-CD1 3.6Å; I82-L95 HydrophobicContact CG2-CD1 4.06Å; I82-Y98 HydrophobicContact CD1-CD1 3.52Å; I82-Y98 HydrophobicContact CD1-CD2 4.35Å; I82-Y98 HydrophobicContact CD1-CE1 3.67Å; I82-Y98 HydrophobicContact CD1-CE2 4.46Å; I82-Y98 HydrophobicContact CD1-CG 3.88Å; I82-Y98 HydrophobicContact CG1-CD1 3.87Å; I82-Y98 HydrophobicContact CG1-CD2 3.75Å; I82-Y98 HydrophobicContact CG1-CE1 4.06Å; I82-Y98 HydrophobicContact CG1-CE2 3.92Å; I82-Y98 HydrophobicContact CG1-CG 3.7Å; I82-Y98 HydrophobicContact CG2-CG 4.2Å
83	D	70.8	Confident	71.6	Confident	8 Å²	8	68.3 Å²	68.3	4%	0.043	38%	0.378	C	S	.	.	H	α-helix	trans	-75.8	-22.5	-178	-171	51.8	0	0	0	113.6	F79 T87 L90 K94	F79-D83 PolarHBondContact O-N 2.96Å; D83-T87 PolarHBondContact OD1-OG1 3.45Å; D83-T87 WeakPolarHBondContact OD2-CA 3.43Å; D83-T87 WeakPolarHBondContact OD2-CB 3.35Å; D83-T87 PolarHBondContact OD2-N 2.99Å; D83-T87 PolarHBondContact OD2-OG1 3.47Å; D83-L90 HydrophobicContact CB-CD1 3.88Å; D83-K94 PolarHBondContact O-NZ 2.88Å; D83-K94 IonicContact OD1-NZ 3.47Å; D83-K94 PolarHBondContact OD1-NZ 2.84Å
84	G	64	Low	71.7	Confident	42 Å²	42	69.8 Å²	69.8	43%	0.433	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	27.5	-176.8	0	0	0	0	0	113.5	S80 I82 L86	S80-G84 PolarHBondContact O-N 3.16Å; I82-G84 VanDerWaalsContact C-N 3.33Å; I82-G84 PolarHBondContact O-N 2.98Å; G84-L86 PolarHBondContact O-N 2.87Å
85	H	58	Low	71.5	Confident	145 Å²	145	65.3 Å²	65.3	67%	0.671	35%	0.352	S	S	*	.	S	Bend	trans	61.8	25.1	174.1	-56.9	-67.7	0	0	0	117.5	S80	S80-H85 PolarHBondContact O-N 3.35Å
86	L	54.9	Low	71	Confident	158 Å²	158	65.5 Å²	65.5	83%	0.827	35%	0.354	S	S	*	.	S	Bend	trans	-119.8	-13	-173.7	-69.3	171.1	0	0	0	115.3	G84	G84-L86 PolarHBondContact O-N 2.87Å
87	T	59	Low	71	Confident	59 Å²	59	64.7 Å²	64.7	36%	0.362	35%	0.353	S	S	.	.			trans	-135	137.7	-179.6	20.1	0	0	0	0	111.4	D83 N89	D83-T87 PolarHBondContact OD1-OG1 3.45Å; D83-T87 WeakPolarHBondContact OD2-CA 3.43Å; D83-T87 WeakPolarHBondContact OD2-CB 3.35Å; D83-T87 PolarHBondContact OD2-N 2.99Å; D83-T87 PolarHBondContact OD2-OG1 3.47Å; T87-N89 WeakPolarHBondContact CB-O 3.41Å; T87-N89 PolarHBondContact O-N 3.42Å; T87-N89 VanDerWaalsContact O-N 3.17Å
88	D	65.6	Low	70.9	Confident	147 Å²	147	61.2 Å²	61.2	79%	0.786	33%	0.334	S	S	*	.	S	Bend	trans	-68.6	-10.4	177.3	-144.2	19.5	0	0	0	112
89	N	71.8	Confident	70.6	Confident	56 Å²	56	61.2 Å²	61.2	30%	0.299	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	134.8	-179.8	-60.9	-15.7	0	0	0	109.9	K55 L56 T87	K55-N89 HydrophobicContact CB-CB 3.87Å; K55-N89 HydrophobicContact CD-CB 3.96Å; L56-N89 WeakPolarHBondContact O-CA 3.48Å; T87-N89 WeakPolarHBondContact CB-O 3.41Å; T87-N89 PolarHBondContact O-N 3.42Å; T87-N89 VanDerWaalsContact O-N 3.17Å
90	L	75.6	Confident	70.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	122.3	-178.9	177.2	59.4	0	0	0	110.6	L56 F61 F79 I82 D83 L95	L56-L90 HydrophobicContact CB-CB 4.4Å; L56-L90 PolarHBondContact N-O 3.12Å; L56-L90 PolarHBondContact O-N 3.21Å; F61-L90 HydrophobicContact CD2-CD2 4.06Å; F61-L90 HydrophobicContact CE2-CD2 4.09Å; F79-L90 HydrophobicContact CD2-CB 4.2Å; F79-L90 HydrophobicContact CD2-CD2 3.9Å; F79-L90 HydrophobicContact CE2-CB 3.48Å; F79-L90 VanDerWaalsContact CE2-CB 3.48Å; F79-L90 HydrophobicContact CE2-CD2 3.97Å; F79-L90 HydrophobicContact CE2-CG 4.41Å; F79-L90 HydrophobicContact CZ-CB 3.79Å; I82-L90 HydrophobicContact CB-CD1 4.11Å; I82-L90 HydrophobicContact CG2-CD1 3.72Å; D83-L90 HydrophobicContact CB-CD1 3.88Å; L90-L95 HydrophobicContact CD2-CB 4.24Å; L90-L95 HydrophobicContact CD2-CD1 3.95Å; L90-L95 HydrophobicContact CD2-CD2 3.73Å; L90-L95 HydrophobicContact CD2-CG 4.19Å; L90-L95 HydrophobicContact CG-CB 4.26Å; L90-L95 HydrophobicContact CG-CD2 4.37Å
91	E	72.9	Confident	70.6	Confident	75 Å²	75	67.3 Å²	67.3	35%	0.35	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	130.2	176	-69.7	176	171.8	0	0	110.6	E93 K94 L95	E91-E93 PolarHBondContact O-N 3.24Å; E91-K94 HydrophobicContact CB-CD 4.34Å; E91-K94 HydrophobicContact CB-CG 4.3Å; E91-K94 PolarHBondContact O-N 2.85Å; E91-K94 VanDerWaalsContact OE2-CE 3.23Å; E91-K94 WeakPolarHBondContact OE2-CE 3.33Å; E91-K94 IonicContact OE2-NZ 3.54Å; E91-L95 PolarHBondContact O-N 3.03Å
92	T	66.9	Low	70.6	Confident	36 Å²	36	70.1 Å²	70.1	22%	0.221	36%	0.358	C	S	.	.	H	α-helix	trans	-60.4	-32.2	-176.5	41.9	0	0	0	0	112.9	F45 G54 C96	F45-T92 HydrophobicContact CB-CG2 4.1Å; F45-T92 HydrophobicContact CG-CG2 4.29Å; G54-T92 WeakPolarHBondContact O-CG2 3.39Å; G54-T92 PolarHBondContact O-OG1 3.4Å; G54-T92 VanDerWaalsContact O-OG1 3.12Å; T92-C96 PolarHBondContact O-N 3.35Å; T92-C96 PolarHBondContact O-SG 3.18Å
93	E	71.8	Confident	70.3	Confident	152 Å²	152	70.5 Å²	70.5	71%	0.71	36%	0.36	S	S	*	.	H	α-helix	trans	-66.7	-44.9	175.9	-67.5	-173.4	170.2	0	0	112.6	E91 L95 C96 D97	E91-E93 PolarHBondContact O-N 3.24Å; E93-L95 VanDerWaalsContact C-N 3.29Å; E93-L95 PolarHBondContact O-N 3.42Å; E93-C96 VanDerWaalsContact O-CB 3.27Å; E93-C96 WeakPolarHBondContact O-CB 3.44Å; E93-C96 PolarHBondContact O-N 2.83Å; E93-D97 PolarHBondContact O-N 3.22Å
94	K	75.8	Confident	70.7	Confident	71 Å²	71	72.7 Å²	72.7	31%	0.309	39%	0.385	S	S	.	.	H	α-helix	trans	-64.2	-36.9	178.1	-65.3	-179.4	-174.5	167.3	0	112.1	D83 E91 D97 Y98	D83-K94 PolarHBondContact O-NZ 2.88Å; D83-K94 IonicContact OD1-NZ 3.47Å; D83-K94 PolarHBondContact OD1-NZ 2.84Å; E91-K94 HydrophobicContact CB-CD 4.34Å; E91-K94 HydrophobicContact CB-CG 4.3Å; E91-K94 PolarHBondContact O-N 2.85Å; E91-K94 VanDerWaalsContact OE2-CE 3.23Å; E91-K94 WeakPolarHBondContact OE2-CE 3.33Å; E91-K94 IonicContact OE2-NZ 3.54Å; K94-D97 PolarHBondContact O-N 3.04Å; K94-Y98 PolarHBondContact O-N 2.91Å
95	L	73.3	Confident	71.4	Confident	0 Å²	0	76.3 Å²	76.3	0%	0	40%	0.398	C	S	.	.	H	α-helix	trans	-70.3	-36.9	176.3	-170.7	57	0	0	0	111.8	F45 L56 F61 F65 I82 L90 E91 E93 D97 Y98 F99	F45-L95 HydrophobicContact CD1-CD2 3.88Å; F45-L95 HydrophobicContact CD1-CG 4.49Å; F45-L95 HydrophobicContact CE1-CB 4.07Å; F45-L95 HydrophobicContact CE1-CD2 3.21Å; F45-L95 HydrophobicContact CE1-CG 3.47Å; F45-L95 VanDerWaalsContact CE1-CG 3.47Å; F45-L95 HydrophobicContact CZ-CB 4.07Å; F45-L95 HydrophobicContact CZ-CD2 4.01Å; F45-L95 HydrophobicContact CZ-CG 3.73Å; L56-L95 HydrophobicContact CD1-CD2 3.61Å; F61-L95 HydrophobicContact CD2-CD2 4.46Å; F61-L95 HydrophobicContact CE2-CD1 4.35Å; F61-L95 HydrophobicContact CE2-CD2 4.24Å; F65-L95 HydrophobicContact CE2-CD2 4.46Å; F65-L95 HydrophobicContact CZ-CD2 4.38Å; I82-L95 HydrophobicContact CD1-CD1 3.6Å; I82-L95 HydrophobicContact CG2-CD1 4.06Å; L90-L95 HydrophobicContact CD2-CB 4.24Å; L90-L95 HydrophobicContact CD2-CD1 3.95Å; L90-L95 HydrophobicContact CD2-CD2 3.73Å; L90-L95 HydrophobicContact CD2-CG 4.19Å; L90-L95 HydrophobicContact CG-CB 4.26Å; L90-L95 HydrophobicContact CG-CD2 4.37Å; E91-L95 PolarHBondContact O-N 3.03Å; E93-L95 VanDerWaalsContact C-N 3.29Å; E93-L95 PolarHBondContact O-N 3.42Å; L95-D97 VanDerWaalsContact C-N 3.3Å; L95-D97 PolarHBondContact O-N 3.45Å; L95-Y98 PolarHBondContact O-N 3.27Å; L95-F99 HydrophobicContact CD1-CD2 3.66Å; L95-F99 HydrophobicContact CD1-CE2 3.25Å; L95-F99 HydrophobicContact CD1-CZ 4.13Å; L95-F99 HydrophobicContact CD2-CE2 4.15Å; L95-F99 HydrophobicContact CG-CD2 3.77Å; L95-F99 HydrophobicContact CG-CE2 3.59Å; L95-F99 VanDerWaalsContact O-CD2 3.26Å; L95-F99 WeakPolarHBondContact O-CD2 3.48Å; L95-F99 PolarHBondContact O-N 2.82Å
96	C	70.9	Confident	72.5	Confident	8 Å²	8	75.5 Å²	75.5	5%	0.054	39%	0.39	C	S	.	.	H	α-helix	trans	-55.6	-47.9	169.8	-68.4	0	0	0	0	110.7	F45 T92 E93 F99 S100	F45-C96 HydrophobicContact CE2-CB 4.22Å; F45-C96 WeakPolarHBondContact CE2-SG 3.5Å; T92-C96 PolarHBondContact O-N 3.35Å; T92-C96 PolarHBondContact O-SG 3.18Å; E93-C96 VanDerWaalsContact O-CB 3.27Å; E93-C96 WeakPolarHBondContact O-CB 3.44Å; E93-C96 PolarHBondContact O-N 2.83Å; C96-F99 PolarHBondContact O-N 2.85Å; C96-S100 VanDerWaalsContact O-CB 3.24Å; C96-S100 WeakPolarHBondContact O-CB 3.27Å; C96-S100 PolarHBondContact O-N 2.88Å; C96-S100 PolarHBondContact O-OG 3.42Å
97	D	76.3	Confident	73.6	Confident	91 Å²	91	74.4 Å²	74.4	49%	0.487	38%	0.375	S	S	.	.	H	α-helix	trans	-65.4	-45.3	-176.4	-69.4	-18	0	0	0	111	E93 K94 L95 F99 S100 E101	E93-D97 PolarHBondContact O-N 3.22Å; K94-D97 PolarHBondContact O-N 3.04Å; L95-D97 VanDerWaalsContact C-N 3.3Å; L95-D97 PolarHBondContact O-N 3.45Å; D97-F99 PolarHBondContact O-N 3.33Å; D97-S100 WeakPolarHBondContact O-CB 3.45Å; D97-S100 PolarHBondContact O-N 3.05Å; D97-E101 PolarHBondContact O-N 3.24Å; D97-E101 VanDerWaalsContact O-N 3.14Å
98	Y	77.9	Confident	74.6	Confident	70 Å²	70	75.8 Å²	75.8	28%	0.275	38%	0.384	S	S	.	.	H	α-helix	trans	-56.6	-53.6	175.2	-179.2	-97	0	0	0	112	L78 I82 K94 L95 S100 E101 H102	L78-Y98 HydrophobicContact CD1-CE1 3.94Å; L78-Y98 VanDerWaalsContact CD1-OH 3.24Å; L78-Y98 WeakPolarHBondContact CD1-OH 3.49Å; I82-Y98 HydrophobicContact CD1-CD1 3.52Å; I82-Y98 HydrophobicContact CD1-CD2 4.35Å; I82-Y98 HydrophobicContact CD1-CE1 3.67Å; I82-Y98 HydrophobicContact CD1-CE2 4.46Å; I82-Y98 HydrophobicContact CD1-CG 3.88Å; I82-Y98 HydrophobicContact CG1-CD1 3.87Å; I82-Y98 HydrophobicContact CG1-CD2 3.75Å; I82-Y98 HydrophobicContact CG1-CE1 4.06Å; I82-Y98 HydrophobicContact CG1-CE2 3.92Å; I82-Y98 HydrophobicContact CG1-CG 3.7Å; I82-Y98 HydrophobicContact CG2-CG 4.2Å; K94-Y98 PolarHBondContact O-N 2.91Å; L95-Y98 PolarHBondContact O-N 3.27Å; Y98-S100 VanDerWaalsContact C-N 3.28Å; Y98-S100 PolarHBondContact O-N 2.97Å; Y98-E101 PolarHBondContact O-N 3.01Å; Y98-E101 VanDerWaalsContact O-N 3.14Å; Y98-H102 AromaticContact CD1-CD2 3.83Å; Y98-H102 AromaticContact CD2-CD2 3.57Å; Y98-H102 AromaticContact CD2-NE2 3.7Å; Y98-H102 AromaticContact CE1-CD2 3.56Å; Y98-H102 AromaticContact CE2-CD2 3.3Å; Y98-H102 WeakPolarHBondContact CE2-CD2 3.03Å; Y98-H102 AromaticContact CE2-NE2 3.15Å; Y98-H102 WeakPolarHBondContact CE2-NE2 3.3Å; Y98-H102 AromaticContact CG-CD2 3.83Å; Y98-H102 AromaticContact CZ-CD2 3.29Å; Y98-H102 AromaticContact CZ-NE2 3.44Å; Y98-H102 PolarHBondContact O-CD2 3.19Å; Y98-H102 PolarHBondContact O-N 3.22Å; Y98-H102 VanDerWaalsContact O-N 3.11Å
99	F	74.1	Confident	75.5	Confident	49 Å²	49	72.2 Å²	72.2	22%	0.215	37%	0.368	C	S	.	.	H	α-helix	trans	-64.2	-35.8	178.8	-77	-63	0	0	0	111.8	F41 F45 F65 L95 C96 D97 E101 H102 L103	F41-F99 HydrophobicContact CD1-CB 4.36Å; F41-F99 HydrophobicContact CE1-CB 4.12Å; F45-F99 HydrophobicContact CZ-CD2 4.19Å; F65-F99 HydrophobicContact CD1-CZ 4.26Å; F65-F99 AromaticContact CE1-CE2 3.88Å; F65-F99 HydrophobicContact CE1-CE2 3.88Å; F65-F99 AromaticContact CE1-CZ 3.62Å; F65-F99 HydrophobicContact CE1-CZ 3.62Å; F65-F99 AromaticContact CZ-CE2 3.99Å; F65-F99 HydrophobicContact CZ-CE2 3.99Å; F65-F99 HydrophobicContact CZ-CZ 4.18Å; L95-F99 HydrophobicContact CD1-CD2 3.66Å; L95-F99 HydrophobicContact CD1-CE2 3.25Å; L95-F99 HydrophobicContact CD1-CZ 4.13Å; L95-F99 HydrophobicContact CD2-CE2 4.15Å; L95-F99 HydrophobicContact CG-CD2 3.77Å; L95-F99 HydrophobicContact CG-CE2 3.59Å; L95-F99 VanDerWaalsContact O-CD2 3.26Å; L95-F99 WeakPolarHBondContact O-CD2 3.48Å; L95-F99 PolarHBondContact O-N 2.82Å; C96-F99 PolarHBondContact O-N 2.85Å; D97-F99 PolarHBondContact O-N 3.33Å; F99-E101 PolarHBondContact O-N 3.48Å; F99-H102 CarbonylContact O-C 3.58Å; F99-H102 PolarHBondContact O-N 3.38Å; F99-L103 WeakPolarHBondContact O-CD1 3.48Å; F99-L103 WeakPolarHBondContact O-CG 3.49Å; F99-L103 PolarHBondContact O-N 3.07Å
100	S	74.7	Confident	76	Confident	16 Å²	16	71.1 Å²	71.1	11%	0.112	36%	0.362	C	S	.	.	H	α-helix	trans	-58.7	-30.4	176.3	-65.3	0	0	0	0	113.3	C96 D97 Y98 R107	C96-S100 VanDerWaalsContact O-CB 3.24Å; C96-S100 WeakPolarHBondContact O-CB 3.27Å; C96-S100 PolarHBondContact O-N 2.88Å; C96-S100 PolarHBondContact O-OG 3.42Å; D97-S100 WeakPolarHBondContact O-CB 3.45Å; D97-S100 PolarHBondContact O-N 3.05Å; Y98-S100 VanDerWaalsContact C-N 3.28Å; Y98-S100 PolarHBondContact O-N 2.97Å; S100-R107 PolarHBondContact O-NH2 3.42Å
101	E	77.8	Confident	76.3	Confident	158 Å²	158	72.9 Å²	72.9	74%	0.738	38%	0.376	S	S	*	.	H	α-helix	trans	-80.1	-34.2	172.5	-67.1	-171	166.8	0	0	112.7	D97 Y98 F99	D97-E101 PolarHBondContact O-N 3.24Å; D97-E101 VanDerWaalsContact O-N 3.14Å; Y98-E101 PolarHBondContact O-N 3.01Å; Y98-E101 VanDerWaalsContact O-N 3.14Å; F99-E101 PolarHBondContact O-N 3.48Å
102	H	75.6	Confident	76.8	Confident	112 Å²	112	72.1 Å²	72.1	52%	0.519	38%	0.383	S	S	.	.	H	α-helix	trans	-92.7	-1.8	-173.7	-71.6	-67.2	0	0	0	116.3	Y98 F99 G104	Y98-H102 AromaticContact CD1-CD2 3.83Å; Y98-H102 AromaticContact CD2-CD2 3.57Å; Y98-H102 AromaticContact CD2-NE2 3.7Å; Y98-H102 AromaticContact CE1-CD2 3.56Å; Y98-H102 AromaticContact CE2-CD2 3.3Å; Y98-H102 WeakPolarHBondContact CE2-CD2 3.03Å; Y98-H102 AromaticContact CE2-NE2 3.15Å; Y98-H102 WeakPolarHBondContact CE2-NE2 3.3Å; Y98-H102 AromaticContact CG-CD2 3.83Å; Y98-H102 AromaticContact CZ-CD2 3.29Å; Y98-H102 AromaticContact CZ-NE2 3.44Å; Y98-H102 PolarHBondContact O-CD2 3.19Å; Y98-H102 PolarHBondContact O-N 3.22Å; Y98-H102 VanDerWaalsContact O-N 3.11Å; F99-H102 CarbonylContact O-C 3.58Å; F99-H102 PolarHBondContact O-N 3.38Å; H102-G104 VanDerWaalsContact C-N 3.3Å; H102-G104 PolarHBondContact O-N 3.23Å
103	L	69.3	Low	77.7	Confident	27 Å²	27	73.2 Å²	73.2	14%	0.141	39%	0.388	C	S	.	.			trans	-64.5	-27.4	-177.2	-83.1	157.5	0	0	0	116	F41 F99 V105 Y106 R107 L110	F41-L103 HydrophobicContact CE1-CD1 4.22Å; F41-L103 HydrophobicContact CE1-CD2 4.13Å; F41-L103 HydrophobicContact CE1-CG 4.46Å; F41-L103 HydrophobicContact CE2-CD1 3.56Å; F41-L103 HydrophobicContact CZ-CD1 3.2Å; F41-L103 HydrophobicContact CZ-CD2 3.61Å; F41-L103 HydrophobicContact CZ-CG 3.78Å; F99-L103 WeakPolarHBondContact O-CD1 3.48Å; F99-L103 WeakPolarHBondContact O-CG 3.49Å; F99-L103 PolarHBondContact O-N 3.07Å; L103-V105 PolarHBondContact O-N 2.92Å; L103-Y106 WeakPolarHBondContact O-CB 3.31Å; L103-Y106 PolarHBondContact O-N 3.4Å; L103-R107 HydrophobicContact CB-CB 4.15Å; L103-L110 HydrophobicContact CD1-CD1 4.42Å; L103-L110 HydrophobicContact CD2-CD1 3.35Å; L103-L110 HydrophobicContact CD2-CG 4.44Å; L103-L110 HydrophobicContact CG-CD1 4.46Å
104	G	78.1	Confident	78.3	Confident	55 Å²	55	66.5 Å²	66.5	57%	0.567	36%	0.356	S	S	*	.	G	3₁₀ helix	trans	46.4	-122.9	-178.9	0	0	0	0	0	113.4	H102 Y106 R107	H102-G104 VanDerWaalsContact C-N 3.3Å; H102-G104 PolarHBondContact O-N 3.23Å; G104-Y106 PolarHBondContact O-N 2.73Å; G104-R107 WeakPolarHBondContact O-CB 2.96Å; G104-R107 PolarHBondContact O-N 3.25Å
105	V	79.8	Confident	78.9	Confident	118 Å²	118	66.8 Å²	66.8	72%	0.715	37%	0.367	S	S	*	.	G	3₁₀ helix	trans	-67.3	-16.1	-177.1	-62	0	0	0	0	114.4	L103 P108	L103-V105 PolarHBondContact O-N 2.92Å; V105-P108 WeakPolarHBondContact O-CD 3.35Å; V105-P108 WeakPolarHBondContact O-CG 3.44Å
106	Y	80.6	Confident	79.6	Confident	127 Å²	127	70 Å²	70	50%	0.498	38%	0.384	S	S	.	.	G	3₁₀ helix	trans	-83.4	-14.5	178.5	-69.2	-85.1	0	0	0	113.1	L103 G104 V109 L110	L103-Y106 WeakPolarHBondContact O-CB 3.31Å; L103-Y106 PolarHBondContact O-N 3.4Å; G104-Y106 PolarHBondContact O-N 2.73Å; Y106-V109 WeakPolarHBondContact O-CA 3.36Å; Y106-V109 WeakPolarHBondContact O-CB 3.43Å; Y106-V109 PolarHBondContact O-N 3.37Å; Y106-L110 PolarHBondContact O-N 2.96Å
107	R	78.7	Confident	80.4	Confident	136 Å²	136	73.2 Å²	73.2	51%	0.513	40%	0.401	S	S	.	.	H	α-helix	trans	-51.2	-52.3	176.2	-168.9	-177.9	-132.9	135.6	9	113.3	S100 L103 G104 V109 L110 A111	S100-R107 PolarHBondContact O-NH2 3.42Å; L103-R107 HydrophobicContact CB-CB 4.15Å; G104-R107 WeakPolarHBondContact O-CB 2.96Å; G104-R107 PolarHBondContact O-N 3.25Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 2.85Å; R107-L110 PolarHBondContact O-N 2.92Å; R107-A111 WeakPolarHBondContact O-CB 3.39Å; R107-A111 PolarHBondContact O-N 3.43Å; R107-A111 VanDerWaalsContact O-N 3.09Å
108	P	79.5	Confident	80.9	Confident	87 Å²	87	75.1 Å²	75.1	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-64.5	-29.3	175.8	24.8	-35.3	0	0	0	113.7	V105 A112	V105-P108 WeakPolarHBondContact O-CD 3.35Å; V105-P108 WeakPolarHBondContact O-CG 3.44Å; P108-A112 WeakPolarHBondContact O-CB 3.45Å; P108-A112 PolarHBondContact O-N 3.47Å
109	V	84.2	Confident	81.4	Confident	73 Å²	73	74.5 Å²	74.5	44%	0.442	41%	0.41	S	S	.	.	H	α-helix	trans	-66.5	-49.4	177.5	179.4	0	0	0	0	110.4	Y106 R107 A111 A112 L113	Y106-V109 WeakPolarHBondContact O-CA 3.36Å; Y106-V109 WeakPolarHBondContact O-CB 3.43Å; Y106-V109 PolarHBondContact O-N 3.37Å; R107-V109 VanDerWaalsContact C-N 3.28Å; R107-V109 PolarHBondContact O-N 2.85Å; V109-A111 PolarHBondContact O-N 2.72Å; V109-A112 PolarHBondContact O-N 3.16Å; V109-L113 HydrophobicContact CG1-CD1 4.38Å; V109-L113 WeakPolarHBondContact O-CG 3.35Å; V109-L113 PolarHBondContact O-N 3.34Å
110	L	82.3	Confident	82.1	Confident	32 Å²	32	73.8 Å²	73.8	17%	0.168	41%	0.41	C	S	.	.	H	α-helix	trans	-66.7	-37.3	179.4	-60.2	-176.6	0	0	0	112.1	L40 F41 L103 Y106 R107 A112 L113 E114	L40-L110 HydrophobicContact CD2-CB 4.3Å; L40-L110 HydrophobicContact CD2-CD2 3.71Å; L40-L110 HydrophobicContact CD2-CG 4.43Å; F41-L110 HydrophobicContact CE1-CD1 3.99Å; F41-L110 HydrophobicContact CE2-CD1 4.13Å; F41-L110 HydrophobicContact CZ-CD1 3.34Å; L103-L110 HydrophobicContact CD1-CD1 4.42Å; L103-L110 HydrophobicContact CD2-CD1 3.35Å; L103-L110 HydrophobicContact CD2-CG 4.44Å; L103-L110 HydrophobicContact CG-CD1 4.46Å; Y106-L110 PolarHBondContact O-N 2.96Å; R107-L110 PolarHBondContact O-N 2.92Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.18Å; L110-L113 HydrophobicContact CD2-CD1 4.23Å; L110-L113 PolarHBondContact O-N 2.9Å; L110-E114 PolarHBondContact O-N 3.1Å
111	A	81.4	Confident	82.8	Confident	37 Å²	37	77.3 Å²	77.3	31%	0.306	43%	0.427	S	S	.	.	H	α-helix	trans	-62.4	-40.5	173.7	0	0	0	0	0	112.1	R107 V109 E114 S115	R107-A111 WeakPolarHBondContact O-CB 3.39Å; R107-A111 PolarHBondContact O-N 3.43Å; R107-A111 VanDerWaalsContact O-N 3.09Å; V109-A111 PolarHBondContact O-N 2.72Å; A111-E114 PolarHBondContact O-N 3.04Å; A111-S115 WeakPolarHBondContact O-CB 3.45Å; A111-S115 PolarHBondContact O-N 3.4Å
112	A	84.7	Confident	83.3	Confident	60 Å²	60	72.8 Å²	72.8	50%	0.496	42%	0.416	S	S	.	.	H	α-helix	trans	-65.4	-40.5	174.9	0	0	0	0	0	112	P108 V109 L110 S115 L116	P108-A112 WeakPolarHBondContact O-CB 3.45Å; P108-A112 PolarHBondContact O-N 3.47Å; V109-A112 PolarHBondContact O-N 3.16Å; L110-A112 VanDerWaalsContact C-N 3.34Å; L110-A112 PolarHBondContact O-N 3.18Å; A112-S115 PolarHBondContact O-N 3.11Å; A112-L116 WeakPolarHBondContact O-CB 3.39Å; A112-L116 PolarHBondContact O-N 2.87Å
113	L	85.7	Confident	83.9	Confident	59 Å²	59	69.9 Å²	69.9	31%	0.309	41%	0.412	S	S	.	.	H	α-helix	trans	-63.3	-40.9	174.9	-72.3	173.1	0	0	0	112.3	L40 V109 L110 L116 N117 L156	L40-L113 HydrophobicContact CD1-CB 4.43Å; V109-L113 HydrophobicContact CG1-CD1 4.38Å; V109-L113 WeakPolarHBondContact O-CG 3.35Å; V109-L113 PolarHBondContact O-N 3.34Å; L110-L113 HydrophobicContact CD2-CD1 4.23Å; L110-L113 PolarHBondContact O-N 2.9Å; L113-L116 PolarHBondContact O-N 3.42Å; L113-N117 WeakPolarHBondContact O-CB 3.49Å; L113-N117 PolarHBondContact O-N 2.98Å; L113-L156 HydrophobicContact CD2-CD2 4.3Å
114	E	83.9	Confident	84.8	Confident	11 Å²	11	72.9 Å²	72.9	5%	0.051	43%	0.426	C	S	.	.	H	α-helix	trans	-63.5	-45.5	174.5	-169.4	-169.6	156.1	0	0	111.3	G37 T39 L40 L110 A111 L116 N117 R118	G37-E114 WeakPolarHBondContact CA-OE2 3.31Å; G37-E114 PolarHBondContact N-OE2 3.46Å; T39-E114 PolarHBondContact OG1-OE1 3.46Å; L40-E114 HydrophobicContact CD1-CB 4.35Å; L110-E114 PolarHBondContact O-N 3.1Å; A111-E114 PolarHBondContact O-N 3.04Å; E114-L116 VanDerWaalsContact C-N 3.3Å; E114-L116 PolarHBondContact O-N 2.83Å; E114-N117 PolarHBondContact O-N 2.9Å; E114-R118 WeakPolarHBondContact O-CG 3.46Å; E114-R118 PolarHBondContact O-N 3.34Å; E114-R118 IonicContact OE1-CZ 3.18Å; E114-R118 IonicContact OE1-NE 3.29Å; E114-R118 PolarHBondContact OE1-NE 3.28Å; E114-R118 IonicContact OE1-NH2 2.65Å; E114-R118 PolarHBondContact OE1-NH2 2.71Å
115	S	87.3	Confident	85.3	Confident	77 Å²	77	75.6 Å²	75.6	54%	0.538	43%	0.428	S	S	.	.	H	α-helix	trans	-60.7	-40.6	176.2	-174	0	0	0	0	111.9	A111 A112 A119	A111-S115 WeakPolarHBondContact O-CB 3.45Å; A111-S115 PolarHBondContact O-N 3.4Å; A112-S115 PolarHBondContact O-N 3.11Å; S115-A119 WeakPolarHBondContact O-CB 3.49Å; S115-A119 PolarHBondContact O-N 3.42Å
116	L	88.3	Confident	85.6	Confident	66 Å²	66	72.6 Å²	72.6	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-63.1	-47.2	175.9	178.3	60.5	0	0	0	110.8	A112 L113 E114 R118 A119 V120 L153	A112-L116 WeakPolarHBondContact O-CB 3.39Å; A112-L116 PolarHBondContact O-N 2.87Å; L113-L116 PolarHBondContact O-N 3.42Å; E114-L116 VanDerWaalsContact C-N 3.3Å; E114-L116 PolarHBondContact O-N 2.83Å; L116-R118 PolarHBondContact O-N 2.63Å; L116-A119 PolarHBondContact O-N 3.22Å; L116-A119 VanDerWaalsContact O-N 3.16Å; L116-V120 HydrophobicContact CD1-CG2 4.21Å; L116-V120 WeakPolarHBondContact O-CG2 3.41Å; L116-V120 PolarHBondContact O-N 3.1Å; L116-L153 HydrophobicContact CD2-CD2 3.59Å; L116-L153 HydrophobicContact CG-CD2 4.48Å
117	N	87.6	Confident	85.9	Confident	77 Å²	77	68.6 Å²	68.6	41%	0.412	40%	0.404	S	S	.	.	H	α-helix	trans	-60	-44.9	178.8	-167.6	18.6	0	0	0	111.5	L113 E114 A119 V120 L121	L113-N117 WeakPolarHBondContact O-CB 3.49Å; L113-N117 PolarHBondContact O-N 2.98Å; E114-N117 PolarHBondContact O-N 2.9Å; N117-A119 VanDerWaalsContact C-N 3.35Å; N117-A119 PolarHBondContact O-N 3.23Å; N117-V120 PolarHBondContact O-N 3.39Å; N117-L121 WeakPolarHBondContact O-CG 3.35Å; N117-L121 PolarHBondContact O-N 2.98Å
118	R	87.1	Confident	86.2	Confident	130 Å²	130	69.9 Å²	69.9	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-59.4	-43.3	174.1	-71.4	-178.9	-176.3	-167.3	1	112.3	E114 L116 A122	E114-R118 WeakPolarHBondContact O-CG 3.46Å; E114-R118 PolarHBondContact O-N 3.34Å; E114-R118 IonicContact OE1-CZ 3.18Å; E114-R118 IonicContact OE1-NE 3.29Å; E114-R118 PolarHBondContact OE1-NE 3.28Å; E114-R118 IonicContact OE1-NH2 2.65Å; E114-R118 PolarHBondContact OE1-NH2 2.71Å; L116-R118 PolarHBondContact O-N 2.63Å; R118-A122 WeakPolarHBondContact O-CB 3.44Å; R118-A122 PolarHBondContact O-N 3.14Å
119	A	89.2	Confident	86.3	Confident	57 Å²	57	72.4 Å²	72.4	47%	0.471	42%	0.421	S	S	.	.	H	α-helix	trans	-65.5	-41.8	179.3	0	0	0	0	0	112.3	S115 L116 N117 A122 A123	S115-A119 WeakPolarHBondContact O-CB 3.49Å; S115-A119 PolarHBondContact O-N 3.42Å; L116-A119 PolarHBondContact O-N 3.22Å; L116-A119 VanDerWaalsContact O-N 3.16Å; N117-A119 VanDerWaalsContact C-N 3.35Å; N117-A119 PolarHBondContact O-N 3.23Å; A119-A122 PolarHBondContact O-N 3.09Å; A119-A123 WeakPolarHBondContact O-CB 3.34Å; A119-A123 PolarHBondContact O-N 3.38Å
120	V	89	Confident	86.3	Confident	35 Å²	35	75.2 Å²	75.2	21%	0.212	43%	0.43	C	S	.	.	H	α-helix	trans	-63.4	-47.9	176.6	172	0	0	0	0	110.6	L116 N117 A122 A123 M124 T149	L116-V120 HydrophobicContact CD1-CG2 4.21Å; L116-V120 WeakPolarHBondContact O-CG2 3.41Å; L116-V120 PolarHBondContact O-N 3.1Å; N117-V120 PolarHBondContact O-N 3.39Å; V120-A122 PolarHBondContact O-N 3.48Å; V120-A123 PolarHBondContact O-N 3Å; V120-M124 HydrophobicContact CG1-CG 4.42Å; V120-M124 HydrophobicContact CG1-SD 4.02Å; V120-M124 WeakPolarHBondContact O-CB 3.36Å; V120-M124 VanDerWaalsContact O-CG 3.3Å; V120-M124 WeakPolarHBondContact O-CG 3.48Å; V120-M124 PolarHBondContact O-N 3.15Å; V120-T149 HydrophobicContact CG2-CG2 4.04Å
121	L	88.8	Confident	86.6	Confident	90 Å²	90	77.2 Å²	77.2	47%	0.471	44%	0.436	S	S	.	.	H	α-helix	trans	-60.6	-45.7	177.7	-71	172.2	0	0	0	111.9	N117 A123 M124 D125	N117-L121 WeakPolarHBondContact O-CG 3.35Å; N117-L121 PolarHBondContact O-N 2.98Å; L121-A123 VanDerWaalsContact C-N 3.33Å; L121-A123 PolarHBondContact O-N 2.97Å; L121-M124 WeakPolarHBondContact O-CB 3.39Å; L121-M124 PolarHBondContact O-N 3.19Å; L121-M124 VanDerWaalsContact O-N 3.16Å; L121-D125 PolarHBondContact O-N 3.14Å
122	A	89.1	Confident	86.9	Confident	62 Å²	62	83.7 Å²	83.7	51%	0.512	46%	0.46	S	S	.	.	H	α-helix	trans	-61.1	-41.8	176.5	0	0	0	0	0	112.2	R118 A119 V120 M124 D125 A126	R118-A122 WeakPolarHBondContact O-CB 3.44Å; R118-A122 PolarHBondContact O-N 3.14Å; A119-A122 PolarHBondContact O-N 3.09Å; V120-A122 PolarHBondContact O-N 3.48Å; A122-M124 VanDerWaalsContact C-N 3.34Å; A122-D125 PolarHBondContact O-N 3.45Å; A122-A126 WeakPolarHBondContact O-CB 3.42Å; A122-A126 PolarHBondContact O-N 2.96Å
123	A	87.6	Confident	87.1	Confident	51 Å²	51	91.8 Å²	91.8	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-64.6	-38.8	175.4	0	0	0	0	0	111.8	A119 V120 L121 T127	A119-A123 WeakPolarHBondContact O-CB 3.34Å; A119-A123 PolarHBondContact O-N 3.38Å; V120-A123 PolarHBondContact O-N 3Å; L121-A123 VanDerWaalsContact C-N 3.33Å; L121-A123 PolarHBondContact O-N 2.97Å; A123-T127 VanDerWaalsContact O-CB 3.3Å; A123-T127 WeakPolarHBondContact O-CB 3.24Å; A123-T127 WeakPolarHBondContact O-CG2 3.49Å; A123-T127 PolarHBondContact O-N 3.5Å; A123-T127 PolarHBondContact O-OG1 3Å
124	M	88.7	Confident	87.3	Confident	90 Å²	90	90.4 Å²	90.4	44%	0.443	48%	0.475	S	S	.	.	H	α-helix	trans	-65.4	-43.9	175.5	-73.3	-179.9	68.1	0	0	111.9	V120 L121 A122 T127 K128 L146	V120-M124 HydrophobicContact CG1-CG 4.42Å; V120-M124 HydrophobicContact CG1-SD 4.02Å; V120-M124 WeakPolarHBondContact O-CB 3.36Å; V120-M124 VanDerWaalsContact O-CG 3.3Å; V120-M124 WeakPolarHBondContact O-CG 3.48Å; V120-M124 PolarHBondContact O-N 3.15Å; L121-M124 WeakPolarHBondContact O-CB 3.39Å; L121-M124 PolarHBondContact O-N 3.19Å; L121-M124 VanDerWaalsContact O-N 3.16Å; A122-M124 VanDerWaalsContact C-N 3.34Å; M124-T127 WeakPolarHBondContact CA-OG1 3.37Å; M124-T127 PolarHBondContact O-OG1 3.48Å; M124-K128 WeakPolarHBondContact O-CB 3.36Å; M124-K128 PolarHBondContact O-N 3.2Å; M124-L146 HydrophobicContact CG-CD2 4.1Å
125	D	88.2	Confident	87.7	Confident	112 Å²	112	92.5 Å²	92.5	60%	0.599	49%	0.49	S	S	*	.	H	α-helix	trans	-65.3	-44.2	177.8	-75.1	-29	0	0	0	111.9	L121 A122 K128 L129	L121-D125 PolarHBondContact O-N 3.14Å; A122-D125 PolarHBondContact O-N 3.45Å; D125-K128 PolarHBondContact O-N 2.71Å; D125-L129 PolarHBondContact O-N 3.34Å
126	A	86.2	Confident	87.8	Confident	56 Å²	56	96.8 Å²	96.8	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-62	-49.2	176.8	0	0	0	0	0	111.4	A122 K128 L129 E130	A122-A126 WeakPolarHBondContact O-CB 3.42Å; A122-A126 PolarHBondContact O-N 2.96Å; A126-K128 PolarHBondContact O-N 2.88Å; A126-L129 PolarHBondContact O-N 3.47Å; A126-E130 PolarHBondContact O-N 3.04Å
127	T	85.5	Confident	88	Confident	42 Å²	42	98.4 Å²	98.4	26%	0.258	51%	0.512	S	S	.	.	H	α-helix	trans	-67.9	-36.5	-179.1	54.9	0	0	0	0	111.8	A123 M124 L129 E130 Y131 T142	A123-T127 VanDerWaalsContact O-CB 3.3Å; A123-T127 WeakPolarHBondContact O-CB 3.24Å; A123-T127 WeakPolarHBondContact O-CG2 3.49Å; A123-T127 PolarHBondContact O-N 3.5Å; A123-T127 PolarHBondContact O-OG1 3Å; M124-T127 WeakPolarHBondContact CA-OG1 3.37Å; M124-T127 PolarHBondContact O-OG1 3.48Å; T127-L129 VanDerWaalsContact C-N 3.29Å; T127-L129 PolarHBondContact O-N 3.36Å; T127-E130 PolarHBondContact O-N 3.5Å; T127-Y131 WeakPolarHBondContact O-CA 3.41Å; T127-Y131 WeakPolarHBondContact O-CB 3.23Å; T127-Y131 PolarHBondContact O-N 3.43Å; T127-T142 HydrophobicContact CG2-CG2 3.83Å
128	K	86.7	Confident	87.9	Confident	163 Å²	163	98.7 Å²	98.7	71%	0.709	51%	0.513	S	S	*	.	H	α-helix	trans	-57.5	-40.3	176.3	-178.9	178.8	179.2	-177.7	0	112.6	M124 D125 A126	M124-K128 WeakPolarHBondContact O-CB 3.36Å; M124-K128 PolarHBondContact O-N 3.2Å; D125-K128 PolarHBondContact O-N 2.71Å; A126-K128 PolarHBondContact O-N 2.88Å
129	L	81.1	Confident	87.9	Confident	140 Å²	140	93.5 Å²	93.5	73%	0.733	49%	0.494	S	S	*	.	H	α-helix	trans	-70.5	-35.1	-178	-155.3	101.6	0	0	0	112.6	D125 A126 T127	D125-L129 PolarHBondContact O-N 3.34Å; A126-L129 PolarHBondContact O-N 3.47Å; T127-L129 VanDerWaalsContact C-N 3.29Å; T127-L129 PolarHBondContact O-N 3.36Å
130	E	84.3	Confident	87.9	Confident	133 Å²	133	96.5 Å²	96.5	62%	0.621	50%	0.497	S	S	*	.	H	α-helix	trans	-95.8	-22.9	-173.5	-64.2	-176.4	170.8	0	0	113	A126 T127 E132 R133 A134	A126-E130 PolarHBondContact O-N 3.04Å; T127-E130 PolarHBondContact O-N 3.5Å; E130-E132 PolarHBondContact O-N 3.28Å; E130-R133 CarbonylContact O-C 3.57Å; E130-R133 PolarHBondContact O-N 3.33Å; E130-A134 VanDerWaalsContact O-CB 3.3Å; E130-A134 WeakPolarHBondContact O-CB 3.47Å; E130-A134 PolarHBondContact O-N 3.03Å
131	Y	88.7	Confident	88	Confident	73 Å²	73	97.8 Å²	97.8	29%	0.286	51%	0.505	S	S	.	.	H	α-helix	trans	-56	-45.2	-170.2	-178.8	-98.5	0	0	0	113.9	T127 R133 A134 Q139 T142 R143	T127-Y131 WeakPolarHBondContact O-CA 3.41Å; T127-Y131 WeakPolarHBondContact O-CB 3.23Å; T127-Y131 PolarHBondContact O-N 3.43Å; Y131-R133 VanDerWaalsContact C-N 3.26Å; Y131-R133 PolarHBondContact O-N 3.38Å; Y131-A134 PolarHBondContact O-N 2.9Å; Y131-Q139 HydrophobicContact CD2-CB 4.2Å; Y131-Q139 HydrophobicContact CD2-CG 3.93Å; Y131-Q139 HydrophobicContact CE1-CG 4.49Å; Y131-Q139 HydrophobicContact CE2-CB 3.61Å; Y131-Q139 HydrophobicContact CE2-CG 3.74Å; Y131-Q139 HydrophobicContact CG-CG 4.38Å; Y131-Q139 VanDerWaalsContact O-CG 3.3Å; Y131-Q139 WeakPolarHBondContact O-CG 3.33Å; Y131-Q139 PolarHBondContact O-NE2 3.34Å; Y131-T142 HydrophobicContact CD2-CG2 4.06Å; Y131-T142 HydrophobicContact CE2-CG2 4.5Å; Y131-R143 HydrophobicContact CE2-CG 4.36Å; Y131-R143 PolarHBondContact OH-NE 3.08Å
132	E	87.1	Confident	88	Confident	173 Å²	173	94.7 Å²	94.7	81%	0.808	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-28.8	-179	-66.1	-172.5	163.8	0	0	112.8	E130	E130-E132 PolarHBondContact O-N 3.28Å
133	R	88.7	Confident	87.9	Confident	231 Å²	231	97.4 Å²	97.4	87%	0.872	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	-13.9	-178.3	-65.2	179	172.5	171.4	-1.4	112.9	E130 Y131	E130-R133 CarbonylContact O-C 3.57Å; E130-R133 PolarHBondContact O-N 3.33Å; Y131-R133 VanDerWaalsContact C-N 3.26Å; Y131-R133 PolarHBondContact O-N 3.38Å
134	A	89.8	Confident	88	Confident	30 Å²	30	100 Å²	100	25%	0.248	49%	0.489	C	S	.	.	S	Bend	trans	-75	162.5	-176.9	0	0	0	0	0	112.9	E130 Y131 D138 Q139	E130-A134 VanDerWaalsContact O-CB 3.3Å; E130-A134 WeakPolarHBondContact O-CB 3.47Å; E130-A134 PolarHBondContact O-N 3.03Å; Y131-A134 PolarHBondContact O-N 2.9Å; A134-D138 HydrophobicContact CB-CB 3.88Å; A134-Q139 HydrophobicContact CB-CG 4.37Å; A134-Q139 PolarHBondContact O-NE2 2.78Å
135	S	92.7	Very high	88.1	Confident	55 Å²	55	100.3 Å²	100.3	39%	0.385	49%	0.492	S	S	.	.			trans	-67.8	162.5	177.9	80.2	0	0	0	0	111.8	V137 D138 Q139	S135-V137 PolarHBondContact O-N 3.02Å; S135-V137 PolarHBondContact OG-N 3.34Å; S135-D138 VanDerWaalsContact CB-OD2 3.32Å; S135-D138 WeakPolarHBondContact CB-OD2 3.24Å; S135-D138 PolarHBondContact N-OD2 2.97Å; S135-D138 PolarHBondContact O-N 3.2Å; S135-D138 VanDerWaalsContact O-N 3.15Å; S135-D138 PolarHBondContact OG-N 3.18Å; S135-D138 VanDerWaalsContact OG-N 3.14Å; S135-D138 PolarHBondContact OG-OD2 3.18Å; S135-Q139 WeakPolarHBondContact O-CG 3.34Å; S135-Q139 PolarHBondContact O-N 3.08Å
136	K	89.3	Confident	88.1	Confident	167 Å²	167	98.4 Å²	98.4	73%	0.726	48%	0.481	S	S	*	.	H	α-helix	trans	-59.8	-29.7	175.9	-69.2	-63.9	-179.9	-170.4	0	113.1	F140	K136-F140 PolarHBondContact O-N 2.96Å
137	V	91.9	Very high	88.3	Confident	100 Å²	100	105.5 Å²	105.5	61%	0.606	50%	0.496	S	S	*	.	H	α-helix	trans	-72	-47	175.5	179	0	0	0	0	110	S135 Q139 F140 V141	S135-V137 PolarHBondContact O-N 3.02Å; S135-V137 PolarHBondContact OG-N 3.34Å; V137-Q139 VanDerWaalsContact C-N 3.34Å; V137-Q139 PolarHBondContact O-N 3.37Å; V137-F140 CarbonylContact O-C 3.58Å; V137-F140 WeakPolarHBondContact O-CA 3.44Å; V137-F140 WeakPolarHBondContact O-CB 2.87Å; V137-F140 PolarHBondContact O-N 3.25Å; V137-V141 HydrophobicContact CG1-CG2 4.46Å; V137-V141 WeakPolarHBondContact O-CG2 3.46Å; V137-V141 PolarHBondContact O-N 3.05Å
138	D	86.6	Confident	88.6	Confident	82 Å²	82	106.9 Å²	106.9	44%	0.439	50%	0.5	S	S	.	.	H	α-helix	trans	-66.3	-36.8	-179.9	-57.6	-37.9	0	0	0	112.2	A134 S135 F140 V141 T142	A134-D138 HydrophobicContact CB-CB 3.88Å; S135-D138 VanDerWaalsContact CB-OD2 3.32Å; S135-D138 WeakPolarHBondContact CB-OD2 3.24Å; S135-D138 PolarHBondContact N-OD2 2.97Å; S135-D138 PolarHBondContact O-N 3.2Å; S135-D138 VanDerWaalsContact O-N 3.15Å; S135-D138 PolarHBondContact OG-N 3.18Å; S135-D138 VanDerWaalsContact OG-N 3.14Å; S135-D138 PolarHBondContact OG-OD2 3.18Å; D138-F140 VanDerWaalsContact C-N 3.29Å; D138-F140 PolarHBondContact O-N 3.11Å; D138-V141 PolarHBondContact O-N 2.98Å; D138-T142 WeakPolarHBondContact O-CB 3.27Å; D138-T142 PolarHBondContact O-N 2.87Å; D138-T142 PolarHBondContact O-OG1 2.82Å
139	Q	86.9	Confident	88.7	Confident	21 Å²	21	101.7 Å²	101.7	10%	0.098	48%	0.482	C	S	.	.	H	α-helix	trans	-62.5	-37.4	171.2	-70.9	176.8	9	0	0	111.8	Y131 A134 S135 V137 R143	Y131-Q139 HydrophobicContact CD2-CB 4.2Å; Y131-Q139 HydrophobicContact CD2-CG 3.93Å; Y131-Q139 HydrophobicContact CE1-CG 4.49Å; Y131-Q139 HydrophobicContact CE2-CB 3.61Å; Y131-Q139 HydrophobicContact CE2-CG 3.74Å; Y131-Q139 HydrophobicContact CG-CG 4.38Å; Y131-Q139 VanDerWaalsContact O-CG 3.3Å; Y131-Q139 WeakPolarHBondContact O-CG 3.33Å; Y131-Q139 PolarHBondContact O-NE2 3.34Å; A134-Q139 HydrophobicContact CB-CG 4.37Å; A134-Q139 PolarHBondContact O-NE2 2.78Å; S135-Q139 WeakPolarHBondContact O-CG 3.34Å; S135-Q139 PolarHBondContact O-N 3.08Å; V137-Q139 VanDerWaalsContact C-N 3.34Å; V137-Q139 PolarHBondContact O-N 3.37Å; Q139-R143 WeakPolarHBondContact O-CG 3.35Å; Q139-R143 PolarHBondContact O-N 2.92Å; Q139-R143 VanDerWaalsContact O-N 3.12Å; Q139-R143 PolarHBondContact O-NE 3.46Å
140	F	90.1	Very high	89.1	Confident	120 Å²	120	99.2 Å²	99.2	53%	0.526	47%	0.472	S	S	.	.	H	α-helix	trans	-67.2	-47.2	173.9	167.2	-92.4	0	0	0	111.2	K136 V137 D138 T142 R143 F144	K136-F140 PolarHBondContact O-N 2.96Å; V137-F140 CarbonylContact O-C 3.58Å; V137-F140 WeakPolarHBondContact O-CA 3.44Å; V137-F140 WeakPolarHBondContact O-CB 2.87Å; V137-F140 PolarHBondContact O-N 3.25Å; D138-F140 VanDerWaalsContact C-N 3.29Å; D138-F140 PolarHBondContact O-N 3.11Å; F140-T142 VanDerWaalsContact C-N 3.3Å; F140-T142 PolarHBondContact O-N 3.12Å; F140-R143 PolarHBondContact O-N 3.37Å; F140-F144 WeakPolarHBondContact O-CB 3.34Å; F140-F144 PolarHBondContact O-N 3.4Å
141	V	89.4	Confident	89.3	Confident	63 Å²	63	96 Å²	96	38%	0.382	46%	0.464	S	S	.	.	H	α-helix	trans	-58.3	-44.7	177.5	172.5	0	0	0	0	110.4	V137 D138 R143 F144 L145	V137-V141 HydrophobicContact CG1-CG2 4.46Å; V137-V141 WeakPolarHBondContact O-CG2 3.46Å; V137-V141 PolarHBondContact O-N 3.05Å; D138-V141 PolarHBondContact O-N 2.98Å; V141-R143 PolarHBondContact O-N 3.33Å; V141-F144 PolarHBondContact O-N 3.36Å; V141-L145 HydrophobicContact CG1-CD1 3.72Å; V141-L145 HydrophobicContact CG1-CG 4.13Å; V141-L145 WeakPolarHBondContact O-CB 3.43Å; V141-L145 VanDerWaalsContact O-CG 3.27Å; V141-L145 WeakPolarHBondContact O-CG 3.3Å; V141-L145 PolarHBondContact O-N 3.25Å
142	T	88.8	Confident	89.3	Confident	25 Å²	25	98 Å²	98	15%	0.153	48%	0.476	C	S	.	.	H	α-helix	trans	-59.1	-48.3	176.3	-57.1	0	0	0	0	111.7	T127 Y131 D138 F140 F144 L145 L146	T127-T142 HydrophobicContact CG2-CG2 3.83Å; Y131-T142 HydrophobicContact CD2-CG2 4.06Å; Y131-T142 HydrophobicContact CE2-CG2 4.5Å; D138-T142 WeakPolarHBondContact O-CB 3.27Å; D138-T142 PolarHBondContact O-N 2.87Å; D138-T142 PolarHBondContact O-OG1 2.82Å; F140-T142 VanDerWaalsContact C-N 3.3Å; F140-T142 PolarHBondContact O-N 3.12Å; T142-F144 VanDerWaalsContact C-N 3.33Å; T142-F144 PolarHBondContact O-N 2.87Å; T142-L145 PolarHBondContact O-N 3.37Å; T142-L146 HydrophobicContact CG2-CD1 4.22Å; T142-L146 WeakPolarHBondContact O-CB 3.43Å; T142-L146 WeakPolarHBondContact O-CG 3.36Å; T142-L146 PolarHBondContact O-N 3.28Å
143	R	86.9	Confident	89.5	Confident	118 Å²	118	93.2 Å²	93.2	45%	0.445	46%	0.456	S	S	.	.	H	α-helix	trans	-62.3	-40	176.6	-79.1	-178.4	-103	121.2	-2.5	112.5	Y131 Q139 F140 V141 R147	Y131-R143 HydrophobicContact CE2-CG 4.36Å; Y131-R143 PolarHBondContact OH-NE 3.08Å; Q139-R143 WeakPolarHBondContact O-CG 3.35Å; Q139-R143 PolarHBondContact O-N 2.92Å; Q139-R143 VanDerWaalsContact O-N 3.12Å; Q139-R143 PolarHBondContact O-NE 3.46Å; F140-R143 PolarHBondContact O-N 3.37Å; V141-R143 PolarHBondContact O-N 3.33Å; R143-R147 WeakPolarHBondContact O-CB 3.39Å; R143-R147 PolarHBondContact O-N 3.26Å; R143-R147 VanDerWaalsContact O-N 3.1Å
144	F	90.8	Very high	89.5	Confident	107 Å²	107	87.7 Å²	87.7	47%	0.469	44%	0.44	S	S	.	.	H	α-helix	trans	-63.7	-51.2	176.6	171.4	-96.5	0	0	0	111.1	F140 V141 T142 L146 R147 E148	F140-F144 WeakPolarHBondContact O-CB 3.34Å; F140-F144 PolarHBondContact O-N 3.4Å; V141-F144 PolarHBondContact O-N 3.36Å; T142-F144 VanDerWaalsContact C-N 3.33Å; T142-F144 PolarHBondContact O-N 2.87Å; F144-L146 PolarHBondContact O-N 3.37Å; F144-R147 PolarHBondContact O-N 3.12Å; F144-E148 WeakPolarHBondContact O-CB 3.4Å; F144-E148 PolarHBondContact O-N 3.03Å
145	L	90.4	Very high	89.5	Confident	95 Å²	95	89 Å²	89	50%	0.497	45%	0.451	S	S	.	.	H	α-helix	trans	-63.1	-39.1	-179	-69.7	174.9	0	0	0	112.4	V141 T142 E148 T149	V141-L145 HydrophobicContact CG1-CD1 3.72Å; V141-L145 HydrophobicContact CG1-CG 4.13Å; V141-L145 WeakPolarHBondContact O-CB 3.43Å; V141-L145 VanDerWaalsContact O-CG 3.27Å; V141-L145 WeakPolarHBondContact O-CG 3.3Å; V141-L145 PolarHBondContact O-N 3.25Å; T142-L145 PolarHBondContact O-N 3.37Å; L145-E148 PolarHBondContact O-N 3.3Å; L145-T149 WeakPolarHBondContact O-CB 3.48Å; L145-T149 PolarHBondContact O-N 2.98Å; L145-T149 PolarHBondContact O-OG1 2.99Å
146	L	89.2	Confident	89.4	Confident	73 Å²	73	90.8 Å²	90.8	38%	0.382	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-47	173.3	-74.5	172.8	0	0	0	111.4	M124 T142 F144 E148 T149 V150	M124-L146 HydrophobicContact CG-CD2 4.1Å; T142-L146 HydrophobicContact CG2-CD1 4.22Å; T142-L146 WeakPolarHBondContact O-CB 3.43Å; T142-L146 WeakPolarHBondContact O-CG 3.36Å; T142-L146 PolarHBondContact O-N 3.28Å; F144-L146 PolarHBondContact O-N 3.37Å; L146-E148 VanDerWaalsContact C-N 3.33Å; L146-E148 PolarHBondContact O-N 2.77Å; L146-T149 PolarHBondContact O-N 3.18Å; L146-V150 WeakPolarHBondContact O-CG2 3.29Å; L146-V150 PolarHBondContact O-N 3.29Å; L146-V150 VanDerWaalsContact O-N 3.11Å
147	R	89.4	Confident	89.4	Confident	205 Å²	205	87.6 Å²	87.6	77%	0.774	44%	0.443	S	S	*	.	H	α-helix	trans	-62.1	-41.7	177.5	-175	179.7	178.6	-163.2	-1.5	111.8	R143 F144 V150 S151	R143-R147 WeakPolarHBondContact O-CB 3.39Å; R143-R147 PolarHBondContact O-N 3.26Å; R143-R147 VanDerWaalsContact O-N 3.1Å; F144-R147 PolarHBondContact O-N 3.12Å; R147-V150 PolarHBondContact O-N 3.11Å; R147-S151 PolarHBondContact O-N 3.02Å
148	E	90.8	Very high	89.2	Confident	71 Å²	71	85.9 Å²	85.9	33%	0.332	44%	0.436	S	S	.	.	H	α-helix	trans	-65.2	-43.4	178	-171.4	57.8	-150	0	0	111	F144 L145 L146 V150 S151 Q152	F144-E148 WeakPolarHBondContact O-CB 3.4Å; F144-E148 PolarHBondContact O-N 3.03Å; L145-E148 PolarHBondContact O-N 3.3Å; L146-E148 VanDerWaalsContact C-N 3.33Å; L146-E148 PolarHBondContact O-N 2.77Å; E148-V150 VanDerWaalsContact C-N 3.3Å; E148-V150 PolarHBondContact O-N 2.97Å; E148-S151 WeakPolarHBondContact O-CA 3.48Å; E148-S151 WeakPolarHBondContact O-CB 3.45Å; E148-S151 PolarHBondContact O-N 3.28Å; E148-Q152 WeakPolarHBondContact O-CG 3.42Å; E148-Q152 PolarHBondContact O-N 3.28Å; E148-Q152 PolarHBondContact OE1-NE2 3.39Å
149	T	89	Confident	89.3	Confident	54 Å²	54	86.1 Å²	86.1	33%	0.331	44%	0.444	S	S	.	.	H	α-helix	trans	-57.5	-43	176.2	-56	0	0	0	0	111.4	V120 L145 L146 Q152 L153	V120-T149 HydrophobicContact CG2-CG2 4.04Å; L145-T149 WeakPolarHBondContact O-CB 3.48Å; L145-T149 PolarHBondContact O-N 2.98Å; L145-T149 PolarHBondContact O-OG1 2.99Å; L146-T149 PolarHBondContact O-N 3.18Å; T149-Q152 PolarHBondContact O-N 3.35Å; T149-L153 HydrophobicContact CG2-CD1 4.4Å; T149-L153 WeakPolarHBondContact O-CG 3.44Å; T149-L153 PolarHBondContact O-N 3.01Å
150	V	89.4	Confident	89.4	Confident	88 Å²	88	90.6 Å²	90.6	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-61.8	-43.7	173.9	172.9	0	0	0	0	111.3	L146 R147 E148 Q152 L153 Q154	L146-V150 WeakPolarHBondContact O-CG2 3.29Å; L146-V150 PolarHBondContact O-N 3.29Å; L146-V150 VanDerWaalsContact O-N 3.11Å; R147-V150 PolarHBondContact O-N 3.11Å; E148-V150 VanDerWaalsContact C-N 3.3Å; E148-V150 PolarHBondContact O-N 2.97Å; V150-Q152 VanDerWaalsContact C-N 3.33Å; V150-Q152 PolarHBondContact O-N 3.03Å; V150-L153 PolarHBondContact O-N 3.46Å; V150-Q154 PolarHBondContact O-N 2.97Å
151	S	89.4	Confident	89.3	Confident	65 Å²	65	89.2 Å²	89.2	46%	0.455	46%	0.463	S	S	.	.	H	α-helix	trans	-61.5	-41	178.5	-163.7	0	0	0	0	112.2	R147 E148 Q154 A155	R147-S151 PolarHBondContact O-N 3.02Å; E148-S151 WeakPolarHBondContact O-CA 3.48Å; E148-S151 WeakPolarHBondContact O-CB 3.45Å; E148-S151 PolarHBondContact O-N 3.28Å; S151-Q154 PolarHBondContact O-N 2.92Å; S151-A155 PolarHBondContact O-N 3.38Å
152	Q	89.4	Confident	89	Confident	115 Å²	115	87.9 Å²	87.9	54%	0.537	46%	0.462	S	S	.	.	H	α-helix	trans	-67.9	-40.3	178	-64.6	-58.7	-31.2	0	0	112	E148 T149 V150 Q154 A155 L156	E148-Q152 WeakPolarHBondContact O-CG 3.42Å; E148-Q152 PolarHBondContact O-N 3.28Å; E148-Q152 PolarHBondContact OE1-NE2 3.39Å; T149-Q152 PolarHBondContact O-N 3.35Å; V150-Q152 VanDerWaalsContact C-N 3.33Å; V150-Q152 PolarHBondContact O-N 3.03Å; Q152-Q154 VanDerWaalsContact C-N 3.3Å; Q152-Q154 PolarHBondContact O-N 3.49Å; Q152-A155 PolarHBondContact O-N 3.5Å; Q152-L156 PolarHBondContact O-N 3.2Å
153	L	90.6	Very high	88.7	Confident	72 Å²	72	88.8 Å²	88.8	38%	0.377	47%	0.472	S	S	.	.	H	α-helix	trans	-62.3	-39	173.5	-73.3	172.8	0	0	0	112	L116 T149 V150 L156 Q157	L116-L153 HydrophobicContact CD2-CD2 3.59Å; L116-L153 HydrophobicContact CG-CD2 4.48Å; T149-L153 HydrophobicContact CG2-CD1 4.4Å; T149-L153 WeakPolarHBondContact O-CG 3.44Å; T149-L153 PolarHBondContact O-N 3.01Å; V150-L153 PolarHBondContact O-N 3.46Å; L153-L156 WeakPolarHBondContact O-CB 3.15Å; L153-L156 PolarHBondContact O-N 3.35Å; L153-Q157 PolarHBondContact O-N 3.25Å
154	Q	89.2	Confident	88.6	Confident	115 Å²	115	85.4 Å²	85.4	54%	0.537	47%	0.467	S	S	.	.	H	α-helix	trans	-70.2	-37.8	178.6	-169.6	144.1	18.3	0	0	112.4	V150 S151 Q152 L156 Q157 S158	V150-Q154 PolarHBondContact O-N 2.97Å; S151-Q154 PolarHBondContact O-N 2.92Å; Q152-Q154 VanDerWaalsContact C-N 3.3Å; Q152-Q154 PolarHBondContact O-N 3.49Å; Q154-L156 VanDerWaalsContact C-N 3.32Å; Q154-L156 PolarHBondContact O-N 3.27Å; Q154-Q157 WeakPolarHBondContact O-CB 3.33Å; Q154-Q157 PolarHBondContact O-N 2.87Å; Q154-S158 PolarHBondContact O-N 2.7Å; Q154-S158 PolarHBondContact O-OG 2.96Å
155	A	88.8	Confident	88.2	Confident	58 Å²	58	85.2 Å²	85.2	48%	0.479	47%	0.47	S	S	.	.	H	α-helix	trans	-61.7	-41.7	172.1	0	0	0	0	0	111.8	S151 Q152 S158 S159	S151-A155 PolarHBondContact O-N 3.38Å; Q152-A155 PolarHBondContact O-N 3.5Å; A155-S158 PolarHBondContact O-N 2.96Å; A155-S159 PolarHBondContact O-N 2.86Å
156	L	91.4	Very high	87.7	Confident	92 Å²	92	84.7 Å²	84.7	48%	0.482	47%	0.471	S	S	.	.	H	α-helix	trans	-61.9	-44.1	174.4	-178.9	66.5	0	0	0	111.6	L113 Q152 L153 Q154 S159 L160	L113-L156 HydrophobicContact CD2-CD2 4.3Å; Q152-L156 PolarHBondContact O-N 3.2Å; L153-L156 WeakPolarHBondContact O-CB 3.15Å; L153-L156 PolarHBondContact O-N 3.35Å; Q154-L156 VanDerWaalsContact C-N 3.32Å; Q154-L156 PolarHBondContact O-N 3.27Å; L156-S159 PolarHBondContact O-N 3.03Å; L156-L160 PolarHBondContact O-N 3.16Å
157	Q	89.1	Confident	87.4	Confident	100 Å²	100	85.5 Å²	85.5	47%	0.467	48%	0.475	S	S	.	.	H	α-helix	trans	-57.8	-51.3	175.8	-179.8	-174	-8.4	0	0	111.1	L153 Q154 S159 L160 E161	L153-Q157 PolarHBondContact O-N 3.25Å; Q154-Q157 WeakPolarHBondContact O-CB 3.33Å; Q154-Q157 PolarHBondContact O-N 2.87Å; Q157-S159 VanDerWaalsContact C-N 3.28Å; Q157-S159 PolarHBondContact O-N 3.15Å; Q157-L160 PolarHBondContact O-N 2.79Å; Q157-E161 HydrophobicContact CG-CG 4.3Å; Q157-E161 WeakPolarHBondContact CG-OE1 3.14Å; Q157-E161 PolarHBondContact NE2-OE1 2.83Å; Q157-E161 WeakPolarHBondContact O-CG 3.3Å; Q157-E161 PolarHBondContact O-N 3.08Å
158	S	87.2	Confident	86.9	Confident	65 Å²	65	80.3 Å²	80.3	46%	0.455	46%	0.46	S	S	.	.	H	α-helix	trans	-62.1	-34.8	-179.9	-61.2	0	0	0	0	113	Q154 A155 G162	Q154-S158 PolarHBondContact O-N 2.7Å; Q154-S158 PolarHBondContact O-OG 2.96Å; A155-S158 PolarHBondContact O-N 2.96Å; S158-G162 PolarHBondContact O-N 3.28Å
159	S	89.3	Confident	86.3	Confident	86 Å²	86	80.1 Å²	80.1	60%	0.601	47%	0.47	S	S	*	.	H	α-helix	trans	-67	-38.4	173.9	-175.4	0	0	0	0	112.3	A155 L156 Q157 A163	A155-S159 PolarHBondContact O-N 2.86Å; L156-S159 PolarHBondContact O-N 3.03Å; Q157-S159 VanDerWaalsContact C-N 3.28Å; Q157-S159 PolarHBondContact O-N 3.15Å; S159-A163 PolarHBondContact O-N 3.1Å
160	L	88.3	Confident	85.6	Confident	115 Å²	115	83.3 Å²	83.3	60%	0.602	48%	0.482	S	S	*	.	H	α-helix	trans	-73.2	-39.1	178.9	-175.1	61.3	0	0	0	111.6	L156 Q157 A163 S164	L156-L160 PolarHBondContact O-N 3.16Å; Q157-L160 PolarHBondContact O-N 2.79Å; L160-A163 PolarHBondContact O-N 2.79Å; L160-S164 PolarHBondContact O-N 3.4Å
161	E	87.9	Confident	84.8	Confident	91 Å²	91	81 Å²	81	43%	0.425	47%	0.471	S	S	.	.	H	α-helix	trans	-58.1	-49.6	172.7	-74.6	170.4	173.8	0	0	110.7	Q157 A163 S164 D165	Q157-E161 HydrophobicContact CG-CG 4.3Å; Q157-E161 WeakPolarHBondContact CG-OE1 3.14Å; Q157-E161 PolarHBondContact NE2-OE1 2.83Å; Q157-E161 WeakPolarHBondContact O-CG 3.3Å; Q157-E161 PolarHBondContact O-N 3.08Å; E161-A163 VanDerWaalsContact C-N 3.26Å; E161-A163 PolarHBondContact O-N 3.21Å; E161-S164 WeakPolarHBondContact O-CB 3.48Å; E161-S164 PolarHBondContact O-N 3.16Å; E161-D165 PolarHBondContact O-N 3.46Å
162	G	83.6	Confident	83.4	Confident	35 Å²	35	82.4 Å²	82.4	36%	0.361	47%	0.471	S	S	.	.	H	α-helix	trans	-60.5	-34.5	176.8	0	0	0	0	0	113.5	S158 T166	S158-G162 PolarHBondContact O-N 3.28Å; G162-T166 WeakPolarHBondContact O-CG2 3.46Å; G162-T166 PolarHBondContact O-N 3.38Å
163	A	82.6	Confident	81.7	Confident	44 Å²	44	78.3 Å²	78.3	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-70.3	-40.9	173	0	0	0	0	0	112.1	S159 L160 E161 T166 L167	S159-A163 PolarHBondContact O-N 3.1Å; L160-A163 PolarHBondContact O-N 2.79Å; E161-A163 VanDerWaalsContact C-N 3.26Å; E161-A163 PolarHBondContact O-N 3.21Å; A163-T166 PolarHBondContact O-N 3.11Å; A163-T166 PolarHBondContact O-OG1 3.39Å; A163-L167 PolarHBondContact O-N 2.87Å; A163-L167 VanDerWaalsContact O-N 3.13Å
164	S	84.4	Confident	79.5	Confident	48 Å²	48	85.2 Å²	85.2	34%	0.336	48%	0.48	S	S	.	.	H	α-helix	trans	-59.5	-49.3	175.2	-159.9	0	0	0	0	111.1	L160 E161 T166 L167 E168	L160-S164 PolarHBondContact O-N 3.4Å; E161-S164 WeakPolarHBondContact O-CB 3.48Å; E161-S164 PolarHBondContact O-N 3.16Å; S164-T166 PolarHBondContact O-N 2.8Å; S164-L167 WeakPolarHBondContact O-CA 3.44Å; S164-L167 WeakPolarHBondContact O-CB 3.41Å; S164-L167 PolarHBondContact O-N 3.02Å; S164-E168 WeakPolarHBondContact O-CG 3.26Å; S164-E168 PolarHBondContact O-N 2.85Å; S164-E168 PolarHBondContact OG-OE1 2.86Å; S164-E168 VanDerWaalsContact OG-OE1 3.07Å
165	D	82.7	Confident	77.5	Confident	103 Å²	103	87.7 Å²	87.7	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-56.8	-38.8	179.1	-68.7	-14	0	0	0	111.7	E161 A169	E161-D165 PolarHBondContact O-N 3.46Å; D165-A169 VanDerWaalsContact O-CB 3.27Å; D165-A169 WeakPolarHBondContact O-CB 3.26Å; D165-A169 PolarHBondContact O-N 3.15Å
166	T	80.4	Confident	75.6	Confident	83 Å²	83	88.8 Å²	88.8	51%	0.509	49%	0.489	S	S	.	.	H	α-helix	trans	-69.5	-35.7	176.4	60.2	0	0	0	0	113.2	G162 A163 S164 Q170	G162-T166 WeakPolarHBondContact O-CG2 3.46Å; G162-T166 PolarHBondContact O-N 3.38Å; A163-T166 PolarHBondContact O-N 3.11Å; A163-T166 PolarHBondContact O-OG1 3.39Å; S164-T166 PolarHBondContact O-N 2.8Å; T166-Q170 VanDerWaalsContact O-CG 3.31Å; T166-Q170 WeakPolarHBondContact O-CG 3.48Å; T166-Q170 PolarHBondContact O-N 2.91Å; T166-Q170 VanDerWaalsContact O-N 3.1Å
167	L	81.8	Confident	73.3	Confident	91 Å²	91	89.8 Å²	89.8	48%	0.476	50%	0.495	S	S	.	.	H	α-helix	trans	-69.5	-43.8	176.2	-75.1	168.3	0	0	0	111.1	A163 S164 Q170 A171	A163-L167 PolarHBondContact O-N 2.87Å; A163-L167 VanDerWaalsContact O-N 3.13Å; S164-L167 WeakPolarHBondContact O-CA 3.44Å; S164-L167 WeakPolarHBondContact O-CB 3.41Å; S164-L167 PolarHBondContact O-N 3.02Å; L167-Q170 PolarHBondContact O-N 3.27Å; L167-A171 WeakPolarHBondContact O-CB 3.36Å; L167-A171 PolarHBondContact O-N 2.84Å
168	E	80.7	Confident	71.1	Confident	96 Å²	96	88.3 Å²	88.3	45%	0.449	50%	0.5	S	S	.	.	H	α-helix	trans	-62.2	-44.6	175.9	-71.2	172.1	-151.6	0	0	111.1	S164 Q170 A171 H172	S164-E168 WeakPolarHBondContact O-CG 3.26Å; S164-E168 PolarHBondContact O-N 2.85Å; S164-E168 PolarHBondContact OG-OE1 2.86Å; S164-E168 VanDerWaalsContact OG-OE1 3.07Å; E168-Q170 VanDerWaalsContact C-N 3.31Å; E168-Q170 PolarHBondContact O-N 3.22Å; E168-A171 PolarHBondContact O-N 3.06Å; E168-H172 PolarHBondContact O-CD2 3.01Å; E168-H172 PolarHBondContact O-N 3.44Å
169	A	77.4	Confident	69	Low	66 Å²	66	92.8 Å²	92.8	55%	0.545	51%	0.513	S	S	.	.	H	α-helix	trans	-61.4	-37.8	176	0	0	0	0	0	112.7	D165 G173	D165-A169 VanDerWaalsContact O-CB 3.27Å; D165-A169 WeakPolarHBondContact O-CB 3.26Å; D165-A169 PolarHBondContact O-N 3.15Å; A169-G173 PolarHBondContact O-N 3.02Å
170	Q	73.2	Confident	66.7	Low	122 Å²	122	91.4 Å²	91.4	57%	0.57	50%	0.504	S	S	*	.	H	α-helix	trans	-66.9	-43.3	174.2	-76.7	179.8	-9.3	0	0	111.9	T166 L167 E168 H172 G173 W174	T166-Q170 VanDerWaalsContact O-CG 3.31Å; T166-Q170 WeakPolarHBondContact O-CG 3.48Å; T166-Q170 PolarHBondContact O-N 2.91Å; T166-Q170 VanDerWaalsContact O-N 3.1Å; L167-Q170 PolarHBondContact O-N 3.27Å; E168-Q170 VanDerWaalsContact C-N 3.31Å; E168-Q170 PolarHBondContact O-N 3.22Å; Q170-H172 VanDerWaalsContact C-N 3.35Å; Q170-H172 PolarHBondContact O-N 2.86Å; Q170-G173 PolarHBondContact O-N 3.31Å; Q170-W174 PolarHBondContact O-N 3.33Å
171	A	72.7	Confident	64.4	Low	39 Å²	39	91.1 Å²	91.1	32%	0.322	51%	0.507	S	S	.	.	H	α-helix	trans	-63.7	-38.4	-179.9	0	0	0	0	0	112.5	V69 L167 E168	V69-A171 HydrophobicContact CG1-CB 4.14Å; V69-A171 HydrophobicContact CG2-CB 3.67Å; L167-A171 WeakPolarHBondContact O-CB 3.36Å; L167-A171 PolarHBondContact O-N 2.84Å; E168-A171 PolarHBondContact O-N 3.06Å
172	H	61.2	Low	62	Low	94 Å²	94	94.5 Å²	94.5	44%	0.435	52%	0.523	S	S	.	.	H	α-helix	trans	-80.2	-28.9	177.2	-67.4	-57.7	0	0	0	114	E168 Q170 W174	E168-H172 PolarHBondContact O-CD2 3.01Å; E168-H172 PolarHBondContact O-N 3.44Å; Q170-H172 VanDerWaalsContact C-N 3.35Å; Q170-H172 PolarHBondContact O-N 2.86Å; H172-W174 VanDerWaalsContact C-N 3.34Å; H172-W174 PolarHBondContact O-N 3.06Å
173	G	52.4	Low	59.8	Low	29 Å²	29	96.9 Å²	96.9	30%	0.299	54%	0.539	S	S	.	.	H	α-helix	trans	-63.5	-35.5	177.8	0	0	0	0	0	113.6	A169 Q170 R175 S176 D177	A169-G173 PolarHBondContact O-N 3.02Å; Q170-G173 PolarHBondContact O-N 3.31Å; G173-R175 VanDerWaalsContact C-N 3.35Å; G173-R175 PolarHBondContact O-N 3.43Å; G173-S176 PolarHBondContact O-N 3.24Å; G173-D177 PolarHBondContact O-N 3.35Å
174	W	45.4	Very low	57.6	Low	217 Å²	217	102.6 Å²	102.6	82%	0.822	56%	0.558	S	S	*	*	H	α-helix	trans	-68.5	-26.9	-176.5	-77.9	42.7	0	0	0	114.1	Q170 H172	Q170-W174 PolarHBondContact O-N 3.33Å; H172-W174 VanDerWaalsContact C-N 3.34Å; H172-W174 PolarHBondContact O-N 3.06Å
175	R	48	Very low	55.3	Low	168 Å²	168	104.6 Å²	104.6	63%	0.634	57%	0.572	S	S	*	*	H	α-helix	trans	-74.8	-34.3	173.6	-91.9	-138.4	-140.7	-102.3	-1.9	113	G173 A178	G173-R175 VanDerWaalsContact C-N 3.35Å; G173-R175 PolarHBondContact O-N 3.43Å; R175-A178 PolarHBondContact O-N 2.96Å
176	S	47	Very low	53.2	Low	81 Å²	81	110.3 Å²	110.3	57%	0.566	59%	0.586	S	S	*	*	H	α-helix	trans	-74.2	-33.2	-176	-62.7	0	0	0	0	112.3	G173 S180	G173-S176 PolarHBondContact O-N 3.24Å; S176-S180 PolarHBondContact O-N 3.49Å
177	D	44	Very low	51.2	Low	112 Å²	112	114.8 Å²	114.8	60%	0.599	61%	0.606	S	S	*	*	H	α-helix	trans	-74.6	-25.9	176.3	-77.5	-24.5	0	0	0	112.8	G173 S180 V181	G173-D177 PolarHBondContact O-N 3.35Å; D177-S180 PolarHBondContact O-N 3.12Å; D177-V181 VanDerWaalsContact O-CG2 3.25Å; D177-V181 WeakPolarHBondContact O-CG2 3.47Å; D177-V181 PolarHBondContact O-N 2.85Å
178	A	43.6	Very low	48.9	Very low	69 Å²	69	117 Å²	117	57%	0.57	63%	0.627	S	S	*	*	H	α-helix	trans	-68.8	-34	175.6	0	0	0	0	0	112.9	R175	R175-A178 PolarHBondContact O-N 2.96Å
179	E	41.6	Very low	46.5	Very low	159 Å²	159	115.9 Å²	115.9	74%	0.743	64%	0.642	S	S	*	*	H	α-helix	trans	-79.2	-25.5	173.9	-85	-178.5	114	0	0	113.2
180	S	41.2	Very low	44.3	Very low	58 Å²	58	117.6 Å²	117.6	41%	0.406	65%	0.65	S	S	.	*	H	α-helix	trans	-77.6	-31	-179.8	-170.4	0	0	0	0	113.1	S176 D177 E182 A183	S176-S180 PolarHBondContact O-N 3.49Å; D177-S180 PolarHBondContact O-N 3.12Å; S180-E182 PolarHBondContact O-N 3.37Å; S180-A183 PolarHBondContact O-N 2.96Å
181	V	41.7	Very low	42.5	Very low	108 Å²	108	121.8 Å²	121.8	66%	0.655	66%	0.66	S	S	*	*	H	α-helix	trans	-71.3	-26.2	-176.8	171.8	0	0	0	0	113.2	D177	D177-V181 VanDerWaalsContact O-CG2 3.25Å; D177-V181 WeakPolarHBondContact O-CG2 3.47Å; D177-V181 PolarHBondContact O-N 2.85Å
182	E	37.3	Very low	40.6	Very low	163 Å²	163	130.7 Å²	130.7	76%	0.762	69%	0.685	S	S	*	*	H	α-helix	trans	-75.6	-29.3	174.4	-90.9	-168.8	146.5	0	0	113.3	S180 S185	S180-E182 PolarHBondContact O-N 3.37Å; E182-S185 PolarHBondContact O-OG 3.5Å
183	A	36.6	Very low	39	Very low	85 Å²	85	131.4 Å²	131.4	70%	0.702	71%	0.708	S	S	*	*	H	α-helix	trans	-76.5	-24.1	-177.1	0	0	0	0	0	114	S180	S180-A183 PolarHBondContact O-N 2.96Å
184	Q	36.8	Very low	37.8	Very low	163 Å²	163	133.2 Å²	133.2	76%	0.762	73%	0.727	S	S	*	*	G	3₁₀ helix	trans	-85.9	-6.7	-179.8	-83.7	179.6	1.4	0	0	114.7	R186	Q184-R186 VanDerWaalsContact C-N 3.33Å; Q184-R186 PolarHBondContact O-N 3.41Å
185	S	35.3	Very low	37.4	Very low	91 Å²	91	134.5 Å²	134.5	64%	0.636	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-78.5	-4.1	-174.2	69.3	0	0	0	0	115.7	E182	E182-S185 PolarHBondContact O-OG 3.5Å
186	R	39.8	Very low	36.7	Very low	223 Å²	223	138.1 Å²	138.1	84%	0.842	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-113.6	6.9	-169.9	-72.7	-168.1	179.4	176.6	3.1	118.2	Q184	Q184-R186 VanDerWaalsContact C-N 3.33Å; Q184-R186 PolarHBondContact O-N 3.41Å
187	L	37.6	Very low	36	Very low	176 Å²	176	138.6 Å²	138.6	92%	0.921	75%	0.754	S	S	*	*			trans	-129.1	65.7	178.3	-70.8	168.1	0	0	0	112.7
188	C	34.2	Very low	35.3	Very low	137 Å²	137	140.2 Å²	140.2	93%	0.926	76%	0.762	S	S	*	*			trans	-127.1	101.9	157.8	-160.8	0	0	0	0	110
189	G	28.9	Very low	35	Very low	74 Å²	74	147.4 Å²	147.4	76%	0.763	77%	0.774	S	S	*	*			trans	-153.1	81.7	-178.7	0	0	0	0	0	112.8
190	S	31.6	Very low	34.6	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	77%	0.771	S	S	*	*			trans	49.5	114.8	138.7	-154.6	0	0	0	0	122.5
191	R	35.6	Very low	34.2	Very low	211 Å²	211	148.4 Å²	148.4	80%	0.796	79%	0.793	S	S	*	*				71.6	113.7	129	-67.5	178.4	-163	-140.8	1.6	123.3
192	R	33	Very low	33.7	Very low	225 Å²	225	148.3 Å²	148.3	85%	0.849	80%	0.797	S	S	*	*				72.2	140.6	123	-71.5	-173.9	-171.1	-172.7	2.6	123.1
193	A	26.6	Very low	33.3	Very low	110 Å²	110	152.8 Å²	152.8	91%	0.909	81%	0.807	S	S	*	*			trans	81.1	137.8	159.1	0	0	0	0	0	116.4
194	G	28.5	Very low	32.9	Very low	67 Å²	67	153.8 Å²	153.8	69%	0.691	81%	0.809	S	S	*	*			cis	152.9	120.7	2.2	0	0	0	0	0	109.9
195	R	35.9	Very low	32.5	Very low	243 Å²	243	150.8 Å²	150.8	92%	0.917	81%	0.806	S	S	*	*			trans	58.4	129.3	161.9	-50.4	-179.1	-169	-107.8	3	116.3
196	R	34.4	Very low	32.2	Very low	244 Å²	244	152.8 Å²	152.8	92%	0.921	81%	0.814	S	S	*	*				179	153.5	67.2	-145.9	178.1	-73.9	-155.5	-1.2	109.2
197	A	31.4	Very low	31.7	Very low	92 Å²	92	153.1 Å²	153.1	76%	0.76	82%	0.816	S	S	*	*			trans	-88	161.3	-175.1	0	0	0	0	0	114.6
198	L	30.7	Very low	31.4	Very low	145 Å²	145	150.1 Å²	150.1	76%	0.759	81%	0.809	S	S	*	*				-173	123	118.6	-148.8	68.1	0	0	0	113
199	R	37	Very low	31.9	Very low	220 Å²	220	149.5 Å²	149.5	83%	0.83	80%	0.803	S	S	*	*			trans	29.2	151.6	137.2	-59.4	177.6	173.1	171.1	-4	120.1
200	S	32.9	Very low	32	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	80%	0.802	S	S	*	*			cis	165.1	144.6	-8.1	55.9	0	0	0	0	104.4
201	V	31.5	Very low	32.5	Very low	142 Å²	142	150.1 Å²	150.1	86%	0.861	81%	0.807	S	S	*	*			trans	-169.4	129.7	133.4	164	0	0	0	0	108.4
202	S	31.8	Very low	32.5	Very low	106 Å²	106	146 Å²	146	74%	0.741	81%	0.811	S	S	*	*			trans	-82.6	158.6	-175.9	-36.4	0	0	0	0	113.3
203	R	29.7	Very low	33.1	Very low	256 Å²	256	141.7 Å²	141.7	97%	0.966	81%	0.805	S	S	*	*			trans	-158.3	126.9	136.5	-109.8	172.8	168	-127	-5.8	110.1
204	S	27.4	Very low	34	Very low	107 Å²	107	143.6 Å²	143.6	75%	0.748	81%	0.805	S	S	*	*			trans	-97	154.6	-171	-177.2	0	0	0	0	112.5
205	S	29.5	Very low	35	Very low	100 Å²	100	144 Å²	144	70%	0.699	81%	0.81	S	S	*	*			trans	63.9	120.3	144.6	44.5	0	0	0	0	120.5
206	T	28.6	Very low	35.6	Very low	133 Å²	133	142.2 Å²	142.2	82%	0.816	80%	0.803	S	S	*	*				-162.5	133.2	112.7	-64.2	0	0	0	0	110.7
207	W	28.1	Very low	36.5	Very low	230 Å²	230	133.1 Å²	133.1	87%	0.871	78%	0.777	S	S	*	*			trans	-25.2	140.2	175	-91.3	-74.5	0	0	0	120.8
208	S	31.1	Very low	38.3	Very low	113 Å²	113	132 Å²	132	79%	0.79	76%	0.764	S	S	*	*				-170.2	156.3	98.3	-80.4	0	0	0	0	113.6
209	P	46.1	Very low	40.1	Very low	123 Å²	123	131.9 Å²	131.9	80%	0.799	76%	0.759	S	S	*	*			trans	-100.7	138.8	-158.4	35.5	-25.8	0	0	0	113.1
210	G	30.2	Very low	41.4	Very low	72 Å²	72	124 Å²	124	74%	0.742	74%	0.742	S	S	*	*			trans	-147.3	90.7	176.2	0	0	0	0	0	110.9
211	S	43.4	Very low	43.2	Very low	116 Å²	116	123.2 Å²	123.2	81%	0.811	73%	0.727	S	S	*	*			trans	28.7	107.3	151.9	-167.9	0	0	0	0	118.3
212	S	35.2	Very low	45.2	Very low	125 Å²	125	121.5 Å²	121.5	87%	0.874	71%	0.711	S	S	*	*			trans	-134.8	87.9	152.2	-58.9	0	0	0	0	106.5
213	D	45.7	Very low	47.3	Very low	134 Å²	134	122.6 Å²	122.6	72%	0.717	70%	0.704	S	S	*	*			trans	-115.7	78.2	175.2	-153.6	17.1	0	0	0	109
214	T	45.4	Very low	49	Very low	150 Å²	150	118.6 Å²	118.6	92%	0.92	69%	0.689	S	S	*	*			trans	-146.2	86.3	163.4	-51.1	0	0	0	0	107.1
215	G	48.5	Very low	51.4	Low	76 Å²	76	120.5 Å²	120.5	78%	0.784	68%	0.68	S	S	*	*	S	Bend	trans	163.5	9.4	176.5	0	0	0	0	0	118
216	R	48.8	Very low	54	Low	205 Å²	205	121.2 Å²	121.2	77%	0.774	68%	0.676	S	S	*	*			trans	-122.2	97.6	168	-71.7	176.8	72.8	-177.4	1.5	108.3	S218	R216-S218 PolarHBondContact O-N 2.74Å
217	S	53.1	Low	56.5	Low	53 Å²	53	119.6 Å²	119.6	37%	0.371	66%	0.659	S	S	.	*			trans	-53.7	116.4	157.9	176.5	0	0	0	0	106	E219 E221	S217-E219 PolarHBondContact O-N 2.96Å; S217-E221 PolarHBondContact OG-OE2 3.45Å
218	S	69.7	Low	59.2	Low	70 Å²	70	111.4 Å²	111.4	49%	0.49	63%	0.634	S	S	.	*			trans	-56.9	138.7	-174.1	-179.1	0	0	0	0	108.1	R216 A220 E221 M222	R216-S218 PolarHBondContact O-N 2.74Å; S218-A220 PolarHBondContact O-N 3.17Å; S218-E221 WeakPolarHBondContact O-CA 3.48Å; S218-E221 VanDerWaalsContact O-CB 3.31Å; S218-E221 WeakPolarHBondContact O-CB 3.41Å; S218-E221 PolarHBondContact O-N 2.87Å; S218-M222 PolarHBondContact O-N 3.37Å
219	E	68.9	Low	61.6	Low	141 Å²	141	110.7 Å²	110.7	66%	0.659	62%	0.621	S	S	*	*	H	α-helix	trans	-51.5	-28.3	174.3	-69.4	167.8	-177.3	0	0	111.1	S217 M222 Q223	S217-E219 PolarHBondContact O-N 2.96Å; E219-M222 PolarHBondContact O-N 3.48Å; E219-Q223 WeakPolarHBondContact O-CB 3.26Å; E219-Q223 WeakPolarHBondContact O-CG 3.31Å; E219-Q223 PolarHBondContact O-N 3.41Å
220	A	64.7	Low	63.3	Low	56 Å²	56	112.2 Å²	112.2	46%	0.463	61%	0.611	S	S	.	*	H	α-helix	trans	-64	-35.8	171.9	0	0	0	0	0	114.1	S218 Q223 W224	S218-A220 PolarHBondContact O-N 3.17Å; A220-Q223 PolarHBondContact O-N 3.05Å; A220-W224 WeakPolarHBondContact O-CB 3.46Å; A220-W224 PolarHBondContact O-N 3.02Å
221	E	70.4	Confident	65.8	Low	79 Å²	79	113.3 Å²	113.3	37%	0.369	60%	0.6	S	S	.	*	H	α-helix	trans	-72.3	-39.8	177.7	-162.5	-167.4	162.2	0	0	111	S217 S218 W224 R225	S217-E221 PolarHBondContact OG-OE2 3.45Å; S218-E221 WeakPolarHBondContact O-CA 3.48Å; S218-E221 VanDerWaalsContact O-CB 3.31Å; S218-E221 WeakPolarHBondContact O-CB 3.41Å; S218-E221 PolarHBondContact O-N 2.87Å; E221-W224 PolarHBondContact O-N 2.69Å; E221-R225 VanDerWaalsContact O-CG 3.27Å; E221-R225 WeakPolarHBondContact O-CG 3.2Å; E221-R225 PolarHBondContact O-N 3.28Å; E221-R225 IonicContact OE1-CZ 3.36Å; E221-R225 IonicContact OE1-NE 2.82Å; E221-R225 PolarHBondContact OE1-NE 3.23Å; E221-R225 IonicContact OE1-NH2 3.71Å; E221-R225 PolarHBondContact OE1-NH2 3.27Å
222	M	73.6	Confident	67.3	Low	107 Å²	107	112.3 Å²	112.3	53%	0.527	58%	0.582	S	S	.	*	H	α-helix	trans	-65.6	-41	172.4	-63.5	-174.2	-176.2	0	0	111.5	S218 E219 R225 L226	S218-M222 PolarHBondContact O-N 3.37Å; E219-M222 PolarHBondContact O-N 3.48Å; M222-R225 PolarHBondContact O-N 2.93Å; M222-L226 WeakPolarHBondContact O-CG 3.27Å; M222-L226 PolarHBondContact O-N 3.31Å
223	Q	76	Confident	69.1	Low	129 Å²	129	112 Å²	112	60%	0.603	57%	0.567	S	S	*	*	H	α-helix	trans	-63.1	-42.4	174.9	-78.5	177.4	-9.9	0	0	112.2	E219 A220 L226 Q227	E219-Q223 WeakPolarHBondContact O-CB 3.26Å; E219-Q223 WeakPolarHBondContact O-CG 3.31Å; E219-Q223 PolarHBondContact O-N 3.41Å; A220-Q223 PolarHBondContact O-N 3.05Å; Q223-L226 PolarHBondContact O-N 3.15Å; Q223-Q227 WeakPolarHBondContact O-CG 3.13Å; Q223-Q227 PolarHBondContact O-N 2.95Å
224	W	64.2	Low	70.4	Confident	172 Å²	172	109.4 Å²	109.4	65%	0.652	55%	0.552	S	S	*	*	H	α-helix	trans	-62.7	-46	175	172.6	-111.5	0	0	0	111.9	A220 E221 L226 Q227 V228	A220-W224 WeakPolarHBondContact O-CB 3.46Å; A220-W224 PolarHBondContact O-N 3.02Å; E221-W224 PolarHBondContact O-N 2.69Å; W224-L226 VanDerWaalsContact C-N 3.29Å; W224-L226 PolarHBondContact O-N 3.18Å; W224-Q227 PolarHBondContact O-N 2.88Å; W224-V228 HydrophobicContact CD2-CG2 3.98Å; W224-V228 HydrophobicContact CE3-CG2 4.47Å; W224-V228 HydrophobicContact CG-CG2 4.46Å; W224-V228 HydrophobicContact CH2-CG2 4.2Å; W224-V228 HydrophobicContact CZ2-CG2 3.65Å; W224-V228 WeakPolarHBondContact O-CG2 3.24Å; W224-V228 PolarHBondContact O-N 3.19Å
225	R	77.7	Confident	71.9	Confident	147 Å²	147	105.8 Å²	105.8	56%	0.555	53%	0.527	S	S	*	.	H	α-helix	trans	-57.9	-40.3	175.5	-72.2	171.4	-173.9	-100.4	3.3	112.2	E221 M222 V228 N229	E221-R225 VanDerWaalsContact O-CG 3.27Å; E221-R225 WeakPolarHBondContact O-CG 3.2Å; E221-R225 PolarHBondContact O-N 3.28Å; E221-R225 IonicContact OE1-CZ 3.36Å; E221-R225 IonicContact OE1-NE 2.82Å; E221-R225 PolarHBondContact OE1-NE 3.23Å; E221-R225 IonicContact OE1-NH2 3.71Å; E221-R225 PolarHBondContact OE1-NH2 3.27Å; M222-R225 PolarHBondContact O-N 2.93Å; R225-V228 PolarHBondContact O-N 2.92Å; R225-N229 VanDerWaalsContact O-CG 3.25Å; R225-N229 PolarHBondContact O-N 3.13Å; R225-N229 PolarHBondContact O-ND2 3.26Å
226	L	85.5	Confident	72.7	Confident	115 Å²	115	105.7 Å²	105.7	60%	0.602	51%	0.508	S	S	*	.	H	α-helix	trans	-64.6	-39.6	174.4	-75.5	165.1	0	0	0	112.6	M222 Q223 W224 R230	M222-L226 WeakPolarHBondContact O-CG 3.27Å; M222-L226 PolarHBondContact O-N 3.31Å; Q223-L226 PolarHBondContact O-N 3.15Å; W224-L226 VanDerWaalsContact C-N 3.29Å; W224-L226 PolarHBondContact O-N 3.18Å; L226-R230 WeakPolarHBondContact O-CB 3.38Å; L226-R230 PolarHBondContact O-N 3.23Å
227	Q	80.4	Confident	73.2	Confident	98 Å²	98	101.1 Å²	101.1	46%	0.458	50%	0.496	S	S	.	.	H	α-helix	trans	-67.1	-40.8	175.9	-68.4	-59.5	-43.8	0	0	111.9	Q223 W224 R230 L231	Q223-Q227 WeakPolarHBondContact O-CG 3.13Å; Q223-Q227 PolarHBondContact O-N 2.95Å; W224-Q227 PolarHBondContact O-N 2.88Å; Q227-R230 PolarHBondContact O-N 3.33Å; Q227-L231 WeakPolarHBondContact O-CG 3.31Å; Q227-L231 PolarHBondContact O-N 2.87Å
228	V	84.6	Confident	73.4	Confident	58 Å²	58	104.1 Å²	104.1	35%	0.352	51%	0.507	S	S	.	.	H	α-helix	trans	-62.4	-45.7	176.3	172.4	0	0	0	0	110.8	W224 R225 R230 L231 Q232	W224-V228 HydrophobicContact CD2-CG2 3.98Å; W224-V228 HydrophobicContact CE3-CG2 4.47Å; W224-V228 HydrophobicContact CG-CG2 4.46Å; W224-V228 HydrophobicContact CH2-CG2 4.2Å; W224-V228 HydrophobicContact CZ2-CG2 3.65Å; W224-V228 WeakPolarHBondContact O-CG2 3.24Å; W224-V228 PolarHBondContact O-N 3.19Å; R225-V228 PolarHBondContact O-N 2.92Å; V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 PolarHBondContact O-N 3.07Å; V228-L231 PolarHBondContact O-N 2.88Å; V228-Q232 PolarHBondContact O-N 3.05Å
229	N	81.2	Confident	72.8	Confident	99 Å²	99	106.6 Å²	106.6	53%	0.529	51%	0.511	S	S	.	.	H	α-helix	trans	-62.9	-40.1	176.5	-70.2	-17.2	0	0	0	112.3	R225 L231 Q232 E233	R225-N229 VanDerWaalsContact O-CG 3.25Å; R225-N229 PolarHBondContact O-N 3.13Å; R225-N229 PolarHBondContact O-ND2 3.26Å; N229-L231 VanDerWaalsContact C-N 3.32Å; N229-L231 PolarHBondContact O-N 2.71Å; N229-Q232 PolarHBondContact O-N 3.32Å; N229-E233 PolarHBondContact O-N 3.2Å
230	R	83.1	Confident	72	Confident	155 Å²	155	104.5 Å²	104.5	59%	0.585	51%	0.51	S	S	*	.	H	α-helix	trans	-64.7	-36.9	175.6	-172.4	178.4	-176.8	-171	1.5	112.2	L226 Q227 V228 L234	L226-R230 WeakPolarHBondContact O-CB 3.38Å; L226-R230 PolarHBondContact O-N 3.23Å; Q227-R230 PolarHBondContact O-N 3.33Å; V228-R230 VanDerWaalsContact C-N 3.34Å; V228-R230 PolarHBondContact O-N 3.07Å; R230-L234 VanDerWaalsContact O-CG 3.3Å; R230-L234 WeakPolarHBondContact O-CG 3.47Å; R230-L234 PolarHBondContact O-N 2.78Å; R230-L234 VanDerWaalsContact O-N 3.15Å
231	L	82.5	Confident	71.7	Confident	95 Å²	95	107.6 Å²	107.6	50%	0.497	51%	0.513	S	S	.	.	H	α-helix	trans	-69.8	-40.2	175.1	-73.1	169.8	0	0	0	111.4	Q227 V228 N229 L234 I235	Q227-L231 WeakPolarHBondContact O-CG 3.31Å; Q227-L231 PolarHBondContact O-N 2.87Å; V228-L231 PolarHBondContact O-N 2.88Å; N229-L231 VanDerWaalsContact C-N 3.32Å; N229-L231 PolarHBondContact O-N 2.71Å; L231-L234 PolarHBondContact O-N 2.9Å; L231-I235 VanDerWaalsContact O-CG1 3.27Å; L231-I235 WeakPolarHBondContact O-CG1 3.48Å; L231-I235 PolarHBondContact O-N 3.4Å
232	Q	75	Confident	71.1	Confident	95 Å²	95	109.7 Å²	109.7	44%	0.444	52%	0.523	S	S	.	.	H	α-helix	trans	-59.9	-45.6	173.6	-170.5	63.5	54	0	0	111.2	V228 N229 L234 I235 D236	V228-Q232 PolarHBondContact O-N 3.05Å; N229-Q232 PolarHBondContact O-N 3.32Å; Q232-L234 VanDerWaalsContact C-N 3.28Å; Q232-L234 PolarHBondContact O-N 3.06Å; Q232-I235 PolarHBondContact O-N 3.46Å; Q232-I235 VanDerWaalsContact O-N 3.15Å; Q232-D236 PolarHBondContact NE2-OD1 3.07Å; Q232-D236 WeakPolarHBondContact O-CB 3.21Å; Q232-D236 PolarHBondContact O-N 2.98Å
233	E	73.1	Confident	71	Confident	118 Å²	118	110.1 Å²	110.1	55%	0.551	53%	0.526	S	S	*	.	H	α-helix	trans	-60.6	-36	175.4	-76.7	177.4	174.8	0	0	112.8	N229 Q237	N229-E233 PolarHBondContact O-N 3.2Å; E233-Q237 VanDerWaalsContact O-CB 3.31Å; E233-Q237 WeakPolarHBondContact O-CB 3.34Å; E233-Q237 WeakPolarHBondContact O-CG 3.35Å; E233-Q237 PolarHBondContact O-N 3Å
234	L	72.6	Confident	70.8	Confident	80 Å²	80	108.1 Å²	108.1	42%	0.419	52%	0.519	S	S	.	.	H	α-helix	trans	-72.2	-37.6	176.2	-72.3	171.1	0	0	0	111.9	R230 L231 Q232 Q237 L238	R230-L234 VanDerWaalsContact O-CG 3.3Å; R230-L234 WeakPolarHBondContact O-CG 3.47Å; R230-L234 PolarHBondContact O-N 2.78Å; R230-L234 VanDerWaalsContact O-N 3.15Å; L231-L234 PolarHBondContact O-N 2.9Å; Q232-L234 VanDerWaalsContact C-N 3.28Å; Q232-L234 PolarHBondContact O-N 3.06Å; L234-Q237 PolarHBondContact O-N 2.91Å; L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.8Å
235	I	76.2	Confident	71.2	Confident	74 Å²	74	106.8 Å²	106.8	38%	0.379	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-49	174.5	-70.2	165.5	0	0	0	109.4	L231 Q232 Q237 L238 E239	L231-I235 VanDerWaalsContact O-CG1 3.27Å; L231-I235 WeakPolarHBondContact O-CG1 3.48Å; L231-I235 PolarHBondContact O-N 3.4Å; Q232-I235 PolarHBondContact O-N 3.46Å; Q232-I235 VanDerWaalsContact O-N 3.15Å; I235-Q237 VanDerWaalsContact C-N 3.26Å; I235-Q237 PolarHBondContact O-N 3.46Å; I235-L238 CarbonylContact O-C 3.53Å; I235-L238 WeakPolarHBondContact O-CA 3.3Å; I235-L238 WeakPolarHBondContact O-CB 3.38Å; I235-L238 PolarHBondContact O-N 2.97Å; I235-E239 HydrophobicContact CG2-CG 4.06Å; I235-E239 WeakPolarHBondContact CG2-OE1 3.33Å; I235-E239 WeakPolarHBondContact O-CB 3.32Å; I235-E239 WeakPolarHBondContact O-CG 3.3Å; I235-E239 PolarHBondContact O-N 3.28Å
236	D	65.3	Low	71	Confident	73 Å²	73	102.6 Å²	102.6	39%	0.39	52%	0.519	S	S	.	.	H	α-helix	trans	-58.9	-38.7	176.8	-64.8	-9.4	0	0	0	111.4	Q232 L238 C240	Q232-D236 PolarHBondContact NE2-OD1 3.07Å; Q232-D236 WeakPolarHBondContact O-CB 3.21Å; Q232-D236 PolarHBondContact O-N 2.98Å; D236-L238 VanDerWaalsContact C-N 3.31Å; D236-L238 PolarHBondContact O-N 3.23Å; D236-C240 VanDerWaalsContact O-CB 3.29Å; D236-C240 WeakPolarHBondContact O-CB 3.44Å; D236-C240 PolarHBondContact O-N 3Å; D236-C240 PolarHBondContact O-SG 3.46Å
237	Q	59	Low	70.5	Confident	110 Å²	110	103.3 Å²	103.3	51%	0.514	52%	0.519	S	S	.	.	H	α-helix	trans	-67.2	-27.9	173.9	-79	175.8	34.8	0	0	113.8	E233 L234 I235	E233-Q237 VanDerWaalsContact O-CB 3.31Å; E233-Q237 WeakPolarHBondContact O-CB 3.34Å; E233-Q237 WeakPolarHBondContact O-CG 3.35Å; E233-Q237 PolarHBondContact O-N 3Å; L234-Q237 PolarHBondContact O-N 2.91Å; I235-Q237 VanDerWaalsContact C-N 3.26Å; I235-Q237 PolarHBondContact O-N 3.46Å
238	L	58.3	Low	70.3	Confident	116 Å²	116	107.2 Å²	107.2	61%	0.607	53%	0.529	S	S	*	.	H	α-helix	trans	-83.9	-42.2	176.3	-72.2	169.5	0	0	0	111.2	L234 I235 D236 C240 K241	L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 WeakPolarHBondContact O-CG 3.43Å; L234-L238 PolarHBondContact O-N 2.8Å; I235-L238 CarbonylContact O-C 3.53Å; I235-L238 WeakPolarHBondContact O-CA 3.3Å; I235-L238 WeakPolarHBondContact O-CB 3.38Å; I235-L238 PolarHBondContact O-N 2.97Å; D236-L238 VanDerWaalsContact C-N 3.31Å; D236-L238 PolarHBondContact O-N 3.23Å; L238-C240 PolarHBondContact O-N 3.31Å; L238-K241 PolarHBondContact O-N 3.42Å
239	E	55.9	Low	69.9	Low	122 Å²	122	111.1 Å²	111.1	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-64.8	-29.1	175.9	-70.6	-178.6	173.2	0	0	111.9	I235 K241 H242	I235-E239 HydrophobicContact CG2-CG 4.06Å; I235-E239 WeakPolarHBondContact CG2-OE1 3.33Å; I235-E239 WeakPolarHBondContact O-CB 3.32Å; I235-E239 WeakPolarHBondContact O-CG 3.3Å; I235-E239 PolarHBondContact O-N 3.28Å; E239-K241 PolarHBondContact O-N 3.32Å; E239-H242 PolarHBondContact O-CE1 2.9Å; E239-H242 PolarHBondContact O-ND1 2.98Å
240	C	52	Low	69.7	Low	96 Å²	96	108.5 Å²	108.5	65%	0.649	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-12.5	172.1	-77.3	0	0	0	0	114.2	D236 L238 H242	D236-C240 VanDerWaalsContact O-CB 3.29Å; D236-C240 WeakPolarHBondContact O-CB 3.44Å; D236-C240 PolarHBondContact O-N 3Å; D236-C240 PolarHBondContact O-SG 3.46Å; L238-C240 PolarHBondContact O-N 3.31Å; C240-H242 PolarHBondContact O-N 3Å
241	K	58.3	Low	69.4	Low	122 Å²	122	109.1 Å²	109.1	53%	0.53	54%	0.541	S	S	.	.			trans	-98.5	73	179.4	-66.1	176.7	-172.3	171.6	0	111.1	L12 L238 E239 I243	L12-K241 HydrophobicContact CD2-CB 4.02Å; L12-K241 HydrophobicContact CD2-CD 4.42Å; L12-K241 HydrophobicContact CD2-CG 4.21Å; L238-K241 PolarHBondContact O-N 3.42Å; E239-K241 PolarHBondContact O-N 3.32Å; K241-I243 PolarHBondContact O-N 3.42Å
242	H	59.7	Low	69.2	Low	122 Å²	122	105.2 Å²	105.2	57%	0.565	52%	0.521	S	S	*	.	P	Polyproline II helix	trans	-67.5	117.6	169.7	-67.6	71.9	0	0	0	109.5	R13 E239 C240	R13-H242 HydrophobicContact CB-CB 4.44Å; R13-H242 PolarHBondContact N-O 3.01Å; E239-H242 PolarHBondContact O-CE1 2.9Å; E239-H242 PolarHBondContact O-ND1 2.98Å; C240-H242 PolarHBondContact O-N 3Å
243	I	71	Confident	69.3	Low	117 Å²	117	103.3 Å²	103.3	60%	0.6	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	119	174.5	-60	175.1	0	0	0	108.1	K241 L278	K241-I243 PolarHBondContact O-N 3.42Å; I243-L278 HydrophobicContact CD1-CD1 4.24Å; I243-L278 HydrophobicContact CG1-CD1 4.02Å; I243-L278 HydrophobicContact CG2-CD1 4.02Å
244	L	70.4	Confident	69.4	Low	86 Å²	86	103.7 Å²	103.7	45%	0.45	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	127.1	173.9	-66.4	171.8	0	0	0	109.3	C10 L11 R13	C10-L244 CarbonylContact C-O 3.57Å; C10-L244 VanDerWaalsContact CA-O 3.31Å; C10-L244 WeakPolarHBondContact CA-O 3.37Å; L11-L244 PolarHBondContact N-O 3.13Å; L11-L244 PolarHBondContact O-N 2.94Å; R13-L244 HydrophobicContact CB-CD1 4.32Å
245	M	74.2	Confident	69.6	Low	144 Å²	144	108.8 Å²	108.8	71%	0.709	55%	0.545	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.1	120.1	175.3	-140.5	172.3	77.9	0	0	109.2
246	A	73.1	Confident	69.7	Low	59 Å²	59	106.5 Å²	106.5	49%	0.488	54%	0.54	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	127.7	177.1	0	0	0	0	0	109.7	T8 V9	T8-A246 CarbonylContact C-O 3.57Å; T8-A246 WeakPolarHBondContact CA-O 3.49Å; V9-A246 PolarHBondContact N-O 3.3Å; V9-A246 PolarHBondContact O-N 3.19Å
247	Q	75.4	Confident	70.4	Confident	130 Å²	130	104.7 Å²	104.7	61%	0.607	53%	0.53	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.1	127	177.4	-172.3	179.1	22	0	0	109	L6 L7	L6-Q247 HydrophobicContact CD1-CG 3.66Å; L6-Q247 HydrophobicContact CG-CG 4.34Å; L7-Q247 CarbonylContact O-C 3.55Å; L7-Q247 WeakPolarHBondContact O-CA 3.4Å
248	R	74.6	Confident	71.4	Confident	180 Å²	180	107.2 Å²	107.2	68%	0.679	54%	0.542	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.6	-179	-170.4	172.4	-176.4	175.1	1.4	111.5	L7 V250	L7-R248 PolarHBondContact N-O 3.27Å; L7-R248 PolarHBondContact O-N 2.99Å; R248-V250 HydrophobicContact CG-CG2 4.23Å
249	Q	76.8	Confident	72.5	Confident	140 Å²	140	107 Å²	107	65%	0.654	54%	0.541	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.8	169.7	-66.9	178.6	-0.6	0	0	109.8	G5 L6	G5-Q249 CarbonylContact O-C 3.55Å; G5-Q249 VanDerWaalsContact O-CA 3.31Å; G5-Q249 WeakPolarHBondContact O-CA 3.39Å; L6-Q249 HydrophobicContact CD1-CG 3.57Å
250	V	78.1	Confident	73.8	Confident	45 Å²	45	103.6 Å²	103.6	27%	0.273	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	124.6	-179.8	-173.5	0	0	0	0	109.3	A4 G5 R248 V252 F260	A4-V250 CarbonylContact C-O 3.55Å; A4-V250 WeakPolarHBondContact CA-O 3.48Å; G5-V250 PolarHBondContact N-O 3.1Å; G5-V250 PolarHBondContact O-N 2.97Å; R248-V250 HydrophobicContact CG-CG2 4.23Å; V250-V252 HydrophobicContact CG1-CG2 4.07Å; V250-F260 HydrophobicContact CB-CE2 4.23Å; V250-F260 HydrophobicContact CB-CZ 4.04Å; V250-F260 HydrophobicContact CG1-CE2 3.79Å; V250-F260 HydrophobicContact CG1-CZ 4.07Å
251	Q	77	Confident	75.2	Confident	167 Å²	167	102.1 Å²	102.1	78%	0.78	51%	0.508	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.1	134	172.3	-64.2	-178.2	15.6	0	0	109.6
252	V	76.7	Confident	76.4	Confident	14 Å²	14	104.4 Å²	104.4	9%	0.085	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.9	-175.2	-171.8	0	0	0	0	110	A2 C3 V250 L257 F260	A2-V252 CarbonylContact C-O 3.58Å; A2-V252 WeakPolarHBondContact CA-O 3.47Å; C3-V252 PolarHBondContact N-O 2.67Å; C3-V252 VanDerWaalsContact N-O 3.13Å; C3-V252 PolarHBondContact O-N 3.2Å; V250-V252 HydrophobicContact CG1-CG2 4.07Å; V252-L257 HydrophobicContact CB-CD1 4.42Å; V252-L257 HydrophobicContact CG1-CD1 4.28Å; V252-F260 HydrophobicContact CB-CG 4.47Å; V252-F260 HydrophobicContact CG1-CB 3.75Å; V252-F260 HydrophobicContact CG1-CD1 4.41Å; V252-F260 HydrophobicContact CG1-CG 4.05Å; V252-F260 HydrophobicContact CG2-CB 4.26Å; V252-F260 HydrophobicContact CG2-CD1 3.63Å; V252-F260 HydrophobicContact CG2-CD2 3.83Å; V252-F260 HydrophobicContact CG2-CE1 3.81Å; V252-F260 HydrophobicContact CG2-CE2 4.02Å; V252-F260 HydrophobicContact CG2-CG 3.62Å; V252-F260 HydrophobicContact CG2-CZ 4.01Å
253	A	77.8	Confident	77.6	Confident	54 Å²	54	101.5 Å²	101.5	45%	0.446	51%	0.51	S	S	.	.			trans	-65.8	144.8	172.4	0	0	0	0	0	110.6	E255 G256 L257	A253-E255 HydrophobicContact CB-CG 4.07Å; A253-E255 PolarHBondContact O-N 3.13Å; A253-G256 PolarHBondContact O-N 3Å; A253-L257 PolarHBondContact O-N 2.83Å
254	E	74.2	Confident	78.2	Confident	127 Å²	127	97.5 Å²	97.5	59%	0.593	49%	0.49	S	S	*	.	G	3₁₀ helix	trans	-56.7	-37.8	-175.4	-72.3	-174.7	177.7	0	0	113	M1 G256 L257	M1-E254 PolarHBondContact N-OE1 2.96Å; M1-E254 WeakPolarHBondContact O-CG 3.35Å; E254-G256 VanDerWaalsContact C-N 3.28Å; E254-G256 PolarHBondContact O-N 3.48Å; E254-L257 WeakPolarHBondContact O-CB 3.22Å; E254-L257 PolarHBondContact O-N 3.46Å
255	E	78.5	Confident	78.8	Confident	187 Å²	187	101.4 Å²	101.4	87%	0.874	50%	0.499	S	S	*	.	G	3₁₀ helix	trans	-63.8	-28.7	177.9	57.9	-163.4	-178.9	0	0	113.7	A253	A253-E255 HydrophobicContact CB-CG 4.07Å; A253-E255 PolarHBondContact O-N 3.13Å
256	G	78	Confident	79.3	Confident	26 Å²	26	98.3 Å²	98.3	27%	0.268	49%	0.49	S	S	.	.	G	3₁₀ helix	trans	-99.3	3.4	178.8	0	0	0	0	0	114.6	A253 E254 Q258 D259 F260	A253-G256 PolarHBondContact O-N 3Å; E254-G256 VanDerWaalsContact C-N 3.28Å; E254-G256 PolarHBondContact O-N 3.48Å; G256-Q258 PolarHBondContact O-N 3.01Å; G256-D259 PolarHBondContact O-N 3.11Å; G256-F260 WeakPolarHBondContact O-CB 3.31Å; G256-F260 PolarHBondContact O-N 2.85Å
257	L	79.7	Confident	79.8	Confident	35 Å²	35	100.4 Å²	100.4	18%	0.183	49%	0.486	C	S	.	.	H	α-helix	trans	-65.8	-38.7	-170.3	-174	66.4	0	0	0	113.1	C3 V252 A253 E254 H261	C3-L257 HydrophobicContact CB-CD1 4Å; V252-L257 HydrophobicContact CB-CD1 4.42Å; V252-L257 HydrophobicContact CG1-CD1 4.28Å; A253-L257 PolarHBondContact O-N 2.83Å; E254-L257 WeakPolarHBondContact O-CB 3.22Å; E254-L257 PolarHBondContact O-N 3.46Å; L257-H261 WeakPolarHBondContact O-CB 2.98Å; L257-H261 PolarHBondContact O-N 3.23Å; L257-H261 PolarHBondContact O-ND1 3.16Å
258	Q	78.9	Confident	80.2	Confident	163 Å²	163	95.9 Å²	95.9	76%	0.762	47%	0.468	S	S	*	.	H	α-helix	trans	-68	-41.9	179.2	-69	-167.9	11.2	0	0	112	G256 H261 R262	G256-Q258 PolarHBondContact O-N 3.01Å; Q258-H261 PolarHBondContact O-N 3.39Å; Q258-R262 PolarHBondContact O-N 2.98Å
259	D	82.1	Confident	80.7	Confident	112 Å²	112	92.8 Å²	92.8	60%	0.599	46%	0.464	S	S	*	.	H	α-helix	trans	-67.3	-40.7	177.5	-69.1	-29.4	0	0	0	111.1	G256 R262 A263	G256-D259 PolarHBondContact O-N 3.11Å; D259-R262 PolarHBondContact O-N 3.07Å; D259-A263 WeakPolarHBondContact O-CB 3.5Å; D259-A263 PolarHBondContact O-N 3.44Å
260	F	83.1	Confident	81	Confident	50 Å²	50	92.7 Å²	92.7	22%	0.219	46%	0.462	C	S	.	.	H	α-helix	trans	-61	-46.7	172.8	177.8	-101.9	0	0	0	112.2	V250 V252 G256 R262 A263 L264	V250-F260 HydrophobicContact CB-CE2 4.23Å; V250-F260 HydrophobicContact CB-CZ 4.04Å; V250-F260 HydrophobicContact CG1-CE2 3.79Å; V250-F260 HydrophobicContact CG1-CZ 4.07Å; V252-F260 HydrophobicContact CB-CG 4.47Å; V252-F260 HydrophobicContact CG1-CB 3.75Å; V252-F260 HydrophobicContact CG1-CD1 4.41Å; V252-F260 HydrophobicContact CG1-CG 4.05Å; V252-F260 HydrophobicContact CG2-CB 4.26Å; V252-F260 HydrophobicContact CG2-CD1 3.63Å; V252-F260 HydrophobicContact CG2-CD2 3.83Å; V252-F260 HydrophobicContact CG2-CE1 3.81Å; V252-F260 HydrophobicContact CG2-CE2 4.02Å; V252-F260 HydrophobicContact CG2-CG 3.62Å; V252-F260 HydrophobicContact CG2-CZ 4.01Å; G256-F260 WeakPolarHBondContact O-CB 3.31Å; G256-F260 PolarHBondContact O-N 2.85Å; F260-R262 VanDerWaalsContact C-N 3.26Å; F260-R262 PolarHBondContact O-N 3.36Å; F260-A263 PolarHBondContact O-N 3.46Å; F260-L264 HydrophobicContact CE1-CB 4.49Å; F260-L264 HydrophobicContact CE1-CD2 3.83Å; F260-L264 HydrophobicContact CZ-CD1 4.47Å; F260-L264 HydrophobicContact CZ-CD2 4.19Å; F260-L264 WeakPolarHBondContact O-CB 3.38Å; F260-L264 PolarHBondContact O-N 3.02Å
261	H	81.8	Confident	81.1	Confident	64 Å²	64	91.2 Å²	91.2	30%	0.296	45%	0.453	S	S	.	.	H	α-helix	trans	-60.6	-37	176.4	-75.8	157.6	0	0	0	112.4	L257 Q258 R265	L257-H261 WeakPolarHBondContact O-CB 2.98Å; L257-H261 PolarHBondContact O-N 3.23Å; L257-H261 PolarHBondContact O-ND1 3.16Å; Q258-H261 PolarHBondContact O-N 3.39Å; H261-R265 WeakPolarHBondContact O-CG 3.31Å; H261-R265 PolarHBondContact O-N 3.04Å
262	R	83.9	Confident	81.3	Confident	170 Å²	170	85.5 Å²	85.5	64%	0.642	44%	0.439	S	S	*	.	H	α-helix	trans	-65.8	-49	175.8	-170.9	-178.9	-65.7	-169	1.1	110.9	Q258 D259 F260 L264 R265 C266	Q258-R262 PolarHBondContact O-N 2.98Å; D259-R262 PolarHBondContact O-N 3.07Å; F260-R262 VanDerWaalsContact C-N 3.26Å; F260-R262 PolarHBondContact O-N 3.36Å; R262-L264 VanDerWaalsContact C-N 3.33Å; R262-L264 PolarHBondContact O-N 3.45Å; R262-R265 PolarHBondContact O-N 3.02Å; R262-C266 PolarHBondContact O-N 3.33Å; R262-C266 VanDerWaalsContact O-N 3.08Å; R262-C266 PolarHBondContact O-SG 2.98Å
263	A	84.1	Confident	81.4	Confident	61 Å²	61	88.7 Å²	88.7	50%	0.504	47%	0.467	S	S	.	.	H	α-helix	trans	-62.1	-40.7	177.7	0	0	0	0	0	112.2	D259 F260 C266 Y267	D259-A263 WeakPolarHBondContact O-CB 3.5Å; D259-A263 PolarHBondContact O-N 3.44Å; F260-A263 PolarHBondContact O-N 3.46Å; A263-C266 PolarHBondContact O-N 3.38Å; A263-Y267 WeakPolarHBondContact O-CB 3.39Å; A263-Y267 PolarHBondContact O-N 3.43Å
264	L	83.6	Confident	81.4	Confident	34 Å²	34	89 Å²	89	18%	0.178	46%	0.46	C	S	.	.	H	α-helix	trans	-64.7	-43.8	178.5	-175.1	64.4	0	0	0	111.6	L7 F260 R262 Y267 V268 A282	L7-L264 HydrophobicContact CD1-CD1 3.47Å; L7-L264 VanDerWaalsContact CD1-CD1 3.47Å; F260-L264 HydrophobicContact CE1-CB 4.49Å; F260-L264 HydrophobicContact CE1-CD2 3.83Å; F260-L264 HydrophobicContact CZ-CD1 4.47Å; F260-L264 HydrophobicContact CZ-CD2 4.19Å; F260-L264 WeakPolarHBondContact O-CB 3.38Å; F260-L264 PolarHBondContact O-N 3.02Å; R262-L264 VanDerWaalsContact C-N 3.33Å; R262-L264 PolarHBondContact O-N 3.45Å; L264-Y267 PolarHBondContact O-N 2.89Å; L264-V268 VanDerWaalsContact O-CG2 3.3Å; L264-V268 WeakPolarHBondContact O-CG2 3.29Å; L264-V268 PolarHBondContact O-N 3.38Å; L264-A282 HydrophobicContact CD1-CB 4.4Å; L264-A282 HydrophobicContact CD2-CB 3.97Å; L264-A282 HydrophobicContact CG-CB 4.24Å
265	R	83.4	Confident	81.2	Confident	167 Å²	167	88.6 Å²	88.6	63%	0.63	47%	0.471	S	S	*	.	H	α-helix	trans	-59.5	-49.5	173.7	-76.6	178.8	-172.2	136	0.9	111.2	H261 R262 Y267 V268 D269	H261-R265 WeakPolarHBondContact O-CG 3.31Å; H261-R265 PolarHBondContact O-N 3.04Å; R262-R265 PolarHBondContact O-N 3.02Å; R265-Y267 VanDerWaalsContact C-N 3.25Å; R265-Y267 PolarHBondContact O-N 3.41Å; R265-V268 PolarHBondContact O-N 3.37Å; R265-V268 VanDerWaalsContact O-N 3.17Å; R265-D269 WeakPolarHBondContact O-CB 3.49Å; R265-D269 PolarHBondContact O-N 2.82Å
266	C	84.4	Confident	80.9	Confident	79 Å²	79	82.8 Å²	82.8	53%	0.534	44%	0.443	S	S	.	.	H	α-helix	trans	-57.5	-40	177.1	-65.4	0	0	0	0	112.2	R262 A263 F270	R262-C266 PolarHBondContact O-N 3.33Å; R262-C266 VanDerWaalsContact O-N 3.08Å; R262-C266 PolarHBondContact O-SG 2.98Å; A263-C266 PolarHBondContact O-N 3.38Å; C266-F270 WeakPolarHBondContact O-CB 3.45Å; C266-F270 PolarHBondContact O-N 3.46Å
267	Y	83.6	Confident	80.6	Confident	104 Å²	104	82.5 Å²	82.5	41%	0.408	44%	0.437	S	S	.	.	H	α-helix	trans	-65.7	-47.4	176.1	178.3	-89.9	0	0	0	112.2	L7 V9 A263 L264 R265 F270 T271	L7-Y267 HydrophobicContact CD1-CD1 3.73Å; L7-Y267 HydrophobicContact CD1-CE1 3.74Å; L7-Y267 HydrophobicContact CD2-CD1 4.45Å; L7-Y267 HydrophobicContact CD2-CE1 3.71Å; L7-Y267 HydrophobicContact CG-CE1 4.29Å; V9-Y267 HydrophobicContact CG2-CE1 4.07Å; A263-Y267 WeakPolarHBondContact O-CB 3.39Å; A263-Y267 PolarHBondContact O-N 3.43Å; L264-Y267 PolarHBondContact O-N 2.89Å; R265-Y267 VanDerWaalsContact C-N 3.25Å; R265-Y267 PolarHBondContact O-N 3.41Å; Y267-F270 PolarHBondContact O-N 3.37Å; Y267-T271 HydrophobicContact CD1-CG2 4.18Å; Y267-T271 HydrophobicContact CD2-CG2 4.18Å; Y267-T271 HydrophobicContact CE1-CG2 3.75Å; Y267-T271 HydrophobicContact CE2-CG2 3.77Å; Y267-T271 HydrophobicContact CG-CG2 4.38Å; Y267-T271 WeakPolarHBondContact O-CB 3.4Å; Y267-T271 WeakPolarHBondContact O-CG2 3.27Å; Y267-T271 PolarHBondContact O-N 2.75Å; Y267-T271 PolarHBondContact O-OG1 3.48Å
268	V	83.7	Confident	80.5	Confident	35 Å²	35	85 Å²	85	21%	0.212	45%	0.45	C	S	.	.	H	α-helix	trans	-62.4	-44.5	179.1	172.1	0	0	0	0	110.9	L7 L264 R265 T271 G272 V280 A282	L7-V268 HydrophobicContact CD1-CG2 4.32Å; L264-V268 VanDerWaalsContact O-CG2 3.3Å; L264-V268 WeakPolarHBondContact O-CG2 3.29Å; L264-V268 PolarHBondContact O-N 3.38Å; R265-V268 PolarHBondContact O-N 3.37Å; R265-V268 VanDerWaalsContact O-N 3.17Å; V268-T271 WeakPolarHBondContact CA-OG1 3.27Å; V268-T271 PolarHBondContact O-N 3.5Å; V268-T271 PolarHBondContact O-OG1 3.29Å; V268-G272 PolarHBondContact O-N 3.26Å; V268-V280 HydrophobicContact CB-CG1 4.28Å; V268-V280 HydrophobicContact CG1-CB 4.49Å; V268-V280 HydrophobicContact CG1-CG1 4.04Å; V268-V280 HydrophobicContact CG2-CG1 3.88Å; V268-A282 HydrophobicContact CG2-CB 4.15Å
269	D	84.4	Confident	80.6	Confident	114 Å²	114	82.1 Å²	82.1	61%	0.61	44%	0.436	S	S	*	.	H	α-helix	trans	-64.8	-44	178.5	-64.8	-25	0	0	0	111	R265 A273	R265-D269 WeakPolarHBondContact O-CB 3.49Å; R265-D269 PolarHBondContact O-N 2.82Å; D269-A273 WeakPolarHBondContact O-CB 3.34Å; D269-A273 PolarHBondContact O-N 3.47Å; D269-A273 VanDerWaalsContact O-N 3.11Å
270	F	83.8	Confident	80.6	Confident	138 Å²	138	78 Å²	78	61%	0.605	42%	0.415	S	S	*	.	H	α-helix	trans	-66.5	-41.9	178.7	-179.4	-93.9	0	0	0	112.6	C266 Y267 Q274	C266-F270 WeakPolarHBondContact O-CB 3.45Å; C266-F270 PolarHBondContact O-N 3.46Å; Y267-F270 PolarHBondContact O-N 3.37Å; F270-Q274 WeakPolarHBondContact O-CG 3.47Å
271	T	81.2	Confident	80.5	Confident	14 Å²	14	77.8 Å²	77.8	9%	0.086	42%	0.42	C	S	.	.	H	α-helix	trans	-74.8	-40.5	-179.7	48.8	0	0	0	0	111.9	Y267 V268 A273 Q274 C277 V280	Y267-T271 HydrophobicContact CD1-CG2 4.18Å; Y267-T271 HydrophobicContact CD2-CG2 4.18Å; Y267-T271 HydrophobicContact CE1-CG2 3.75Å; Y267-T271 HydrophobicContact CE2-CG2 3.77Å; Y267-T271 HydrophobicContact CG-CG2 4.38Å; Y267-T271 WeakPolarHBondContact O-CB 3.4Å; Y267-T271 WeakPolarHBondContact O-CG2 3.27Å; Y267-T271 PolarHBondContact O-N 2.75Å; Y267-T271 PolarHBondContact O-OG1 3.48Å; V268-T271 WeakPolarHBondContact CA-OG1 3.27Å; V268-T271 PolarHBondContact O-N 3.5Å; V268-T271 PolarHBondContact O-OG1 3.29Å; T271-A273 PolarHBondContact O-N 2.93Å; T271-Q274 VanDerWaalsContact O-CB 3.27Å; T271-Q274 WeakPolarHBondContact O-CB 3.22Å; T271-Q274 WeakPolarHBondContact O-CG 3.36Å; T271-Q274 PolarHBondContact O-N 2.74Å; T271-C277 WeakPolarHBondContact O-CB 3.42Å; T271-V280 WeakPolarHBondContact OG1-CG2 3.37Å
272	G	79.4	Confident	80.4	Confident	47 Å²	47	77.1 Å²	77.1	49%	0.485	43%	0.426	S	S	.	.	H	α-helix	trans	-63.5	-27.6	174.1	0	0	0	0	0	113.5	V268 Q274	V268-G272 PolarHBondContact O-N 3.26Å; G272-Q274 VanDerWaalsContact C-N 3.26Å; G272-Q274 PolarHBondContact O-N 2.97Å
273	A	80.4	Confident	80.1	Confident	82 Å²	82	75.1 Å²	75.1	68%	0.678	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-9	173.7	0	0	0	0	0	113.9	D269 T271	D269-A273 WeakPolarHBondContact O-CB 3.34Å; D269-A273 PolarHBondContact O-N 3.47Å; D269-A273 VanDerWaalsContact O-N 3.11Å; T271-A273 PolarHBondContact O-N 2.93Å
274	Q	77.4	Confident	79.7	Confident	61 Å²	61	77.8 Å²	77.8	29%	0.285	42%	0.424	S	S	.	.	S	Bend	trans	-74.4	132.7	177	-62.2	-62.6	-31.7	0	0	110.7	F270 T271 G272 H276 C277	F270-Q274 WeakPolarHBondContact O-CG 3.47Å; T271-Q274 VanDerWaalsContact O-CB 3.27Å; T271-Q274 WeakPolarHBondContact O-CB 3.22Å; T271-Q274 WeakPolarHBondContact O-CG 3.36Å; T271-Q274 PolarHBondContact O-N 2.74Å; G272-Q274 VanDerWaalsContact C-N 3.26Å; G272-Q274 PolarHBondContact O-N 2.97Å; Q274-H276 PolarHBondContact O-N 3.35Å; Q274-H276 VanDerWaalsContact O-N 3.1Å; Q274-H276 PolarHBondContact OE1-CE1 3.4Å; Q274-C277 HydrophobicContact CB-CB 4.08Å; Q274-C277 WeakPolarHBondContact O-CB 3.31Å; Q274-C277 PolarHBondContact O-N 3.24Å
275	S	70.7	Confident	79.1	Confident	118 Å²	118	79.5 Å²	79.5	83%	0.825	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-21.3	178.8	55.8	0	0	0	0	114.3
276	H	70.6	Confident	78.1	Confident	64 Å²	64	78.6 Å²	78.6	30%	0.296	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.1	7.6	179.2	56.5	-87.6	0	0	0	112.2	L11 L12 Q274	L11-H276 CarbonylContact C-O 3.47Å; L11-H276 VanDerWaalsContact CA-O 3.3Å; L11-H276 WeakPolarHBondContact CA-O 3.38Å; L12-H276 HydrophobicContact CB-CB 4.28Å; L12-H276 PolarHBondContact N-O 2.99Å; L12-H276 WeakPolarHBondContact O-CB 3.44Å; Q274-H276 PolarHBondContact O-N 3.35Å; Q274-H276 VanDerWaalsContact O-N 3.1Å; Q274-H276 PolarHBondContact OE1-CE1 3.4Å
277	C	72.3	Confident	76.7	Confident	20 Å²	20	78.4 Å²	78.4	14%	0.135	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	119.4	170.7	-179.9	0	0	0	0	109.8	L11 T271 Q274 V280	L11-C277 HydrophobicContact CD2-CB 3.67Å; T271-C277 WeakPolarHBondContact O-CB 3.42Å; Q274-C277 HydrophobicContact CB-CB 4.08Å; Q274-C277 WeakPolarHBondContact O-CB 3.31Å; Q274-C277 PolarHBondContact O-N 3.24Å; C277-V280 WeakPolarHBondContact SG-CG2 3.25Å
278	L	77.8	Confident	74.9	Confident	88 Å²	88	76.8 Å²	76.8	46%	0.461	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	-40.8	175.2	-67.2	175.4	0	0	0	111.2	C10 L12 I243	C10-L278 HydrophobicContact CB-CB 4.11Å; C10-L278 PolarHBondContact O-N 3.03Å; L12-L278 HydrophobicContact CD1-CD2 3.45Å; L12-L278 VanDerWaalsContact CD1-CD2 3.45Å; L12-L278 HydrophobicContact CD1-CG 4.01Å; L12-L278 HydrophobicContact CD2-CD1 4.29Å; L12-L278 HydrophobicContact CD2-CD2 4.4Å; L12-L278 HydrophobicContact CG-CD1 3.93Å; L12-L278 HydrophobicContact CG-CD2 3.7Å; L12-L278 HydrophobicContact CG-CG 3.73Å; I243-L278 HydrophobicContact CD1-CD1 4.24Å; I243-L278 HydrophobicContact CG1-CD1 4.02Å; I243-L278 HydrophobicContact CG2-CD1 4.02Å
279	H	80.1	Confident	72.7	Confident	102 Å²	102	83.6 Å²	83.6	47%	0.472	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-163.4	134.5	-174.3	-179.6	-92.2	0	0	0	111.3	C10	C10-H279 HydrophobicContact CB-CB 4.03Å; C10-H279 PolarHBondContact N-O 3.04Å; C10-H279 PolarHBondContact O-N 3.45Å
280	V	83.5	Confident	72.1	Confident	26 Å²	26	82.1 Å²	82.1	16%	0.158	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	132.6	166.9	-179.7	0	0	0	0	108.7	T8 V9 V268 T271 C277	T8-V280 WeakPolarHBondContact O-CA 3.5Å; V9-V280 HydrophobicContact CB-CG2 4.47Å; V9-V280 HydrophobicContact CG1-CG2 3.89Å; V9-V280 HydrophobicContact CG2-CG1 4.2Å; V9-V280 HydrophobicContact CG2-CG2 4.35Å; V268-V280 HydrophobicContact CB-CG1 4.28Å; V268-V280 HydrophobicContact CG1-CB 4.49Å; V268-V280 HydrophobicContact CG1-CG1 4.04Å; V268-V280 HydrophobicContact CG2-CG1 3.88Å; T271-V280 WeakPolarHBondContact OG1-CG2 3.37Å; C277-V280 WeakPolarHBondContact SG-CG2 3.25Å
281	S	80.4	Confident	71.5	Confident	46 Å²	46	79.1 Å²	79.1	32%	0.322	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	148.4	169	62.1	0	0	0	0	111.5	T8	T8-S281 PolarHBondContact N-O 3.37Å; T8-S281 PolarHBondContact O-N 3.28Å
282	A	80.7	Confident	70.9	Confident	50 Å²	50	82.7 Å²	82.7	41%	0.413	52%	0.519	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	129.4	172.2	0	0	0	0	0	108.9	L6 L264 V268	L6-A282 CarbonylContact O-C 3.56Å; L6-A282 VanDerWaalsContact O-CA 3.31Å; L6-A282 WeakPolarHBondContact O-CA 3.38Å; L264-A282 HydrophobicContact CD1-CB 4.4Å; L264-A282 HydrophobicContact CD2-CB 3.97Å; L264-A282 HydrophobicContact CG-CB 4.24Å; V268-A282 HydrophobicContact CG2-CB 4.15Å
283	Q	75.9	Confident	70.4	Confident	127 Å²	127	84.8 Å²	84.8	59%	0.593	52%	0.521	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.2	133.7	179.1	-172.8	173.9	5.6	0	0	109.8	L6 M285	L6-Q283 PolarHBondContact N-O 3.43Å; L6-Q283 PolarHBondContact O-N 3.44Å; Q283-M285 PolarHBondContact O-N 3.34Å
284	K	76	Confident	69.8	Low	117 Å²	117	85 Å²	85	51%	0.509	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.8	167.8	-175.3	178	-179.4	-178	0	108
285	M	70.7	Confident	69.3	Low	70 Å²	70	86.6 Å²	86.6	35%	0.345	53%	0.526	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	128.6	168.5	-59.8	-65.4	-69.9	0	0	107.1	A4 L6 Q283	A4-M285 HydrophobicContact CB-CB 3.98Å; A4-M285 WeakPolarHBondContact O-CA 3.2Å; A4-M285 VanDerWaalsContact O-CB 3.3Å; A4-M285 WeakPolarHBondContact O-CB 3.38Å; A4-M285 PolarHBondContact O-N 2.72Å; L6-M285 HydrophobicContact CB-CG 4.02Å; L6-M285 HydrophobicContact CB-SD 4.12Å; L6-M285 HydrophobicContact CD2-SD 4.48Å; Q283-M285 PolarHBondContact O-N 3.34Å
286	L	62.4	Low	69.2	Low	149 Å²	149	84.4 Å²	84.4	78%	0.78	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-75.3	127.6	165.8	-69.8	163.3	0	0	0	106	G288	L286-G288 PolarHBondContact O-N 3.31Å
287	D	55	Low	69.1	Low	75 Å²	75	85.9 Å²	85.9	40%	0.401	52%	0.521	S	S	.	.	P	Polyproline II helix	trans	-53.8	116.1	167.9	-66.1	-24.6	0	0	0	106.5
288	G	46.9	Very low	68.8	Low	70 Å²	70	91.4 Å²	91.4	72%	0.722	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-60.3	143.9	177	0	0	0	0	0	110	L286	L286-G288 PolarHBondContact O-N 3.31Å
289	A	36.6	Very low	68	Low	177 Å²	177	91.7 Å²	91.7	100%	1.463	56%	0.562	S	S	*	*			trans	-46.4	0	164.2	0	0	0	0	0	113.1

Retrieved 289 of 289 residues in 97.1 ms (Link to these results)

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