A0A077ZAB3_TRITR Loading...

Deoxyribose phosphate aldolase

AlphaFold DB , UniProt , Accession A0A077ZAB3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 338 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	39.8	Very low	37.7	Very low	247 Å²	247	163.3 Å²	163.3	100%	1.217	78%	0.784	S	S	*	*				0	82	0	-77	-166	-76.7	0	0	109.7
2	S	37.1	Very low	37.3	Very low	117 Å²	117	168 Å²	168	82%	0.818	79%	0.788	S	S	*	*			trans	-162	55.6	169.3	67.9	0	0	0	0	111.6
3	E	36.6	Very low	36.8	Very low	190 Å²	190	169.6 Å²	169.6	89%	0.888	79%	0.791	S	S	*	*			trans	-128.1	58.1	172.6	-74.8	-171	149.2	0	0	110.3
4	R	38.8	Very low	36.4	Very low	251 Å²	251	171.4 Å²	171.4	95%	0.947	80%	0.795	S	S	*	*			trans	-147	43.8	168.6	-71.5	-164.5	-179.8	175.7	0.5	113
5	K	32	Very low	35.9	Very low	198 Å²	198	169.5 Å²	169.5	86%	0.861	79%	0.786	S	S	*	*			trans	-127.3	121.8	156.9	-67.1	-177.6	179.5	-179.6	0	103.9
6	S	39.1	Very low	35.5	Very low	42 Å²	42	166.9 Å²	166.9	29%	0.294	77%	0.774	S	S	.	*			cis	-178.8	97.6	19.5	36.2	0	0	0	0	105.4	S8 E9	S6-S8 PolarHBondContact O-N 3.33Å; S6-E9 WeakPolarHBondContact CB-OE2 3.4Å; S6-E9 PolarHBondContact O-N 2.66Å; S6-E9 WeakPolarHBondContact OG-CB 3.47Å; S6-E9 PolarHBondContact OG-OE2 3.49Å
7	E	39.1	Very low	35.2	Very low	171 Å²	171	160.5 Å²	160.5	80%	0.799	75%	0.747	S	S	*	*	H	α-helix	trans	-67.7	-18.7	175.2	-129.9	168.8	-177.6	0	0	111.6
8	S	41.1	Very low	35.2	Very low	90 Å²	90	154.7 Å²	154.7	63%	0.629	72%	0.72	S	S	*	*	H	α-helix	trans	-74.2	-24.5	171.8	51.4	0	0	0	0	114.2	S6	S6-S8 PolarHBondContact O-N 3.33Å
9	E	36.4	Very low	35	Very low	127 Å²	127	148.1 Å²	148.1	59%	0.593	69%	0.691	S	S	*	*	H	α-helix	trans	-83.8	-26.5	174.5	-98	169.3	142.9	0	0	112.7	S6 K11 R12	S6-E9 WeakPolarHBondContact CB-OE2 3.4Å; S6-E9 PolarHBondContact O-N 2.66Å; S6-E9 WeakPolarHBondContact OG-CB 3.47Å; S6-E9 PolarHBondContact OG-OE2 3.49Å; E9-K11 VanDerWaalsContact C-N 3.32Å; E9-K11 PolarHBondContact O-N 2.66Å; E9-R12 PolarHBondContact O-N 3.43Å
10	K	38.3	Very low	35.1	Very low	180 Å²	180	140.9 Å²	140.9	78%	0.783	66%	0.658	S	S	*	*	H	α-helix	trans	-71	-25.5	174.4	-80.7	179.4	172.2	173.2	0	113.1
11	K	36.7	Very low	35.1	Very low	183 Å²	183	135.2 Å²	135.2	80%	0.796	63%	0.632	S	S	*	*	H	α-helix	trans	-82	-19.3	174.7	-74.2	-174	179.4	177.9	0	114.1	E9	E9-K11 VanDerWaalsContact C-N 3.32Å; E9-K11 PolarHBondContact O-N 2.66Å
12	R	32.2	Very low	34.7	Very low	220 Å²	220	123.7 Å²	123.7	83%	0.83	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	-6.1	179	-89.3	-178.3	158.2	-179.2	-6.8	115.3	E9	E9-R12 PolarHBondContact O-N 3.43Å
13	K	31	Very low	34.1	Very low	189 Å²	189	120.6 Å²	120.6	82%	0.822	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.8	15.2	-175.9	-93.2	-177.3	175.1	177.9	0	115.7
14	K	31	Very low	33.7	Very low	195 Å²	195	115.9 Å²	115.9	85%	0.848	54%	0.538	S	S	*	.	S	Bend	trans	-123.9	8.6	-174.3	-106.9	-174.5	179.2	-177.2	0	117.6
15	Q	29.7	Very low	33.3	Very low	143 Å²	143	111.4 Å²	111.4	67%	0.668	53%	0.528	S	S	*	.			trans	-112.5	103	168.5	-94.4	163.3	-40.1	0	0	108
16	Q	29	Very low	33.2	Very low	127 Å²	127	106.6 Å²	106.6	59%	0.593	52%	0.515	S	S	*	.			trans	-113	131	173.2	-91.7	-176.2	-28.3	0	0	108.6
17	D	30.7	Very low	32.6	Very low	59 Å²	59	109.5 Å²	109.5	32%	0.316	53%	0.531	S	S	.	.			trans	-62.8	146.2	-162.6	-54.5	-66	0	0	0	113.7	H215 S242	D17-H215 IonicContact OD1-ND1 2.68Å; D17-H215 IonicContact OD2-CE1 2.84Å; D17-S242 PolarHBondContact O-OG 2.92Å; D17-S242 VanDerWaalsContact O-OG 3.13Å
18	H	35.2	Very low	31.9	Very low	56 Å²	56	107.6 Å²	107.6	26%	0.259	53%	0.534	S	S	.	.			trans	-100	127.9	172	-68.4	-71.1	0	0	0	108.2	A223 I225	H18-A223 PolarHBondContact CD2-O 3.04Å; H18-I225 WeakPolarHBondContact O-CB 3.43Å
19	V	31.4	Very low	31.6	Very low	29 Å²	29	107.2 Å²	107.2	18%	0.176	52%	0.524	C	S	.	.			trans	-129.4	122.1	179.3	174.3	0	0	0	0	107.9	V227 L235	V19-V227 HydrophobicContact CB-CG2 4.12Å; V19-V227 HydrophobicContact CG1-CB 3.76Å; V19-V227 HydrophobicContact CG1-CG1 3.99Å; V19-V227 HydrophobicContact CG1-CG2 3.81Å; V19-V227 HydrophobicContact CG2-CG2 4.18Å; V19-L235 HydrophobicContact CG1-CD2 4.35Å
20	V	37.3	Very low	31	Very low	3 Å²	3	107.5 Å²	107.5	2%	0.018	53%	0.529	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	121.2	178.9	166	0	0	0	0	109.8	I225 D226 V227 F245 R247	V20-I225 PolarHBondContact N-O 3.05Å; V20-D226 HydrophobicContact CB-CB 4.42Å; V20-D226 HydrophobicContact CG1-CB 4.43Å; V20-D226 WeakPolarHBondContact CG1-OD1 3.29Å; V20-D226 CarbonylContact O-C 3.34Å; V20-V227 CarbonylContact C-O 3.48Å; V20-V227 CarbonylContact O-C 3.58Å; V20-V227 WeakPolarHBondContact O-CA 3.38Å; V20-V227 PolarHBondContact O-N 3.43Å; V20-F245 HydrophobicContact CB-CB 4.4Å; V20-F245 HydrophobicContact CG1-CB 3.84Å; V20-F245 WeakPolarHBondContact CG1-O 3.34Å; V20-F245 HydrophobicContact CG2-CB 3.78Å; V20-R247 HydrophobicContact CG1-CB 4.04Å
21	I	33.8	Very low	30.5	Very low	22 Å²	22	108.8 Å²	108.8	11%	0.113	54%	0.535	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	138.9	-169.1	-64.9	154.1	0	0	0	113.3	V227 P229 F232 L235 Y237 R247	I21-V227 VanDerWaalsContact CA-O 3.22Å; I21-V227 WeakPolarHBondContact CA-O 3.35Å; I21-P229 HydrophobicContact CB-CG 4.33Å; I21-P229 HydrophobicContact CG1-CG 4.15Å; I21-P229 HydrophobicContact CG2-CG 3.47Å; I21-P229 VanDerWaalsContact CG2-CG 3.47Å; I21-F232 HydrophobicContact CG2-CD1 4.29Å; I21-F232 HydrophobicContact CG2-CE1 3.32Å; I21-F232 HydrophobicContact CG2-CZ 3.65Å; I21-L235 HydrophobicContact CD1-CD1 3.36Å; I21-L235 HydrophobicContact CD1-CD2 4.25Å; I21-L235 HydrophobicContact CD1-CG 4.32Å; I21-L235 HydrophobicContact CG1-CD1 3.93Å; I21-Y237 HydrophobicContact CD1-CE1 4.07Å; I21-Y237 WeakPolarHBondContact CD1-OH 3.46Å; I21-R247 PolarHBondContact O-N 2.94Å
22	L	31.4	Very low	30	Very low	5 Å²	5	104.9 Å²	104.9	3%	0.026	53%	0.531	C	S	.	.			trans	-125.4	144	176.9	-86.9	172	0	0	0	112.5	V227 I228 R247	L22-V227 PolarHBondContact N-O 2.97Å; L22-I228 HydrophobicContact CB-CB 4.42Å; L22-I228 HydrophobicContact CB-CD1 4.24Å; L22-I228 HydrophobicContact CB-CG1 3.92Å; L22-I228 HydrophobicContact CB-CG2 4.21Å; L22-I228 HydrophobicContact CD1-CD1 3.89Å; L22-I228 HydrophobicContact CD1-CG1 3.95Å; L22-R247 HydrophobicContact CD2-CB 3.57Å; L22-R247 HydrophobicContact CD2-CG 3.41Å; L22-R247 VanDerWaalsContact CD2-CG 3.41Å; L22-R247 HydrophobicContact CG-CB 4.01Å; L22-R247 HydrophobicContact CG-CG 4.2Å
23	P	25.5	Very low	30	Very low	53 Å²	53	96.4 Å²	96.4	34%	0.344	50%	0.502	S	S	.	.			trans	-81.7	157.6	169.7	32	-32.8	0	0	0	113.1	Q25 P249	P23-Q25 PolarHBondContact O-N 3.27Å; P23-P249 HydrophobicContact CG-CG 4.01Å
24	P	27.6	Very low	30.1	Very low	90 Å²	90	93.1 Å²	93.1	58%	0.584	49%	0.493	S	S	*	.	S	Bend	trans	-94.1	86.1	-164.5	36	-32.9	0	0	0	113.2
25	Q	31	Very low	30.3	Very low	157 Å²	157	88.1 Å²	88.1	73%	0.734	48%	0.475	S	S	*	.			trans	-151.8	99	151.1	-71.8	-158.6	5.8	0	0	110.7	P23	P23-Q25 PolarHBondContact O-N 3.27Å
26	V	30.6	Very low	30.4	Very low	98 Å²	98	86.3 Å²	86.3	59%	0.594	47%	0.47	S	S	*	.			trans	-121.8	99.3	163	-172.7	0	0	0	0	107	L286	V26-L286 HydrophobicContact CG2-CD1 3.64Å
27	T	25.6	Very low	30.6	Very low	102 Å²	102	84.6 Å²	84.6	63%	0.626	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-77.9	146.4	170.6	17.9	0	0	0	0	109.6	I29	T27-I29 PolarHBondContact O-N 3.2Å
28	P	24.7	Very low	30.5	Very low	132 Å²	132	89.4 Å²	89.4	86%	0.857	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-64.5	130.5	-178.7	-12.3	26.4	0	0	0	110.4
29	I	33.6	Very low	30.2	Very low	81 Å²	81	92.7 Å²	92.7	42%	0.415	53%	0.531	S	S	.	.	P	Polyproline II helix	trans	-103	149.6	-178.4	-63	179.8	0	0	0	111.5	T27 E287	T27-I29 PolarHBondContact O-N 3.2Å; I29-E287 WeakPolarHBondContact CD1-OE2 3.4Å
30	D	25.7	Very low	30.6	Very low	134 Å²	134	97.4 Å²	97.4	72%	0.717	56%	0.555	S	S	*	*	P	Polyproline II helix	trans	-54.9	152.6	-166.4	-146.2	-17.5	0	0	0	117.1	S32	D30-S32 VanDerWaalsContact C-N 3.31Å; D30-S32 PolarHBondContact O-N 2.94Å; D30-S32 VanDerWaalsContact O-N 3.08Å
31	K	27.2	Very low	30.6	Very low	206 Å²	206	105.6 Å²	105.6	90%	0.896	59%	0.59	S	S	*	*	S	Bend	trans	-78.8	18.8	-162.3	-70.6	179.1	178.9	171.5	0	116.4
32	S	25.6	Very low	30.7	Very low	101 Å²	101	110.8 Å²	110.8	71%	0.706	63%	0.625	S	S	*	*			trans	-126.3	80.6	-170.3	57.6	0	0	0	0	113.6	D30	D30-S32 VanDerWaalsContact C-N 3.31Å; D30-S32 PolarHBondContact O-N 2.94Å; D30-S32 VanDerWaalsContact O-N 3.08Å
33	L	32.5	Very low	31.2	Very low	42 Å²	42	113.5 Å²	113.5	22%	0.22	64%	0.639	C	S	.	*			trans	-113.4	98.1	161.1	-96.4	143.9	0	0	0	109.2	L35 R141 Y321	L33-L35 HydrophobicContact CD2-CD1 4.41Å; L33-L35 HydrophobicContact CD2-CD2 3.53Å; L33-L35 HydrophobicContact CD2-CG 3.78Å; L33-R141 PolarHBondContact O-NH2 3.47Å; L33-Y321 HydrophobicContact CD2-CE1 4.36Å
34	N	33.7	Very low	32	Very low	120 Å²	120	116.5 Å²	116.5	64%	0.642	65%	0.647	S	S	*	*			trans	-95.3	100.5	155.4	-92.6	-21.7	0	0	0	106.8	D36	N34-D36 VanDerWaalsContact C-N 3.27Å; N34-D36 PolarHBondContact O-N 3.42Å
35	L	34.4	Very low	32.5	Very low	91 Å²	91	115.8 Å²	115.8	48%	0.476	64%	0.642	S	S	.	*	S	Bend	trans	-73.2	-22.6	-177.4	-78.3	166.7	0	0	0	112.5	L33	L33-L35 HydrophobicContact CD2-CD1 4.41Å; L33-L35 HydrophobicContact CD2-CD2 3.53Å; L33-L35 HydrophobicContact CD2-CG 3.78Å
36	D	32.4	Very low	33.2	Very low	104 Å²	104	108.8 Å²	108.8	56%	0.556	61%	0.611	S	S	*	*	S	Bend	trans	-130.2	129	174.1	-57.5	-29.8	0	0	0	107	N34 K38	N34-D36 VanDerWaalsContact C-N 3.27Å; N34-D36 PolarHBondContact O-N 3.42Å; D36-K38 PolarHBondContact O-N 3.38Å
37	G	31.9	Very low	33.6	Very low	91 Å²	91	110.6 Å²	110.6	94%	0.938	62%	0.616	S	S	*	*	S	Bend	trans	-66.5	38.1	176.3	0	0	0	0	0	114.4
38	K	30.3	Very low	34.2	Very low	161 Å²	161	111.9 Å²	111.9	70%	0.7	62%	0.615	S	S	*	*	S	Bend	trans	-106	143.5	177.5	-69.7	-175	178.1	179.6	0	109.7	D36 N40	D36-K38 PolarHBondContact O-N 3.38Å; K38-N40 PolarHBondContact O-N 2.96Å
39	P	29.1	Very low	34.9	Very low	124 Å²	124	111.1 Å²	111.1	81%	0.805	60%	0.596	S	S	*	*			trans	-57.9	138.5	177	23.4	-31.7	0	0	0	110.4	K41	P39-K41 PolarHBondContact O-N 3Å
40	N	38.4	Very low	34.8	Very low	128 Å²	128	110.9 Å²	110.9	68%	0.684	61%	0.607	S	S	*	*			trans	-49.2	107.7	-177.7	-87.6	-31.7	0	0	0	110.8	K38	K38-N40 PolarHBondContact O-N 2.96Å
41	K	37.7	Very low	35.3	Very low	176 Å²	176	112.9 Å²	112.9	77%	0.765	61%	0.609	S	S	*	*			trans	-63.2	143.7	152.8	-82.4	-176.1	174.7	-177	0	107.4	P39 L43	P39-K41 PolarHBondContact O-N 3Å; K41-L43 PolarHBondContact O-N 2.73Å
42	P	35.9	Very low	35.6	Very low	130 Å²	130	109.1 Å²	109.1	84%	0.844	59%	0.589	S	S	*	*			trans	-60.5	109.4	176.3	24	-30.7	0	0	0	108.8
43	L	42.2	Very low	35.8	Very low	62 Å²	62	110.4 Å²	110.4	33%	0.325	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-79	135.8	178.1	-68.4	164	0	0	0	108.9	K41 Y138 E140	K41-L43 PolarHBondContact O-N 2.73Å; L43-Y138 HydrophobicContact CB-CD1 3.3Å; L43-Y138 HydrophobicContact CB-CE1 3.48Å; L43-Y138 VanDerWaalsContact CB-CE1 3.48Å; L43-Y138 HydrophobicContact CB-CG 3.93Å; L43-Y138 HydrophobicContact CD1-CD1 4.12Å; L43-Y138 HydrophobicContact CD1-CD2 4.01Å; L43-Y138 HydrophobicContact CD1-CE1 4.27Å; L43-Y138 HydrophobicContact CD1-CE2 4.15Å; L43-Y138 HydrophobicContact CD1-CG 3.97Å; L43-Y138 HydrophobicContact CG-CD1 4.25Å; L43-Y138 HydrophobicContact CG-CG 4.44Å; L43-E140 HydrophobicContact CD2-CB 4.09Å; L43-E140 HydrophobicContact CD2-CG 4.13Å
44	K	41.5	Very low	35.8	Very low	117 Å²	117	111.7 Å²	111.7	51%	0.509	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-77.9	130.3	179.8	-73.1	-172.1	176.3	-170.5	0	110.7	A46 Y138 E140	K44-A46 PolarHBondContact O-N 2.58Å; K44-Y138 WeakPolarHBondContact O-CD1 3.3Å; K44-E140 PolarHBondContact N-OE1 2.81Å
45	P	39.4	Very low	35.9	Very low	74 Å²	74	113.5 Å²	113.5	48%	0.481	62%	0.616	S	S	.	*	B	Isolated β-bridge	trans	-67	131.9	-179.8	19.9	-23.8	0	0	0	111.6	I47 E48	P45-I47 PolarHBondContact O-N 3.28Å; P45-E48 PolarHBondContact O-N 2.9Å
46	A	44.5	Very low	35.7	Very low	10 Å²	10	115.7 Å²	115.7	8%	0.083	63%	0.634	C	S	.	*	G	3₁₀ helix	trans	-60.2	-17.4	-177.7	0	0	0	0	0	114.7	K44 E48 Y49 A50 T136 R137 V139 F176	K44-A46 PolarHBondContact O-N 2.58Å; A46-E48 PolarHBondContact O-N 2.98Å; A46-Y49 PolarHBondContact O-N 3.44Å; A46-A50 PolarHBondContact O-N 3.47Å; A46-T136 WeakPolarHBondContact CB-O 3.31Å; A46-R137 VanDerWaalsContact CB-O 3.26Å; A46-R137 WeakPolarHBondContact CB-O 3.45Å; A46-R137 PolarHBondContact N-O 3.29Å; A46-V139 HydrophobicContact CB-CG2 4.32Å; A46-F176 HydrophobicContact CB-CE1 4.03Å; A46-F176 HydrophobicContact CB-CZ 3.73Å
47	I	39.5	Very low	35.5	Very low	136 Å²	136	119.7 Å²	119.7	70%	0.697	65%	0.646	S	S	*	*	G	3₁₀ helix	trans	-59.3	-27.3	176.7	-71.7	170.5	0	0	0	112.1	P45 Y49 A50	P45-I47 PolarHBondContact O-N 3.28Å; I47-Y49 VanDerWaalsContact C-N 3.3Å; I47-Y49 PolarHBondContact O-N 3.2Å; I47-A50 PolarHBondContact O-N 3.25Å
48	E	38.1	Very low	35.4	Very low	130 Å²	130	124.3 Å²	124.3	61%	0.607	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-67.9	-29.3	173.6	-78	-170.6	155.3	0	0	113	P45 A46	P45-E48 PolarHBondContact O-N 2.9Å; A46-E48 PolarHBondContact O-N 2.98Å
49	Y	39.4	Very low	35.4	Very low	115 Å²	115	123.6 Å²	123.6	45%	0.451	64%	0.643	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-19.2	179.3	-72.4	-87.9	0	0	0	113.3	A46 I47 K51 V139	A46-Y49 PolarHBondContact O-N 3.44Å; I47-Y49 VanDerWaalsContact C-N 3.3Å; I47-Y49 PolarHBondContact O-N 3.2Å; Y49-K51 PolarHBondContact O-N 3.17Å; Y49-V139 HydrophobicContact CD2-CB 4.5Å; Y49-V139 HydrophobicContact CD2-CG2 3.58Å; Y49-V139 HydrophobicContact CE2-CB 4.44Å; Y49-V139 HydrophobicContact CE2-CG2 3.99Å; Y49-V139 HydrophobicContact CG-CG2 4Å
50	A	31.7	Very low	35.4	Very low	77 Å²	77	122.7 Å²	122.7	64%	0.636	64%	0.637	S	S	*	*	S	Bend	trans	-70	-14	173.6	0	0	0	0	0	113	A46 I47 W52	A46-A50 PolarHBondContact O-N 3.47Å; I47-A50 PolarHBondContact O-N 3.25Å; A50-W52 PolarHBondContact O-N 3.41Å; A50-W52 VanDerWaalsContact O-N 3.16Å
51	K	35.3	Very low	34.9	Very low	176 Å²	176	125.2 Å²	125.2	77%	0.765	64%	0.642	S	S	*	*			trans	-84.8	43.2	173.4	-68.3	-173.9	177.9	179.6	0	112.4	Y49	Y49-K51 PolarHBondContact O-N 3.17Å
52	W	33.8	Very low	34.4	Very low	126 Å²	126	125.8 Å²	125.8	48%	0.477	65%	0.647	S	S	.	*			trans	-68.3	133.1	175.2	-134.4	-2	0	0	0	109.4	A50 G54 E178	A50-W52 PolarHBondContact O-N 3.41Å; A50-W52 VanDerWaalsContact O-N 3.16Å; W52-G54 PolarHBondContact O-N 3.04Å; W52-E178 HydrophobicContact CH2-CB 4.39Å; W52-E178 HydrophobicContact CH2-CG 3.86Å; W52-E178 WeakPolarHBondContact CH2-OE1 3.18Å; W52-E178 HydrophobicContact CZ3-CB 4.14Å; W52-E178 HydrophobicContact CZ3-CG 3.98Å; W52-E178 WeakPolarHBondContact CZ3-OE2 3.44Å
53	P	29.3	Very low	34.2	Very low	129 Å²	129	128 Å²	128	84%	0.838	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	105.1	179.8	7.9	2.4	0	0	0	108.7
54	G	33.1	Very low	33.6	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	150.7	-20.9	175.6	0	0	0	0	0	116.3	W52	W52-G54 PolarHBondContact O-N 3.04Å
55	R	36.4	Very low	33	Very low	158 Å²	158	133.1 Å²	133.1	60%	0.596	68%	0.679	S	S	*	*			trans	-116.7	73.3	-177.6	-68.4	-167.8	-163.1	-169.6	7.9	113	E178 D220	R55-E178 IonicContact NH2-OE2 3.51Å; R55-D220 IonicContact CZ-OD1 3.9Å; R55-D220 IonicContact NH1-OD2 2.65Å; R55-D220 IonicContact NH2-OD1 2.71Å; R55-D220 PolarHBondContact NH2-OD1 2.88Å; R55-D220 IonicContact NH2-OD2 2.81Å
56	T	29.3	Very low	32.5	Very low	136 Å²	136	135 Å²	135	83%	0.834	69%	0.693	S	S	*	*			trans	-104.6	8.9	161	33.5	0	0	0	0	113
57	K	29.5	Very low	32.2	Very low	188 Å²	188	139.7 Å²	139.7	82%	0.817	72%	0.723	S	S	*	*			trans	-103.6	77.8	-177.9	-68.1	-175.1	-178.3	178.2	0	110.8
58	F	30	Very low	31.7	Very low	188 Å²	188	140.5 Å²	140.5	83%	0.825	73%	0.729	S	S	*	*			trans	-171.5	79.8	142.4	-109.8	-77.3	0	0	0	108.9
59	I	28.5	Very low	31.5	Very low	147 Å²	147	142.1 Å²	142.1	75%	0.754	74%	0.742	S	S	*	*			trans	-87.4	120.6	153.5	-60.4	173.7	0	0	0	104.2	K61	I59-K61 PolarHBondContact O-N 2.93Å
60	P	30.5	Very low	31	Very low	104 Å²	104	141.7 Å²	141.7	68%	0.675	76%	0.756	S	S	*	*			trans	-56.6	119	170.4	-14.2	26.7	0	0	0	106.7	E62	P60-E62 VanDerWaalsContact C-N 3.28Å; P60-E62 PolarHBondContact O-N 3.19Å
61	K	27.2	Very low	31.2	Very low	181 Å²	181	146.5 Å²	146.5	79%	0.787	77%	0.765	S	S	*	*			trans	-64.3	99.4	167.8	-84.6	-174.4	174.6	178	0	106.7	I59 K63	I59-K61 PolarHBondContact O-N 2.93Å; K61-K63 VanDerWaalsContact C-N 3.31Å; K61-K63 PolarHBondContact O-N 3.49Å
62	E	27.3	Very low	31.1	Very low	189 Å²	189	147.1 Å²	147.1	88%	0.883	77%	0.771	S	S	*	*			trans	-54.8	104.3	150.2	-78	-176.7	162.2	0	0	106.4	P60	P60-E62 VanDerWaalsContact C-N 3.28Å; P60-E62 PolarHBondContact O-N 3.19Å
63	K	31.6	Very low	31.3	Very low	176 Å²	176	149.5 Å²	149.5	77%	0.765	78%	0.784	S	S	*	*			trans	-103.8	100	159.3	-84.6	-166.6	172.3	-169.4	0	107.5	K61	K61-K63 VanDerWaalsContact C-N 3.31Å; K61-K63 PolarHBondContact O-N 3.49Å
64	S	29.8	Very low	31.3	Very low	98 Å²	98	150.8 Å²	150.8	69%	0.685	78%	0.784	S	S	*	*			trans	-38.4	133.4	149.3	51.9	0	0	0	0	112.9
65	Q	28	Very low	31.4	Very low	189 Å²	189	158.5 Å²	158.5	88%	0.883	79%	0.792	S	S	*	*			trans	48.2	132.2	141.1	-62.4	176.2	-17.5	0	0	118.2
66	S	30.6	Very low	31.1	Very low	112 Å²	112	160.2 Å²	160.2	78%	0.783	81%	0.806	S	S	*	*				-176.4	-163.6	56.9	56.9	0	0	0	0	110
67	P	36.8	Very low	31.1	Very low	110 Å²	110	159.3 Å²	159.3	71%	0.714	80%	0.801	S	S	*	*				-119.8	177.7	-68.8	33	-13.9	0	0	0	111.5
68	N	30.3	Very low	31.2	Very low	152 Å²	152	155.3 Å²	155.3	81%	0.813	79%	0.794	S	S	*	*			trans	16.9	113.7	157.9	-73.3	-8.2	0	0	0	118.5
69	D	33.4	Very low	31.3	Very low	165 Å²	165	158 Å²	158	88%	0.882	80%	0.799	S	S	*	*			trans	-142.2	112	135.7	-97.9	-31.6	0	0	0	110.3	Q71	D69-Q71 PolarHBondContact O-N 3.36Å
70	S	29.3	Very low	31.5	Very low	106 Å²	106	156.2 Å²	156.2	74%	0.741	79%	0.787	S	S	*	*			trans	-59.5	117.7	164	43.8	0	0	0	0	110.3
71	Q	35.8	Very low	31.5	Very low	178 Å²	178	156.4 Å²	156.4	83%	0.832	79%	0.786	S	S	*	*			trans	-164.7	85.8	143	-107.3	170.5	48.3	0	0	109.3	D69 K73	D69-Q71 PolarHBondContact O-N 3.36Å; Q71-K73 PolarHBondContact O-N 2.98Å; Q71-K73 VanDerWaalsContact O-N 3.12Å
72	Q	32.1	Very low	31.9	Very low	189 Å²	189	155.7 Å²	155.7	88%	0.883	79%	0.786	S	S	*	*			trans	-71	96.3	163.3	-157.2	171.7	-10.8	0	0	106.4
73	K	37.5	Very low	32.2	Very low	176 Å²	176	153.5 Å²	153.5	77%	0.765	78%	0.775	S	S	*	*			trans	-119.3	110.1	164.7	-105.2	-177	179	177.6	0	107.6	Q71 R75	Q71-K73 PolarHBondContact O-N 2.98Å; Q71-K73 VanDerWaalsContact O-N 3.12Å; K73-R75 PolarHBondContact O-N 3.21Å
74	D	30.6	Very low	32.6	Very low	156 Å²	156	148.6 Å²	148.6	83%	0.834	76%	0.758	S	S	*	*			trans	-45.6	104.9	171.6	-59.3	-53.3	0	0	0	110.1
75	R	34.9	Very low	33.2	Very low	231 Å²	231	149.4 Å²	149.4	87%	0.872	75%	0.753	S	S	*	*			trans	-111	112.8	157.5	-81.6	-173.8	174.3	-178.9	-1	105.7	K73 T77	K73-R75 PolarHBondContact O-N 3.21Å; R75-T77 PolarHBondContact O-N 3.12Å
76	E	30	Very low	33.8	Very low	194 Å²	194	145.8 Å²	145.8	91%	0.907	74%	0.74	S	S	*	*			trans	-45	102.7	169.7	-67.2	177.1	146.4	0	0	109.4	P78	E76-P78 WeakPolarHBondContact O-CD 3.21Å
77	T	30.3	Very low	34.3	Very low	116 Å²	116	148 Å²	148	71%	0.712	74%	0.735	S	S	*	*			trans	-61.5	122.7	168.3	-32.9	0	0	0	0	105.9	R75 R79	R75-T77 PolarHBondContact O-N 3.12Å; T77-R79 PolarHBondContact O-N 3.33Å
78	P	31.2	Very low	34.9	Very low	105 Å²	105	147 Å²	147	68%	0.682	73%	0.727	S	S	*	*			trans	-54.2	124.1	171.3	-17.3	28.2	0	0	0	106.2	E76 Q80	E76-P78 WeakPolarHBondContact O-CD 3.21Å; P78-Q80 VanDerWaalsContact C-N 3.28Å; P78-Q80 PolarHBondContact O-N 3.47Å
79	R	31.4	Very low	36	Very low	244 Å²	244	146.6 Å²	146.6	92%	0.921	73%	0.725	S	S	*	*			trans	-51.6	100.9	173.2	-77.9	-177.4	-177	175	1.2	106.6	T77 V81	T77-R79 PolarHBondContact O-N 3.33Å; R79-V81 VanDerWaalsContact C-N 3.28Å; R79-V81 PolarHBondContact O-N 3.45Å
80	Q	33.5	Very low	37.4	Very low	110 Å²	110	141.7 Å²	141.7	51%	0.514	70%	0.702	S	S	.	*			trans	-71.1	98	172.5	-68	-164.1	-6.6	0	0	104.4	P78 E82	P78-Q80 VanDerWaalsContact C-N 3.28Å; P78-Q80 PolarHBondContact O-N 3.47Å; Q80-E82 PolarHBondContact O-N 3.05Å
81	V	29.4	Very low	39.4	Very low	108 Å²	108	140 Å²	140	66%	0.655	69%	0.689	S	S	*	*			trans	-64.4	97.7	161.4	-171.4	0	0	0	0	104.2	R79 E83	R79-V81 VanDerWaalsContact C-N 3.28Å; R79-V81 PolarHBondContact O-N 3.45Å; V81-E83 HydrophobicContact CB-CG 4.49Å; V81-E83 HydrophobicContact CG1-CG 3.68Å; V81-E83 PolarHBondContact O-N 3.36Å
82	E	35.2	Very low	41.2	Very low	166 Å²	166	137.4 Å²	137.4	78%	0.776	68%	0.68	S	S	*	*			trans	-69.3	81.5	164.1	-138.6	171.1	-158.2	0	0	104.8	Q80 D84	Q80-E82 PolarHBondContact O-N 3.05Å; E82-D84 VanDerWaalsContact C-N 3.28Å; E82-D84 PolarHBondContact O-N 3.21Å
83	E	34.9	Very low	43.4	Very low	142 Å²	142	136.4 Å²	136.4	66%	0.664	67%	0.668	S	S	*	*			trans	-63.4	102.2	166.5	-72	-171.9	167.1	0	0	105.9	V81 I85	V81-E83 HydrophobicContact CB-CG 4.49Å; V81-E83 HydrophobicContact CG1-CG 3.68Å; V81-E83 PolarHBondContact O-N 3.36Å; E83-I85 VanDerWaalsContact C-N 3.31Å; E83-I85 PolarHBondContact O-N 2.84Å
84	D	40.4	Very low	45.4	Very low	74 Å²	74	129.4 Å²	129.4	40%	0.396	64%	0.639	S	S	.	*			trans	-58.7	98.5	168.1	-163.7	-1.7	0	0	0	106	E82 D86 K87	E82-D84 VanDerWaalsContact C-N 3.28Å; E82-D84 PolarHBondContact O-N 3.21Å; D84-D86 PolarHBondContact O-N 2.99Å; D84-K87 HydrophobicContact CB-CB 4.39Å; D84-K87 HydrophobicContact CB-CD 3.95Å; D84-K87 HydrophobicContact CB-CG 4.01Å; D84-K87 WeakPolarHBondContact O-CA 3.28Å; D84-K87 WeakPolarHBondContact O-CB 3.4Å; D84-K87 PolarHBondContact O-N 3.16Å; D84-K87 WeakPolarHBondContact OD2-CE 3.49Å; D84-K87 IonicContact OD2-NZ 3.86Å; D84-K87 PolarHBondContact OD2-NZ 3.35Å
85	I	41.7	Very low	47.9	Very low	114 Å²	114	125.7 Å²	125.7	59%	0.585	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-54.9	-27.3	-176.6	-76.7	168.9	0	0	0	110.5	E83 K87 V88	E83-I85 VanDerWaalsContact C-N 3.31Å; E83-I85 PolarHBondContact O-N 2.84Å; I85-K87 PolarHBondContact O-N 3.5Å; I85-V88 PolarHBondContact O-N 3.19Å
86	D	39.9	Very low	50.3	Low	113 Å²	113	119.3 Å²	119.3	60%	0.604	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-65.7	-13.4	174.8	-68.3	-15.3	0	0	0	113.4	D84	D84-D86 PolarHBondContact O-N 2.99Å
87	K	41.5	Very low	53.2	Low	158 Å²	158	112 Å²	112	69%	0.687	57%	0.568	S	S	*	*	G	3₁₀ helix	trans	-103.4	-4	176.2	-62.5	-177.4	-175.9	157.5	0	114.1	D84 I85 D89	D84-K87 HydrophobicContact CB-CB 4.39Å; D84-K87 HydrophobicContact CB-CD 3.95Å; D84-K87 HydrophobicContact CB-CG 4.01Å; D84-K87 WeakPolarHBondContact O-CA 3.28Å; D84-K87 WeakPolarHBondContact O-CB 3.4Å; D84-K87 PolarHBondContact O-N 3.16Å; D84-K87 WeakPolarHBondContact OD2-CE 3.49Å; D84-K87 IonicContact OD2-NZ 3.86Å; D84-K87 PolarHBondContact OD2-NZ 3.35Å; I85-K87 PolarHBondContact O-N 3.5Å; K87-D89 PolarHBondContact O-N 3.49Å
88	V	49.7	Very low	55.9	Low	91 Å²	91	106.7 Å²	106.7	55%	0.552	54%	0.535	S	S	*	.			trans	-83.4	97	174.6	-176.5	0	0	0	0	107.5	I85	I85-V88 PolarHBondContact O-N 3.19Å
89	D	54.3	Low	58.7	Low	142 Å²	142	102.5 Å²	102.5	76%	0.759	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-57.8	128.8	173.7	-81.5	-33.1	0	0	0	109.1	K87	K87-D89 PolarHBondContact O-N 3.49Å
90	P	61.6	Low	61.7	Low	63 Å²	63	98.3 Å²	98.3	41%	0.409	50%	0.497	S	S	.	.	P	Polyproline II helix	trans	-58.1	149.1	174.3	23.9	-31.4	0	0	0	109	L92 L94	P90-L92 PolarHBondContact O-N 3.09Å; P90-L94 HydrophobicContact CB-CD2 4.07Å
91	P	71.3	Confident	64.6	Low	70 Å²	70	95.1 Å²	95.1	46%	0.455	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-50	132.3	177.4	-25.4	32.1	0	0	0	110.8	W93 L94 E95	P91-W93 VanDerWaalsContact CB-CD1 3.44Å; P91-W93 HydrophobicContact CB-CG 4.27Å; P91-W93 PolarHBondContact O-N 2.84Å; P91-L94 WeakPolarHBondContact O-CA 3.37Å; P91-L94 VanDerWaalsContact O-CB 3.27Å; P91-L94 WeakPolarHBondContact O-CB 3.47Å; P91-L94 PolarHBondContact O-N 2.91Å; P91-E95 PolarHBondContact O-N 3.38Å
92	L	73.6	Confident	67.4	Low	123 Å²	123	90 Å²	90	64%	0.644	45%	0.451	S	S	*	.	H	α-helix	trans	-49.9	-36.1	-174.1	-174.1	71	0	0	0	113.2	P90 L94 E95 L96	P90-L92 PolarHBondContact O-N 3.09Å; L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.36Å; L92-E95 PolarHBondContact O-N 3Å; L92-L96 HydrophobicContact CG-CD1 4.17Å; L92-L96 WeakPolarHBondContact O-CG 3.4Å; L92-L96 PolarHBondContact O-N 3.48Å
93	W	78.7	Confident	70.1	Confident	169 Å²	169	87.9 Å²	87.9	64%	0.64	44%	0.439	S	S	*	.	H	α-helix	trans	-62.6	-36.8	177.2	68.3	-98.5	0	0	0	112.8	P91 T97	P91-W93 VanDerWaalsContact CB-CD1 3.44Å; P91-W93 HydrophobicContact CB-CG 4.27Å; P91-W93 PolarHBondContact O-N 2.84Å; W93-T97 WeakPolarHBondContact O-CB 3.44Å; W93-T97 PolarHBondContact O-N 3.36Å; W93-T97 PolarHBondContact O-OG1 3.33Å
94	L	80.3	Confident	72.8	Confident	29 Å²	29	84.7 Å²	84.7	15%	0.152	42%	0.423	C	S	.	.	H	α-helix	trans	-67.4	-42.7	177.4	-174.4	69.6	0	0	0	109.5	P90 P91 L92 T97 A98 Y263 A264	P90-L94 HydrophobicContact CB-CD2 4.07Å; P91-L94 WeakPolarHBondContact O-CA 3.37Å; P91-L94 VanDerWaalsContact O-CB 3.27Å; P91-L94 WeakPolarHBondContact O-CB 3.47Å; P91-L94 PolarHBondContact O-N 2.91Å; L92-L94 VanDerWaalsContact C-N 3.32Å; L92-L94 PolarHBondContact O-N 3.36Å; L94-T97 PolarHBondContact O-N 3.3Å; L94-A98 WeakPolarHBondContact O-CB 3.46Å; L94-A98 PolarHBondContact O-N 2.99Å; L94-Y263 HydrophobicContact CD1-CD1 4.3Å; L94-Y263 HydrophobicContact CD1-CE1 3.82Å; L94-A264 HydrophobicContact CD2-CB 4.05Å
95	E	82.1	Confident	75.3	Confident	77 Å²	77	81.7 Å²	81.7	36%	0.36	41%	0.407	S	S	.	.	H	α-helix	trans	-65.1	-44.3	180	-163.7	-172	178.7	0	0	112.7	P91 L92 T97 S99 K260	P91-E95 PolarHBondContact O-N 3.38Å; L92-E95 PolarHBondContact O-N 3Å; E95-T97 VanDerWaalsContact C-N 3.34Å; E95-S99 VanDerWaalsContact O-CB 3.27Å; E95-S99 WeakPolarHBondContact O-CB 3.48Å; E95-S99 PolarHBondContact O-N 3.08Å; E95-S99 PolarHBondContact O-OG 2.9Å; E95-K260 VanDerWaalsContact CG-CE 3.49Å; E95-K260 VanDerWaalsContact CG-NZ 3.28Å; E95-K260 IonicContact OE1-NZ 2.7Å; E95-K260 PolarHBondContact OE1-NZ 2.76Å
96	L	86	Confident	77.4	Confident	97 Å²	97	79.9 Å²	79.9	51%	0.508	40%	0.398	S	S	.	.	H	α-helix	trans	-63.9	-41	176.4	-73.1	171.2	0	0	0	111.5	L92 S99 K100	L92-L96 HydrophobicContact CG-CD1 4.17Å; L92-L96 WeakPolarHBondContact O-CG 3.4Å; L92-L96 PolarHBondContact O-N 3.48Å; L96-S99 WeakPolarHBondContact O-CB 3.45Å; L96-S99 PolarHBondContact O-N 3.47Å; L96-K100 WeakPolarHBondContact O-CG 3.37Å; L96-K100 PolarHBondContact O-N 3.35Å
97	T	90	Very high	79.6	Confident	42 Å²	42	83.2 Å²	83.2	26%	0.258	41%	0.407	S	S	.	.	H	α-helix	trans	-67.6	-48.5	178.6	-53.4	0	0	0	0	110.6	W93 L94 E95 S99 K100 H101 Y263	W93-T97 WeakPolarHBondContact O-CB 3.44Å; W93-T97 PolarHBondContact O-N 3.36Å; W93-T97 PolarHBondContact O-OG1 3.33Å; L94-T97 PolarHBondContact O-N 3.3Å; E95-T97 VanDerWaalsContact C-N 3.34Å; T97-S99 PolarHBondContact O-N 3.08Å; T97-K100 WeakPolarHBondContact O-CB 3.35Å; T97-K100 PolarHBondContact O-N 3.47Å; T97-K100 VanDerWaalsContact O-N 3.08Å; T97-H101 PolarHBondContact O-CD2 3.4Å; T97-H101 VanDerWaalsContact O-CD2 3.3Å; T97-H101 PolarHBondContact O-N 3.27Å; T97-Y263 HydrophobicContact CG2-CE1 4.25Å; T97-Y263 HydrophobicContact CG2-CE2 4.42Å; T97-Y263 WeakPolarHBondContact CG2-OH 3.27Å
98	A	88.3	Confident	81.4	Confident	3 Å²	3	84.6 Å²	84.6	3%	0.025	41%	0.408	C	S	.	.	H	α-helix	trans	-54.6	-43	174.6	0	0	0	0	0	111.6	L94 K100 H101 A102 K260 Y263	L94-A98 WeakPolarHBondContact O-CB 3.46Å; L94-A98 PolarHBondContact O-N 2.99Å; A98-K100 PolarHBondContact O-N 3.43Å; A98-H101 PolarHBondContact O-N 2.88Å; A98-A102 WeakPolarHBondContact O-CB 3.43Å; A98-A102 PolarHBondContact O-N 3.32Å; A98-K260 HydrophobicContact CB-CB 4.02Å; A98-K260 HydrophobicContact CB-CG 4Å; A98-Y263 HydrophobicContact CB-CD1 3.52Å; A98-Y263 HydrophobicContact CB-CE1 4.26Å; A98-Y263 HydrophobicContact CB-CG 3.87Å
99	S	89.9	Confident	82.4	Confident	18 Å²	18	82.9 Å²	82.9	13%	0.126	40%	0.396	C	S	.	.	H	α-helix	trans	-61.4	-43.1	176.4	-68.5	0	0	0	0	113	E95 L96 T97 A102 K103 Y256	E95-S99 VanDerWaalsContact O-CB 3.27Å; E95-S99 WeakPolarHBondContact O-CB 3.48Å; E95-S99 PolarHBondContact O-N 3.08Å; E95-S99 PolarHBondContact O-OG 2.9Å; L96-S99 WeakPolarHBondContact O-CB 3.45Å; L96-S99 PolarHBondContact O-N 3.47Å; T97-S99 PolarHBondContact O-N 3.08Å; S99-A102 PolarHBondContact O-N 2.96Å; S99-K103 WeakPolarHBondContact O-CG 3.46Å; S99-K103 PolarHBondContact O-N 3.39Å; S99-Y256 VanDerWaalsContact CA-OH 3.3Å; S99-Y256 WeakPolarHBondContact CA-OH 3.46Å; S99-Y256 WeakPolarHBondContact CB-OH 3.32Å; S99-Y256 PolarHBondContact OG-OH 2.76Å; S99-Y256 VanDerWaalsContact OG-OH 3.13Å
100	K	93.2	Very high	83	Confident	156 Å²	156	81.1 Å²	81.1	68%	0.678	40%	0.395	S	S	*	.	H	α-helix	trans	-61.6	-46.5	176.1	-74	174.4	-178.8	177.7	0	111.4	L96 T97 A98 K103 K104	L96-K100 WeakPolarHBondContact O-CG 3.37Å; L96-K100 PolarHBondContact O-N 3.35Å; T97-K100 WeakPolarHBondContact O-CB 3.35Å; T97-K100 PolarHBondContact O-N 3.47Å; T97-K100 VanDerWaalsContact O-N 3.08Å; A98-K100 PolarHBondContact O-N 3.43Å; K100-K103 PolarHBondContact O-N 2.64Å; K100-K104 WeakPolarHBondContact O-CB 3.24Å; K100-K104 PolarHBondContact O-N 3.47Å
101	H	93.8	Very high	83.6	Confident	43 Å²	43	80 Å²	80	20%	0.199	39%	0.387	C	S	.	.	H	α-helix	trans	-65.1	-44.5	177.9	-77.5	-84.7	0	0	0	112	T97 A98 K103 K104 I105 Y263 M300 E303	T97-H101 PolarHBondContact O-CD2 3.4Å; T97-H101 VanDerWaalsContact O-CD2 3.3Å; T97-H101 PolarHBondContact O-N 3.27Å; A98-H101 PolarHBondContact O-N 2.88Å; H101-K103 VanDerWaalsContact C-N 3.34Å; H101-K103 PolarHBondContact O-N 3.39Å; H101-K104 WeakPolarHBondContact O-CB 3.26Å; H101-K104 PolarHBondContact O-N 2.66Å; H101-K104 VanDerWaalsContact O-N 3.07Å; H101-I105 WeakPolarHBondContact O-CG1 3.15Å; H101-I105 PolarHBondContact O-N 2.81Å; H101-Y263 HydrophobicContact CB-CD2 3.96Å; H101-Y263 HydrophobicContact CB-CE2 4.22Å; H101-Y263 AromaticContact CD2-CD2 3.98Å; H101-Y263 AromaticContact CD2-CE2 3.34Å; H101-Y263 WeakPolarHBondContact CD2-CE2 3.36Å; H101-Y263 AromaticContact CG-CD2 3.98Å; H101-Y263 AromaticContact CG-CE2 3.75Å; H101-Y263 AromaticContact NE2-CE2 3.84Å; H101-M300 HydrophobicContact CB-CE 3.96Å; H101-M300 HydrophobicContact CB-SD 4.01Å; H101-E303 IonicContact CE1-OE1 2.86Å; H101-E303 PolarHBondContact CE1-OE1 3.49Å; H101-E303 WeakPolarHBondContact ND1-CG 3.34Å; H101-E303 IonicContact ND1-OE1 3.85Å; H101-E303 PolarHBondContact ND1-OE1 3.43Å
102	A	89.9	Confident	84	Confident	0 Å²	0	83.6 Å²	83.6	0%	0	41%	0.408	C	S	.	.	H	α-helix	trans	-59	-45.1	178	0	0	0	0	0	111.5	A98 S99 K104 I105 L106 Y256 L259 M300	A98-A102 WeakPolarHBondContact O-CB 3.43Å; A98-A102 PolarHBondContact O-N 3.32Å; S99-A102 PolarHBondContact O-N 2.96Å; A102-K104 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 2.83Å; A102-I105 PolarHBondContact O-N 3.14Å; A102-L106 VanDerWaalsContact O-CG 3.29Å; A102-L106 WeakPolarHBondContact O-CG 3.31Å; A102-L106 PolarHBondContact O-N 3.42Å; A102-Y256 HydrophobicContact CB-CD2 3.76Å; A102-Y256 HydrophobicContact CB-CE2 3.59Å; A102-L259 HydrophobicContact CB-CB 3.88Å; A102-L259 HydrophobicContact CB-CD1 4.33Å; A102-M300 HydrophobicContact CB-CE 4.17Å
103	K	90.4	Very high	84.8	Confident	122 Å²	122	80 Å²	80	53%	0.53	39%	0.392	S	S	.	.	H	α-helix	trans	-60.8	-41.5	173.9	-71.8	178.6	-175.9	179.1	0	112.2	S99 K100 H101 K107 Y256	S99-K103 WeakPolarHBondContact O-CG 3.46Å; S99-K103 PolarHBondContact O-N 3.39Å; K100-K103 PolarHBondContact O-N 2.64Å; H101-K103 VanDerWaalsContact C-N 3.34Å; H101-K103 PolarHBondContact O-N 3.39Å; K103-K107 VanDerWaalsContact O-CG 3.31Å; K103-K107 WeakPolarHBondContact O-CG 3.31Å; K103-K107 PolarHBondContact O-N 3.47Å; K103-K107 VanDerWaalsContact O-N 3.13Å; K103-Y256 HydrophobicContact CG-CE2 3.95Å
104	K	92.9	Very high	85.3	Confident	75 Å²	75	74.5 Å²	74.5	33%	0.326	38%	0.375	S	S	.	.	H	α-helix	trans	-61.2	-46.8	177.7	-179.3	-175.4	172.9	-170	0	111.2	K100 H101 A102 K107 R108 E303	K100-K104 WeakPolarHBondContact O-CB 3.24Å; K100-K104 PolarHBondContact O-N 3.47Å; H101-K104 WeakPolarHBondContact O-CB 3.26Å; H101-K104 PolarHBondContact O-N 2.66Å; H101-K104 VanDerWaalsContact O-N 3.07Å; A102-K104 VanDerWaalsContact C-N 3.34Å; A102-K104 PolarHBondContact O-N 2.83Å; K104-K107 PolarHBondContact O-N 2.89Å; K104-R108 WeakPolarHBondContact O-CB 3.37Å; K104-R108 PolarHBondContact O-N 2.74Å; K104-E303 IonicContact NZ-OE1 3.94Å; K104-E303 PolarHBondContact NZ-OE1 2.8Å; K104-E303 IonicContact NZ-OE2 4Å; K104-E303 PolarHBondContact NZ-OE2 3.01Å
105	I	91.8	Very high	85.8	Confident	11 Å²	11	77 Å²	77	6%	0.056	39%	0.389	C	S	.	.	H	α-helix	trans	-62.8	-49.1	179.1	-65.6	-54.9	0	0	0	110.9	H101 A102 K107 R108 L109 A296 A299 M300 E303	H101-I105 WeakPolarHBondContact O-CG1 3.15Å; H101-I105 PolarHBondContact O-N 2.81Å; A102-I105 PolarHBondContact O-N 3.14Å; I105-K107 PolarHBondContact O-N 3.15Å; I105-R108 PolarHBondContact O-N 2.98Å; I105-L109 HydrophobicContact CG2-CD1 4.3Å; I105-L109 HydrophobicContact CG2-CG 4.41Å; I105-L109 WeakPolarHBondContact O-CG 3Å; I105-L109 PolarHBondContact O-N 3.34Å; I105-A296 HydrophobicContact CG2-CB 4.26Å; I105-A299 HydrophobicContact CD1-CB 3.94Å; I105-A299 HydrophobicContact CG2-CB 4.01Å; I105-M300 HydrophobicContact CG1-CB 4.47Å; I105-M300 HydrophobicContact CG1-CE 4.18Å; I105-E303 HydrophobicContact CD1-CB 4.32Å
106	L	87.1	Confident	86.2	Confident	76 Å²	76	77 Å²	77	40%	0.398	39%	0.392	S	S	.	.	H	α-helix	trans	-60.9	-30.8	-179.8	-68.5	172.4	0	0	0	112.9	A102 R108 L255 Y256 L259	A102-L106 VanDerWaalsContact O-CG 3.29Å; A102-L106 WeakPolarHBondContact O-CG 3.31Å; A102-L106 PolarHBondContact O-N 3.42Å; L106-R108 VanDerWaalsContact C-N 3.33Å; L106-L255 HydrophobicContact CD2-CD2 3.74Å; L106-L255 HydrophobicContact CD2-CG 4.25Å; L106-Y256 HydrophobicContact CD1-CD2 3.94Å; L106-L259 HydrophobicContact CD1-CD1 4.39Å; L106-L259 HydrophobicContact CD2-CD1 4Å; L106-L259 HydrophobicContact CG-CD1 4.02Å
107	K	86.1	Confident	86.4	Confident	182 Å²	182	76.4 Å²	76.4	79%	0.791	39%	0.385	S	S	*	.	H	α-helix	trans	-75.5	-16.6	173.9	-73.3	179.3	179.6	-170.3	0	114	K103 K104 I105	K103-K107 VanDerWaalsContact O-CG 3.31Å; K103-K107 WeakPolarHBondContact O-CG 3.31Å; K103-K107 PolarHBondContact O-N 3.47Å; K103-K107 VanDerWaalsContact O-N 3.13Å; K104-K107 PolarHBondContact O-N 2.89Å; I105-K107 PolarHBondContact O-N 3.15Å
108	R	78.3	Confident	86.5	Confident	187 Å²	187	75.3 Å²	75.3	71%	0.706	38%	0.377	S	S	*	.			trans	-120	18.9	-166.1	-86.9	-170.1	171.4	-175.3	-1.4	115.6	K104 I105 L106 S110	K104-R108 WeakPolarHBondContact O-CB 3.37Å; K104-R108 PolarHBondContact O-N 2.74Å; I105-R108 PolarHBondContact O-N 2.98Å; L106-R108 VanDerWaalsContact C-N 3.33Å; R108-S110 PolarHBondContact O-N 3.12Å; R108-S110 VanDerWaalsContact O-N 3.12Å
109	L	71.2	Confident	86.6	Confident	55 Å²	55	77.5 Å²	77.5	29%	0.288	40%	0.395	S	S	.	.			trans	-79.4	12.1	-174.2	-84.5	158.7	0	0	0	116.5	I105 P111 L295 A296	I105-L109 HydrophobicContact CG2-CD1 4.3Å; I105-L109 HydrophobicContact CG2-CG 4.41Å; I105-L109 WeakPolarHBondContact O-CG 3Å; I105-L109 PolarHBondContact O-N 3.34Å; L109-P111 WeakPolarHBondContact O-CD 3.1Å; L109-L295 HydrophobicContact CD2-CB 4Å; L109-A296 HydrophobicContact CD1-CB 3.76Å; L109-A296 HydrophobicContact CD2-CB 4.38Å
110	S	67.2	Low	86.8	Confident	106 Å²	106	78.8 Å²	78.8	74%	0.741	40%	0.399	S	S	*	.			trans	-103.7	111	-178.4	-64.4	0	0	0	0	111.8	R108	R108-S110 PolarHBondContact O-N 3.12Å; R108-S110 VanDerWaalsContact O-N 3.12Å
111	P	74	Confident	86.8	Confident	38 Å²	38	71.6 Å²	71.6	25%	0.247	37%	0.368	C	S	.	.			trans	-66.9	147.9	169.6	-15.7	31.2	0	0	0	110.3	L109 D116 K117	L109-P111 WeakPolarHBondContact O-CD 3.1Å; P111-D116 HydrophobicContact CB-CB 3.72Å; P111-K117 HydrophobicContact CB-CB 4.49Å; P111-K117 HydrophobicContact CB-CG 3.61Å; P111-K117 HydrophobicContact CG-CB 4.36Å; P111-K117 HydrophobicContact CG-CG 3.58Å; P111-K117 WeakPolarHBondContact O-CE 2.92Å
112	V	78.6	Confident	86.7	Confident	147 Å²	147	70.7 Å²	70.7	89%	0.891	37%	0.365	S	S	*	.	S	Bend	trans	-80.2	-32.6	-170.8	-170.5	0	0	0	0	111.5
113	S	90.7	Very high	86.9	Confident	46 Å²	46	73 Å²	73	32%	0.322	37%	0.373	S	S	.	.	S	Bend	trans	-118.8	160.4	178.5	76.7	0	0	0	0	113.4	D115 D116 K117	S113-D115 VanDerWaalsContact C-N 3.26Å; S113-D115 PolarHBondContact O-N 2.66Å; S113-D116 WeakPolarHBondContact CB-OD2 3.36Å; S113-D116 PolarHBondContact N-OD2 3.37Å; S113-D116 PolarHBondContact O-N 2.78Å; S113-D116 PolarHBondContact OG-N 3.09Å; S113-D116 PolarHBondContact OG-OD2 3.31Å; S113-K117 WeakPolarHBondContact O-CG 3.43Å; S113-K117 PolarHBondContact O-N 2.89Å; S113-K117 VanDerWaalsContact O-N 3.12Å
114	I	89.8	Confident	87.1	Confident	54 Å²	54	67.2 Å²	67.2	28%	0.277	35%	0.348	S	S	.	.	H	α-helix	trans	-58.9	-41.1	172.2	-68.7	171.9	0	0	0	110.4	D116 K117 I118 L333 M336 K337	I114-D116 VanDerWaalsContact C-N 3.34Å; I114-D116 PolarHBondContact O-N 3.06Å; I114-K117 WeakPolarHBondContact O-CB 3.37Å; I114-K117 PolarHBondContact O-N 2.83Å; I114-I118 HydrophobicContact CG2-CD1 4Å; I114-I118 HydrophobicContact CG2-CG1 4.49Å; I114-I118 WeakPolarHBondContact O-CG1 3.48Å; I114-I118 PolarHBondContact O-N 3.41Å; I114-L333 HydrophobicContact CG2-CB 4.23Å; I114-L333 HydrophobicContact CG2-CD2 4.2Å; I114-M336 HydrophobicContact CD1-CB 3.85Å; I114-M336 HydrophobicContact CD1-CE 4.41Å; I114-K337 HydrophobicContact CG2-CB 4.37Å
115	D	90	Very high	87.2	Confident	81 Å²	81	63.6 Å²	63.6	43%	0.433	33%	0.333	S	S	.	.	H	α-helix	trans	-64.2	-39.1	179.6	-77.8	-32.3	0	0	0	112.1	S113 I118 A119 K337	S113-D115 VanDerWaalsContact C-N 3.26Å; S113-D115 PolarHBondContact O-N 2.66Å; D115-I118 PolarHBondContact O-N 3.13Å; D115-A119 WeakPolarHBondContact O-CB 3.32Å; D115-A119 PolarHBondContact O-N 2.89Å; D115-K337 WeakPolarHBondContact OD1-CE 3.26Å; D115-K337 IonicContact OD1-NZ 2.66Å; D115-K337 PolarHBondContact OD1-NZ 2.88Å; D115-K337 IonicContact OD2-NZ 3.49Å; D115-K337 PolarHBondContact OD2-NZ 2.99Å
116	D	90.5	Very high	87.2	Confident	79 Å²	79	66.2 Å²	66.2	42%	0.422	34%	0.343	S	S	.	.	H	α-helix	trans	-65.2	-40.1	174.4	-61.7	-41.7	0	0	0	111.5	P111 S113 I114 I118 A119 E120	P111-D116 HydrophobicContact CB-CB 3.72Å; S113-D116 WeakPolarHBondContact CB-OD2 3.36Å; S113-D116 PolarHBondContact N-OD2 3.37Å; S113-D116 PolarHBondContact O-N 2.78Å; S113-D116 PolarHBondContact OG-N 3.09Å; S113-D116 PolarHBondContact OG-OD2 3.31Å; I114-D116 VanDerWaalsContact C-N 3.34Å; I114-D116 PolarHBondContact O-N 3.06Å; D116-I118 PolarHBondContact O-N 2.68Å; D116-A119 PolarHBondContact O-N 3.02Å; D116-E120 WeakPolarHBondContact O-CG 3.08Å; D116-E120 PolarHBondContact O-N 2.97Å
117	K	91.4	Very high	87.6	Confident	84 Å²	84	62.7 Å²	62.7	37%	0.365	33%	0.325	S	S	.	.	H	α-helix	trans	-60.8	-45.7	175.6	-67.7	-179.9	-179.5	-179.2	0	111.3	P111 S113 I114 A119 E120 I121 L333	P111-K117 HydrophobicContact CB-CB 4.49Å; P111-K117 HydrophobicContact CB-CG 3.61Å; P111-K117 HydrophobicContact CG-CB 4.36Å; P111-K117 HydrophobicContact CG-CG 3.58Å; P111-K117 WeakPolarHBondContact O-CE 2.92Å; S113-K117 WeakPolarHBondContact O-CG 3.43Å; S113-K117 PolarHBondContact O-N 2.89Å; S113-K117 VanDerWaalsContact O-N 3.12Å; I114-K117 WeakPolarHBondContact O-CB 3.37Å; I114-K117 PolarHBondContact O-N 2.83Å; K117-A119 VanDerWaalsContact C-N 3.34Å; K117-E120 PolarHBondContact O-N 2.69Å; K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.42Å; K117-I121 PolarHBondContact O-N 2.83Å; K117-I121 VanDerWaalsContact O-N 3.08Å; K117-L333 HydrophobicContact CB-CD1 3.63Å; K117-L333 HydrophobicContact CB-CD2 4.02Å; K117-L333 HydrophobicContact CB-CG 4.49Å; K117-L333 HydrophobicContact CD-CD2 3.75Å; K117-L333 HydrophobicContact CG-CD2 4.49Å
118	I	91.3	Very high	88.1	Confident	18 Å²	18	54 Å²	54	9%	0.092	29%	0.287	C	S	.	.	H	α-helix	trans	-60.2	-47.1	176.4	-70	174.3	0	0	0	110	I114 D115 D116 E120 I121 L122 L330 L333 I334	I114-I118 HydrophobicContact CG2-CD1 4Å; I114-I118 HydrophobicContact CG2-CG1 4.49Å; I114-I118 WeakPolarHBondContact O-CG1 3.48Å; I114-I118 PolarHBondContact O-N 3.41Å; D115-I118 PolarHBondContact O-N 3.13Å; D116-I118 PolarHBondContact O-N 2.68Å; I118-E120 PolarHBondContact O-N 3.07Å; I118-I121 PolarHBondContact O-N 3.44Å; I118-L122 HydrophobicContact CG2-CD1 3.76Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 VanDerWaalsContact O-CG 3.26Å; I118-L122 WeakPolarHBondContact O-CG 3.32Å; I118-L122 PolarHBondContact O-N 3.24Å; I118-L330 HydrophobicContact CB-CD1 4.21Å; I118-L330 HydrophobicContact CG1-CD1 3.94Å; I118-L330 HydrophobicContact CG2-CD1 3.81Å; I118-L333 HydrophobicContact CD1-CB 4.12Å; I118-L333 HydrophobicContact CG1-CB 3.78Å; I118-L333 HydrophobicContact CG1-CD1 4.17Å; I118-I334 HydrophobicContact CD1-CG1 4.17Å
119	A	91.5	Very high	88.8	Confident	49 Å²	49	45.1 Å²	45.1	41%	0.405	25%	0.254	S	S	.	.	H	α-helix	trans	-60.3	-45.8	-179.5	0	0	0	0	0	112.1	D115 D116 K117 L122 R123	D115-A119 WeakPolarHBondContact O-CB 3.32Å; D115-A119 PolarHBondContact O-N 2.89Å; D116-A119 PolarHBondContact O-N 3.02Å; K117-A119 VanDerWaalsContact C-N 3.34Å; A119-L122 PolarHBondContact O-N 3.11Å; A119-R123 VanDerWaalsContact O-CB 3.24Å; A119-R123 WeakPolarHBondContact O-CB 3.34Å; A119-R123 PolarHBondContact O-N 2.96Å
120	E	92.4	Very high	89.9	Confident	45 Å²	45	42.6 Å²	42.6	21%	0.21	24%	0.241	C	C	.	.	H	α-helix	trans	-65.9	-39.5	179.6	-70.3	-64.5	124.6	0	0	112.3	D116 K117 I118 R123 I124 L295 M298	D116-E120 WeakPolarHBondContact O-CG 3.08Å; D116-E120 PolarHBondContact O-N 2.97Å; K117-E120 PolarHBondContact O-N 2.69Å; I118-E120 PolarHBondContact O-N 3.07Å; E120-R123 PolarHBondContact O-N 3.03Å; E120-R123 IonicContact OE1-CZ 2.73Å; E120-R123 IonicContact OE1-NH1 2.66Å; E120-R123 PolarHBondContact OE1-NH1 2.77Å; E120-R123 IonicContact OE2-CZ 3.33Å; E120-R123 IonicContact OE2-NH1 2.81Å; E120-R123 PolarHBondContact OE2-NH1 3.2Å; E120-R123 VanDerWaalsContact OE2-NH1 3.15Å; E120-I124 PolarHBondContact O-N 3.08Å; E120-L295 HydrophobicContact CB-CD2 4.12Å; E120-M298 HydrophobicContact CB-CE 4.38Å; E120-M298 WeakPolarHBondContact OE2-CE 3.48Å
121	I	93.4	Very high	91	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-48.4	174.3	-70.3	170.1	0	0	0	111.1	K117 I118 R123 I124 V125 Y153 L291 A329 L330 L333	K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.42Å; K117-I121 PolarHBondContact O-N 2.83Å; K117-I121 VanDerWaalsContact O-N 3.08Å; I118-I121 PolarHBondContact O-N 3.44Å; I121-R123 PolarHBondContact O-N 3.06Å; I121-I124 WeakPolarHBondContact O-CG2 3.23Å; I121-I124 PolarHBondContact O-N 3.13Å; I121-V125 PolarHBondContact O-N 3.42Å; I121-V125 VanDerWaalsContact O-N 3.13Å; I121-Y153 WeakPolarHBondContact CG2-OH 3.23Å; I121-L291 HydrophobicContact CD1-CD2 4.03Å; I121-L291 HydrophobicContact CG1-CD1 4.31Å; I121-L291 HydrophobicContact CG1-CD2 3.93Å; I121-A329 HydrophobicContact CD1-CB 3.96Å; I121-L330 HydrophobicContact CG2-CB 4.31Å; I121-L333 HydrophobicContact CD1-CD1 3.59Å
122	L	92.8	Very high	91.6	Very high	24 Å²	24	37.5 Å²	37.5	13%	0.126	20%	0.204	C	C	.	.	H	α-helix	trans	-63.4	-36.2	179	-66.7	171.6	0	0	0	111.4	I118 A119 K126 Y153 L161 P165 L330	I118-L122 HydrophobicContact CG2-CD1 3.76Å; I118-L122 HydrophobicContact CG2-CG 4.36Å; I118-L122 VanDerWaalsContact O-CG 3.26Å; I118-L122 WeakPolarHBondContact O-CG 3.32Å; I118-L122 PolarHBondContact O-N 3.24Å; A119-L122 PolarHBondContact O-N 3.11Å; L122-K126 WeakPolarHBondContact O-CG 3.36Å; L122-K126 PolarHBondContact O-N 3.29Å; L122-K126 VanDerWaalsContact O-N 3.11Å; L122-Y153 HydrophobicContact CD2-CE2 4.26Å; L122-L161 HydrophobicContact CD1-CD2 4.05Å; L122-L161 HydrophobicContact CD2-CD1 4.05Å; L122-L161 HydrophobicContact CD2-CD2 4.38Å; L122-P165 HydrophobicContact CD2-CB 3.94Å; L122-P165 HydrophobicContact CD2-CG 4.2Å; L122-L330 HydrophobicContact CD2-CD2 3.91Å
123	R	93.8	Very high	91.7	Very high	48 Å²	48	31.9 Å²	31.9	18%	0.181	17%	0.169	C	C	.	.	H	α-helix	trans	-67.4	-45.7	179.5	-161.7	-178.8	118.1	-154.4	1.6	111.8	A119 E120 I121 V125 K126 M298 D302	A119-R123 VanDerWaalsContact O-CB 3.24Å; A119-R123 WeakPolarHBondContact O-CB 3.34Å; A119-R123 PolarHBondContact O-N 2.96Å; E120-R123 PolarHBondContact O-N 3.03Å; E120-R123 IonicContact OE1-CZ 2.73Å; E120-R123 IonicContact OE1-NH1 2.66Å; E120-R123 PolarHBondContact OE1-NH1 2.77Å; E120-R123 IonicContact OE2-CZ 3.33Å; E120-R123 IonicContact OE2-NH1 2.81Å; E120-R123 PolarHBondContact OE2-NH1 3.2Å; E120-R123 VanDerWaalsContact OE2-NH1 3.15Å; I121-R123 PolarHBondContact O-N 3.06Å; R123-V125 VanDerWaalsContact C-N 3.32Å; R123-V125 PolarHBondContact O-N 3.17Å; R123-K126 WeakPolarHBondContact O-CB 3.4Å; R123-K126 PolarHBondContact O-N 2.92Å; R123-M298 HydrophobicContact CB-SD 4.33Å; R123-M298 HydrophobicContact CG-SD 4.22Å; R123-M298 PolarHBondContact NE-SD 3.38Å; R123-M298 VanDerWaalsContact NE-SD 3.42Å; R123-M298 VanDerWaalsContact NH2-CG 3.28Å; R123-M298 PolarHBondContact NH2-SD 2.8Å; R123-D302 IonicContact CZ-OD1 3.88Å; R123-D302 IonicContact CZ-OD2 2.58Å; R123-D302 IonicContact NH1-OD2 2.83Å; R123-D302 PolarHBondContact NH1-OD2 3.2Å; R123-D302 VanDerWaalsContact NH1-OD2 3.14Å; R123-D302 IonicContact NH2-OD1 3.86Å; R123-D302 PolarHBondContact NH2-OD1 2.92Å; R123-D302 IonicContact NH2-OD2 3.91Å; R123-D302 PolarHBondContact NH2-OD2 2.9Å
124	I	94.3	Very high	90.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.9	-36.7	178.2	-167.1	57.1	0	0	0	112.1	E120 I121 K126 M127 A128 L291 L295 M298 I317 F322	E120-I124 PolarHBondContact O-N 3.08Å; I121-I124 WeakPolarHBondContact O-CG2 3.23Å; I121-I124 PolarHBondContact O-N 3.13Å; I124-K126 VanDerWaalsContact C-N 3.34Å; I124-K126 PolarHBondContact O-N 3.5Å; I124-M127 HydrophobicContact CD1-CE 3.86Å; I124-M127 CarbonylContact O-C 3.56Å; I124-M127 PolarHBondContact O-N 3.25Å; I124-M127 VanDerWaalsContact O-N 3.08Å; I124-A128 PolarHBondContact O-N 2.95Å; I124-A128 VanDerWaalsContact O-N 3.13Å; I124-L291 HydrophobicContact CG2-CD1 3.95Å; I124-L295 HydrophobicContact CB-CD2 4.23Å; I124-L295 HydrophobicContact CG2-CD2 3.96Å; I124-M298 HydrophobicContact CB-CE 4.11Å; I124-M298 HydrophobicContact CB-SD 4Å; I124-M298 HydrophobicContact CD1-CB 3.71Å; I124-M298 HydrophobicContact CD1-CG 4.26Å; I124-M298 HydrophobicContact CD1-SD 3.95Å; I124-I317 HydrophobicContact CD1-CD1 3.37Å; I124-I317 HydrophobicContact CD1-CG1 4.04Å; I124-I317 HydrophobicContact CG1-CD1 4.29Å; I124-F322 HydrophobicContact CG1-CE2 4.37Å; I124-F322 HydrophobicContact CG1-CZ 4.07Å; I124-F322 HydrophobicContact CG2-CE2 4.24Å
125	V	94.2	Very high	88.7	Confident	0 Å²	0	34 Å²	34	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62	-40.5	173.8	165.7	0	0	0	0	112.1	I121 R123 M127 A128 P152 Y153 P165 C167 F322 L323	I121-V125 PolarHBondContact O-N 3.42Å; I121-V125 VanDerWaalsContact O-N 3.13Å; R123-V125 VanDerWaalsContact C-N 3.32Å; R123-V125 PolarHBondContact O-N 3.17Å; V125-M127 PolarHBondContact O-N 3.46Å; V125-A128 VanDerWaalsContact O-CB 3.29Å; V125-A128 WeakPolarHBondContact O-CB 3.41Å; V125-A128 PolarHBondContact O-N 3.13Å; V125-P152 HydrophobicContact CG1-CB 4.25Å; V125-P152 HydrophobicContact CG1-CG 3.64Å; V125-Y153 HydrophobicContact CG2-CE2 4.48Å; V125-Y153 WeakPolarHBondContact CG2-OH 3.36Å; V125-P165 HydrophobicContact CG1-CB 4.48Å; V125-C167 WeakPolarHBondContact O-CA 3.44Å; V125-F322 HydrophobicContact CG2-CE2 4.42Å; V125-L323 HydrophobicContact CG1-CD2 4.44Å; V125-L323 HydrophobicContact CG2-CD2 3.85Å
126	K	93.7	Very high	87.2	Confident	66 Å²	66	32.8 Å²	32.8	29%	0.287	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-16.2	175.5	-78.5	177.3	166.2	-173.5	0	114.3	L122 R123 I124 E163 A168 K312	L122-K126 WeakPolarHBondContact O-CG 3.36Å; L122-K126 PolarHBondContact O-N 3.29Å; L122-K126 VanDerWaalsContact O-N 3.11Å; R123-K126 WeakPolarHBondContact O-CB 3.4Å; R123-K126 PolarHBondContact O-N 2.92Å; I124-K126 VanDerWaalsContact C-N 3.34Å; I124-K126 PolarHBondContact O-N 3.5Å; K126-E163 WeakPolarHBondContact CE-OE1 3.45Å; K126-E163 WeakPolarHBondContact CE-OE2 3.14Å; K126-E163 IonicContact NZ-OE1 3.74Å; K126-E163 PolarHBondContact NZ-OE1 3.33Å; K126-E163 IonicContact NZ-OE2 3.66Å; K126-E163 PolarHBondContact NZ-OE2 3.31Å; K126-A168 WeakPolarHBondContact O-CB 3.3Å; K126-K312 WeakPolarHBondContact O-CB 3.41Å
127	M	94.9	Very high	86	Confident	2 Å²	2	37.4 Å²	37.4	1%	0.01	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	-4.4	177.1	-61.9	-178.1	-64.7	0	0	112.8	I124 V125 M298 T310 F315 R316 I317	I124-M127 HydrophobicContact CD1-CE 3.86Å; I124-M127 CarbonylContact O-C 3.56Å; I124-M127 PolarHBondContact O-N 3.25Å; I124-M127 VanDerWaalsContact O-N 3.08Å; V125-M127 PolarHBondContact O-N 3.46Å; M127-M298 HydrophobicContact CE-CB 4.39Å; M127-M298 HydrophobicContact CE-CG 3.64Å; M127-M298 HydrophobicContact CE-SD 3.23Å; M127-M298 WeakPolarHBondContact CE-SD 3.28Å; M127-T310 HydrophobicContact CE-CG2 4Å; M127-T310 VanDerWaalsContact SD-C 3.54Å; M127-T310 HydrophobicContact SD-CG2 3.87Å; M127-T310 VanDerWaalsContact SD-O 3.32Å; M127-F315 HydrophobicContact CE-CD1 4.17Å; M127-F315 HydrophobicContact SD-CB 4.22Å; M127-F315 HydrophobicContact SD-CD1 3.76Å; M127-F315 HydrophobicContact SD-CG 4.48Å; M127-R316 VanDerWaalsContact O-CA 3.29Å; M127-R316 WeakPolarHBondContact O-CA 3.22Å; M127-R316 WeakPolarHBondContact O-CD 3.29Å; M127-I317 PolarHBondContact O-N 2.75Å
128	A	95.3	Very high	85	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	142.9	179.1	0	0	0	0	0	111.3	I124 V125 C167 A168 A169 I317 T319 F322 L323	I124-A128 PolarHBondContact O-N 2.95Å; I124-A128 VanDerWaalsContact O-N 3.13Å; V125-A128 VanDerWaalsContact O-CB 3.29Å; V125-A128 WeakPolarHBondContact O-CB 3.41Å; V125-A128 PolarHBondContact O-N 3.13Å; A128-C167 HydrophobicContact CB-CB 4.24Å; A128-C167 WeakPolarHBondContact O-CB 3.39Å; A128-A168 WeakPolarHBondContact O-CB 3.5Å; A128-A168 PolarHBondContact O-N 3.42Å; A128-A169 PolarHBondContact O-N 3.48Å; A128-I317 CarbonylContact C-O 3.55Å; A128-I317 WeakPolarHBondContact CA-O 3.29Å; A128-T319 HydrophobicContact CB-CG2 4.12Å; A128-F322 HydrophobicContact CB-CZ 4.01Å; A128-L323 HydrophobicContact CB-CD2 4.15Å
129	E	94.3	Very high	84.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	113.4	171.1	177.1	168.1	-141	0	0	107.9	M131 A169 Y171 N199 R247 K283 I317 G318 T319	E129-M131 HydrophobicContact CG-SD 4.26Å; E129-M131 PolarHBondContact O-N 2.91Å; E129-A169 CarbonylContact C-O 3.57Å; E129-A169 VanDerWaalsContact CA-O 3.32Å; E129-A169 WeakPolarHBondContact CA-O 3.4Å; E129-A169 HydrophobicContact CB-CB 4.4Å; E129-A169 HydrophobicContact CG-CB 3.99Å; E129-Y171 WeakPolarHBondContact OE1-CD2 3.49Å; E129-N199 WeakPolarHBondContact OE1-CB 3.3Å; E129-N199 PolarHBondContact OE1-ND2 2.86Å; E129-R247 IonicContact OE1-NH2 3.94Å; E129-R247 IonicContact OE2-CZ 3.54Å; E129-R247 IonicContact OE2-NH2 3.01Å; E129-R247 PolarHBondContact OE2-NH2 2.95Å; E129-K283 IonicContact OE1-NZ 2.89Å; E129-K283 IonicContact OE2-NZ 3.37Å; E129-I317 PolarHBondContact N-O 2.73Å; E129-G318 WeakPolarHBondContact O-CA 3.06Å; E129-T319 PolarHBondContact O-N 2.81Å
130	V	93.3	Very high	84.3	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.012	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118.4	-175.5	179.2	0	0	0	0	109.6	A145 L148 T149 C167 A169 V170 Y171 T319 L323	V130-A145 HydrophobicContact CG1-CB 4.13Å; V130-L148 HydrophobicContact CG1-CD2 4.07Å; V130-T149 VanDerWaalsContact CB-OG1 3.25Å; V130-T149 WeakPolarHBondContact CB-OG1 3.49Å; V130-T149 WeakPolarHBondContact CG2-OG1 3.44Å; V130-C167 HydrophobicContact CG2-CB 4.22Å; V130-A169 PolarHBondContact N-O 3.28Å; V130-V170 HydrophobicContact CB-CG2 4.29Å; V130-V170 CarbonylContact O-C 3.5Å; V130-V170 WeakPolarHBondContact O-CA 3.35Å; V130-Y171 PolarHBondContact O-N 2.89Å; V130-T319 CarbonylContact C-O 3.5Å; V130-T319 VanDerWaalsContact CA-O 3.27Å; V130-T319 WeakPolarHBondContact CA-O 3.32Å; V130-L323 HydrophobicContact CG2-CD1 3.64Å
131	M	90	Very high	84	Confident	12 Å²	12	36.4 Å²	36.4	6%	0.059	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.1	-175.1	-53	-66.8	-65	0	0	111.5	E129 I133 Y171 L286 T319 T320	E129-M131 HydrophobicContact CG-SD 4.26Å; E129-M131 PolarHBondContact O-N 2.91Å; M131-I133 HydrophobicContact CE-CD1 4Å; M131-I133 HydrophobicContact CE-CG1 4.45Å; M131-Y171 HydrophobicContact CE-CD1 3.38Å; M131-Y171 HydrophobicContact CE-CE1 3.78Å; M131-Y171 HydrophobicContact CE-CG 3.87Å; M131-Y171 HydrophobicContact SD-CD1 4.03Å; M131-Y171 HydrophobicContact SD-CG 3.9Å; M131-L286 HydrophobicContact CE-CD2 3.5Å; M131-L286 WeakPolarHBondContact CG-O 3.36Å; M131-T319 PolarHBondContact N-O 3.46Å; M131-T320 HydrophobicContact CB-CG2 4.02Å; M131-T320 WeakPolarHBondContact O-CG2 3.21Å
132	C	88.4	Confident	83.8	Confident	24 Å²	24	36.4 Å²	36.4	16%	0.162	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	65.9	177	-166.5	0	0	0	0	109.8	A145 Y171 I172 H173	C132-A145 HydrophobicContact CB-CB 3.75Å; C132-Y171 CarbonylContact C-O 3.56Å; C132-Y171 WeakPolarHBondContact CA-O 3.4Å; C132-Y171 PolarHBondContact N-O 3.39Å; C132-I172 HydrophobicContact CB-CD1 3.85Å; C132-H173 PolarHBondContact O-N 2.96Å
133	I	79	Confident	83.6	Confident	30 Å²	30	38.1 Å²	38.1	15%	0.154	17%	0.174	C	C	.	.			trans	-112.4	-29.5	-176.9	44.4	166.4	0	0	0	113.6	M131 N135 Y171 L286	M131-I133 HydrophobicContact CE-CD1 4Å; M131-I133 HydrophobicContact CE-CG1 4.45Å; I133-N135 PolarHBondContact O-N 3.17Å; I133-Y171 HydrophobicContact CG2-CD1 3.46Å; I133-Y171 VanDerWaalsContact CG2-CD1 3.46Å; I133-Y171 HydrophobicContact CG2-CE1 3.66Å; I133-L286 HydrophobicContact CD1-CD2 4.29Å
134	D	63.4	Low	83.4	Confident	88 Å²	88	39 Å²	39	47%	0.471	18%	0.182	S	C	.	.	S	Bend	trans	-90.9	-1.6	-162.8	-59	-31.7	0	0	0	115.5
135	N	54.6	Low	83.3	Confident	56 Å²	56	39.3 Å²	39.3	30%	0.299	19%	0.186	S	C	.	.			trans	-146.6	63.1	-178.3	-88.9	-57.5	0	0	0	112.6	I133 R137	I133-N135 PolarHBondContact O-N 3.17Å; N135-R137 PolarHBondContact O-N 3.08Å
136	T	59.6	Low	83.2	Confident	55 Å²	55	39.3 Å²	39.3	34%	0.337	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-0.3	171	50.3	0	0	0	0	115.1	A46 Y138 H173 F176	A46-T136 WeakPolarHBondContact CB-O 3.31Å; T136-Y138 VanDerWaalsContact C-N 3.35Å; T136-H173 HydrophobicContact CG2-CB 3.55Å; T136-F176 HydrophobicContact CG2-CD2 4.23Å; T136-F176 HydrophobicContact CG2-CE2 3.74Å; T136-F176 VanDerWaalsContact O-CE2 3.28Å; T136-F176 WeakPolarHBondContact O-CE2 3.48Å; T136-F176 WeakPolarHBondContact O-CZ 3.31Å
137	R	63.9	Low	83.1	Confident	177 Å²	177	37.3 Å²	37.3	67%	0.668	18%	0.178	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-17.3	-177.3	-66.5	-171.2	-175.6	-162.5	0.5	113.8	A46 N135	A46-R137 VanDerWaalsContact CB-O 3.26Å; A46-R137 WeakPolarHBondContact CB-O 3.45Å; A46-R137 PolarHBondContact N-O 3.29Å; N135-R137 PolarHBondContact O-N 3.08Å
138	Y	71.6	Confident	83	Confident	72 Å²	72	39.7 Å²	39.7	28%	0.282	19%	0.191	S	C	.	.	B	Isolated β-bridge	trans	-137.9	123.5	-171.5	-55.9	-66.8	0	0	0	112	L43 K44 T136 E140 R141	L43-Y138 HydrophobicContact CB-CD1 3.3Å; L43-Y138 HydrophobicContact CB-CE1 3.48Å; L43-Y138 VanDerWaalsContact CB-CE1 3.48Å; L43-Y138 HydrophobicContact CB-CG 3.93Å; L43-Y138 HydrophobicContact CD1-CD1 4.12Å; L43-Y138 HydrophobicContact CD1-CD2 4.01Å; L43-Y138 HydrophobicContact CD1-CE1 4.27Å; L43-Y138 HydrophobicContact CD1-CE2 4.15Å; L43-Y138 HydrophobicContact CD1-CG 3.97Å; L43-Y138 HydrophobicContact CG-CD1 4.25Å; L43-Y138 HydrophobicContact CG-CG 4.44Å; K44-Y138 WeakPolarHBondContact O-CD1 3.3Å; T136-Y138 VanDerWaalsContact C-N 3.35Å; Y138-E140 VanDerWaalsContact C-N 3.25Å; Y138-E140 PolarHBondContact O-N 2.91Å; Y138-R141 PolarHBondContact O-N 3.48Å
139	V	82.6	Confident	82.9	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.024	19%	0.191	C	C	.	.	H	α-helix	trans	-68.5	-30.1	-176.9	174.8	0	0	0	0	111.6	A46 Y49 R141 I142 F143 F176 F179	A46-V139 HydrophobicContact CB-CG2 4.32Å; Y49-V139 HydrophobicContact CD2-CB 4.5Å; Y49-V139 HydrophobicContact CD2-CG2 3.58Å; Y49-V139 HydrophobicContact CE2-CB 4.44Å; Y49-V139 HydrophobicContact CE2-CG2 3.99Å; Y49-V139 HydrophobicContact CG-CG2 4Å; V139-R141 PolarHBondContact O-N 3.38Å; V139-I142 WeakPolarHBondContact O-CB 3.33Å; V139-I142 PolarHBondContact O-N 3.16Å; V139-F143 HydrophobicContact CG1-CE2 4.18Å; V139-F143 HydrophobicContact CG1-CZ 4.27Å; V139-F143 PolarHBondContact O-N 3.31Å; V139-F176 HydrophobicContact CG2-CE1 4.27Å; V139-F179 HydrophobicContact CG1-CD1 4.18Å; V139-F179 HydrophobicContact CG1-CE1 3.24Å; V139-F179 HydrophobicContact CG1-CE2 4.12Å; V139-F179 HydrophobicContact CG1-CZ 3.17Å
140	E	85.2	Confident	82.8	Confident	54 Å²	54	39.7 Å²	39.7	25%	0.252	19%	0.191	S	C	.	.	H	α-helix	trans	-57.9	-35.1	179	-62.7	84.6	171	0	0	112	L43 K44 Y138 I142 F143 D144	L43-E140 HydrophobicContact CD2-CB 4.09Å; L43-E140 HydrophobicContact CD2-CG 4.13Å; K44-E140 PolarHBondContact N-OE1 2.81Å; Y138-E140 VanDerWaalsContact C-N 3.25Å; Y138-E140 PolarHBondContact O-N 2.91Å; E140-I142 VanDerWaalsContact C-N 3.27Å; E140-I142 PolarHBondContact O-N 2.89Å; E140-F143 WeakPolarHBondContact O-CB 3.44Å; E140-F143 PolarHBondContact O-N 3.42Å; E140-F143 VanDerWaalsContact O-N 3.1Å; E140-D144 PolarHBondContact O-N 2.97Å
141	R	85.8	Confident	82.6	Confident	44 Å²	44	40.6 Å²	40.6	17%	0.166	20%	0.197	C	C	.	.	H	α-helix	trans	-66.4	-30.3	177.6	-68.1	-161.2	-179.5	-143.3	0.3	113.4	L33 Y138 V139 F143 D144 A145	L33-R141 PolarHBondContact O-NH2 3.47Å; Y138-R141 PolarHBondContact O-N 3.48Å; V139-R141 PolarHBondContact O-N 3.38Å; R141-F143 VanDerWaalsContact C-N 3.32Å; R141-D144 PolarHBondContact O-N 3.25Å; R141-A145 WeakPolarHBondContact O-CB 3.27Å; R141-A145 PolarHBondContact O-N 3.36Å
142	I	88.6	Confident	82.7	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-68.2	-40.8	175.3	-58.4	154.5	0	0	0	108.9	V139 E140 A145 I146 I172 F176 F179 A180	V139-I142 WeakPolarHBondContact O-CB 3.33Å; V139-I142 PolarHBondContact O-N 3.16Å; E140-I142 VanDerWaalsContact C-N 3.27Å; E140-I142 PolarHBondContact O-N 2.89Å; I142-A145 PolarHBondContact O-N 3.39Å; I142-I146 HydrophobicContact CG2-CD1 3.88Å; I142-I146 HydrophobicContact CG2-CG1 4.46Å; I142-I146 WeakPolarHBondContact O-CB 3.27Å; I142-I146 WeakPolarHBondContact O-CG1 3.19Å; I142-I146 PolarHBondContact O-N 2.87Å; I142-I172 HydrophobicContact CG2-CD1 4.1Å; I142-F176 HydrophobicContact CD1-CB 3.46Å; I142-F176 VanDerWaalsContact CD1-CB 3.46Å; I142-F176 HydrophobicContact CD1-CD1 3.4Å; I142-F176 VanDerWaalsContact CD1-CD1 3.4Å; I142-F176 HydrophobicContact CD1-CD2 3.79Å; I142-F176 HydrophobicContact CD1-CE1 4.1Å; I142-F176 HydrophobicContact CD1-CE2 4.43Å; I142-F176 HydrophobicContact CD1-CG 3.24Å; I142-F176 HydrophobicContact CG1-CB 4.28Å; I142-F176 HydrophobicContact CG1-CG 4.3Å; I142-F179 HydrophobicContact CD1-CD1 4.26Å; I142-F179 HydrophobicContact CD1-CE1 4.5Å; I142-F179 HydrophobicContact CG2-CD1 4.23Å; I142-F179 HydrophobicContact CG2-CE1 4.42Å; I142-A180 HydrophobicContact CG2-CB 3.8Å
143	F	89.6	Confident	82.7	Confident	60 Å²	60	39.8 Å²	39.8	26%	0.263	19%	0.191	S	C	.	.	H	α-helix	trans	-61.9	-46.2	174	-63.8	-35.5	0	0	0	112	V139 E140 R141 A145 I146 D147 F179 K183	V139-F143 HydrophobicContact CG1-CE2 4.18Å; V139-F143 HydrophobicContact CG1-CZ 4.27Å; V139-F143 PolarHBondContact O-N 3.31Å; E140-F143 WeakPolarHBondContact O-CB 3.44Å; E140-F143 PolarHBondContact O-N 3.42Å; E140-F143 VanDerWaalsContact O-N 3.1Å; R141-F143 VanDerWaalsContact C-N 3.32Å; F143-A145 VanDerWaalsContact C-N 3.31Å; F143-A145 PolarHBondContact O-N 2.96Å; F143-I146 PolarHBondContact O-N 3.36Å; F143-D147 WeakPolarHBondContact O-CB 3.26Å; F143-D147 PolarHBondContact O-N 3.3Å; F143-F179 HydrophobicContact CD1-CE1 4.05Å; F143-F179 HydrophobicContact CD1-CZ 4.31Å; F143-F179 AromaticContact CE1-CE1 3.42Å; F143-F179 HydrophobicContact CE1-CE1 3.42Å; F143-F179 VanDerWaalsContact CE1-CE1 3.42Å; F143-F179 HydrophobicContact CE1-CE2 4.4Å; F143-F179 AromaticContact CE1-CZ 3.29Å; F143-F179 HydrophobicContact CE1-CZ 3.29Å; F143-F179 HydrophobicContact CE2-CZ 4.23Å; F143-F179 AromaticContact CZ-CE1 3.84Å; F143-F179 HydrophobicContact CZ-CE1 3.84Å; F143-F179 HydrophobicContact CZ-CE2 4.31Å; F143-F179 AromaticContact CZ-CZ 3.28Å; F143-F179 HydrophobicContact CZ-CZ 3.28Å; F143-K183 HydrophobicContact CD1-CD 4.02Å; F143-K183 HydrophobicContact CD1-CG 3.72Å; F143-K183 HydrophobicContact CE1-CB 4.22Å; F143-K183 HydrophobicContact CE1-CD 3.58Å; F143-K183 HydrophobicContact CE1-CG 3.63Å; F143-K183 HydrophobicContact CZ-CD 4.47Å
144	D	89.8	Confident	82.7	Confident	66 Å²	66	45.7 Å²	45.7	35%	0.353	22%	0.216	S	C	.	.	H	α-helix	trans	-62.3	-40.7	178.8	-66.8	-30.1	0	0	0	111.5	E140 R141 D147 L148	E140-D144 PolarHBondContact O-N 2.97Å; R141-D144 PolarHBondContact O-N 3.25Å; D144-D147 PolarHBondContact O-N 3.47Å; D144-L148 WeakPolarHBondContact O-CB 3.34Å; D144-L148 PolarHBondContact O-N 3.3Å
145	A	91.5	Very high	83.2	Confident	8 Å²	8	45.6 Å²	45.6	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-63.6	-47.1	175.9	0	0	0	0	0	111.8	V130 C132 R141 I142 F143 D147 L148 T149 V170	V130-A145 HydrophobicContact CG1-CB 4.13Å; C132-A145 HydrophobicContact CB-CB 3.75Å; R141-A145 WeakPolarHBondContact O-CB 3.27Å; R141-A145 PolarHBondContact O-N 3.36Å; I142-A145 PolarHBondContact O-N 3.39Å; F143-A145 VanDerWaalsContact C-N 3.31Å; F143-A145 PolarHBondContact O-N 2.96Å; A145-D147 VanDerWaalsContact C-N 3.34Å; A145-D147 PolarHBondContact O-N 2.89Å; A145-L148 PolarHBondContact O-N 3.35Å; A145-T149 WeakPolarHBondContact O-CB 3.3Å; A145-T149 PolarHBondContact O-N 3.02Å; A145-T149 PolarHBondContact O-OG1 2.9Å; A145-V170 HydrophobicContact CB-CG2 3.84Å
146	I	92.6	Very high	84.2	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.8	-45.1	176.6	-70.1	170	0	0	0	110.8	I142 F143 T149 A150 V170 A180 K183 Y188 F196	I142-I146 HydrophobicContact CG2-CD1 3.88Å; I142-I146 HydrophobicContact CG2-CG1 4.46Å; I142-I146 WeakPolarHBondContact O-CB 3.27Å; I142-I146 WeakPolarHBondContact O-CG1 3.19Å; I142-I146 PolarHBondContact O-N 2.87Å; F143-I146 PolarHBondContact O-N 3.36Å; I146-T149 PolarHBondContact O-N 3.39Å; I146-A150 WeakPolarHBondContact O-CB 3.16Å; I146-A150 PolarHBondContact O-N 3.07Å; I146-V170 HydrophobicContact CG1-CG1 4.42Å; I146-A180 HydrophobicContact CD1-CB 3.96Å; I146-K183 HydrophobicContact CD1-CB 4.04Å; I146-K183 HydrophobicContact CD1-CG 4.14Å; I146-Y188 HydrophobicContact CG2-CD2 3.86Å; I146-Y188 HydrophobicContact CG2-CE2 3.88Å; I146-F196 HydrophobicContact CG2-CE2 4.42Å; I146-F196 HydrophobicContact CG2-CZ 3.91Å
147	D	91.5	Very high	84.5	Confident	24 Å²	24	44.7 Å²	44.7	13%	0.128	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-40.2	179	-78.8	9.1	0	0	0	111.8	F143 D144 A145 A150 S151 K187 Y188	F143-D147 WeakPolarHBondContact O-CB 3.26Å; F143-D147 PolarHBondContact O-N 3.3Å; D144-D147 PolarHBondContact O-N 3.47Å; A145-D147 VanDerWaalsContact C-N 3.34Å; A145-D147 PolarHBondContact O-N 2.89Å; D147-A150 PolarHBondContact O-N 3.32Å; D147-S151 WeakPolarHBondContact O-CA 3.21Å; D147-S151 WeakPolarHBondContact O-CB 3.05Å; D147-S151 PolarHBondContact O-N 3.2Å; D147-K187 WeakPolarHBondContact OD1-CE 3.49Å; D147-K187 IonicContact OD1-NZ 2.66Å; D147-K187 PolarHBondContact OD1-NZ 2.8Å; D147-K187 IonicContact OD2-NZ 3.31Å; D147-K187 PolarHBondContact OD2-NZ 3.31Å; D147-Y188 WeakPolarHBondContact OD1-CE2 2.93Å; D147-Y188 PolarHBondContact OD1-OH 2.75Å; D147-Y188 VanDerWaalsContact OD1-OH 3.09Å
148	L	91.7	Very high	84.4	Confident	52 Å²	52	40.2 Å²	40.2	27%	0.272	21%	0.214	S	C	.	.	H	α-helix	trans	-65.9	-41.3	176.4	-177.7	65.3	0	0	0	111.3	V130 D144 A145 S151 P152 L323	V130-L148 HydrophobicContact CG1-CD2 4.07Å; D144-L148 WeakPolarHBondContact O-CB 3.34Å; D144-L148 PolarHBondContact O-N 3.3Å; A145-L148 PolarHBondContact O-N 3.35Å; L148-S151 CarbonylContact O-C 3.54Å; L148-S151 PolarHBondContact O-N 3.44Å; L148-P152 VanDerWaalsContact O-CA 3.23Å; L148-P152 WeakPolarHBondContact O-CA 3.05Å; L148-P152 WeakPolarHBondContact O-CD 3Å; L148-L323 HydrophobicContact CD1-CD1 4.28Å; L148-L323 HydrophobicContact CD2-CD1 3.97Å; L148-L323 HydrophobicContact CG-CD1 3.86Å
149	T	93.6	Very high	83.9	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.7	-45.5	174	-59.6	0	0	0	0	111.2	V130 A145 I146 S151 C167 A169 V170 F196	V130-T149 VanDerWaalsContact CB-OG1 3.25Å; V130-T149 WeakPolarHBondContact CB-OG1 3.49Å; V130-T149 WeakPolarHBondContact CG2-OG1 3.44Å; A145-T149 WeakPolarHBondContact O-CB 3.3Å; A145-T149 PolarHBondContact O-N 3.02Å; A145-T149 PolarHBondContact O-OG1 2.9Å; I146-T149 PolarHBondContact O-N 3.39Å; T149-S151 VanDerWaalsContact C-N 3.34Å; T149-C167 HydrophobicContact CG2-CB 3.79Å; T149-C167 PolarHBondContact O-N 3.49Å; T149-A169 VanDerWaalsContact CG2-C 3.47Å; T149-A169 WeakPolarHBondContact CG2-O 3.38Å; T149-V170 HydrophobicContact CG2-CB 4.25Å; T149-V170 WeakPolarHBondContact OG1-CB 3.27Å; T149-F196 HydrophobicContact CG2-CB 3.73Å; T149-F196 HydrophobicContact CG2-CD1 4.26Å; T149-F196 HydrophobicContact CG2-CD2 3.31Å; T149-F196 HydrophobicContact CG2-CE2 3.9Å; T149-F196 HydrophobicContact CG2-CG 3.51Å
150	A	92	Very high	83.3	Confident	0 Å²	0	51 Å²	51	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-69.8	-31.1	-179.6	0	0	0	0	0	113.2	I146 D147 Y188 F194 F196	I146-A150 WeakPolarHBondContact O-CB 3.16Å; I146-A150 PolarHBondContact O-N 3.07Å; D147-A150 PolarHBondContact O-N 3.32Å; A150-Y188 HydrophobicContact CB-CD1 3.83Å; A150-Y188 HydrophobicContact CB-CD2 3.91Å; A150-Y188 HydrophobicContact CB-CE1 3.56Å; A150-Y188 HydrophobicContact CB-CE2 3.65Å; A150-Y188 HydrophobicContact CB-CG 4Å; A150-Y188 VanDerWaalsContact CB-CZ 3.47Å; A150-F194 HydrophobicContact CB-CE1 4.49Å; A150-F194 HydrophobicContact CB-CZ 3.8Å; A150-F194 WeakPolarHBondContact O-CE2 3.42Å; A150-F194 WeakPolarHBondContact O-CZ 3.36Å; A150-F196 HydrophobicContact CB-CD1 4.39Å; A150-F196 HydrophobicContact CB-CE1 3.77Å; A150-F196 HydrophobicContact CB-CZ 4.36Å
151	S	89.7	Confident	82.7	Confident	21 Å²	21	49 Å²	49	15%	0.147	26%	0.256	C	S	.	.			trans	-150.2	69.3	-169.3	-156.9	0	0	0	0	111.5	D147 L148 T149 Y153 R164	D147-S151 WeakPolarHBondContact O-CA 3.21Å; D147-S151 WeakPolarHBondContact O-CB 3.05Å; D147-S151 PolarHBondContact O-N 3.2Å; L148-S151 CarbonylContact O-C 3.54Å; L148-S151 PolarHBondContact O-N 3.44Å; T149-S151 VanDerWaalsContact C-N 3.34Å; S151-Y153 PolarHBondContact O-N 3.07Å; S151-Y153 VanDerWaalsContact O-N 3.07Å; S151-R164 VanDerWaalsContact CB-NH2 3.27Å; S151-R164 PolarHBondContact OG-NH2 2.94Å
152	P	91.5	Very high	82.2	Confident	11 Å²	11	57.8 Å²	57.8	7%	0.071	30%	0.295	C	S	.	.	S	Bend	trans	-58.6	-27.3	-175.4	20.6	-31.9	0	0	0	112.9	V125 L148 P165 L323	V125-P152 HydrophobicContact CG1-CB 4.25Å; V125-P152 HydrophobicContact CG1-CG 3.64Å; L148-P152 VanDerWaalsContact O-CA 3.23Å; L148-P152 WeakPolarHBondContact O-CA 3.05Å; L148-P152 WeakPolarHBondContact O-CD 3Å; P152-P165 WeakPolarHBondContact CD-O 3.17Å; P152-P165 HydrophobicContact CG-CB 4.43Å; P152-L323 HydrophobicContact CB-CD2 4.29Å
153	Y	88.9	Confident	81.5	Confident	7 Å²	7	62.2 Å²	62.2	3%	0.027	32%	0.316	C	S	.	.			trans	-118.9	76.6	-177.1	-50.4	-36.3	0	0	0	112.2	I121 L122 V125 S151 S155 I156 P165 S326 A327 L330	I121-Y153 WeakPolarHBondContact CG2-OH 3.23Å; L122-Y153 HydrophobicContact CD2-CE2 4.26Å; V125-Y153 HydrophobicContact CG2-CE2 4.48Å; V125-Y153 WeakPolarHBondContact CG2-OH 3.36Å; S151-Y153 PolarHBondContact O-N 3.07Å; S151-Y153 VanDerWaalsContact O-N 3.07Å; Y153-S155 PolarHBondContact O-N 3Å; Y153-S155 VanDerWaalsContact O-N 3.13Å; Y153-I156 HydrophobicContact CD2-CD1 4.35Å; Y153-I156 HydrophobicContact CG-CD1 4.19Å; Y153-I156 PolarHBondContact O-N 3.13Å; Y153-P165 HydrophobicContact CD2-CB 4.17Å; Y153-P165 HydrophobicContact CD2-CG 3.48Å; Y153-P165 VanDerWaalsContact CD2-CG 3.48Å; Y153-P165 HydrophobicContact CE2-CB 4.21Å; Y153-P165 HydrophobicContact CE2-CG 3.99Å; Y153-P165 HydrophobicContact CG-CG 4.45Å; Y153-S326 VanDerWaalsContact CE1-OG 3.27Å; Y153-S326 WeakPolarHBondContact CE1-OG 3.41Å; Y153-S326 VanDerWaalsContact OH-CB 3.3Å; Y153-S326 WeakPolarHBondContact OH-CB 3.49Å; Y153-S326 PolarHBondContact OH-OG 3.37Å; Y153-A327 HydrophobicContact CD1-CB 3.4Å; Y153-A327 VanDerWaalsContact CD1-CB 3.4Å; Y153-A327 VanDerWaalsContact CE1-CA 3.48Å; Y153-A327 HydrophobicContact CE1-CB 3.67Å; Y153-A327 HydrophobicContact CG-CB 4.43Å; Y153-L330 HydrophobicContact CD2-CD2 3.51Å; Y153-L330 HydrophobicContact CE2-CD2 3.27Å; Y153-L330 HydrophobicContact CG-CD2 4.43Å
154	K	79.2	Confident	81	Confident	154 Å²	154	64.9 Å²	64.9	67%	0.67	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-30.4	178.6	-66.8	-177.5	-178.1	174.6	0	113.3
155	S	73.2	Confident	80.9	Confident	86 Å²	86	62.2 Å²	62.2	60%	0.601	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-8.6	-176.6	53.7	0	0	0	0	115	Y153	Y153-S155 PolarHBondContact O-N 3Å; Y153-S155 VanDerWaalsContact O-N 3.13Å
156	I	75.8	Confident	80.9	Confident	13 Å²	13	62.9 Å²	62.9	7%	0.067	31%	0.312	C	S	.	.	S	Bend	trans	-109.5	102.5	-176.4	-55.8	177.2	0	0	0	107.9	Y153 L161 L330 L331 I334	Y153-I156 HydrophobicContact CD2-CD1 4.35Å; Y153-I156 HydrophobicContact CG-CD1 4.19Å; Y153-I156 PolarHBondContact O-N 3.13Å; I156-L161 HydrophobicContact CG2-CD1 3.68Å; I156-L161 HydrophobicContact CG2-CG 4.04Å; I156-L330 HydrophobicContact CD1-CB 4Å; I156-L330 HydrophobicContact CD1-CD2 3.71Å; I156-L330 HydrophobicContact CD1-CG 3.78Å; I156-L331 HydrophobicContact CD1-CB 4.34Å; I156-L331 HydrophobicContact CG1-CD1 4.49Å; I156-I334 HydrophobicContact CD1-CD1 4.49Å; I156-I334 HydrophobicContact CG2-CD1 3.83Å
157	T	66.3	Low	81	Confident	79 Å²	79	62.9 Å²	62.9	49%	0.485	31%	0.312	S	S	.	.			trans	-71.7	149.8	-177.8	55.9	0	0	0	0	111.5	Q159 K160	T157-Q159 PolarHBondContact O-N 2.53Å; T157-K160 PolarHBondContact O-N 3.18Å
158	S	61.7	Low	81.1	Confident	83 Å²	83	61.9 Å²	61.9	58%	0.58	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-16.3	177.5	-7.6	0	0	0	0	113.6	K160 L161	S158-K160 PolarHBondContact O-N 3.28Å; S158-L161 CarbonylContact O-C 3.53Å; S158-L161 PolarHBondContact O-N 2.94Å
159	Q	61.5	Low	81.2	Confident	189 Å²	189	59.4 Å²	59.4	88%	0.883	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-25.3	174	-78.3	176.7	-20.7	0	0	112.6	T157	T157-Q159 PolarHBondContact O-N 2.53Å
160	K	69.9	Low	81.2	Confident	113 Å²	113	59.4 Å²	59.4	49%	0.491	29%	0.294	S	S	.	.	S	Bend	trans	-90.6	-12.6	179.1	-68.1	-179.8	169.3	-168.1	0	113.4	T157 S158 I334	T157-K160 PolarHBondContact O-N 3.18Å; S158-K160 PolarHBondContact O-N 3.28Å; K160-I334 HydrophobicContact CB-CD1 4.5Å; K160-I334 HydrophobicContact CB-CG2 4.49Å; K160-I334 HydrophobicContact CD-CG2 4.05Å
161	L	73.3	Confident	81.2	Confident	13 Å²	13	59.4 Å²	59.4	7%	0.068	29%	0.294	C	S	.	.	S	Bend	trans	-132.6	128.8	-176	-64.5	176.1	0	0	0	109.8	L122 I156 S158 E163 P165 L330 I334	L122-L161 HydrophobicContact CD1-CD2 4.05Å; L122-L161 HydrophobicContact CD2-CD1 4.05Å; L122-L161 HydrophobicContact CD2-CD2 4.38Å; I156-L161 HydrophobicContact CG2-CD1 3.68Å; I156-L161 HydrophobicContact CG2-CG 4.04Å; S158-L161 CarbonylContact O-C 3.53Å; S158-L161 PolarHBondContact O-N 2.94Å; L161-E163 WeakPolarHBondContact CB-O 3.38Å; L161-E163 PolarHBondContact O-N 3.38Å; L161-P165 HydrophobicContact CD1-CG 3.9Å; L161-L330 HydrophobicContact CD1-CD2 4.16Å; L161-I334 HydrophobicContact CD2-CD1 4.2Å
162	K	73.4	Confident	81.3	Confident	229 Å²	229	58.5 Å²	58.5	100%	0.996	29%	0.287	S	S	*	.	S	Bend	trans	-52.8	-27.4	-178.5	-69.3	-175.6	179	-179.9	0	113.9
163	E	75.2	Confident	81	Confident	99 Å²	99	60.9 Å²	60.9	46%	0.463	30%	0.298	S	S	.	.	S	Bend	trans	-137	152.2	177.2	65.7	-172.6	158.2	0	0	110.2	K126 L161 P165	K126-E163 WeakPolarHBondContact CE-OE1 3.45Å; K126-E163 WeakPolarHBondContact CE-OE2 3.14Å; K126-E163 IonicContact NZ-OE1 3.74Å; K126-E163 PolarHBondContact NZ-OE1 3.33Å; K126-E163 IonicContact NZ-OE2 3.66Å; K126-E163 PolarHBondContact NZ-OE2 3.31Å; L161-E163 WeakPolarHBondContact CB-O 3.38Å; L161-E163 PolarHBondContact O-N 3.38Å; E163-P165 VanDerWaalsContact O-CD 3.31Å; E163-P165 WeakPolarHBondContact O-CD 3.37Å
164	R	79	Confident	80.7	Confident	116 Å²	116	62 Å²	62	44%	0.438	31%	0.305	S	S	.	.			trans	-73.2	116.9	173	-177.5	-177	-178.6	171.1	6.6	109	S151	S151-R164 VanDerWaalsContact CB-NH2 3.27Å; S151-R164 PolarHBondContact OG-NH2 2.94Å
165	P	87.3	Confident	80.9	Confident	10 Å²	10	59.5 Å²	59.5	7%	0.065	30%	0.303	C	S	.	.			trans	-67.9	141	176.3	25.4	-28.6	0	0	0	110	L122 V125 P152 Y153 L161 E163	L122-P165 HydrophobicContact CD2-CB 3.94Å; L122-P165 HydrophobicContact CD2-CG 4.2Å; V125-P165 HydrophobicContact CG1-CB 4.48Å; P152-P165 WeakPolarHBondContact CD-O 3.17Å; P152-P165 HydrophobicContact CG-CB 4.43Å; Y153-P165 HydrophobicContact CD2-CB 4.17Å; Y153-P165 HydrophobicContact CD2-CG 3.48Å; Y153-P165 VanDerWaalsContact CD2-CG 3.48Å; Y153-P165 HydrophobicContact CE2-CB 4.21Å; Y153-P165 HydrophobicContact CE2-CG 3.99Å; Y153-P165 HydrophobicContact CG-CG 4.45Å; L161-P165 HydrophobicContact CD1-CG 3.9Å; E163-P165 VanDerWaalsContact O-CD 3.31Å; E163-P165 WeakPolarHBondContact O-CD 3.37Å
166	H	91.5	Very high	81.7	Confident	22 Å²	22	56.3 Å²	56.3	10%	0.102	28%	0.278	C	S	.	.			trans	-146.8	155.2	171.1	66.7	77.5	0	0	0	109.4	F194 H195	H166-F194 HydrophobicContact CB-CD2 4.38Å; H166-F194 HydrophobicContact CB-CE2 3.66Å; H166-F194 HydrophobicContact CB-CZ 4.36Å; H166-F194 AromaticContact CD2-CD2 3.6Å; H166-F194 AromaticContact CD2-CE2 3.79Å; H166-F194 AromaticContact CG-CE2 3.85Å; H166-H195 PolarHBondContact CE1-O 3.42Å
167	C	94.3	Very high	82.3	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	28%	0.275	C	S	.	.			trans	-75.6	164.8	176.5	-60	0	0	0	0	110.9	V125 A128 V130 T149 F196	V125-C167 WeakPolarHBondContact O-CA 3.44Å; A128-C167 HydrophobicContact CB-CB 4.24Å; A128-C167 WeakPolarHBondContact O-CB 3.39Å; V130-C167 HydrophobicContact CG2-CB 4.22Å; T149-C167 HydrophobicContact CG2-CB 3.79Å; T149-C167 PolarHBondContact O-N 3.49Å; C167-F196 WeakPolarHBondContact O-CB 3.15Å
168	A	94.1	Very high	83.4	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	26%	0.264	C	S	.	.	S	Bend	trans	-73.8	-39.6	178.7	0	0	0	0	0	112.3	K126 A128 F196 R197 K312	K126-A168 WeakPolarHBondContact O-CB 3.3Å; A128-A168 WeakPolarHBondContact O-CB 3.5Å; A128-A168 PolarHBondContact O-N 3.42Å; A168-F196 CarbonylContact O-C 3.59Å; A168-F196 VanDerWaalsContact O-CA 3.32Å; A168-F196 WeakPolarHBondContact O-CA 3.32Å; A168-R197 PolarHBondContact O-N 2.94Å; A168-K312 HydrophobicContact CB-CB 3.94Å
169	A	94.6	Very high	84.8	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	166.2	-176	0	0	0	0	0	113.5	A128 E129 V130 T149 R197 N199	A128-A169 PolarHBondContact O-N 3.48Å; E129-A169 CarbonylContact C-O 3.57Å; E129-A169 VanDerWaalsContact CA-O 3.32Å; E129-A169 WeakPolarHBondContact CA-O 3.4Å; E129-A169 HydrophobicContact CB-CB 4.4Å; E129-A169 HydrophobicContact CG-CB 3.99Å; V130-A169 PolarHBondContact N-O 3.28Å; T149-A169 VanDerWaalsContact CG2-C 3.47Å; T149-A169 WeakPolarHBondContact CG2-O 3.38Å; A169-R197 CarbonylContact C-O 3.24Å; A169-R197 WeakPolarHBondContact CA-O 3.25Å; A169-R197 HydrophobicContact CB-CB 3.93Å; A169-R197 WeakPolarHBondContact CB-O 3.47Å; A169-N199 WeakPolarHBondContact CB-ND2 3.45Å
170	V	93.8	Very high	86.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	138.9	161.7	66.4	0	0	0	0	108.1	V130 A145 I146 T149 I172 F196 R197 V198 N199	V130-V170 HydrophobicContact CB-CG2 4.29Å; V130-V170 CarbonylContact O-C 3.5Å; V130-V170 WeakPolarHBondContact O-CA 3.35Å; A145-V170 HydrophobicContact CB-CG2 3.84Å; I146-V170 HydrophobicContact CG1-CG1 4.42Å; T149-V170 HydrophobicContact CG2-CB 4.25Å; T149-V170 WeakPolarHBondContact OG1-CB 3.27Å; V170-I172 HydrophobicContact CB-CD1 4.49Å; V170-I172 HydrophobicContact CG1-CD1 4.26Å; V170-I172 HydrophobicContact CG1-CG1 4Å; V170-I172 HydrophobicContact CG2-CD1 3.51Å; V170-I172 HydrophobicContact CG2-CG1 4.07Å; V170-F196 HydrophobicContact CG1-CD2 4.44Å; V170-F196 HydrophobicContact CG1-CE2 4.16Å; V170-R197 PolarHBondContact N-O 2.81Å; V170-V198 HydrophobicContact CG1-CB 4.21Å; V170-V198 HydrophobicContact CG1-CG1 4.04Å; V170-V198 HydrophobicContact CG1-CG2 3.93Å; V170-N199 PolarHBondContact O-N 3.01Å
171	Y	92.1	Very high	87.3	Confident	1 Å²	1	39.3 Å²	39.3	0%	0.004	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	108.6	-178.9	-166.8	-96.4	0	0	0	109.4	E129 V130 M131 C132 I133 N199 T201 D226 R247	E129-Y171 WeakPolarHBondContact OE1-CD2 3.49Å; V130-Y171 PolarHBondContact O-N 2.89Å; M131-Y171 HydrophobicContact CE-CD1 3.38Å; M131-Y171 HydrophobicContact CE-CE1 3.78Å; M131-Y171 HydrophobicContact CE-CG 3.87Å; M131-Y171 HydrophobicContact SD-CD1 4.03Å; M131-Y171 HydrophobicContact SD-CG 3.9Å; C132-Y171 CarbonylContact C-O 3.56Å; C132-Y171 WeakPolarHBondContact CA-O 3.4Å; C132-Y171 PolarHBondContact N-O 3.39Å; I133-Y171 HydrophobicContact CG2-CD1 3.46Å; I133-Y171 VanDerWaalsContact CG2-CD1 3.46Å; I133-Y171 HydrophobicContact CG2-CE1 3.66Å; Y171-N199 CarbonylContact C-O 3.38Å; Y171-N199 WeakPolarHBondContact CA-O 3.47Å; Y171-N199 HydrophobicContact CD2-CB 3.86Å; Y171-T201 HydrophobicContact CE1-CG2 4.33Å; Y171-T201 VanDerWaalsContact CZ-CB 3.47Å; Y171-T201 WeakPolarHBondContact OH-CB 3.29Å; Y171-T201 PolarHBondContact OH-OG1 3.12Å; Y171-D226 HydrophobicContact CE2-CB 3.84Å; Y171-D226 WeakPolarHBondContact CE2-OD2 3.34Å; Y171-D226 WeakPolarHBondContact OH-CB 3.45Å; Y171-D226 PolarHBondContact OH-OD2 2.68Å; Y171-R247 VanDerWaalsContact CE2-NH1 3.28Å; Y171-R247 PolarHBondContact OH-NH1 2.7Å
172	I	90.1	Very high	88.1	Confident	1 Å²	1	43.1 Å²	43.1	1%	0.005	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	140.7	-167.5	-59.7	-61.5	0	0	0	110	C132 I142 V170 F176 A180 V198 N199 T200	C132-I172 HydrophobicContact CB-CD1 3.85Å; I142-I172 HydrophobicContact CG2-CD1 4.1Å; V170-I172 HydrophobicContact CB-CD1 4.49Å; V170-I172 HydrophobicContact CG1-CD1 4.26Å; V170-I172 HydrophobicContact CG1-CG1 4Å; V170-I172 HydrophobicContact CG2-CD1 3.51Å; V170-I172 HydrophobicContact CG2-CG1 4.07Å; I172-F176 HydrophobicContact CG2-CB 3.82Å; I172-A180 HydrophobicContact CB-CB 4.46Å; I172-A180 HydrophobicContact CD1-CB 4.38Å; I172-A180 HydrophobicContact CG1-CB 3.87Å; I172-A180 HydrophobicContact CG2-CB 4.05Å; I172-V198 HydrophobicContact CB-CG1 4.42Å; I172-V198 HydrophobicContact CG1-CG1 3.87Å; I172-N199 PolarHBondContact N-O 3.49Å; I172-T200 WeakPolarHBondContact O-CA 3.24Å; I172-T200 WeakPolarHBondContact O-CB 3.26Å; I172-T200 PolarHBondContact O-OG1 3.47Å
173	H	85.4	Confident	88.9	Confident	62 Å²	62	35.4 Å²	35.4	29%	0.287	17%	0.17	S	C	.	.			trans	-59.4	137.1	170.2	-174.2	-83.9	0	0	0	111.7	C132 T136 V175 F176	C132-H173 PolarHBondContact O-N 2.96Å; T136-H173 HydrophobicContact CG2-CB 3.55Å; H173-V175 VanDerWaalsContact C-N 3.27Å; H173-V175 PolarHBondContact ND1-N 3.4Å; H173-V175 PolarHBondContact O-N 3.4Å; H173-F176 HydrophobicContact CB-CD2 4.47Å; H173-F176 PolarHBondContact O-N 2.83Å
174	P	83.6	Confident	89.7	Confident	29 Å²	29	32 Å²	32	19%	0.188	15%	0.154	C	C	.	.	G	3₁₀ helix	trans	-48.5	-41.7	-172.7	-32.4	35.2	0	0	0	115.6	F176 L177 T200 T201 L202	P174-F176 PolarHBondContact O-N 3.3Å; P174-L177 VanDerWaalsContact O-CB 3.25Å; P174-L177 WeakPolarHBondContact O-CB 3.43Å; P174-L177 PolarHBondContact O-N 2.85Å; P174-T200 WeakPolarHBondContact CA-OG1 3.4Å; P174-T200 WeakPolarHBondContact CD-OG1 3.37Å; P174-T200 WeakPolarHBondContact CG-OG1 3.33Å; P174-T201 WeakPolarHBondContact CG-O 3.28Å; P174-L202 HydrophobicContact CB-CD2 4.11Å; P174-L202 HydrophobicContact CG-CD2 3.65Å; P174-L202 HydrophobicContact CG-CG 4.39Å
175	V	83.4	Confident	90.2	Very high	102 Å²	102	31.7 Å²	31.7	62%	0.618	16%	0.16	S	C	*	.	G	3₁₀ helix	trans	-55.5	-24.2	-179.8	171.1	0	0	0	0	113.7	H173	H173-V175 VanDerWaalsContact C-N 3.27Å; H173-V175 PolarHBondContact ND1-N 3.4Å; H173-V175 PolarHBondContact O-N 3.4Å
176	F	88.6	Confident	90.3	Very high	19 Å²	19	35.2 Å²	35.2	8%	0.083	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-111.3	8.1	-179.6	-61.2	-69.4	0	0	0	114.3	A46 T136 V139 I142 I172 H173 P174 F179 A180	A46-F176 HydrophobicContact CB-CE1 4.03Å; A46-F176 HydrophobicContact CB-CZ 3.73Å; T136-F176 HydrophobicContact CG2-CD2 4.23Å; T136-F176 HydrophobicContact CG2-CE2 3.74Å; T136-F176 VanDerWaalsContact O-CE2 3.28Å; T136-F176 WeakPolarHBondContact O-CE2 3.48Å; T136-F176 WeakPolarHBondContact O-CZ 3.31Å; V139-F176 HydrophobicContact CG2-CE1 4.27Å; I142-F176 HydrophobicContact CD1-CB 3.46Å; I142-F176 VanDerWaalsContact CD1-CB 3.46Å; I142-F176 HydrophobicContact CD1-CD1 3.4Å; I142-F176 VanDerWaalsContact CD1-CD1 3.4Å; I142-F176 HydrophobicContact CD1-CD2 3.79Å; I142-F176 HydrophobicContact CD1-CE1 4.1Å; I142-F176 HydrophobicContact CD1-CE2 4.43Å; I142-F176 HydrophobicContact CD1-CG 3.24Å; I142-F176 HydrophobicContact CG1-CB 4.28Å; I142-F176 HydrophobicContact CG1-CG 4.3Å; I172-F176 HydrophobicContact CG2-CB 3.82Å; H173-F176 HydrophobicContact CB-CD2 4.47Å; H173-F176 PolarHBondContact O-N 2.83Å; P174-F176 PolarHBondContact O-N 3.3Å; F176-F179 PolarHBondContact O-N 3.21Å; F176-A180 WeakPolarHBondContact O-CB 3.32Å; F176-A180 PolarHBondContact O-N 2.88Å
177	L	89	Confident	90.3	Very high	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-60	-53.7	-172.7	177.4	61.9	0	0	0	111.7	P174 F179 A180 V181 V198 T200 A217 D220 A222	P174-L177 VanDerWaalsContact O-CB 3.25Å; P174-L177 WeakPolarHBondContact O-CB 3.43Å; P174-L177 PolarHBondContact O-N 2.85Å; L177-F179 VanDerWaalsContact C-N 3.28Å; L177-F179 PolarHBondContact O-N 3.39Å; L177-A180 PolarHBondContact O-N 2.87Å; L177-A180 VanDerWaalsContact O-N 3.11Å; L177-V181 HydrophobicContact CD1-CG2 4.08Å; L177-V181 HydrophobicContact CG-CG2 4.47Å; L177-V181 WeakPolarHBondContact O-CG2 3.42Å; L177-V181 PolarHBondContact O-N 2.92Å; L177-V198 HydrophobicContact CD1-CG1 3.79Å; L177-T200 HydrophobicContact CD2-CG2 4.02Å; L177-A217 HydrophobicContact CD2-CB 3.9Å; L177-A217 VanDerWaalsContact CD2-O 3.28Å; L177-A217 WeakPolarHBondContact CD2-O 3.34Å; L177-D220 HydrophobicContact CB-CB 4.25Å; L177-D220 HydrophobicContact CD2-CB 3.75Å; L177-D220 HydrophobicContact CG-CB 3.96Å; L177-A222 HydrophobicContact CD1-CB 4.19Å; L177-A222 HydrophobicContact CD2-CB 3.62Å; L177-A222 HydrophobicContact CG-CB 4.46Å
178	E	90.1	Very high	90.1	Very high	55 Å²	55	39.9 Å²	39.9	26%	0.257	21%	0.209	S	C	.	.	H	α-helix	trans	-56.1	-47.1	179.8	-174	-177.4	173.9	0	0	110.8	W52 R55 A180 V181 Q182 D220	W52-E178 HydrophobicContact CH2-CB 4.39Å; W52-E178 HydrophobicContact CH2-CG 3.86Å; W52-E178 WeakPolarHBondContact CH2-OE1 3.18Å; W52-E178 HydrophobicContact CZ3-CB 4.14Å; W52-E178 HydrophobicContact CZ3-CG 3.98Å; W52-E178 WeakPolarHBondContact CZ3-OE2 3.44Å; R55-E178 IonicContact NH2-OE2 3.51Å; E178-A180 PolarHBondContact O-N 3.43Å; E178-V181 PolarHBondContact O-N 2.88Å; E178-Q182 WeakPolarHBondContact O-CB 3.45Å; E178-Q182 VanDerWaalsContact O-CG 3.32Å; E178-Q182 WeakPolarHBondContact O-CG 3.44Å; E178-Q182 PolarHBondContact O-N 3.45Å; E178-Q182 PolarHBondContact OE1-NE2 2.88Å; E178-D220 HydrophobicContact CB-CB 3.96Å
179	F	90.2	Very high	89.6	Confident	43 Å²	43	42.9 Å²	42.9	19%	0.189	23%	0.229	C	C	.	.	H	α-helix	trans	-58.9	-45.7	177.5	177.9	-96.1	0	0	0	112.5	V139 I142 F143 F176 L177 Q182 K183	V139-F179 HydrophobicContact CG1-CD1 4.18Å; V139-F179 HydrophobicContact CG1-CE1 3.24Å; V139-F179 HydrophobicContact CG1-CE2 4.12Å; V139-F179 HydrophobicContact CG1-CZ 3.17Å; I142-F179 HydrophobicContact CD1-CD1 4.26Å; I142-F179 HydrophobicContact CD1-CE1 4.5Å; I142-F179 HydrophobicContact CG2-CD1 4.23Å; I142-F179 HydrophobicContact CG2-CE1 4.42Å; F143-F179 HydrophobicContact CD1-CE1 4.05Å; F143-F179 HydrophobicContact CD1-CZ 4.31Å; F143-F179 AromaticContact CE1-CE1 3.42Å; F143-F179 HydrophobicContact CE1-CE1 3.42Å; F143-F179 VanDerWaalsContact CE1-CE1 3.42Å; F143-F179 HydrophobicContact CE1-CE2 4.4Å; F143-F179 AromaticContact CE1-CZ 3.29Å; F143-F179 HydrophobicContact CE1-CZ 3.29Å; F143-F179 HydrophobicContact CE2-CZ 4.23Å; F143-F179 AromaticContact CZ-CE1 3.84Å; F143-F179 HydrophobicContact CZ-CE1 3.84Å; F143-F179 HydrophobicContact CZ-CE2 4.31Å; F143-F179 AromaticContact CZ-CZ 3.28Å; F143-F179 HydrophobicContact CZ-CZ 3.28Å; F176-F179 PolarHBondContact O-N 3.21Å; L177-F179 VanDerWaalsContact C-N 3.28Å; L177-F179 PolarHBondContact O-N 3.39Å; F179-Q182 PolarHBondContact O-N 3.36Å; F179-K183 WeakPolarHBondContact O-CB 3.39Å; F179-K183 PolarHBondContact O-N 2.79Å
180	A	91.8	Very high	88.9	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-65.3	-41	178.8	0	0	0	0	0	112	I142 I146 I172 F176 L177 E178 K183 K184 V198	I142-A180 HydrophobicContact CG2-CB 3.8Å; I146-A180 HydrophobicContact CD1-CB 3.96Å; I172-A180 HydrophobicContact CB-CB 4.46Å; I172-A180 HydrophobicContact CD1-CB 4.38Å; I172-A180 HydrophobicContact CG1-CB 3.87Å; I172-A180 HydrophobicContact CG2-CB 4.05Å; F176-A180 WeakPolarHBondContact O-CB 3.32Å; F176-A180 PolarHBondContact O-N 2.88Å; L177-A180 PolarHBondContact O-N 2.87Å; L177-A180 VanDerWaalsContact O-N 3.11Å; E178-A180 PolarHBondContact O-N 3.43Å; A180-K183 PolarHBondContact O-N 2.78Å; A180-K184 WeakPolarHBondContact O-CB 3.44Å; A180-K184 PolarHBondContact O-N 2.71Å; A180-V198 HydrophobicContact CB-CG1 4.02Å
181	V	91.9	Very high	88.2	Confident	22 Å²	22	54.2 Å²	54.2	13%	0.133	29%	0.292	C	S	.	.	H	α-helix	trans	-62.6	-50.2	176.4	170.1	0	0	0	0	110.5	L177 E178 K183 K184 I185 V198 G221	L177-V181 HydrophobicContact CD1-CG2 4.08Å; L177-V181 HydrophobicContact CG-CG2 4.47Å; L177-V181 WeakPolarHBondContact O-CG2 3.42Å; L177-V181 PolarHBondContact O-N 2.92Å; E178-V181 PolarHBondContact O-N 2.88Å; V181-K183 VanDerWaalsContact C-N 3.32Å; V181-K183 PolarHBondContact O-N 2.86Å; V181-K184 PolarHBondContact O-N 3.36Å; V181-I185 HydrophobicContact CG1-CD1 3.78Å; V181-I185 VanDerWaalsContact O-CG1 3.32Å; V181-I185 WeakPolarHBondContact O-CG1 3.46Å; V181-I185 PolarHBondContact O-N 2.78Å; V181-V198 HydrophobicContact CG2-CB 3.97Å; V181-V198 HydrophobicContact CG2-CG1 4.02Å; V181-V198 HydrophobicContact CG2-CG2 4.31Å; V181-G221 WeakPolarHBondContact CG2-O 3.47Å
182	Q	91.3	Very high	87.3	Confident	92 Å²	92	58.5 Å²	58.5	43%	0.43	34%	0.336	S	S	.	.	H	α-helix	trans	-58.3	-44.7	177.5	-72.2	179	7.3	0	0	111.3	E178 F179 I185 A186	E178-Q182 WeakPolarHBondContact O-CB 3.45Å; E178-Q182 VanDerWaalsContact O-CG 3.32Å; E178-Q182 WeakPolarHBondContact O-CG 3.44Å; E178-Q182 PolarHBondContact O-N 3.45Å; E178-Q182 PolarHBondContact OE1-NE2 2.88Å; F179-Q182 PolarHBondContact O-N 3.36Å; Q182-I185 PolarHBondContact O-N 3.13Å; Q182-A186 WeakPolarHBondContact O-CB 3.49Å; Q182-A186 PolarHBondContact O-N 3.31Å
183	K	88.7	Confident	86.3	Confident	68 Å²	68	61.7 Å²	61.7	30%	0.296	37%	0.369	S	S	.	.	H	α-helix	trans	-64.3	-44.7	178.1	-176	64.5	168.3	-172.2	0	112.6	F143 I146 F179 A180 V181 I185 A186 K187	F143-K183 HydrophobicContact CD1-CD 4.02Å; F143-K183 HydrophobicContact CD1-CG 3.72Å; F143-K183 HydrophobicContact CE1-CB 4.22Å; F143-K183 HydrophobicContact CE1-CD 3.58Å; F143-K183 HydrophobicContact CE1-CG 3.63Å; F143-K183 HydrophobicContact CZ-CD 4.47Å; I146-K183 HydrophobicContact CD1-CB 4.04Å; I146-K183 HydrophobicContact CD1-CG 4.14Å; F179-K183 WeakPolarHBondContact O-CB 3.39Å; F179-K183 PolarHBondContact O-N 2.79Å; A180-K183 PolarHBondContact O-N 2.78Å; V181-K183 VanDerWaalsContact C-N 3.32Å; V181-K183 PolarHBondContact O-N 2.86Å; K183-I185 VanDerWaalsContact C-N 3.32Å; K183-I185 PolarHBondContact O-N 3.13Å; K183-A186 PolarHBondContact O-N 2.79Å; K183-K187 WeakPolarHBondContact O-CB 3.36Å; K183-K187 PolarHBondContact O-N 2.6Å
184	K	92.5	Very high	86	Confident	27 Å²	27	60.5 Å²	60.5	12%	0.117	36%	0.363	C	S	.	.	H	α-helix	trans	-54.6	-52	173.9	170.1	-166.2	155.8	-171.1	0	109.4	A180 V181 A186 K187 Y188 H195 F196 V198	A180-K184 WeakPolarHBondContact O-CB 3.44Å; A180-K184 PolarHBondContact O-N 2.71Å; V181-K184 PolarHBondContact O-N 3.36Å; K184-A186 VanDerWaalsContact C-N 3.31Å; K184-A186 PolarHBondContact O-N 3.42Å; K184-K187 PolarHBondContact O-N 3.28Å; K184-Y188 CarbonylContact O-C 3.53Å; K184-Y188 VanDerWaalsContact O-C 3.24Å; K184-Y188 VanDerWaalsContact O-CA 3.26Å; K184-Y188 WeakPolarHBondContact O-CA 3.36Å; K184-Y188 WeakPolarHBondContact O-CB 3.4Å; K184-Y188 PolarHBondContact O-N 3.4Å; K184-H195 PolarHBondContact NZ-NE2 3.05Å; K184-F196 HydrophobicContact CB-CE2 4.43Å; K184-F196 HydrophobicContact CB-CZ 4.21Å; K184-F196 HydrophobicContact CD-CD2 4.34Å; K184-F196 HydrophobicContact CD-CE2 3.94Å; K184-F196 HydrophobicContact CD-CZ 4.13Å; K184-F196 WeakPolarHBondContact CE-O 3.37Å; K184-F196 HydrophobicContact CG-CE1 4.23Å; K184-F196 HydrophobicContact CG-CE2 3.94Å; K184-F196 HydrophobicContact CG-CZ 3.66Å; K184-F196 PolarHBondContact NZ-O 2.92Å; K184-V198 HydrophobicContact CB-CG2 4.17Å; K184-V198 HydrophobicContact CD-CG2 3.56Å; K184-V198 HydrophobicContact CG-CG2 4.42Å
185	I	89.2	Confident	86	Confident	110 Å²	110	62.6 Å²	62.6	56%	0.564	37%	0.37	S	S	*	.	H	α-helix	trans	-58.8	-45	-178	-69.2	167.6	0	0	0	110.8	V181 Q182 K183	V181-I185 HydrophobicContact CG1-CD1 3.78Å; V181-I185 VanDerWaalsContact O-CG1 3.32Å; V181-I185 WeakPolarHBondContact O-CG1 3.46Å; V181-I185 PolarHBondContact O-N 2.78Å; Q182-I185 PolarHBondContact O-N 3.13Å; K183-I185 VanDerWaalsContact C-N 3.32Å; K183-I185 PolarHBondContact O-N 3.13Å
186	A	90	Very high	86.3	Confident	83 Å²	83	57.7 Å²	57.7	69%	0.686	34%	0.341	S	S	*	.	H	α-helix	trans	-67.3	-42.7	-177.8	0	0	0	0	0	113.3	Q182 K183 K184	Q182-A186 WeakPolarHBondContact O-CB 3.49Å; Q182-A186 PolarHBondContact O-N 3.31Å; K183-A186 PolarHBondContact O-N 2.79Å; K184-A186 VanDerWaalsContact C-N 3.31Å; K184-A186 PolarHBondContact O-N 3.42Å
187	K	91.2	Very high	86.3	Confident	90 Å²	90	60.1 Å²	60.1	39%	0.391	35%	0.349	S	S	.	.	H	α-helix	trans	-94.4	-28.6	-172.9	-168.4	172.6	178.3	-176.2	0	113.7	D147 K183 K184	D147-K187 WeakPolarHBondContact OD1-CE 3.49Å; D147-K187 IonicContact OD1-NZ 2.66Å; D147-K187 PolarHBondContact OD1-NZ 2.8Å; D147-K187 IonicContact OD2-NZ 3.31Å; D147-K187 PolarHBondContact OD2-NZ 3.31Å; K183-K187 WeakPolarHBondContact O-CB 3.36Å; K183-K187 PolarHBondContact O-N 2.6Å; K184-K187 PolarHBondContact O-N 3.28Å
188	Y	89.6	Confident	86.3	Confident	30 Å²	30	60.2 Å²	60.2	12%	0.118	35%	0.35	C	S	.	.	S	Bend	trans	-136	62.6	-169	-65.2	-59.9	0	0	0	110.9	I146 D147 A150 K184 F194 F196	I146-Y188 HydrophobicContact CG2-CD2 3.86Å; I146-Y188 HydrophobicContact CG2-CE2 3.88Å; D147-Y188 WeakPolarHBondContact OD1-CE2 2.93Å; D147-Y188 PolarHBondContact OD1-OH 2.75Å; D147-Y188 VanDerWaalsContact OD1-OH 3.09Å; A150-Y188 HydrophobicContact CB-CD1 3.83Å; A150-Y188 HydrophobicContact CB-CD2 3.91Å; A150-Y188 HydrophobicContact CB-CE1 3.56Å; A150-Y188 HydrophobicContact CB-CE2 3.65Å; A150-Y188 HydrophobicContact CB-CG 4Å; A150-Y188 VanDerWaalsContact CB-CZ 3.47Å; K184-Y188 CarbonylContact O-C 3.53Å; K184-Y188 VanDerWaalsContact O-C 3.24Å; K184-Y188 VanDerWaalsContact O-CA 3.26Å; K184-Y188 WeakPolarHBondContact O-CA 3.36Å; K184-Y188 WeakPolarHBondContact O-CB 3.4Å; K184-Y188 PolarHBondContact O-N 3.4Å; Y188-F194 AromaticContact CD1-CE1 3.97Å; Y188-F194 HydrophobicContact CD1-CE1 3.97Å; Y188-F194 HydrophobicContact CD1-CZ 4.3Å; Y188-F194 HydrophobicContact CG-CE1 4.25Å; Y188-F196 HydrophobicContact CD2-CE1 4.17Å; Y188-F196 HydrophobicContact CD2-CZ 4.17Å; Y188-F196 HydrophobicContact CG-CE1 4.12Å
189	P	83.7	Confident	86.3	Confident	66 Å²	66	57.6 Å²	57.6	43%	0.429	34%	0.338	S	S	.	.			trans	-62.4	145.9	-179.4	27.5	-35.1	0	0	0	110.7	K191	P189-K191 VanDerWaalsContact C-N 3.34Å; P189-K191 PolarHBondContact O-N 3.01Å
190	A	81.1	Confident	86	Confident	74 Å²	74	55.5 Å²	55.5	61%	0.612	33%	0.329	S	S	*	.	S	Bend	trans	-68	89.1	177.3	0	0	0	0	0	110.2
191	K	78.5	Confident	85.5	Confident	164 Å²	164	57 Å²	57	71%	0.713	34%	0.337	S	S	*	.	B	Isolated β-bridge	trans	-135.2	144.8	177.4	-72.5	-171.1	177.8	-177.1	0	110.1	P189 G193 F194	P189-K191 VanDerWaalsContact C-N 3.34Å; P189-K191 PolarHBondContact O-N 3.01Å; K191-G193 VanDerWaalsContact C-N 3.28Å; K191-G193 PolarHBondContact O-N 3Å; K191-F194 WeakPolarHBondContact O-CB 3.16Å; K191-F194 PolarHBondContact O-N 2.81Å; K191-F194 VanDerWaalsContact O-N 3.16Å
192	G	72.5	Confident	84.6	Confident	91 Å²	91	56.7 Å²	56.7	94%	0.938	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.4	32.9	173.9	0	0	0	0	0	114.5	F194	G192-F194 PolarHBondContact O-N 2.82Å
193	G	70.8	Confident	83.3	Confident	68 Å²	68	56.1 Å²	56.1	70%	0.701	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.8	-6.2	-179	0	0	0	0	0	115.2	K191 H195	K191-G193 VanDerWaalsContact C-N 3.28Å; K191-G193 PolarHBondContact O-N 3Å; G193-H195 PolarHBondContact O-N 3.21Å
194	F	77.9	Confident	82.2	Confident	36 Å²	36	53.2 Å²	53.2	16%	0.158	33%	0.326	C	S	.	.	B	Isolated β-bridge	trans	-73.8	108.2	174.3	-176.8	-94.2	0	0	0	110.1	A150 H166 Y188 K191 G192 F196	A150-F194 HydrophobicContact CB-CE1 4.49Å; A150-F194 HydrophobicContact CB-CZ 3.8Å; A150-F194 WeakPolarHBondContact O-CE2 3.42Å; A150-F194 WeakPolarHBondContact O-CZ 3.36Å; H166-F194 HydrophobicContact CB-CD2 4.38Å; H166-F194 HydrophobicContact CB-CE2 3.66Å; H166-F194 HydrophobicContact CB-CZ 4.36Å; H166-F194 AromaticContact CD2-CD2 3.6Å; H166-F194 AromaticContact CD2-CE2 3.79Å; H166-F194 AromaticContact CG-CE2 3.85Å; Y188-F194 AromaticContact CD1-CE1 3.97Å; Y188-F194 HydrophobicContact CD1-CE1 3.97Å; Y188-F194 HydrophobicContact CD1-CZ 4.3Å; Y188-F194 HydrophobicContact CG-CE1 4.25Å; K191-F194 WeakPolarHBondContact O-CB 3.16Å; K191-F194 PolarHBondContact O-N 2.81Å; K191-F194 VanDerWaalsContact O-N 3.16Å; G192-F194 PolarHBondContact O-N 2.82Å; F194-F196 HydrophobicContact CE1-CD1 4.14Å; F194-F196 HydrophobicContact CE1-CE1 4.15Å; F194-F196 HydrophobicContact CZ-CD1 4.22Å; F194-F196 HydrophobicContact CZ-CE1 4.36Å
195	H	84.5	Confident	80.7	Confident	73 Å²	73	52.5 Å²	52.5	34%	0.338	32%	0.324	S	S	.	.			trans	-155	125	178.1	-178.1	-85.3	0	0	0	111.2	H166 K184 G193	H166-H195 PolarHBondContact CE1-O 3.42Å; K184-H195 PolarHBondContact NZ-NE2 3.05Å; G193-H195 PolarHBondContact O-N 3.21Å
196	F	88.4	Confident	79.3	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	30%	0.303	C	S	.	.			trans	-119.8	154.3	166.5	66.9	-90.6	0	0	0	110.3	I146 T149 A150 C167 A168 V170 K184 Y188 F194	I146-F196 HydrophobicContact CG2-CE2 4.42Å; I146-F196 HydrophobicContact CG2-CZ 3.91Å; T149-F196 HydrophobicContact CG2-CB 3.73Å; T149-F196 HydrophobicContact CG2-CD1 4.26Å; T149-F196 HydrophobicContact CG2-CD2 3.31Å; T149-F196 HydrophobicContact CG2-CE2 3.9Å; T149-F196 HydrophobicContact CG2-CG 3.51Å; A150-F196 HydrophobicContact CB-CD1 4.39Å; A150-F196 HydrophobicContact CB-CE1 3.77Å; A150-F196 HydrophobicContact CB-CZ 4.36Å; C167-F196 WeakPolarHBondContact O-CB 3.15Å; A168-F196 CarbonylContact O-C 3.59Å; A168-F196 VanDerWaalsContact O-CA 3.32Å; A168-F196 WeakPolarHBondContact O-CA 3.32Å; V170-F196 HydrophobicContact CG1-CD2 4.44Å; V170-F196 HydrophobicContact CG1-CE2 4.16Å; K184-F196 HydrophobicContact CB-CE2 4.43Å; K184-F196 HydrophobicContact CB-CZ 4.21Å; K184-F196 HydrophobicContact CD-CD2 4.34Å; K184-F196 HydrophobicContact CD-CE2 3.94Å; K184-F196 HydrophobicContact CD-CZ 4.13Å; K184-F196 WeakPolarHBondContact CE-O 3.37Å; K184-F196 HydrophobicContact CG-CE1 4.23Å; K184-F196 HydrophobicContact CG-CE2 3.94Å; K184-F196 HydrophobicContact CG-CZ 3.66Å; K184-F196 PolarHBondContact NZ-O 2.92Å; Y188-F196 HydrophobicContact CD2-CE1 4.17Å; Y188-F196 HydrophobicContact CD2-CZ 4.17Å; Y188-F196 HydrophobicContact CG-CE1 4.12Å; F194-F196 HydrophobicContact CE1-CD1 4.14Å; F194-F196 HydrophobicContact CE1-CE1 4.15Å; F194-F196 HydrophobicContact CZ-CD1 4.22Å; F194-F196 HydrophobicContact CZ-CE1 4.36Å
197	R	90.2	Very high	77.7	Confident	69 Å²	69	51.8 Å²	51.8	26%	0.26	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	152.2	-177	-60.7	176.8	-171.2	-114.8	6	111.5	A168 A169 V170 N199 A223 E224 D313	A168-R197 PolarHBondContact O-N 2.94Å; A169-R197 CarbonylContact C-O 3.24Å; A169-R197 WeakPolarHBondContact CA-O 3.25Å; A169-R197 HydrophobicContact CB-CB 3.93Å; A169-R197 WeakPolarHBondContact CB-O 3.47Å; V170-R197 PolarHBondContact N-O 2.81Å; R197-N199 WeakPolarHBondContact CB-OD1 3.39Å; R197-A223 HydrophobicContact CB-CB 3.81Å; R197-A223 HydrophobicContact CG-CB 4.14Å; R197-E224 WeakPolarHBondContact CD-OE1 3.38Å; R197-E224 IonicContact CZ-OE1 3.15Å; R197-E224 IonicContact NE-OE1 3.34Å; R197-E224 PolarHBondContact NE-OE1 3.37Å; R197-E224 IonicContact NH1-OE1 3.14Å; R197-D313 IonicContact CZ-OD1 2.98Å; R197-D313 IonicContact NH2-OD1 3.77Å; R197-D313 PolarHBondContact NH2-OD1 2.94Å
198	V	89.1	Confident	76.3	Confident	3 Å²	3	55.3 Å²	55.3	2%	0.018	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	112.9	167.8	-174.2	0	0	0	0	106.1	V170 I172 L177 A180 V181 K184 A223	V170-V198 HydrophobicContact CG1-CB 4.21Å; V170-V198 HydrophobicContact CG1-CG1 4.04Å; V170-V198 HydrophobicContact CG1-CG2 3.93Å; I172-V198 HydrophobicContact CB-CG1 4.42Å; I172-V198 HydrophobicContact CG1-CG1 3.87Å; L177-V198 HydrophobicContact CD1-CG1 3.79Å; A180-V198 HydrophobicContact CB-CG1 4.02Å; V181-V198 HydrophobicContact CG2-CB 3.97Å; V181-V198 HydrophobicContact CG2-CG1 4.02Å; V181-V198 HydrophobicContact CG2-CG2 4.31Å; K184-V198 HydrophobicContact CB-CG2 4.17Å; K184-V198 HydrophobicContact CD-CG2 3.56Å; K184-V198 HydrophobicContact CG-CG2 4.42Å; V198-A223 WeakPolarHBondContact O-CB 3.28Å; V198-A223 PolarHBondContact O-N 3.47Å
199	N	88.5	Confident	74.9	Confident	0 Å²	0	63.2 Å²	63.2	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	158.5	-173.2	-66.9	-4.6	0	0	0	109.3	E129 A169 V170 Y171 I172 R197 E224	E129-N199 WeakPolarHBondContact OE1-CB 3.3Å; E129-N199 PolarHBondContact OE1-ND2 2.86Å; A169-N199 WeakPolarHBondContact CB-ND2 3.45Å; V170-N199 PolarHBondContact O-N 3.01Å; Y171-N199 CarbonylContact C-O 3.38Å; Y171-N199 WeakPolarHBondContact CA-O 3.47Å; Y171-N199 HydrophobicContact CD2-CB 3.86Å; I172-N199 PolarHBondContact N-O 3.49Å; R197-N199 WeakPolarHBondContact CB-OD1 3.39Å; N199-E224 WeakPolarHBondContact CA-O 3.37Å; N199-E224 HydrophobicContact CB-CB 4.32Å; N199-E224 VanDerWaalsContact ND2-CD 3.34Å; N199-E224 PolarHBondContact ND2-OE2 2.69Å; N199-E224 WeakPolarHBondContact OD1-CB 3.43Å; N199-E224 PolarHBondContact OD1-N 3.45Å
200	T	85.1	Confident	73.9	Confident	0 Å²	0	63 Å²	63	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	173.9	176.4	-160.4	0	0	0	0	112.4	I172 P174 L177 A217 A222 E224 I225 D226	I172-T200 WeakPolarHBondContact O-CA 3.24Å; I172-T200 WeakPolarHBondContact O-CB 3.26Å; I172-T200 PolarHBondContact O-OG1 3.47Å; P174-T200 WeakPolarHBondContact CA-OG1 3.4Å; P174-T200 WeakPolarHBondContact CD-OG1 3.37Å; P174-T200 WeakPolarHBondContact CG-OG1 3.33Å; L177-T200 HydrophobicContact CD2-CG2 4.02Å; T200-A217 HydrophobicContact CG2-CB 4.02Å; T200-A222 HydrophobicContact CG2-CB 4.12Å; T200-E224 PolarHBondContact N-O 3.49Å; T200-I225 HydrophobicContact CG2-CG1 4.19Å; T200-I225 HydrophobicContact CG2-CG2 4.2Å; T200-D226 PolarHBondContact O-N 3.04Å
201	T	81.1	Confident	73.5	Confident	30 Å²	30	63.8 Å²	63.8	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	140.1	177	-151.7	0	0	0	0	111.1	Y171 P174 D226	Y171-T201 HydrophobicContact CE1-CG2 4.33Å; Y171-T201 VanDerWaalsContact CZ-CB 3.47Å; Y171-T201 WeakPolarHBondContact OH-CB 3.29Å; Y171-T201 PolarHBondContact OH-OG1 3.12Å; P174-T201 WeakPolarHBondContact CG-O 3.28Å; T201-D226 CarbonylContact C-O 3.53Å; T201-D226 VanDerWaalsContact CA-O 3.23Å; T201-D226 WeakPolarHBondContact CA-O 3.27Å; T201-D226 PolarHBondContact OG1-O 3.16Å
202	L	72	Confident	73.3	Confident	16 Å²	16	60.7 Å²	60.7	8%	0.084	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	121.8	170.6	-71.1	174.4	0	0	0	109.9	P174 I204 Y213 L214 A217 I225 D226 V227 I228	P174-L202 HydrophobicContact CB-CD2 4.11Å; P174-L202 HydrophobicContact CG-CD2 3.65Å; P174-L202 HydrophobicContact CG-CG 4.39Å; L202-I204 HydrophobicContact CB-CG2 4.27Å; L202-I204 PolarHBondContact O-N 3.42Å; L202-Y213 VanDerWaalsContact CD1-C 3.45Å; L202-Y213 WeakPolarHBondContact CD1-O 3.41Å; L202-L214 HydrophobicContact CB-CD2 4.38Å; L202-L214 HydrophobicContact CD1-CD2 3.81Å; L202-A217 HydrophobicContact CD1-CB 3.77Å; L202-I225 HydrophobicContact CB-CG2 4.18Å; L202-I225 HydrophobicContact CD1-CG2 3.88Å; L202-I225 HydrophobicContact CG-CG2 4.11Å; L202-D226 PolarHBondContact N-O 2.9Å; L202-V227 CarbonylContact O-C 3.56Å; L202-V227 VanDerWaalsContact O-CA 3.27Å; L202-V227 WeakPolarHBondContact O-CA 3.47Å; L202-I228 PolarHBondContact O-N 3.25Å
203	T	65.9	Low	73.5	Confident	80 Å²	80	62.3 Å²	62.3	49%	0.491	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	118.2	165.9	-55.4	0	0	0	0	107.7	I228 L230	T203-I228 HydrophobicContact CG2-CB 4.29Å; T203-L230 HydrophobicContact CG2-CD1 4.36Å; T203-L230 HydrophobicContact CG2-CD2 4.22Å; T203-L230 HydrophobicContact CG2-CG 4.14Å
204	I	65.2	Low	73.9	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.036	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	129.3	178.6	71.2	177.2	0	0	0	110.4	L202 V206 L214 V227 I228 L230	L202-I204 HydrophobicContact CB-CG2 4.27Å; L202-I204 PolarHBondContact O-N 3.42Å; I204-V206 HydrophobicContact CD1-CG2 4.38Å; I204-V206 HydrophobicContact CG1-CG2 4.37Å; I204-L214 HydrophobicContact CD1-CD1 4.41Å; I204-L214 HydrophobicContact CG2-CD2 4.21Å; I204-L214 HydrophobicContact CG2-CG 4.39Å; I204-V227 HydrophobicContact CB-CG1 4.46Å; I204-V227 HydrophobicContact CD1-CG1 3.18Å; I204-V227 HydrophobicContact CG1-CG1 3.4Å; I204-V227 VanDerWaalsContact CG1-CG1 3.4Å; I204-V227 HydrophobicContact CG2-CG1 4.39Å; I204-I228 PolarHBondContact N-O 3.46Å; I204-I228 VanDerWaalsContact N-O 3.07Å; I204-L230 PolarHBondContact O-N 3.48Å
205	S	61	Low	74	Confident	12 Å²	12	62 Å²	62	8%	0.084	28%	0.279	C	S	.	.			trans	-84	108	158.4	179.3	0	0	0	0	107.5	R207 K208 R209	S205-R207 PolarHBondContact O-N 3.48Å; S205-K208 PolarHBondContact O-N 3.37Å; S205-K208 PolarHBondContact OG-N 3.04Å; S205-R209 PolarHBondContact O-N 3.19Å
206	V	59.6	Low	73.9	Confident	22 Å²	22	61.4 Å²	61.4	13%	0.133	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-37.6	175.9	-171.5	0	0	0	0	110	I204 K208 R209 F211 H234	I204-V206 HydrophobicContact CD1-CG2 4.38Å; I204-V206 HydrophobicContact CG1-CG2 4.37Å; V206-K208 PolarHBondContact O-N 3.33Å; V206-R209 PolarHBondContact O-N 3.11Å; V206-R209 VanDerWaalsContact O-N 3.07Å; V206-F211 HydrophobicContact CG1-CZ 4.33Å; V206-H234 HydrophobicContact CB-CB 4.43Å; V206-H234 HydrophobicContact CG1-CB 3.73Å
207	R	56.3	Low	73.8	Confident	156 Å²	156	61.6 Å²	61.6	59%	0.589	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.5	-44.9	173.6	-93.7	-170.4	-179.7	142.7	-9.3	113.6	S205 R209 E231	S205-R207 PolarHBondContact O-N 3.48Å; R207-R209 PolarHBondContact O-N 3.31Å; R207-E231 VanDerWaalsContact CD-OE1 3.23Å; R207-E231 WeakPolarHBondContact CD-OE1 3.47Å; R207-E231 WeakPolarHBondContact CD-OE2 3.39Å; R207-E231 WeakPolarHBondContact CG-OE2 3.06Å; R207-E231 IonicContact CZ-OE1 2.72Å; R207-E231 IonicContact CZ-OE2 3.52Å; R207-E231 IonicContact NE-OE1 2.78Å; R207-E231 IonicContact NE-OE2 2.88Å; R207-E231 PolarHBondContact NE-OE2 2.82Å; R207-E231 IonicContact NH1-OE1 3.38Å; R207-E231 PolarHBondContact NH1-OE1 2.85Å; R207-E231 IonicContact NH1-OE2 3.38Å
208	K	62.1	Low	73.6	Confident	165 Å²	165	59.1 Å²	59.1	72%	0.717	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	3.1	179.4	-64.4	-176.1	177.8	-178.5	0	113.1	S205 V206 M210	S205-K208 PolarHBondContact O-N 3.37Å; S205-K208 PolarHBondContact OG-N 3.04Å; V206-K208 PolarHBondContact O-N 3.33Å; K208-M210 HydrophobicContact CB-CG 3.89Å; K208-M210 HydrophobicContact CB-SD 4.28Å; K208-M210 HydrophobicContact CD-SD 4.5Å; K208-M210 PolarHBondContact O-N 2.88Å; K208-M210 VanDerWaalsContact O-N 3.15Å
209	R	59.3	Low	73.5	Confident	195 Å²	195	66.3 Å²	66.3	74%	0.736	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.2	43.5	-178.6	-61.7	-174	-179.3	-173.6	0.1	112.2	S205 V206 R207 F211	S205-R209 PolarHBondContact O-N 3.19Å; V206-R209 PolarHBondContact O-N 3.11Å; V206-R209 VanDerWaalsContact O-N 3.07Å; R207-R209 PolarHBondContact O-N 3.31Å; R209-F211 HydrophobicContact CB-CD2 3.92Å; R209-F211 HydrophobicContact CB-CE2 4.14Å; R209-F211 HydrophobicContact CG-CE2 4.28Å; R209-F211 PolarHBondContact O-N 3.24Å
210	M	63.7	Low	73.5	Confident	63 Å²	63	67.2 Å²	67.2	31%	0.31	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	38.9	179.2	-68.7	179.2	72	0	0	112.5	K208 D212 Y213	K208-M210 HydrophobicContact CB-CG 3.89Å; K208-M210 HydrophobicContact CB-SD 4.28Å; K208-M210 HydrophobicContact CD-SD 4.5Å; K208-M210 PolarHBondContact O-N 2.88Å; K208-M210 VanDerWaalsContact O-N 3.15Å; M210-D212 PolarHBondContact O-N 2.89Å; M210-Y213 HydrophobicContact CB-CD2 4.16Å; M210-Y213 HydrophobicContact CE-CD2 3.75Å; M210-Y213 HydrophobicContact CE-CE2 3.32Å; M210-Y213 PolarHBondContact O-N 3.45Å
211	F	72	Confident	73.8	Confident	89 Å²	89	68.6 Å²	68.6	39%	0.39	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-21.9	177.5	-64.8	-73.5	0	0	0	112.2	V206 R209 Y213 L214 H215	V206-F211 HydrophobicContact CG1-CZ 4.33Å; R209-F211 HydrophobicContact CB-CD2 3.92Å; R209-F211 HydrophobicContact CB-CE2 4.14Å; R209-F211 HydrophobicContact CG-CE2 4.28Å; R209-F211 PolarHBondContact O-N 3.24Å; F211-Y213 PolarHBondContact O-N 3.38Å; F211-L214 HydrophobicContact CD1-CD1 3.82Å; F211-L214 HydrophobicContact CE1-CD1 4.46Å; F211-L214 WeakPolarHBondContact O-CA 2.99Å; F211-L214 WeakPolarHBondContact O-CB 3.34Å; F211-L214 PolarHBondContact O-N 3.43Å; F211-H215 PolarHBondContact O-N 2.96Å
212	D	74.3	Confident	74.2	Confident	100 Å²	100	68 Å²	68	54%	0.535	32%	0.324	S	S	.	.	H	α-helix	trans	-54.1	-36.8	174.5	-66	-15.5	0	0	0	111.9	M210 H215 I216	M210-D212 PolarHBondContact O-N 2.89Å; D212-H215 PolarHBondContact O-N 3.2Å; D212-I216 VanDerWaalsContact O-CG1 3.23Å; D212-I216 WeakPolarHBondContact O-CG1 3.35Å; D212-I216 PolarHBondContact O-N 2.84Å
213	Y	76.3	Confident	75	Confident	124 Å²	124	68.5 Å²	68.5	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-68.1	-35.2	176.7	-72.1	-82.9	0	0	0	112.7	L202 M210 F211 H215 I216 A217	L202-Y213 VanDerWaalsContact CD1-C 3.45Å; L202-Y213 WeakPolarHBondContact CD1-O 3.41Å; M210-Y213 HydrophobicContact CB-CD2 4.16Å; M210-Y213 HydrophobicContact CE-CD2 3.75Å; M210-Y213 HydrophobicContact CE-CE2 3.32Å; M210-Y213 PolarHBondContact O-N 3.45Å; F211-Y213 PolarHBondContact O-N 3.38Å; Y213-H215 VanDerWaalsContact C-N 3.33Å; Y213-I216 PolarHBondContact O-N 2.88Å; Y213-A217 WeakPolarHBondContact O-CB 3.4Å; Y213-A217 PolarHBondContact O-N 3.25Å
214	L	79.1	Confident	76.1	Confident	6 Å²	6	65.1 Å²	65.1	3%	0.031	31%	0.309	C	S	.	.	H	α-helix	trans	-64.5	-43.4	174.3	-61.2	179.2	0	0	0	110.1	L202 I204 F211 A217 A218 I225 V227	L202-L214 HydrophobicContact CB-CD2 4.38Å; L202-L214 HydrophobicContact CD1-CD2 3.81Å; I204-L214 HydrophobicContact CD1-CD1 4.41Å; I204-L214 HydrophobicContact CG2-CD2 4.21Å; I204-L214 HydrophobicContact CG2-CG 4.39Å; F211-L214 HydrophobicContact CD1-CD1 3.82Å; F211-L214 HydrophobicContact CE1-CD1 4.46Å; F211-L214 WeakPolarHBondContact O-CA 2.99Å; F211-L214 WeakPolarHBondContact O-CB 3.34Å; F211-L214 PolarHBondContact O-N 3.43Å; L214-A217 PolarHBondContact O-N 3.22Å; L214-A218 WeakPolarHBondContact O-CB 3.28Å; L214-A218 PolarHBondContact O-N 2.93Å; L214-I225 HydrophobicContact CD2-CD1 4.4Å; L214-I225 HydrophobicContact CD2-CG2 3.9Å; L214-V227 HydrophobicContact CD2-CG2 3.76Å
215	H	79.6	Confident	77.1	Confident	92 Å²	92	65 Å²	65	43%	0.426	31%	0.308	S	S	.	.	H	α-helix	trans	-63.5	-44.6	176.4	-68	-29.5	0	0	0	111.9	D17 F211 D212 Y213 A217 A218 E219	D17-H215 IonicContact OD1-ND1 2.68Å; D17-H215 IonicContact OD2-CE1 2.84Å; F211-H215 PolarHBondContact O-N 2.96Å; D212-H215 PolarHBondContact O-N 3.2Å; Y213-H215 VanDerWaalsContact C-N 3.33Å; H215-A217 VanDerWaalsContact C-N 3.34Å; H215-A217 PolarHBondContact O-N 2.87Å; H215-A218 PolarHBondContact O-N 2.96Å; H215-E219 WeakPolarHBondContact O-CB 3.49Å; H215-E219 WeakPolarHBondContact O-CG 3.33Å; H215-E219 PolarHBondContact O-N 2.93Å
216	I	83	Confident	78.1	Confident	60 Å²	60	64.4 Å²	64.4	31%	0.308	30%	0.304	S	S	.	.	H	α-helix	trans	-59.5	-45.8	175.1	-68.5	163.6	0	0	0	110.5	D212 Y213 A218 E219 D220	D212-I216 VanDerWaalsContact O-CG1 3.23Å; D212-I216 WeakPolarHBondContact O-CG1 3.35Å; D212-I216 PolarHBondContact O-N 2.84Å; Y213-I216 PolarHBondContact O-N 2.88Å; I216-A218 VanDerWaalsContact C-N 3.32Å; I216-A218 PolarHBondContact O-N 3Å; I216-E219 PolarHBondContact O-N 3.35Å; I216-D220 VanDerWaalsContact O-CB 3.28Å; I216-D220 WeakPolarHBondContact O-CB 3.44Å; I216-D220 PolarHBondContact O-N 3.5Å
217	A	86.2	Confident	79	Confident	4 Å²	4	63.3 Å²	63.3	3%	0.033	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-37.4	177.7	0	0	0	0	0	112.4	L177 T200 L202 Y213 L214 H215 G221 A222 I225	L177-A217 HydrophobicContact CD2-CB 3.9Å; L177-A217 VanDerWaalsContact CD2-O 3.28Å; L177-A217 WeakPolarHBondContact CD2-O 3.34Å; T200-A217 HydrophobicContact CG2-CB 4.02Å; L202-A217 HydrophobicContact CD1-CB 3.77Å; Y213-A217 WeakPolarHBondContact O-CB 3.4Å; Y213-A217 PolarHBondContact O-N 3.25Å; L214-A217 PolarHBondContact O-N 3.22Å; H215-A217 VanDerWaalsContact C-N 3.34Å; H215-A217 PolarHBondContact O-N 2.87Å; A217-G221 PolarHBondContact O-N 2.84Å; A217-A222 HydrophobicContact CB-CB 4.38Å; A217-A222 VanDerWaalsContact O-CB 3.28Å; A217-A222 WeakPolarHBondContact O-CB 3.22Å; A217-A222 PolarHBondContact O-N 3.38Å; A217-I225 HydrophobicContact CB-CD1 3.74Å; A217-I225 HydrophobicContact CB-CG1 4.27Å
218	A	85.8	Confident	79.9	Confident	18 Å²	18	57.1 Å²	57.1	15%	0.149	28%	0.276	C	S	.	.	H	α-helix	trans	-66.4	-41.1	174.5	0	0	0	0	0	112.2	L214 H215 I216 G221	L214-A218 WeakPolarHBondContact O-CB 3.28Å; L214-A218 PolarHBondContact O-N 2.93Å; H215-A218 PolarHBondContact O-N 2.96Å; I216-A218 VanDerWaalsContact C-N 3.32Å; I216-A218 PolarHBondContact O-N 3Å; A218-G221 PolarHBondContact O-N 3.27Å; A218-G221 VanDerWaalsContact O-N 3.14Å
219	E	87.5	Confident	80.1	Confident	154 Å²	154	49.6 Å²	49.6	72%	0.72	24%	0.244	S	C	*	.	H	α-helix	trans	-64.9	-41.1	175	-74.4	-178.2	163.4	0	0	111.9	H215 I216 G221	H215-E219 WeakPolarHBondContact O-CB 3.49Å; H215-E219 WeakPolarHBondContact O-CG 3.33Å; H215-E219 PolarHBondContact O-N 2.93Å; I216-E219 PolarHBondContact O-N 3.35Å; E219-G221 PolarHBondContact O-N 3.06Å; E219-G221 VanDerWaalsContact O-N 3.16Å
220	D	89.3	Confident	80.3	Confident	18 Å²	18	45.6 Å²	45.6	10%	0.096	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-4.6	174.6	-70.6	-7.3	0	0	0	112.2	R55 L177 E178 I216	R55-D220 IonicContact CZ-OD1 3.9Å; R55-D220 IonicContact NH1-OD2 2.65Å; R55-D220 IonicContact NH2-OD1 2.71Å; R55-D220 PolarHBondContact NH2-OD1 2.88Å; R55-D220 IonicContact NH2-OD2 2.81Å; L177-D220 HydrophobicContact CB-CB 4.25Å; L177-D220 HydrophobicContact CD2-CB 3.75Å; L177-D220 HydrophobicContact CG-CB 3.96Å; E178-D220 HydrophobicContact CB-CB 3.96Å; I216-D220 VanDerWaalsContact O-CB 3.28Å; I216-D220 WeakPolarHBondContact O-CB 3.44Å; I216-D220 PolarHBondContact O-N 3.5Å
221	G	89.6	Confident	80.3	Confident	30 Å²	30	45 Å²	45	31%	0.309	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	91.3	23.8	169.4	0	0	0	0	0	115.5	V181 A217 A218 E219 A223	V181-G221 WeakPolarHBondContact CG2-O 3.47Å; A217-G221 PolarHBondContact O-N 2.84Å; A218-G221 PolarHBondContact O-N 3.27Å; A218-G221 VanDerWaalsContact O-N 3.14Å; E219-G221 PolarHBondContact O-N 3.06Å; E219-G221 VanDerWaalsContact O-N 3.16Å; G221-A223 PolarHBondContact O-N 3.08Å
222	A	90.1	Very high	79.7	Confident	16 Å²	16	45 Å²	45	13%	0.132	23%	0.233	C	C	.	.			trans	-54.1	130.5	170.9	0	0	0	0	0	111.1	L177 T200 A217 I225	L177-A222 HydrophobicContact CD1-CB 4.19Å; L177-A222 HydrophobicContact CD2-CB 3.62Å; L177-A222 HydrophobicContact CG-CB 4.46Å; T200-A222 HydrophobicContact CG2-CB 4.12Å; A217-A222 HydrophobicContact CB-CB 4.38Å; A217-A222 VanDerWaalsContact O-CB 3.28Å; A217-A222 WeakPolarHBondContact O-CB 3.22Å; A217-A222 PolarHBondContact O-N 3.38Å; A222-I225 HydrophobicContact CB-CD1 4.35Å; A222-I225 HydrophobicContact CB-CG1 3.77Å
223	A	89.5	Confident	78.9	Confident	27 Å²	27	46.9 Å²	46.9	22%	0.223	23%	0.233	C	C	.	.	S	Bend	trans	-83.1	-31.6	173.5	0	0	0	0	0	112.3	H18 R197 V198 G221	H18-A223 PolarHBondContact CD2-O 3.04Å; R197-A223 HydrophobicContact CB-CB 3.81Å; R197-A223 HydrophobicContact CG-CB 4.14Å; V198-A223 WeakPolarHBondContact O-CB 3.28Å; V198-A223 PolarHBondContact O-N 3.47Å; G221-A223 PolarHBondContact O-N 3.08Å
224	E	88.4	Confident	77.7	Confident	9 Å²	9	46.1 Å²	46.1	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	143.4	172.9	-55.2	168.7	-166.4	0	0	108.2	R197 N199 T200 K283 R316	R197-E224 WeakPolarHBondContact CD-OE1 3.38Å; R197-E224 IonicContact CZ-OE1 3.15Å; R197-E224 IonicContact NE-OE1 3.34Å; R197-E224 PolarHBondContact NE-OE1 3.37Å; R197-E224 IonicContact NH1-OE1 3.14Å; N199-E224 WeakPolarHBondContact CA-O 3.37Å; N199-E224 HydrophobicContact CB-CB 4.32Å; N199-E224 VanDerWaalsContact ND2-CD 3.34Å; N199-E224 PolarHBondContact ND2-OE2 2.69Å; N199-E224 WeakPolarHBondContact OD1-CB 3.43Å; N199-E224 PolarHBondContact OD1-N 3.45Å; T200-E224 PolarHBondContact N-O 3.49Å; E224-K283 VanDerWaalsContact OE2-CE 3.3Å; E224-K283 WeakPolarHBondContact OE2-CE 3.3Å; E224-K283 IonicContact OE2-NZ 3.77Å; E224-K283 PolarHBondContact OE2-NZ 3.05Å; E224-R316 IonicContact OE1-CZ 3.75Å; E224-R316 IonicContact OE1-NH1 2.76Å; E224-R316 IonicContact OE1-NH2 3.78Å; E224-R316 PolarHBondContact OE1-NH2 3.42Å; E224-R316 IonicContact OE2-NH1 2.63Å
225	I	86.2	Confident	76.6	Confident	4 Å²	4	47.9 Å²	47.9	2%	0.021	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	120.9	176.5	-51.9	171	0	0	0	108.6	H18 V20 T200 L202 L214 A217 A222 V227	H18-I225 WeakPolarHBondContact O-CB 3.43Å; V20-I225 PolarHBondContact N-O 3.05Å; T200-I225 HydrophobicContact CG2-CG1 4.19Å; T200-I225 HydrophobicContact CG2-CG2 4.2Å; L202-I225 HydrophobicContact CB-CG2 4.18Å; L202-I225 HydrophobicContact CD1-CG2 3.88Å; L202-I225 HydrophobicContact CG-CG2 4.11Å; L214-I225 HydrophobicContact CD2-CD1 4.4Å; L214-I225 HydrophobicContact CD2-CG2 3.9Å; A217-I225 HydrophobicContact CB-CD1 3.74Å; A217-I225 HydrophobicContact CB-CG1 4.27Å; A222-I225 HydrophobicContact CB-CD1 4.35Å; A222-I225 HydrophobicContact CB-CG1 3.77Å; I225-V227 HydrophobicContact CG2-CG2 4.04Å
226	D	82.5	Confident	75.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	113.5	171.2	-75.2	21.6	0	0	0	110	V20 Y171 T200 T201 L202 R247 K283	V20-D226 HydrophobicContact CB-CB 4.42Å; V20-D226 HydrophobicContact CG1-CB 4.43Å; V20-D226 WeakPolarHBondContact CG1-OD1 3.29Å; V20-D226 CarbonylContact O-C 3.34Å; Y171-D226 HydrophobicContact CE2-CB 3.84Å; Y171-D226 WeakPolarHBondContact CE2-OD2 3.34Å; Y171-D226 WeakPolarHBondContact OH-CB 3.45Å; Y171-D226 PolarHBondContact OH-OD2 2.68Å; T200-D226 PolarHBondContact O-N 3.04Å; T201-D226 CarbonylContact C-O 3.53Å; T201-D226 VanDerWaalsContact CA-O 3.23Å; T201-D226 WeakPolarHBondContact CA-O 3.27Å; T201-D226 PolarHBondContact OG1-O 3.16Å; L202-D226 PolarHBondContact N-O 2.9Å; D226-R247 VanDerWaalsContact OD2-CD 3.27Å; D226-R247 WeakPolarHBondContact OD2-CD 3.15Å; D226-R247 IonicContact OD2-CZ 3.57Å; D226-R247 IonicContact OD2-NE 3.71Å; D226-R247 PolarHBondContact OD2-NE 3.29Å; D226-R247 IonicContact OD2-NH1 2.79Å; D226-R247 PolarHBondContact OD2-NH1 3.43Å; D226-R247 IonicContact OD2-NH2 3.84Å; D226-K283 IonicContact OD1-NZ 3.73Å; D226-K283 PolarHBondContact OD1-NZ 3.36Å; D226-K283 IonicContact OD2-NZ 3.9Å
227	V	78.4	Confident	74.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	119.9	-173.4	176.8	0	0	0	0	110	V19 V20 I21 L22 L202 I204 L214 I225 P229	V19-V227 HydrophobicContact CB-CG2 4.12Å; V19-V227 HydrophobicContact CG1-CB 3.76Å; V19-V227 HydrophobicContact CG1-CG1 3.99Å; V19-V227 HydrophobicContact CG1-CG2 3.81Å; V19-V227 HydrophobicContact CG2-CG2 4.18Å; V20-V227 CarbonylContact C-O 3.48Å; V20-V227 CarbonylContact O-C 3.58Å; V20-V227 WeakPolarHBondContact O-CA 3.38Å; V20-V227 PolarHBondContact O-N 3.43Å; I21-V227 VanDerWaalsContact CA-O 3.22Å; I21-V227 WeakPolarHBondContact CA-O 3.35Å; L22-V227 PolarHBondContact N-O 2.97Å; L202-V227 CarbonylContact O-C 3.56Å; L202-V227 VanDerWaalsContact O-CA 3.27Å; L202-V227 WeakPolarHBondContact O-CA 3.47Å; I204-V227 HydrophobicContact CB-CG1 4.46Å; I204-V227 HydrophobicContact CD1-CG1 3.18Å; I204-V227 HydrophobicContact CG1-CG1 3.4Å; I204-V227 VanDerWaalsContact CG1-CG1 3.4Å; I204-V227 HydrophobicContact CG2-CG1 4.39Å; L214-V227 HydrophobicContact CD2-CG2 3.76Å; I225-V227 HydrophobicContact CG2-CG2 4.04Å; V227-P229 WeakPolarHBondContact O-CD 3.34Å
228	I	74.7	Confident	72.6	Confident	26 Å²	26	55.4 Å²	55.4	13%	0.133	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	101.8	173.2	-42	-166.2	0	0	0	107.6	L22 L202 T203 I204 L230	L22-I228 HydrophobicContact CB-CB 4.42Å; L22-I228 HydrophobicContact CB-CD1 4.24Å; L22-I228 HydrophobicContact CB-CG1 3.92Å; L22-I228 HydrophobicContact CB-CG2 4.21Å; L22-I228 HydrophobicContact CD1-CD1 3.89Å; L22-I228 HydrophobicContact CD1-CG1 3.95Å; L202-I228 PolarHBondContact O-N 3.25Å; T203-I228 HydrophobicContact CG2-CB 4.29Å; I204-I228 PolarHBondContact N-O 3.46Å; I204-I228 VanDerWaalsContact N-O 3.07Å; I228-L230 PolarHBondContact O-N 3.49Å
229	P	67	Low	71.1	Confident	7 Å²	7	60.4 Å²	60.4	5%	0.045	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	124.1	176.9	30.7	-33.2	0	0	0	108.9	I21 V227 E231 F232 L235	I21-P229 HydrophobicContact CB-CG 4.33Å; I21-P229 HydrophobicContact CG1-CG 4.15Å; I21-P229 HydrophobicContact CG2-CG 3.47Å; I21-P229 VanDerWaalsContact CG2-CG 3.47Å; V227-P229 WeakPolarHBondContact O-CD 3.34Å; P229-E231 PolarHBondContact O-N 2.87Å; P229-F232 HydrophobicContact CG-CD1 4.34Å; P229-F232 HydrophobicContact CG-CD2 4.47Å; P229-F232 HydrophobicContact CG-CE1 4.1Å; P229-F232 HydrophobicContact CG-CE2 4.21Å; P229-F232 HydrophobicContact CG-CZ 4.01Å; P229-L235 HydrophobicContact CB-CD1 4.02Å; P229-L235 HydrophobicContact CG-CD1 4.05Å
230	L	64	Low	69.4	Low	111 Å²	111	54.6 Å²	54.6	58%	0.581	28%	0.279	S	S	*	.	S	Bend	trans	-69.6	-21.4	170.1	-70.8	168.4	0	0	0	112.1	T203 I204 I228	T203-L230 HydrophobicContact CG2-CD1 4.36Å; T203-L230 HydrophobicContact CG2-CD2 4.22Å; T203-L230 HydrophobicContact CG2-CG 4.14Å; I204-L230 PolarHBondContact O-N 3.48Å; I228-L230 PolarHBondContact O-N 3.49Å
231	E	63.6	Low	67.8	Low	49 Å²	49	62.1 Å²	62.1	23%	0.229	31%	0.31	C	S	.	.			trans	-141.1	119.9	179.6	-65.3	174.3	-159.7	0	0	109.5	R207 P229 R233	R207-E231 VanDerWaalsContact CD-OE1 3.23Å; R207-E231 WeakPolarHBondContact CD-OE1 3.47Å; R207-E231 WeakPolarHBondContact CD-OE2 3.39Å; R207-E231 WeakPolarHBondContact CG-OE2 3.06Å; R207-E231 IonicContact CZ-OE1 2.72Å; R207-E231 IonicContact CZ-OE2 3.52Å; R207-E231 IonicContact NE-OE1 2.78Å; R207-E231 IonicContact NE-OE2 2.88Å; R207-E231 PolarHBondContact NE-OE2 2.82Å; R207-E231 IonicContact NH1-OE1 3.38Å; R207-E231 PolarHBondContact NH1-OE1 2.85Å; R207-E231 IonicContact NH1-OE2 3.38Å; P229-E231 PolarHBondContact O-N 2.87Å; E231-R233 VanDerWaalsContact C-N 3.35Å; E231-R233 PolarHBondContact O-N 3.11Å
232	F	58.7	Low	66.3	Low	89 Å²	89	61.7 Å²	61.7	39%	0.39	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-76.5	-17.5	-176.2	-82.5	-95.3	0	0	0	114.4	I21 P229 H234	I21-F232 HydrophobicContact CG2-CD1 4.29Å; I21-F232 HydrophobicContact CG2-CE1 3.32Å; I21-F232 HydrophobicContact CG2-CZ 3.65Å; P229-F232 HydrophobicContact CG-CD1 4.34Å; P229-F232 HydrophobicContact CG-CD2 4.47Å; P229-F232 HydrophobicContact CG-CE1 4.1Å; P229-F232 HydrophobicContact CG-CE2 4.21Å; P229-F232 HydrophobicContact CG-CZ 4.01Å; F232-H234 PolarHBondContact O-N 2.93Å
233	R	56.5	Low	65.1	Low	140 Å²	140	66.1 Å²	66.1	53%	0.528	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-69.2	-5.4	-168.2	-58.5	-172.1	-157.9	161.1	11.6	115	E231	E231-R233 VanDerWaalsContact C-N 3.35Å; E231-R233 PolarHBondContact O-N 3.11Å
234	H	52.6	Low	64.6	Low	109 Å²	109	65.8 Å²	65.8	51%	0.505	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-125.4	15.9	-167.5	-62.4	-44.2	0	0	0	114.5	V206 F232 D236	V206-H234 HydrophobicContact CB-CB 4.43Å; V206-H234 HydrophobicContact CG1-CB 3.73Å; F232-H234 PolarHBondContact O-N 2.93Å; H234-D236 PolarHBondContact O-N 3.14Å
235	L	55.4	Low	64.5	Low	42 Å²	42	65.9 Å²	65.9	22%	0.22	32%	0.315	C	S	.	.			trans	-88.4	105.4	175.2	-74.2	154.2	0	0	0	109.8	V19 I21 P229 Y237	V19-L235 HydrophobicContact CG1-CD2 4.35Å; I21-L235 HydrophobicContact CD1-CD1 3.36Å; I21-L235 HydrophobicContact CD1-CD2 4.25Å; I21-L235 HydrophobicContact CD1-CG 4.32Å; I21-L235 HydrophobicContact CG1-CD1 3.93Å; P229-L235 HydrophobicContact CB-CD1 4.02Å; P229-L235 HydrophobicContact CG-CD1 4.05Å; L235-Y237 HydrophobicContact CB-CD2 4.41Å; L235-Y237 HydrophobicContact CB-CE2 3.89Å; L235-Y237 VanDerWaalsContact O-CD2 3.29Å; L235-Y237 WeakPolarHBondContact O-CD2 3.42Å; L235-Y237 PolarHBondContact O-N 3.33Å
236	D	57.3	Low	64.5	Low	89 Å²	89	68.5 Å²	68.5	48%	0.476	33%	0.33	S	S	.	.			trans	-78.2	103.6	169.1	179.5	7.2	0	0	0	109.3	H234 D238 N239	H234-D236 PolarHBondContact O-N 3.14Å; D236-D238 PolarHBondContact OD1-N 3.21Å; D236-N239 PolarHBondContact OD2-ND2 3.31Å
237	Y	54.6	Low	64.8	Low	98 Å²	98	68.6 Å²	68.6	38%	0.384	33%	0.331	S	S	.	.			trans	-78.4	-20.1	-179.7	-72	-86	0	0	0	113.1	I21 L235 N239 R278	I21-Y237 HydrophobicContact CD1-CE1 4.07Å; I21-Y237 WeakPolarHBondContact CD1-OH 3.46Å; L235-Y237 HydrophobicContact CB-CD2 4.41Å; L235-Y237 HydrophobicContact CB-CE2 3.89Å; L235-Y237 VanDerWaalsContact O-CD2 3.29Å; L235-Y237 WeakPolarHBondContact O-CD2 3.42Å; L235-Y237 PolarHBondContact O-N 3.33Å; Y237-N239 VanDerWaalsContact C-N 3.28Å; Y237-N239 PolarHBondContact O-N 2.95Å; Y237-R278 PolarHBondContact O-NH1 3.36Å
238	D	53.9	Low	65.2	Low	128 Å²	128	69.7 Å²	69.7	68%	0.684	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-25.9	-169.8	-69.7	-24.1	0	0	0	112	D236	D236-D238 PolarHBondContact OD1-N 3.21Å
239	N	52.4	Low	65.6	Low	123 Å²	123	70.1 Å²	70.1	66%	0.658	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-7.6	-173.4	-79.4	-51.3	0	0	0	115.8	D236 Y237 K241	D236-N239 PolarHBondContact OD2-ND2 3.31Å; Y237-N239 VanDerWaalsContact C-N 3.28Å; Y237-N239 PolarHBondContact O-N 2.95Å; N239-K241 PolarHBondContact O-N 3.4Å
240	V	53.6	Low	66.1	Low	32 Å²	32	71 Å²	71	19%	0.194	35%	0.349	C	S	.	.			trans	-75.1	122.9	176.6	-175.6	0	0	0	0	107.7	S242 Q244 R278	V240-S242 WeakPolarHBondContact CG1-OG 3.32Å; V240-Q244 HydrophobicContact CG1-CG 3.94Å; V240-R278 PolarHBondContact O-NH1 3.32Å; V240-R278 PolarHBondContact O-NH2 3.33Å
241	K	54.4	Low	66.8	Low	175 Å²	175	68 Å²	68	76%	0.761	34%	0.335	S	S	*	.			trans	-94.9	-11.5	176.6	-68.8	-172.5	178.7	-175.7	0	114	N239	N239-K241 PolarHBondContact O-N 3.4Å
242	S	59.5	Low	67.4	Low	21 Å²	21	72.5 Å²	72.5	15%	0.147	35%	0.354	C	S	.	.	S	Bend	trans	-89.1	164.5	-172.3	56.5	0	0	0	0	112.7	D17 V240 Q244 R278	D17-S242 PolarHBondContact O-OG 2.92Å; D17-S242 VanDerWaalsContact O-OG 3.13Å; V240-S242 WeakPolarHBondContact CG1-OG 3.32Å; S242-Q244 PolarHBondContact O-N 3.43Å; S242-R278 PolarHBondContact O-NH2 3.39Å
243	H	63.2	Low	68.3	Low	110 Å²	110	74 Å²	74	51%	0.509	37%	0.365	S	S	.	.			trans	-64.7	125.4	171.5	-78.6	71.2	0	0	0	109.1	F314	H243-F314 AromaticContact CD2-CE1 3.34Å; H243-F314 WeakPolarHBondContact CD2-CE1 3.12Å; H243-F314 AromaticContact CD2-CZ 3.99Å; H243-F314 AromaticContact NE2-CE1 3.44Å; H243-F314 WeakPolarHBondContact NE2-CE1 2.95Å; H243-F314 AromaticContact NE2-CZ 3.64Å
244	Q	79.2	Confident	69.7	Low	20 Å²	20	69.8 Å²	69.8	9%	0.093	36%	0.357	C	S	.	.			trans	-108.5	151	179.7	-69.7	172.3	-45	0	0	109.3	V240 S242 P280 G281	V240-Q244 HydrophobicContact CG1-CG 3.94Å; S242-Q244 PolarHBondContact O-N 3.43Å; Q244-P280 CarbonylContact O-C 3.39Å; Q244-P280 VanDerWaalsContact O-CA 3.26Å; Q244-P280 WeakPolarHBondContact O-CA 3.47Å; Q244-G281 PolarHBondContact O-N 3.44Å
245	F	86.2	Confident	71.5	Confident	11 Å²	11	66.5 Å²	66.5	5%	0.048	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	149.5	166.8	-75.7	-103.3	0	0	0	109.7	V20 G281 K283 D313 R316	V20-F245 HydrophobicContact CB-CB 4.4Å; V20-F245 HydrophobicContact CG1-CB 3.84Å; V20-F245 WeakPolarHBondContact CG1-O 3.34Å; V20-F245 HydrophobicContact CG2-CB 3.78Å; F245-G281 CarbonylContact C-O 3.42Å; F245-G281 VanDerWaalsContact CA-O 3.24Å; F245-G281 WeakPolarHBondContact CA-O 3.42Å; F245-K283 HydrophobicContact CB-CD 4.3Å; F245-K283 HydrophobicContact CB-CG 3.82Å; F245-K283 HydrophobicContact CD1-CB 4.46Å; F245-K283 HydrophobicContact CD1-CD 4.23Å; F245-K283 HydrophobicContact CD1-CG 3.3Å; F245-K283 HydrophobicContact CE1-CG 3.98Å; F245-K283 HydrophobicContact CG-CD 4.26Å; F245-K283 HydrophobicContact CG-CG 3.73Å; F245-D313 WeakPolarHBondContact CZ-O 3.27Å; F245-R316 HydrophobicContact CE1-CG 4.01Å; F245-R316 HydrophobicContact CZ-CG 4.26Å
246	V	87.1	Confident	73.1	Confident	58 Å²	58	67.8 Å²	67.8	35%	0.352	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.1	153.8	145.3	0	0	0	0	107.3	L248 A265 G281 V282 K283	V246-L248 HydrophobicContact CG1-CD1 4.07Å; V246-A265 HydrophobicContact CG1-CB 4.22Å; V246-G281 PolarHBondContact N-O 3.04Å; V246-V282 CarbonylContact O-C 3.45Å; V246-V282 WeakPolarHBondContact O-CA 3.3Å; V246-K283 PolarHBondContact O-N 3.24Å
247	R	87.5	Confident	74.6	Confident	3 Å²	3	67 Å²	67	1%	0.011	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.6	173.7	-176	178.7	-104.5	-169.7	-5.5	110.2	V20 I21 L22 E129 Y171 D226 K283	V20-R247 HydrophobicContact CG1-CB 4.04Å; I21-R247 PolarHBondContact O-N 2.94Å; L22-R247 HydrophobicContact CD2-CB 3.57Å; L22-R247 HydrophobicContact CD2-CG 3.41Å; L22-R247 VanDerWaalsContact CD2-CG 3.41Å; L22-R247 HydrophobicContact CG-CB 4.01Å; L22-R247 HydrophobicContact CG-CG 4.2Å; E129-R247 IonicContact OE1-NH2 3.94Å; E129-R247 IonicContact OE2-CZ 3.54Å; E129-R247 IonicContact OE2-NH2 3.01Å; E129-R247 PolarHBondContact OE2-NH2 2.95Å; Y171-R247 VanDerWaalsContact CE2-NH1 3.28Å; Y171-R247 PolarHBondContact OH-NH1 2.7Å; D226-R247 VanDerWaalsContact OD2-CD 3.27Å; D226-R247 WeakPolarHBondContact OD2-CD 3.15Å; D226-R247 IonicContact OD2-CZ 3.57Å; D226-R247 IonicContact OD2-NE 3.71Å; D226-R247 PolarHBondContact OD2-NE 3.29Å; D226-R247 IonicContact OD2-NH1 2.79Å; D226-R247 PolarHBondContact OD2-NH1 3.43Å; D226-R247 IonicContact OD2-NH2 3.84Å; R247-K283 CarbonylContact C-O 3.58Å; R247-K283 VanDerWaalsContact CA-O 3.3Å; R247-K283 WeakPolarHBondContact CA-O 3.41Å; R247-K283 HydrophobicContact CB-CB 3.89Å; R247-K283 HydrophobicContact CG-CB 3.75Å
248	L	86.9	Confident	76.4	Confident	23 Å²	23	62.4 Å²	62.4	12%	0.12	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133.6	172	-60.4	98.6	0	0	0	109.6	V246 D261 L262 A265 V282 K283 M284 G285	V246-L248 HydrophobicContact CG1-CD1 4.07Å; L248-D261 HydrophobicContact CD2-CB 4.06Å; L248-D261 WeakPolarHBondContact CD2-O 3.41Å; L248-L262 HydrophobicContact CD1-CD1 4.37Å; L248-A265 HydrophobicContact CD1-CB 3.41Å; L248-A265 VanDerWaalsContact CD1-CB 3.41Å; L248-A265 HydrophobicContact CD2-CB 3.73Å; L248-A265 HydrophobicContact CG-CB 4.02Å; L248-V282 HydrophobicContact CD1-CG1 3.64Å; L248-K283 PolarHBondContact N-O 3.1Å; L248-M284 HydrophobicContact CB-SD 3.95Å; L248-G285 PolarHBondContact O-N 2.97Å
249	P	83.1	Confident	78.2	Confident	34 Å²	34	56.3 Å²	56.3	22%	0.221	29%	0.287	C	S	.	.			trans	-68.9	141.8	168.2	30.4	-33.4	0	0	0	109.7	P23 T251	P23-P249 HydrophobicContact CG-CG 4.01Å; P249-T251 PolarHBondContact O-N 3.06Å
250	A	79.3	Confident	80.1	Confident	27 Å²	27	52.1 Å²	52.1	22%	0.223	26%	0.263	C	S	.	.			trans	-82.6	115.1	163.8	0	0	0	0	0	108.4	M284 I288	A250-M284 HydrophobicContact CB-CE 4.02Å; A250-I288 HydrophobicContact CB-CD1 3.27Å
251	T	77.5	Confident	81.8	Confident	46 Å²	46	52.8 Å²	52.8	28%	0.282	27%	0.266	S	S	.	.			trans	-78.5	155.9	178.6	72.6	0	0	0	0	110.5	P249 I253 N258	P249-T251 PolarHBondContact O-N 3.06Å; T251-I253 PolarHBondContact O-N 2.89Å; T251-I253 PolarHBondContact OG1-N 2.8Å; T251-N258 PolarHBondContact N-OD1 2.81Å; T251-N258 PolarHBondContact O-ND2 2.89Å; T251-N258 PolarHBondContact OG1-OD1 3.34Å
252	K	77.6	Confident	83.7	Confident	144 Å²	144	44.5 Å²	44.5	63%	0.626	23%	0.229	S	C	*	.	S	Bend	trans	-75.5	3.3	173.3	-64.2	-179.5	-176.6	173.2	0	113.2
253	I	76.2	Confident	85.4	Confident	121 Å²	121	44.7 Å²	44.7	62%	0.621	23%	0.227	S	C	*	.	S	Bend	trans	-70.5	-62.9	-172.8	-60.5	173.6	0	0	0	110.6	T251 K257	T251-I253 PolarHBondContact O-N 2.89Å; T251-I253 PolarHBondContact OG1-N 2.8Å; I253-K257 HydrophobicContact CB-CG 4.37Å; I253-K257 HydrophobicContact CD1-CG 4.44Å; I253-K257 HydrophobicContact CG2-CB 4.27Å; I253-K257 HydrophobicContact CG2-CG 4.32Å
254	S	87	Confident	86.7	Confident	51 Å²	51	41 Å²	41	36%	0.357	22%	0.216	S	C	.	.			trans	-169.6	155.1	174.7	63	0	0	0	0	111.5	Y256 K257 N258	S254-Y256 PolarHBondContact O-N 2.81Å; S254-K257 PolarHBondContact O-N 3.18Å; S254-K257 VanDerWaalsContact OG-CB 3.32Å; S254-K257 WeakPolarHBondContact OG-CB 3.33Å; S254-K257 PolarHBondContact OG-N 2.86Å; S254-N258 VanDerWaalsContact O-CG 3.3Å; S254-N258 PolarHBondContact O-N 2.63Å; S254-N258 VanDerWaalsContact O-N 3.07Å; S254-N258 PolarHBondContact O-ND2 3.28Å
255	L	89.5	Confident	87.2	Confident	40 Å²	40	40.7 Å²	40.7	21%	0.209	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-39.8	168.6	176.4	56.9	0	0	0	111.6	L106 N258 L259 E293 A296 Y297	L106-L255 HydrophobicContact CD2-CD2 3.74Å; L106-L255 HydrophobicContact CD2-CG 4.25Å; L255-N258 PolarHBondContact O-N 2.92Å; L255-L259 HydrophobicContact CD1-CD1 4.13Å; L255-L259 HydrophobicContact CD1-CG 4.01Å; L255-L259 HydrophobicContact CG-CD1 3.99Å; L255-L259 HydrophobicContact CG-CG 4.35Å; L255-L259 WeakPolarHBondContact O-CB 3.21Å; L255-L259 VanDerWaalsContact O-CG 3.27Å; L255-L259 WeakPolarHBondContact O-CG 3.15Å; L255-L259 PolarHBondContact O-N 3.05Å; L255-E293 HydrophobicContact CD1-CB 4.37Å; L255-E293 HydrophobicContact CD1-CG 4.18Å; L255-E293 HydrophobicContact CD2-CG 4.38Å; L255-A296 HydrophobicContact CD1-CB 4.14Å; L255-A296 HydrophobicContact CD2-CB 4.22Å; L255-Y297 HydrophobicContact CD1-CD1 4.36Å; L255-Y297 HydrophobicContact CD1-CE1 3.58Å; L255-Y297 HydrophobicContact CD1-CE2 4.3Å; L255-Y297 WeakPolarHBondContact CD1-OH 3.28Å
256	Y	89.4	Confident	87.6	Confident	69 Å²	69	40.1 Å²	40.1	27%	0.271	21%	0.214	S	C	.	.	H	α-helix	trans	-61.8	-46.3	179.7	-176.5	-102	0	0	0	112.9	S99 A102 K103 L106 S254 L259 K260	S99-Y256 VanDerWaalsContact CA-OH 3.3Å; S99-Y256 WeakPolarHBondContact CA-OH 3.46Å; S99-Y256 WeakPolarHBondContact CB-OH 3.32Å; S99-Y256 PolarHBondContact OG-OH 2.76Å; S99-Y256 VanDerWaalsContact OG-OH 3.13Å; A102-Y256 HydrophobicContact CB-CD2 3.76Å; A102-Y256 HydrophobicContact CB-CE2 3.59Å; K103-Y256 HydrophobicContact CG-CE2 3.95Å; L106-Y256 HydrophobicContact CD1-CD2 3.94Å; S254-Y256 PolarHBondContact O-N 2.81Å; Y256-L259 PolarHBondContact O-N 2.76Å; Y256-K260 HydrophobicContact CD1-CD 4.2Å; Y256-K260 HydrophobicContact CE1-CD 3.76Å; Y256-K260 HydrophobicContact CE1-CG 4.49Å; Y256-K260 PolarHBondContact O-N 2.95Å
257	K	89.1	Confident	87.8	Confident	72 Å²	72	38.7 Å²	38.7	31%	0.313	21%	0.207	S	C	.	.	H	α-helix	trans	-58.1	-51.3	173.5	173.2	82.7	177	69.4	0	110.5	I253 S254 L259 K260 D261	I253-K257 HydrophobicContact CB-CG 4.37Å; I253-K257 HydrophobicContact CD1-CG 4.44Å; I253-K257 HydrophobicContact CG2-CB 4.27Å; I253-K257 HydrophobicContact CG2-CG 4.32Å; S254-K257 PolarHBondContact O-N 3.18Å; S254-K257 VanDerWaalsContact OG-CB 3.32Å; S254-K257 WeakPolarHBondContact OG-CB 3.33Å; S254-K257 PolarHBondContact OG-N 2.86Å; K257-L259 VanDerWaalsContact C-N 3.27Å; K257-L259 PolarHBondContact O-N 3.01Å; K257-K260 WeakPolarHBondContact O-CB 3.32Å; K257-K260 PolarHBondContact O-N 2.85Å; K257-D261 IonicContact NZ-OD1 3.35Å; K257-D261 PolarHBondContact NZ-OD1 2.88Å; K257-D261 IonicContact NZ-OD2 3.59Å; K257-D261 PolarHBondContact NZ-OD2 3.33Å; K257-D261 PolarHBondContact O-N 3.29Å
258	N	91.3	Very high	87.9	Confident	3 Å²	3	41.2 Å²	41.2	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-61.2	-35.3	-178.5	-69.7	-17.9	0	0	0	112.4	T251 S254 L255 D261 L262 M284 Y297	T251-N258 PolarHBondContact N-OD1 2.81Å; T251-N258 PolarHBondContact O-ND2 2.89Å; T251-N258 PolarHBondContact OG1-OD1 3.34Å; S254-N258 VanDerWaalsContact O-CG 3.3Å; S254-N258 PolarHBondContact O-N 2.63Å; S254-N258 VanDerWaalsContact O-N 3.07Å; S254-N258 PolarHBondContact O-ND2 3.28Å; L255-N258 PolarHBondContact O-N 2.92Å; N258-D261 PolarHBondContact O-N 3.4Å; N258-L262 WeakPolarHBondContact O-CB 3.45Å; N258-L262 PolarHBondContact O-N 2.8Å; N258-M284 HydrophobicContact CB-CE 3.67Å; N258-Y297 HydrophobicContact CB-CE1 3.71Å; N258-Y297 VanDerWaalsContact CB-OH 3.25Å; N258-Y297 WeakPolarHBondContact CB-OH 3.33Å; N258-Y297 PolarHBondContact ND2-OH 3.47Å; N258-Y297 VanDerWaalsContact ND2-OH 3.16Å
259	L	92.9	Very high	88	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-36.5	173.5	-75.2	169.7	0	0	0	112.5	A102 L106 L255 Y256 K257 Y263 A296 Y297 M300	A102-L259 HydrophobicContact CB-CB 3.88Å; A102-L259 HydrophobicContact CB-CD1 4.33Å; L106-L259 HydrophobicContact CD1-CD1 4.39Å; L106-L259 HydrophobicContact CD2-CD1 4Å; L106-L259 HydrophobicContact CG-CD1 4.02Å; L255-L259 HydrophobicContact CD1-CD1 4.13Å; L255-L259 HydrophobicContact CD1-CG 4.01Å; L255-L259 HydrophobicContact CG-CD1 3.99Å; L255-L259 HydrophobicContact CG-CG 4.35Å; L255-L259 WeakPolarHBondContact O-CB 3.21Å; L255-L259 VanDerWaalsContact O-CG 3.27Å; L255-L259 WeakPolarHBondContact O-CG 3.15Å; L255-L259 PolarHBondContact O-N 3.05Å; Y256-L259 PolarHBondContact O-N 2.76Å; K257-L259 VanDerWaalsContact C-N 3.27Å; K257-L259 PolarHBondContact O-N 3.01Å; L259-Y263 WeakPolarHBondContact O-CB 3.47Å; L259-Y263 PolarHBondContact O-N 3.22Å; L259-A296 HydrophobicContact CD2-CB 4.23Å; L259-Y297 HydrophobicContact CD2-CD1 3.76Å; L259-Y297 HydrophobicContact CD2-CE1 4.15Å; L259-Y297 HydrophobicContact CG-CD1 4.37Å; L259-Y297 HydrophobicContact CG-CE1 4.26Å; L259-M300 HydrophobicContact CB-CE 3.96Å; L259-M300 HydrophobicContact CD2-CB 3.87Å; L259-M300 HydrophobicContact CD2-CE 4.14Å; L259-M300 HydrophobicContact CD2-CG 4.39Å
260	K	91.9	Very high	88.4	Confident	34 Å²	34	43.1 Å²	43.1	15%	0.148	23%	0.232	C	C	.	.	H	α-helix	trans	-66	-45	174.8	-69.6	171.9	61.2	-172.3	0	111.4	E95 A98 Y256 K257 L262 Y263 A264	E95-K260 VanDerWaalsContact CG-CE 3.49Å; E95-K260 VanDerWaalsContact CG-NZ 3.28Å; E95-K260 IonicContact OE1-NZ 2.7Å; E95-K260 PolarHBondContact OE1-NZ 2.76Å; A98-K260 HydrophobicContact CB-CB 4.02Å; A98-K260 HydrophobicContact CB-CG 4Å; Y256-K260 HydrophobicContact CD1-CD 4.2Å; Y256-K260 HydrophobicContact CE1-CD 3.76Å; Y256-K260 HydrophobicContact CE1-CG 4.49Å; Y256-K260 PolarHBondContact O-N 2.95Å; K257-K260 WeakPolarHBondContact O-CB 3.32Å; K257-K260 PolarHBondContact O-N 2.85Å; K260-L262 VanDerWaalsContact C-N 3.32Å; K260-L262 PolarHBondContact O-N 2.99Å; K260-Y263 WeakPolarHBondContact O-CB 3.39Å; K260-Y263 PolarHBondContact O-N 3.04Å; K260-A264 PolarHBondContact O-N 3.24Å
261	D	89.5	Confident	88.7	Confident	47 Å²	47	47.7 Å²	47.7	25%	0.251	25%	0.249	S	C	.	.	H	α-helix	trans	-63.2	-42.9	178.9	-59.4	-19	0	0	0	110.3	L248 K257 N258 Y263 A264 A265	L248-D261 HydrophobicContact CD2-CB 4.06Å; L248-D261 WeakPolarHBondContact CD2-O 3.41Å; K257-D261 IonicContact NZ-OD1 3.35Å; K257-D261 PolarHBondContact NZ-OD1 2.88Å; K257-D261 IonicContact NZ-OD2 3.59Å; K257-D261 PolarHBondContact NZ-OD2 3.33Å; K257-D261 PolarHBondContact O-N 3.29Å; N258-D261 PolarHBondContact O-N 3.4Å; D261-Y263 PolarHBondContact O-N 3.39Å; D261-A264 PolarHBondContact O-N 3.34Å; D261-A265 PolarHBondContact O-N 3.47Å
262	L	93.7	Very high	89.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-62	-41.9	174.3	-179.3	59.7	0	0	0	112.3	L248 N258 K260 A264 A265 C266 V282 M284 Y297 M300 F315	L248-L262 HydrophobicContact CD1-CD1 4.37Å; N258-L262 WeakPolarHBondContact O-CB 3.45Å; N258-L262 PolarHBondContact O-N 2.8Å; K260-L262 VanDerWaalsContact C-N 3.32Å; K260-L262 PolarHBondContact O-N 2.99Å; L262-A264 VanDerWaalsContact C-N 3.31Å; L262-A264 PolarHBondContact O-N 3.28Å; L262-A265 PolarHBondContact O-N 3.4Å; L262-C266 WeakPolarHBondContact O-CB 3.43Å; L262-C266 PolarHBondContact O-N 3.46Å; L262-C266 PolarHBondContact O-SG 3.04Å; L262-V282 HydrophobicContact CD1-CG1 3.69Å; L262-M284 HydrophobicContact CB-SD 4.38Å; L262-M284 HydrophobicContact CD1-SD 4.38Å; L262-Y297 HydrophobicContact CD2-CD1 3.76Å; L262-Y297 HydrophobicContact CD2-CG 4.12Å; L262-Y297 WeakPolarHBondContact CD2-O 3.41Å; L262-M300 HydrophobicContact CD2-CB 4.07Å; L262-M300 HydrophobicContact CD2-CG 4.12Å; L262-M300 HydrophobicContact CG-CG 4.2Å; L262-F315 HydrophobicContact CD1-CE2 4.23Å
263	Y	94.5	Very high	89.6	Confident	26 Å²	26	42 Å²	42	10%	0.102	22%	0.223	C	C	.	.	H	α-helix	trans	-58.1	-44.8	175	175.5	-84.2	0	0	0	111.6	L94 T97 A98 H101 L259 K260 D261 C266 S267 M300 V304	L94-Y263 HydrophobicContact CD1-CD1 4.3Å; L94-Y263 HydrophobicContact CD1-CE1 3.82Å; T97-Y263 HydrophobicContact CG2-CE1 4.25Å; T97-Y263 HydrophobicContact CG2-CE2 4.42Å; T97-Y263 WeakPolarHBondContact CG2-OH 3.27Å; A98-Y263 HydrophobicContact CB-CD1 3.52Å; A98-Y263 HydrophobicContact CB-CE1 4.26Å; A98-Y263 HydrophobicContact CB-CG 3.87Å; H101-Y263 HydrophobicContact CB-CD2 3.96Å; H101-Y263 HydrophobicContact CB-CE2 4.22Å; H101-Y263 AromaticContact CD2-CD2 3.98Å; H101-Y263 AromaticContact CD2-CE2 3.34Å; H101-Y263 WeakPolarHBondContact CD2-CE2 3.36Å; H101-Y263 AromaticContact CG-CD2 3.98Å; H101-Y263 AromaticContact CG-CE2 3.75Å; H101-Y263 AromaticContact NE2-CE2 3.84Å; L259-Y263 WeakPolarHBondContact O-CB 3.47Å; L259-Y263 PolarHBondContact O-N 3.22Å; K260-Y263 WeakPolarHBondContact O-CB 3.39Å; K260-Y263 PolarHBondContact O-N 3.04Å; D261-Y263 PolarHBondContact O-N 3.39Å; Y263-C266 PolarHBondContact O-N 3.16Å; Y263-S267 VanDerWaalsContact CE1-OG 3.3Å; Y263-S267 WeakPolarHBondContact CE1-OG 3.27Å; Y263-S267 WeakPolarHBondContact O-CB 3.39Å; Y263-S267 PolarHBondContact O-N 3.05Å; Y263-S267 PolarHBondContact O-OG 3.17Å; Y263-M300 HydrophobicContact CD2-SD 3.95Å; Y263-M300 HydrophobicContact CG-SD 4.49Å; Y263-V304 HydrophobicContact CD2-CG2 3.44Å; Y263-V304 VanDerWaalsContact CD2-CG2 3.44Å; Y263-V304 HydrophobicContact CE2-CG2 3.71Å; Y263-V304 HydrophobicContact CG-CG2 4.42Å
264	A	90.5	Very high	90.1	Very high	32 Å²	32	43.2 Å²	43.2	26%	0.264	22%	0.224	S	C	.	.	H	α-helix	trans	-62	-47.4	179.4	0	0	0	0	0	111.2	L94 K260 D261 L262 S267 A268	L94-A264 HydrophobicContact CD2-CB 4.05Å; K260-A264 PolarHBondContact O-N 3.24Å; D261-A264 PolarHBondContact O-N 3.34Å; L262-A264 VanDerWaalsContact C-N 3.31Å; L262-A264 PolarHBondContact O-N 3.28Å; A264-S267 PolarHBondContact O-N 3Å; A264-A268 WeakPolarHBondContact O-CB 3.35Å; A264-A268 PolarHBondContact O-N 3.29Å
265	A	91.4	Very high	89.9	Confident	13 Å²	13	45.6 Å²	45.6	11%	0.107	23%	0.233	C	C	.	.	H	α-helix	trans	-61.9	-47.9	176.1	0	0	0	0	0	112.6	V246 L248 D261 L262 S267 A268 V269	V246-A265 HydrophobicContact CG1-CB 4.22Å; L248-A265 HydrophobicContact CD1-CB 3.41Å; L248-A265 VanDerWaalsContact CD1-CB 3.41Å; L248-A265 HydrophobicContact CD2-CB 3.73Å; L248-A265 HydrophobicContact CG-CB 4.02Å; D261-A265 PolarHBondContact O-N 3.47Å; L262-A265 PolarHBondContact O-N 3.4Å; A265-S267 VanDerWaalsContact C-N 3.26Å; A265-S267 PolarHBondContact O-N 2.94Å; A265-A268 WeakPolarHBondContact O-CB 3.42Å; A265-A268 PolarHBondContact O-N 3.48Å; A265-A268 VanDerWaalsContact O-N 3.11Å; A265-V269 WeakPolarHBondContact O-CG2 3.29Å; A265-V269 PolarHBondContact O-N 2.88Å
266	C	94.3	Very high	89.6	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.6	-39.9	175.4	-72.7	0	0	0	0	112.1	L262 Y263 V269 K270 V304 L305	L262-C266 WeakPolarHBondContact O-CB 3.43Å; L262-C266 PolarHBondContact O-N 3.46Å; L262-C266 PolarHBondContact O-SG 3.04Å; Y263-C266 PolarHBondContact O-N 3.16Å; C266-V269 WeakPolarHBondContact O-CG2 3.3Å; C266-K270 VanDerWaalsContact O-CB 3.28Å; C266-K270 WeakPolarHBondContact O-CB 2.9Å; C266-K270 PolarHBondContact O-N 3.32Å; C266-V304 HydrophobicContact CB-CB 3.86Å; C266-V304 HydrophobicContact CB-CG1 3.6Å; C266-V304 HydrophobicContact CB-CG2 4.41Å; C266-L305 HydrophobicContact CB-CD1 4.09Å; C266-L305 HydrophobicContact CB-CD2 3.72Å; C266-L305 HydrophobicContact CB-CG 3.88Å; C266-L305 WeakPolarHBondContact O-CD2 3.34Å; C266-L305 VanDerWaalsContact SG-CD1 3.56Å
267	S	91.8	Very high	89.3	Confident	28 Å²	28	56.7 Å²	56.7	20%	0.196	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-43	176.5	-60.7	0	0	0	0	111.5	Y263 A264 A265 K270 Q271	Y263-S267 VanDerWaalsContact CE1-OG 3.3Å; Y263-S267 WeakPolarHBondContact CE1-OG 3.27Å; Y263-S267 WeakPolarHBondContact O-CB 3.39Å; Y263-S267 PolarHBondContact O-N 3.05Å; Y263-S267 PolarHBondContact O-OG 3.17Å; A264-S267 PolarHBondContact O-N 3Å; A265-S267 VanDerWaalsContact C-N 3.26Å; A265-S267 PolarHBondContact O-N 2.94Å; S267-K270 PolarHBondContact O-N 3.07Å; S267-Q271 PolarHBondContact O-N 3.33Å
268	A	88.4	Confident	89	Confident	56 Å²	56	56.1 Å²	56.1	46%	0.463	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-48	177.9	0	0	0	0	0	112	A264 A265 K270 Q271 F272	A264-A268 WeakPolarHBondContact O-CB 3.35Å; A264-A268 PolarHBondContact O-N 3.29Å; A265-A268 WeakPolarHBondContact O-CB 3.42Å; A265-A268 PolarHBondContact O-N 3.48Å; A265-A268 VanDerWaalsContact O-N 3.11Å; A268-K270 VanDerWaalsContact C-N 3.29Å; A268-K270 PolarHBondContact O-N 3.33Å; A268-Q271 PolarHBondContact O-N 3.38Å; A268-F272 WeakPolarHBondContact O-CB 3.34Å; A268-F272 PolarHBondContact O-N 3.26Å
269	V	89.8	Confident	88.7	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.042	29%	0.286	C	S	.	.	H	α-helix	trans	-63.8	-35	176.4	-78	0	0	0	0	112.2	A265 C266 F272 S273 P280 V282 L305 W309	A265-V269 WeakPolarHBondContact O-CG2 3.29Å; A265-V269 PolarHBondContact O-N 2.88Å; C266-V269 WeakPolarHBondContact O-CG2 3.3Å; V269-F272 PolarHBondContact O-N 3.32Å; V269-S273 WeakPolarHBondContact O-CB 3.25Å; V269-S273 PolarHBondContact O-N 3.37Å; V269-P280 HydrophobicContact CB-CG 3.75Å; V269-P280 HydrophobicContact CG1-CB 3.88Å; V269-P280 HydrophobicContact CG1-CG 3.5Å; V269-P280 VanDerWaalsContact CG1-CG 3.5Å; V269-V282 HydrophobicContact CB-CG2 4.38Å; V269-V282 HydrophobicContact CG1-CG2 4.1Å; V269-V282 HydrophobicContact CG2-CG2 3.41Å; V269-V282 VanDerWaalsContact CG2-CG2 3.41Å; V269-L305 HydrophobicContact CG2-CD2 4.17Å; V269-W309 HydrophobicContact CB-CZ3 4.38Å; V269-W309 HydrophobicContact CG2-CZ3 4.09Å
270	K	90.5	Very high	88.4	Confident	89 Å²	89	59.9 Å²	59.9	39%	0.387	29%	0.29	S	S	.	.	H	α-helix	trans	-64.1	-41.1	174.3	-167	174.2	-171.7	174.9	0	112.1	C266 S267 A268 K274 V304 L305 W309	C266-K270 VanDerWaalsContact O-CB 3.28Å; C266-K270 WeakPolarHBondContact O-CB 2.9Å; C266-K270 PolarHBondContact O-N 3.32Å; S267-K270 PolarHBondContact O-N 3.07Å; A268-K270 VanDerWaalsContact C-N 3.29Å; A268-K270 PolarHBondContact O-N 3.33Å; K270-K274 WeakPolarHBondContact O-CG 3.31Å; K270-K274 PolarHBondContact O-N 3.43Å; K270-V304 WeakPolarHBondContact CD-O 3.49Å; K270-V304 WeakPolarHBondContact CE-O 3.37Å; K270-V304 PolarHBondContact NZ-O 3.05Å; K270-L305 HydrophobicContact CB-CD2 4.16Å; K270-W309 HydrophobicContact CB-CH2 4.35Å; K270-W309 HydrophobicContact CB-CZ3 4.14Å
271	Q	86.5	Confident	88.4	Confident	123 Å²	123	58.3 Å²	58.3	58%	0.575	28%	0.283	S	S	*	.	H	α-helix	trans	-69.8	-44.6	176.2	-171.3	173	20.2	0	0	111.8	S267 A268 S273 K274 N275	S267-Q271 PolarHBondContact O-N 3.33Å; A268-Q271 PolarHBondContact O-N 3.38Å; Q271-S273 PolarHBondContact O-N 2.92Å; Q271-K274 PolarHBondContact O-N 3.13Å; Q271-K274 VanDerWaalsContact O-N 3.16Å; Q271-N275 PolarHBondContact O-N 2.78Å; Q271-N275 VanDerWaalsContact O-N 3.08Å
272	F	86.1	Confident	88.6	Confident	50 Å²	50	56.1 Å²	56.1	22%	0.219	27%	0.271	C	S	.	.	H	α-helix	trans	-54.4	-44.7	173.9	-177.3	-88	0	0	0	111	A268 V269 K274 N275 Y276 R278 P280	A268-F272 WeakPolarHBondContact O-CB 3.34Å; A268-F272 PolarHBondContact O-N 3.26Å; V269-F272 PolarHBondContact O-N 3.32Å; F272-K274 VanDerWaalsContact C-N 3.33Å; F272-K274 PolarHBondContact O-N 3.42Å; F272-N275 PolarHBondContact O-N 2.98Å; F272-N275 VanDerWaalsContact O-N 3.17Å; F272-Y276 HydrophobicContact CD1-CD2 4.24Å; F272-Y276 AromaticContact CD2-CD2 3.43Å; F272-Y276 HydrophobicContact CD2-CD2 3.43Å; F272-Y276 VanDerWaalsContact CD2-CD2 3.43Å; F272-Y276 AromaticContact CD2-CE2 3.68Å; F272-Y276 HydrophobicContact CD2-CE2 3.68Å; F272-Y276 HydrophobicContact CD2-CG 4.45Å; F272-Y276 HydrophobicContact CE1-CD2 4.29Å; F272-Y276 AromaticContact CE2-CD2 3.46Å; F272-Y276 HydrophobicContact CE2-CD2 3.46Å; F272-Y276 VanDerWaalsContact CE2-CD2 3.46Å; F272-Y276 AromaticContact CE2-CE2 3.76Å; F272-Y276 HydrophobicContact CE2-CE2 3.76Å; F272-Y276 HydrophobicContact CE2-CG 4.14Å; F272-Y276 AromaticContact CG-CD2 3.84Å; F272-Y276 HydrophobicContact CG-CD2 3.84Å; F272-Y276 HydrophobicContact CG-CE2 4.44Å; F272-Y276 AromaticContact CZ-CD2 3.92Å; F272-Y276 HydrophobicContact CZ-CD2 3.92Å; F272-Y276 HydrophobicContact CZ-CG 4.19Å; F272-Y276 WeakPolarHBondContact O-CD2 3.49Å; F272-Y276 PolarHBondContact O-N 2.98Å; F272-R278 HydrophobicContact CE1-CB 3.96Å; F272-P280 HydrophobicContact CD1-CG 3.71Å; F272-P280 HydrophobicContact CE1-CG 4.28Å; F272-P280 HydrophobicContact CG-CG 4.43Å
273	S	87.5	Confident	88.6	Confident	21 Å²	21	56.1 Å²	56.1	15%	0.147	27%	0.271	C	S	.	.	H	α-helix	trans	-62.9	-38.5	-180	-167.6	0	0	0	0	113.8	V269 Q271 Y277 R278	V269-S273 WeakPolarHBondContact O-CB 3.25Å; V269-S273 PolarHBondContact O-N 3.37Å; Q271-S273 PolarHBondContact O-N 2.92Å; S273-Y277 VanDerWaalsContact O-CA 3.27Å; S273-Y277 WeakPolarHBondContact O-CA 3.39Å; S273-Y277 PolarHBondContact O-N 2.81Å; S273-R278 WeakPolarHBondContact CA-O 3.45Å; S273-R278 WeakPolarHBondContact CB-O 3.2Å; S273-R278 PolarHBondContact OG-O 2.82Å
274	K	87.5	Confident	88.5	Confident	146 Å²	146	54.9 Å²	54.9	64%	0.635	27%	0.267	S	S	*	.	H	α-helix	trans	-65.3	-39.2	174.7	-71.3	176.2	176.6	-173.3	0	112.4	K270 Q271 F272	K270-K274 WeakPolarHBondContact O-CG 3.31Å; K270-K274 PolarHBondContact O-N 3.43Å; Q271-K274 PolarHBondContact O-N 3.13Å; Q271-K274 VanDerWaalsContact O-N 3.16Å; F272-K274 VanDerWaalsContact C-N 3.33Å; F272-K274 PolarHBondContact O-N 3.42Å
275	N	82.7	Confident	87.9	Confident	101 Å²	101	53.4 Å²	53.4	54%	0.54	25%	0.254	S	S	.	.	H	α-helix	trans	-80.7	-35.2	-173.6	-66.6	-3.9	0	0	0	112.6	Q271 F272	Q271-N275 PolarHBondContact O-N 2.78Å; Q271-N275 VanDerWaalsContact O-N 3.08Å; F272-N275 PolarHBondContact O-N 2.98Å; F272-N275 VanDerWaalsContact O-N 3.17Å
276	Y	83.2	Confident	87	Confident	132 Å²	132	54.1 Å²	54.1	52%	0.518	26%	0.256	S	S	.	.	H	α-helix	trans	-115	-1.8	-171.4	-60.1	-77.5	0	0	0	114	F272 R278	F272-Y276 HydrophobicContact CD1-CD2 4.24Å; F272-Y276 AromaticContact CD2-CD2 3.43Å; F272-Y276 HydrophobicContact CD2-CD2 3.43Å; F272-Y276 VanDerWaalsContact CD2-CD2 3.43Å; F272-Y276 AromaticContact CD2-CE2 3.68Å; F272-Y276 HydrophobicContact CD2-CE2 3.68Å; F272-Y276 HydrophobicContact CD2-CG 4.45Å; F272-Y276 HydrophobicContact CE1-CD2 4.29Å; F272-Y276 AromaticContact CE2-CD2 3.46Å; F272-Y276 HydrophobicContact CE2-CD2 3.46Å; F272-Y276 VanDerWaalsContact CE2-CD2 3.46Å; F272-Y276 AromaticContact CE2-CE2 3.76Å; F272-Y276 HydrophobicContact CE2-CE2 3.76Å; F272-Y276 HydrophobicContact CE2-CG 4.14Å; F272-Y276 AromaticContact CG-CD2 3.84Å; F272-Y276 HydrophobicContact CG-CD2 3.84Å; F272-Y276 HydrophobicContact CG-CE2 4.44Å; F272-Y276 AromaticContact CZ-CD2 3.92Å; F272-Y276 HydrophobicContact CZ-CD2 3.92Å; F272-Y276 HydrophobicContact CZ-CG 4.19Å; F272-Y276 WeakPolarHBondContact O-CD2 3.49Å; F272-Y276 PolarHBondContact O-N 2.98Å; Y276-R278 WeakPolarHBondContact O-CG 3.45Å; Y276-R278 PolarHBondContact O-N 2.79Å
277	Y	83.3	Confident	86.1	Confident	210 Å²	210	55.5 Å²	55.5	82%	0.824	26%	0.263	S	S	*	.	S	Bend	trans	57.2	32.5	-178.1	-55.7	-83.1	0	0	0	114.1	S273	S273-Y277 VanDerWaalsContact O-CA 3.27Å; S273-Y277 WeakPolarHBondContact O-CA 3.39Å; S273-Y277 PolarHBondContact O-N 2.81Å
278	R	81.5	Confident	86	Confident	61 Å²	61	54.2 Å²	54.2	23%	0.23	25%	0.254	C	S	.	.			trans	-122.4	148.8	179.1	-65.5	-178.5	71.1	175.2	1.4	110.1	Y237 V240 S242 F272 S273 Y276 P280	Y237-R278 PolarHBondContact O-NH1 3.36Å; V240-R278 PolarHBondContact O-NH1 3.32Å; V240-R278 PolarHBondContact O-NH2 3.33Å; S242-R278 PolarHBondContact O-NH2 3.39Å; F272-R278 HydrophobicContact CE1-CB 3.96Å; S273-R278 WeakPolarHBondContact CA-O 3.45Å; S273-R278 WeakPolarHBondContact CB-O 3.2Å; S273-R278 PolarHBondContact OG-O 2.82Å; Y276-R278 WeakPolarHBondContact O-CG 3.45Å; Y276-R278 PolarHBondContact O-N 2.79Å; R278-P280 WeakPolarHBondContact O-CD 3.27Å
279	I	84.8	Confident	85.9	Confident	70 Å²	70	57.2 Å²	57.2	36%	0.359	25%	0.253	S	S	.	.			trans	-113.8	88.2	-177.6	-56	176	0	0	0	109.1	W309 F314	I279-W309 HydrophobicContact CB-CZ2 4.45Å; I279-W309 HydrophobicContact CG1-CZ2 4.31Å; I279-W309 HydrophobicContact CG2-CD2 4.24Å; I279-W309 VanDerWaalsContact CG2-CE2 3.46Å; I279-W309 HydrophobicContact CG2-CZ2 3.68Å; I279-F314 HydrophobicContact CB-CD1 4.23Å; I279-F314 HydrophobicContact CB-CE1 3.73Å; I279-F314 HydrophobicContact CB-CZ 4.38Å; I279-F314 HydrophobicContact CG2-CD1 3.41Å; I279-F314 VanDerWaalsContact CG2-CD1 3.41Å; I279-F314 HydrophobicContact CG2-CE1 3.35Å; I279-F314 HydrophobicContact CG2-CG 4.08Å; I279-F314 HydrophobicContact CG2-CZ 4.04Å
280	P	87.4	Confident	86	Confident	12 Å²	12	59.3 Å²	59.3	8%	0.078	27%	0.266	C	S	.	.			trans	-71.4	145.1	169.4	29.6	-32.9	0	0	0	110.4	Q244 V269 F272 R278	Q244-P280 CarbonylContact O-C 3.39Å; Q244-P280 VanDerWaalsContact O-CA 3.26Å; Q244-P280 WeakPolarHBondContact O-CA 3.47Å; V269-P280 HydrophobicContact CB-CG 3.75Å; V269-P280 HydrophobicContact CG1-CB 3.88Å; V269-P280 HydrophobicContact CG1-CG 3.5Å; V269-P280 VanDerWaalsContact CG1-CG 3.5Å; F272-P280 HydrophobicContact CD1-CG 3.71Å; F272-P280 HydrophobicContact CE1-CG 4.28Å; F272-P280 HydrophobicContact CG-CG 4.43Å; R278-P280 WeakPolarHBondContact O-CD 3.27Å
281	G	91.5	Very high	86.1	Confident	1 Å²	1	55.9 Å²	55.9	1%	0.01	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	169.4	172.1	0	0	0	0	0	113.2	Q244 F245 V246 F314	Q244-G281 PolarHBondContact O-N 3.44Å; F245-G281 CarbonylContact C-O 3.42Å; F245-G281 VanDerWaalsContact CA-O 3.24Å; F245-G281 WeakPolarHBondContact CA-O 3.42Å; V246-G281 PolarHBondContact N-O 3.04Å; G281-F314 CarbonylContact C-O 3.57Å; G281-F314 WeakPolarHBondContact CA-O 3.23Å
282	V	93.4	Very high	86.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.2	174.2	-177.9	0	0	0	0	109.5	V246 L248 L262 V269 L305 F314 F315 R316	V246-V282 CarbonylContact O-C 3.45Å; V246-V282 WeakPolarHBondContact O-CA 3.3Å; L248-V282 HydrophobicContact CD1-CG1 3.64Å; L262-V282 HydrophobicContact CD1-CG1 3.69Å; V269-V282 HydrophobicContact CB-CG2 4.38Å; V269-V282 HydrophobicContact CG1-CG2 4.1Å; V269-V282 HydrophobicContact CG2-CG2 3.41Å; V269-V282 VanDerWaalsContact CG2-CG2 3.41Å; V282-L305 HydrophobicContact CG2-CD1 4.48Å; V282-F314 PolarHBondContact N-O 2.91Å; V282-F315 HydrophobicContact CB-CD2 4.19Å; V282-F315 HydrophobicContact CG1-CE2 4.47Å; V282-F315 VanDerWaalsContact O-CA 3.26Å; V282-F315 WeakPolarHBondContact O-CA 3.39Å; V282-F315 WeakPolarHBondContact O-CD2 3.06Å; V282-R316 PolarHBondContact O-N 3.18Å
283	K	94	Very high	86.6	Confident	0 Å²	0	55 Å²	55	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	126.3	170.1	-53.9	-166.9	179.9	176	0	108.8	E129 E224 D226 F245 V246 R247 L248 R316	E129-K283 IonicContact OE1-NZ 2.89Å; E129-K283 IonicContact OE2-NZ 3.37Å; E224-K283 VanDerWaalsContact OE2-CE 3.3Å; E224-K283 WeakPolarHBondContact OE2-CE 3.3Å; E224-K283 IonicContact OE2-NZ 3.77Å; E224-K283 PolarHBondContact OE2-NZ 3.05Å; D226-K283 IonicContact OD1-NZ 3.73Å; D226-K283 PolarHBondContact OD1-NZ 3.36Å; D226-K283 IonicContact OD2-NZ 3.9Å; F245-K283 HydrophobicContact CB-CD 4.3Å; F245-K283 HydrophobicContact CB-CG 3.82Å; F245-K283 HydrophobicContact CD1-CB 4.46Å; F245-K283 HydrophobicContact CD1-CD 4.23Å; F245-K283 HydrophobicContact CD1-CG 3.3Å; F245-K283 HydrophobicContact CE1-CG 3.98Å; F245-K283 HydrophobicContact CG-CD 4.26Å; F245-K283 HydrophobicContact CG-CG 3.73Å; V246-K283 PolarHBondContact O-N 3.24Å; R247-K283 CarbonylContact C-O 3.58Å; R247-K283 VanDerWaalsContact CA-O 3.3Å; R247-K283 WeakPolarHBondContact CA-O 3.41Å; R247-K283 HydrophobicContact CB-CB 3.89Å; R247-K283 HydrophobicContact CG-CB 3.75Å; L248-K283 PolarHBondContact N-O 3.1Å; K283-R316 CarbonylContact C-O 3.6Å; K283-R316 WeakPolarHBondContact CA-O 3.16Å; K283-R316 HydrophobicContact CB-CB 4.16Å; K283-R316 HydrophobicContact CD-CB 4.26Å; K283-R316 HydrophobicContact CD-CG 4.41Å; K283-R316 HydrophobicContact CG-CB 3.84Å; K283-R316 HydrophobicContact CG-CG 4.19Å
284	M	92.8	Very high	86.9	Confident	1 Å²	1	54 Å²	54	1%	0.005	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	127.9	171.5	-170.8	59.8	-175.3	0	0	110.2	L248 A250 N258 L262 I288 Y297 R316 I317 G318	L248-M284 HydrophobicContact CB-SD 3.95Å; A250-M284 HydrophobicContact CB-CE 4.02Å; N258-M284 HydrophobicContact CB-CE 3.67Å; L262-M284 HydrophobicContact CB-SD 4.38Å; L262-M284 HydrophobicContact CD1-SD 4.38Å; M284-I288 HydrophobicContact CG-CD1 4.46Å; M284-Y297 HydrophobicContact CE-CD1 4.17Å; M284-Y297 HydrophobicContact CE-CE1 3.68Å; M284-Y297 HydrophobicContact CE-CE2 4.4Å; M284-Y297 HydrophobicContact CG-CD1 4.1Å; M284-Y297 HydrophobicContact CG-CD2 3.88Å; M284-Y297 HydrophobicContact CG-CE1 4.42Å; M284-Y297 HydrophobicContact CG-CE2 4.22Å; M284-Y297 HydrophobicContact CG-CG 3.84Å; M284-R316 PolarHBondContact N-O 3.45Å; M284-I317 CarbonylContact O-C 3.58Å; M284-I317 VanDerWaalsContact O-CA 3.28Å; M284-I317 WeakPolarHBondContact O-CA 3.45Å; M284-G318 PolarHBondContact O-N 3.46Å
285	G	78.3	Confident	87.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	121.7	-171	162.9	0	0	0	0	0	116.2	L248	L248-G285 PolarHBondContact O-N 2.97Å
286	L	71.2	Confident	87.7	Confident	29 Å²	29	43.3 Å²	43.3	15%	0.152	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.2	-25.8	159.5	-88.7	178.4	0	0	0	106.1	V26 M131 I133	V26-L286 HydrophobicContact CG2-CD1 3.64Å; M131-L286 HydrophobicContact CE-CD2 3.5Å; M131-L286 WeakPolarHBondContact CG-O 3.36Å; I133-L286 HydrophobicContact CD1-CD2 4.29Å
287	E	76.9	Confident	88.3	Confident	29 Å²	29	37 Å²	37	14%	0.136	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	77.1	169.7	-68.5	-168.2	125.8	0	0	112	I29 R289 Y321	I29-E287 WeakPolarHBondContact CD1-OE2 3.4Å; E287-R289 PolarHBondContact O-N 2.86Å; E287-Y321 HydrophobicContact CB-CE2 4.06Å; E287-Y321 HydrophobicContact CG-CE2 4.07Å; E287-Y321 VanDerWaalsContact OE1-CE2 3.29Å; E287-Y321 WeakPolarHBondContact OE1-CE2 3.5Å; E287-Y321 PolarHBondContact OE1-OH 3.4Å
288	I	88.9	Confident	88.9	Confident	1 Å²	1	27 Å²	27	1%	0.005	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	128	167.5	-58.8	-39.4	0	0	0	109.3	A250 M284 E293 Y297 I317 G318 T319 F322	A250-I288 HydrophobicContact CB-CD1 3.27Å; M284-I288 HydrophobicContact CG-CD1 4.46Å; I288-E293 HydrophobicContact CG2-CB 3.71Å; I288-Y297 HydrophobicContact CD1-CD2 4.04Å; I288-Y297 HydrophobicContact CD1-CE2 3.4Å; I288-Y297 VanDerWaalsContact CD1-CE2 3.4Å; I288-Y297 HydrophobicContact CG1-CD2 4.14Å; I288-Y297 HydrophobicContact CG1-CE2 3.93Å; I288-Y297 HydrophobicContact CG2-CD2 4.4Å; I288-Y297 HydrophobicContact CG2-CE2 4.14Å; I288-I317 HydrophobicContact CB-CG2 3.79Å; I288-I317 HydrophobicContact CG1-CG2 3.3Å; I288-I317 HydrophobicContact CG2-CG2 4.3Å; I288-G318 PolarHBondContact N-O 2.7Å; I288-T319 PolarHBondContact O-OG1 3.07Å; I288-F322 HydrophobicContact CB-CD1 4.27Å; I288-F322 HydrophobicContact CG2-CD1 4.06Å
289	R	87.1	Confident	89.6	Confident	118 Å²	118	25.3 Å²	25.3	45%	0.445	13%	0.129	S	C	.	.			trans	-94.7	-43	-164.5	-66.9	-178.9	174.9	-176.6	-8	112.7	E287 E293 Y321 F322	E287-R289 PolarHBondContact O-N 2.86Å; R289-E293 PolarHBondContact N-OE2 3.31Å; R289-Y321 HydrophobicContact CG-CD2 4.38Å; R289-Y321 WeakPolarHBondContact O-CB 3.26Å; R289-F322 PolarHBondContact O-N 3.01Å
290	T	91.2	Very high	90.1	Very high	52 Å²	52	22 Å²	22	32%	0.319	11%	0.112	S	C	.	.			trans	-117.2	158.5	-173.6	75.2	0	0	0	0	112.3	D292 E293 G294 F322	T290-D292 VanDerWaalsContact C-N 3.29Å; T290-D292 PolarHBondContact O-N 3.45Å; T290-E293 PolarHBondContact N-OE2 3.07Å; T290-E293 PolarHBondContact O-N 2.82Å; T290-E293 VanDerWaalsContact OG1-CG 3.31Å; T290-E293 WeakPolarHBondContact OG1-CG 3.27Å; T290-E293 PolarHBondContact OG1-N 3.19Å; T290-G294 PolarHBondContact O-N 3.27Å; T290-F322 WeakPolarHBondContact O-CB 3.23Å
291	L	91.6	Very high	90.5	Very high	17 Å²	17	21.4 Å²	21.4	9%	0.089	11%	0.109	C	C	.	.	H	α-helix	trans	-61.3	-41.7	175.3	173	62.2	0	0	0	110.8	I121 I124 E293 G294 L295 F322 A329	I121-L291 HydrophobicContact CD1-CD2 4.03Å; I121-L291 HydrophobicContact CG1-CD1 4.31Å; I121-L291 HydrophobicContact CG1-CD2 3.93Å; I124-L291 HydrophobicContact CG2-CD1 3.95Å; L291-E293 VanDerWaalsContact C-N 3.33Å; L291-E293 PolarHBondContact O-N 3.43Å; L291-G294 PolarHBondContact O-N 3.42Å; L291-G294 VanDerWaalsContact O-N 3.12Å; L291-L295 HydrophobicContact CD1-CD1 4.11Å; L291-L295 HydrophobicContact CD1-CD2 4.37Å; L291-L295 HydrophobicContact CD1-CG 3.94Å; L291-L295 HydrophobicContact CD2-CD1 4.43Å; L291-L295 HydrophobicContact CG-CD1 3.9Å; L291-L295 HydrophobicContact CG-CG 4.18Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 3.01Å; L291-F322 HydrophobicContact CD1-CD2 4.35Å; L291-A329 HydrophobicContact CD2-CB 3.92Å
292	D	90.6	Very high	90.7	Very high	110 Å²	110	22.9 Å²	22.9	59%	0.588	12%	0.116	S	C	*	.	H	α-helix	trans	-63.7	-38.2	-178	-66.5	-21.4	0	0	0	112.3	T290 L295 A296	T290-D292 VanDerWaalsContact C-N 3.29Å; T290-D292 PolarHBondContact O-N 3.45Å; D292-L295 PolarHBondContact O-N 3.02Å; D292-A296 VanDerWaalsContact O-CB 3.28Å; D292-A296 WeakPolarHBondContact O-CB 3.04Å; D292-A296 PolarHBondContact O-N 3.05Å
293	E	92.3	Very high	90.7	Very high	43 Å²	43	26.5 Å²	26.5	20%	0.201	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-48.2	171.8	-72.2	177.9	153	0	0	110.9	L255 I288 R289 T290 L291 L295 A296 Y297	L255-E293 HydrophobicContact CD1-CB 4.37Å; L255-E293 HydrophobicContact CD1-CG 4.18Å; L255-E293 HydrophobicContact CD2-CG 4.38Å; I288-E293 HydrophobicContact CG2-CB 3.71Å; R289-E293 PolarHBondContact N-OE2 3.31Å; T290-E293 PolarHBondContact N-OE2 3.07Å; T290-E293 PolarHBondContact O-N 2.82Å; T290-E293 VanDerWaalsContact OG1-CG 3.31Å; T290-E293 WeakPolarHBondContact OG1-CG 3.27Å; T290-E293 PolarHBondContact OG1-N 3.19Å; L291-E293 VanDerWaalsContact C-N 3.33Å; L291-E293 PolarHBondContact O-N 3.43Å; E293-L295 PolarHBondContact O-N 2.96Å; E293-A296 WeakPolarHBondContact O-CB 3.34Å; E293-A296 PolarHBondContact O-N 3.34Å; E293-Y297 HydrophobicContact CB-CE2 3.95Å; E293-Y297 WeakPolarHBondContact O-CD2 3.43Å; E293-Y297 PolarHBondContact O-N 3.37Å
294	G	94.1	Very high	90.8	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-57.4	-47.4	177.5	0	0	0	0	0	112.5	T290 L291 A296 Y297 M298 I317	T290-G294 PolarHBondContact O-N 3.27Å; L291-G294 PolarHBondContact O-N 3.42Å; L291-G294 VanDerWaalsContact O-N 3.12Å; G294-A296 PolarHBondContact O-N 2.88Å; G294-Y297 PolarHBondContact O-N 2.92Å; G294-M298 WeakPolarHBondContact O-CB 3.28Å; G294-M298 PolarHBondContact O-N 3.33Å; G294-I317 WeakPolarHBondContact O-CD1 3.15Å
295	L	93.8	Very high	90.9	Very high	23 Å²	23	27.5 Å²	27.5	12%	0.12	14%	0.139	C	C	.	.	H	α-helix	trans	-62.9	-40.2	176.5	-68	177	0	0	0	111.7	L109 E120 I124 L291 D292 E293 M298 A299	L109-L295 HydrophobicContact CD2-CB 4Å; E120-L295 HydrophobicContact CB-CD2 4.12Å; I124-L295 HydrophobicContact CB-CD2 4.23Å; I124-L295 HydrophobicContact CG2-CD2 3.96Å; L291-L295 HydrophobicContact CD1-CD1 4.11Å; L291-L295 HydrophobicContact CD1-CD2 4.37Å; L291-L295 HydrophobicContact CD1-CG 3.94Å; L291-L295 HydrophobicContact CD2-CD1 4.43Å; L291-L295 HydrophobicContact CG-CD1 3.9Å; L291-L295 HydrophobicContact CG-CG 4.18Å; L291-L295 WeakPolarHBondContact O-CG 3.5Å; L291-L295 PolarHBondContact O-N 3.01Å; D292-L295 PolarHBondContact O-N 3.02Å; E293-L295 PolarHBondContact O-N 2.96Å; L295-M298 HydrophobicContact CD2-CE 3.57Å; L295-M298 PolarHBondContact O-N 2.69Å; L295-A299 VanDerWaalsContact O-CB 3.3Å; L295-A299 WeakPolarHBondContact O-CB 3.41Å; L295-A299 PolarHBondContact O-N 2.67Å
296	A	94.4	Very high	91.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.1	-45	176.2	0	0	0	0	0	112.3	I105 L109 L255 L259 D292 E293 G294 A299 M300	I105-A296 HydrophobicContact CG2-CB 4.26Å; L109-A296 HydrophobicContact CD1-CB 3.76Å; L109-A296 HydrophobicContact CD2-CB 4.38Å; L255-A296 HydrophobicContact CD1-CB 4.14Å; L255-A296 HydrophobicContact CD2-CB 4.22Å; L259-A296 HydrophobicContact CD2-CB 4.23Å; D292-A296 VanDerWaalsContact O-CB 3.28Å; D292-A296 WeakPolarHBondContact O-CB 3.04Å; D292-A296 PolarHBondContact O-N 3.05Å; E293-A296 WeakPolarHBondContact O-CB 3.34Å; E293-A296 PolarHBondContact O-N 3.34Å; G294-A296 PolarHBondContact O-N 2.88Å; A296-A299 PolarHBondContact O-N 3.36Å; A296-M300 PolarHBondContact O-N 3.49Å
297	Y	95.6	Very high	92.7	Very high	1 Å²	1	35.8 Å²	35.8	0%	0.004	18%	0.176	C	C	.	.	H	α-helix	trans	-65.3	-41.4	177.1	-62	-46	0	0	0	112	L255 N258 L259 L262 M284 I288 E293 G294 M300 A301 I317	L255-Y297 HydrophobicContact CD1-CD1 4.36Å; L255-Y297 HydrophobicContact CD1-CE1 3.58Å; L255-Y297 HydrophobicContact CD1-CE2 4.3Å; L255-Y297 WeakPolarHBondContact CD1-OH 3.28Å; N258-Y297 HydrophobicContact CB-CE1 3.71Å; N258-Y297 VanDerWaalsContact CB-OH 3.25Å; N258-Y297 WeakPolarHBondContact CB-OH 3.33Å; N258-Y297 PolarHBondContact ND2-OH 3.47Å; N258-Y297 VanDerWaalsContact ND2-OH 3.16Å; L259-Y297 HydrophobicContact CD2-CD1 3.76Å; L259-Y297 HydrophobicContact CD2-CE1 4.15Å; L259-Y297 HydrophobicContact CG-CD1 4.37Å; L259-Y297 HydrophobicContact CG-CE1 4.26Å; L262-Y297 HydrophobicContact CD2-CD1 3.76Å; L262-Y297 HydrophobicContact CD2-CG 4.12Å; L262-Y297 WeakPolarHBondContact CD2-O 3.41Å; M284-Y297 HydrophobicContact CE-CD1 4.17Å; M284-Y297 HydrophobicContact CE-CE1 3.68Å; M284-Y297 HydrophobicContact CE-CE2 4.4Å; M284-Y297 HydrophobicContact CG-CD1 4.1Å; M284-Y297 HydrophobicContact CG-CD2 3.88Å; M284-Y297 HydrophobicContact CG-CE1 4.42Å; M284-Y297 HydrophobicContact CG-CE2 4.22Å; M284-Y297 HydrophobicContact CG-CG 3.84Å; I288-Y297 HydrophobicContact CD1-CD2 4.04Å; I288-Y297 HydrophobicContact CD1-CE2 3.4Å; I288-Y297 VanDerWaalsContact CD1-CE2 3.4Å; I288-Y297 HydrophobicContact CG1-CD2 4.14Å; I288-Y297 HydrophobicContact CG1-CE2 3.93Å; I288-Y297 HydrophobicContact CG2-CD2 4.4Å; I288-Y297 HydrophobicContact CG2-CE2 4.14Å; E293-Y297 HydrophobicContact CB-CE2 3.95Å; E293-Y297 WeakPolarHBondContact O-CD2 3.43Å; E293-Y297 PolarHBondContact O-N 3.37Å; G294-Y297 PolarHBondContact O-N 2.92Å; Y297-M300 PolarHBondContact O-N 2.63Å; Y297-A301 PolarHBondContact O-N 3.38Å; Y297-I317 HydrophobicContact CD2-CD1 4.38Å
298	M	95.6	Very high	93.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.8	-43	174.4	179.9	176.3	63.1	0	0	112	E120 R123 I124 M127 G294 L295 M300 A301 D302 T310 F315	E120-M298 HydrophobicContact CB-CE 4.38Å; E120-M298 WeakPolarHBondContact OE2-CE 3.48Å; R123-M298 HydrophobicContact CB-SD 4.33Å; R123-M298 HydrophobicContact CG-SD 4.22Å; R123-M298 PolarHBondContact NE-SD 3.38Å; R123-M298 VanDerWaalsContact NE-SD 3.42Å; R123-M298 VanDerWaalsContact NH2-CG 3.28Å; R123-M298 PolarHBondContact NH2-SD 2.8Å; I124-M298 HydrophobicContact CB-CE 4.11Å; I124-M298 HydrophobicContact CB-SD 4Å; I124-M298 HydrophobicContact CD1-CB 3.71Å; I124-M298 HydrophobicContact CD1-CG 4.26Å; I124-M298 HydrophobicContact CD1-SD 3.95Å; M127-M298 HydrophobicContact CE-CB 4.39Å; M127-M298 HydrophobicContact CE-CG 3.64Å; M127-M298 HydrophobicContact CE-SD 3.23Å; M127-M298 WeakPolarHBondContact CE-SD 3.28Å; G294-M298 WeakPolarHBondContact O-CB 3.28Å; G294-M298 PolarHBondContact O-N 3.33Å; L295-M298 HydrophobicContact CD2-CE 3.57Å; L295-M298 PolarHBondContact O-N 2.69Å; M298-M300 VanDerWaalsContact C-N 3.34Å; M298-A301 PolarHBondContact O-N 2.73Å; M298-D302 PolarHBondContact O-N 3.36Å; M298-T310 HydrophobicContact CG-CG2 3.73Å; M298-F315 HydrophobicContact CB-CE1 4.47Å
299	A	95	Very high	93.7	Very high	25 Å²	25	43.5 Å²	43.5	21%	0.207	21%	0.209	C	C	.	.	H	α-helix	trans	-66.2	-37	178.6	0	0	0	0	0	112	I105 L295 A296 D302 E303	I105-A299 HydrophobicContact CD1-CB 3.94Å; I105-A299 HydrophobicContact CG2-CB 4.01Å; L295-A299 VanDerWaalsContact O-CB 3.3Å; L295-A299 WeakPolarHBondContact O-CB 3.41Å; L295-A299 PolarHBondContact O-N 2.67Å; A296-A299 PolarHBondContact O-N 3.36Å; A299-D302 PolarHBondContact O-N 3.04Å; A299-E303 WeakPolarHBondContact O-CB 3.25Å; A299-E303 PolarHBondContact O-N 2.79Å
300	M	95.5	Very high	94	Very high	0 Å²	0	38 Å²	38	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62.9	-45.7	171.3	-179.4	62.7	79.1	0	0	111.6	H101 A102 I105 L259 L262 Y263 A296 Y297 M298 D302 E303 V304	H101-M300 HydrophobicContact CB-CE 3.96Å; H101-M300 HydrophobicContact CB-SD 4.01Å; A102-M300 HydrophobicContact CB-CE 4.17Å; I105-M300 HydrophobicContact CG1-CB 4.47Å; I105-M300 HydrophobicContact CG1-CE 4.18Å; L259-M300 HydrophobicContact CB-CE 3.96Å; L259-M300 HydrophobicContact CD2-CB 3.87Å; L259-M300 HydrophobicContact CD2-CE 4.14Å; L259-M300 HydrophobicContact CD2-CG 4.39Å; L262-M300 HydrophobicContact CD2-CB 4.07Å; L262-M300 HydrophobicContact CD2-CG 4.12Å; L262-M300 HydrophobicContact CG-CG 4.2Å; Y263-M300 HydrophobicContact CD2-SD 3.95Å; Y263-M300 HydrophobicContact CG-SD 4.49Å; A296-M300 PolarHBondContact O-N 3.49Å; Y297-M300 PolarHBondContact O-N 2.63Å; M298-M300 VanDerWaalsContact C-N 3.34Å; M300-D302 PolarHBondContact O-N 2.74Å; M300-E303 PolarHBondContact O-N 3.44Å; M300-V304 WeakPolarHBondContact O-CG2 3.36Å; M300-V304 PolarHBondContact O-N 2.95Å; M300-V304 VanDerWaalsContact O-N 3.07Å; M300-V304 HydrophobicContact SD-CG2 3.95Å
301	A	96.2	Very high	94.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-60.6	-44.3	176.7	0	0	0	0	0	111.5	Y297 M298 E303 V304 L305 T310 F315	Y297-A301 PolarHBondContact O-N 3.38Å; M298-A301 PolarHBondContact O-N 2.73Å; A301-E303 PolarHBondContact O-N 2.82Å; A301-V304 PolarHBondContact O-N 2.8Å; A301-L305 HydrophobicContact CB-CD1 4.39Å; A301-L305 WeakPolarHBondContact O-CA 3.48Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.38Å; A301-T310 HydrophobicContact CB-CG2 4.06Å; A301-F315 HydrophobicContact CB-CD2 3.82Å; A301-F315 HydrophobicContact CB-CE1 4.31Å; A301-F315 HydrophobicContact CB-CE2 3.62Å; A301-F315 HydrophobicContact CB-CG 4.28Å; A301-F315 HydrophobicContact CB-CZ 3.87Å
302	D	95.3	Very high	94.2	Very high	31 Å²	31	41.1 Å²	41.1	17%	0.166	20%	0.201	C	C	.	.	H	α-helix	trans	-56.7	-46.8	174.1	-89.2	-2.3	0	0	0	113.2	R123 M298 A299 M300 G306 T310	R123-D302 IonicContact CZ-OD1 3.88Å; R123-D302 IonicContact CZ-OD2 2.58Å; R123-D302 IonicContact NH1-OD2 2.83Å; R123-D302 PolarHBondContact NH1-OD2 3.2Å; R123-D302 VanDerWaalsContact NH1-OD2 3.14Å; R123-D302 IonicContact NH2-OD1 3.86Å; R123-D302 PolarHBondContact NH2-OD1 2.92Å; R123-D302 IonicContact NH2-OD2 3.91Å; R123-D302 PolarHBondContact NH2-OD2 2.9Å; M298-D302 PolarHBondContact O-N 3.36Å; A299-D302 PolarHBondContact O-N 3.04Å; M300-D302 PolarHBondContact O-N 2.74Å; D302-G306 WeakPolarHBondContact O-CA 3.4Å; D302-G306 PolarHBondContact O-N 3.46Å; D302-T310 PolarHBondContact N-OG1 2.97Å; D302-T310 WeakPolarHBondContact OD1-CB 3.33Å; D302-T310 WeakPolarHBondContact OD1-CG2 3.37Å; D302-T310 PolarHBondContact OD1-OG1 3.16Å
303	E	94.4	Very high	94.1	Very high	77 Å²	77	38.5 Å²	38.5	36%	0.36	19%	0.188	S	C	.	.	H	α-helix	trans	-63.7	-43.1	-177.6	175.1	77.1	-177.7	0	0	111.3	H101 K104 I105 A299 M300 A301	H101-E303 IonicContact CE1-OE1 2.86Å; H101-E303 PolarHBondContact CE1-OE1 3.49Å; H101-E303 WeakPolarHBondContact ND1-CG 3.34Å; H101-E303 IonicContact ND1-OE1 3.85Å; H101-E303 PolarHBondContact ND1-OE1 3.43Å; K104-E303 IonicContact NZ-OE1 3.94Å; K104-E303 PolarHBondContact NZ-OE1 2.8Å; K104-E303 IonicContact NZ-OE2 4Å; K104-E303 PolarHBondContact NZ-OE2 3.01Å; I105-E303 HydrophobicContact CD1-CB 4.32Å; A299-E303 WeakPolarHBondContact O-CB 3.25Å; A299-E303 PolarHBondContact O-N 2.79Å; M300-E303 PolarHBondContact O-N 3.44Å; A301-E303 PolarHBondContact O-N 2.82Å
304	V	95	Very high	94.2	Very high	11 Å²	11	38.2 Å²	38.2	7%	0.067	19%	0.186	C	C	.	.	H	α-helix	trans	-85.1	-43.6	-174.5	-174.9	0	0	0	0	111.7	Y263 C266 K270 M300 A301	Y263-V304 HydrophobicContact CD2-CG2 3.44Å; Y263-V304 VanDerWaalsContact CD2-CG2 3.44Å; Y263-V304 HydrophobicContact CE2-CG2 3.71Å; Y263-V304 HydrophobicContact CG-CG2 4.42Å; C266-V304 HydrophobicContact CB-CB 3.86Å; C266-V304 HydrophobicContact CB-CG1 3.6Å; C266-V304 HydrophobicContact CB-CG2 4.41Å; K270-V304 WeakPolarHBondContact CD-O 3.49Å; K270-V304 WeakPolarHBondContact CE-O 3.37Å; K270-V304 PolarHBondContact NZ-O 3.05Å; M300-V304 WeakPolarHBondContact O-CG2 3.36Å; M300-V304 PolarHBondContact O-N 2.95Å; M300-V304 VanDerWaalsContact O-N 3.07Å; M300-V304 HydrophobicContact SD-CG2 3.95Å; A301-V304 PolarHBondContact O-N 2.8Å
305	L	94.8	Very high	94.2	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	19%	0.186	C	C	.	.	H	α-helix	trans	-100.7	-28.7	-169.9	-55.6	177	0	0	0	113.2	C266 V269 K270 V282 A301 W309	C266-L305 HydrophobicContact CB-CD1 4.09Å; C266-L305 HydrophobicContact CB-CD2 3.72Å; C266-L305 HydrophobicContact CB-CG 3.88Å; C266-L305 WeakPolarHBondContact O-CD2 3.34Å; C266-L305 VanDerWaalsContact SG-CD1 3.56Å; V269-L305 HydrophobicContact CG2-CD2 4.17Å; K270-L305 HydrophobicContact CB-CD2 4.16Å; V282-L305 HydrophobicContact CG2-CD1 4.48Å; A301-L305 HydrophobicContact CB-CD1 4.39Å; A301-L305 WeakPolarHBondContact O-CA 3.48Å; A301-L305 WeakPolarHBondContact O-CB 3.44Å; A301-L305 PolarHBondContact O-N 3.38Å; L305-W309 HydrophobicContact CB-CB 3.73Å; L305-W309 HydrophobicContact CB-CD2 4.09Å; L305-W309 HydrophobicContact CB-CE3 3.51Å; L305-W309 HydrophobicContact CB-CG 4.25Å; L305-W309 HydrophobicContact CB-CZ3 4.41Å; L305-W309 HydrophobicContact CD1-CB 4.48Å; L305-W309 HydrophobicContact CD1-CE3 3.76Å; L305-W309 HydrophobicContact CD1-CZ3 4.48Å; L305-W309 HydrophobicContact CD2-CD2 4.5Å; L305-W309 HydrophobicContact CD2-CE3 3.26Å; L305-W309 HydrophobicContact CD2-CZ3 3.33Å; L305-W309 HydrophobicContact CG-CE3 3.63Å; L305-W309 HydrophobicContact CG-CZ3 4.23Å
306	G	94.7	Very high	94.2	Very high	26 Å²	26	37.1 Å²	37.1	27%	0.268	18%	0.18	S	C	.	.			trans	89	149.9	-172.6	0	0	0	0	0	112.8	D302 K308 W309 T310	D302-G306 WeakPolarHBondContact O-CA 3.4Å; D302-G306 PolarHBondContact O-N 3.46Å; G306-K308 PolarHBondContact O-N 3.25Å; G306-W309 PolarHBondContact O-N 2.71Å; G306-T310 PolarHBondContact O-N 2.65Å; G306-T310 PolarHBondContact O-OG1 3.31Å
307	R	93.8	Very high	94.2	Very high	176 Å²	176	37.1 Å²	37.1	66%	0.664	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.5	-26.5	-176.1	-63.2	-169.2	-158.3	-128.2	9.4	114.9	W309 T310	R307-W309 VanDerWaalsContact C-N 3.25Å; R307-W309 PolarHBondContact O-N 2.81Å; R307-T310 PolarHBondContact O-N 3.22Å
308	K	92.8	Very high	94.1	Very high	170 Å²	170	37.1 Å²	37.1	74%	0.739	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-23.7	176.5	67.2	177.5	-178	177.8	0	113.7	G306	G306-K308 PolarHBondContact O-N 3.25Å
309	W	93.8	Very high	93.9	Very high	23 Å²	23	37.1 Å²	37.1	9%	0.087	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94	-23.8	172.2	-86.5	11.8	0	0	0	112.1	V269 K270 I279 L305 G306 R307 V311 F314	V269-W309 HydrophobicContact CB-CZ3 4.38Å; V269-W309 HydrophobicContact CG2-CZ3 4.09Å; K270-W309 HydrophobicContact CB-CH2 4.35Å; K270-W309 HydrophobicContact CB-CZ3 4.14Å; I279-W309 HydrophobicContact CB-CZ2 4.45Å; I279-W309 HydrophobicContact CG1-CZ2 4.31Å; I279-W309 HydrophobicContact CG2-CD2 4.24Å; I279-W309 VanDerWaalsContact CG2-CE2 3.46Å; I279-W309 HydrophobicContact CG2-CZ2 3.68Å; L305-W309 HydrophobicContact CB-CB 3.73Å; L305-W309 HydrophobicContact CB-CD2 4.09Å; L305-W309 HydrophobicContact CB-CE3 3.51Å; L305-W309 HydrophobicContact CB-CG 4.25Å; L305-W309 HydrophobicContact CB-CZ3 4.41Å; L305-W309 HydrophobicContact CD1-CB 4.48Å; L305-W309 HydrophobicContact CD1-CE3 3.76Å; L305-W309 HydrophobicContact CD1-CZ3 4.48Å; L305-W309 HydrophobicContact CD2-CD2 4.5Å; L305-W309 HydrophobicContact CD2-CE3 3.26Å; L305-W309 HydrophobicContact CD2-CZ3 3.33Å; L305-W309 HydrophobicContact CG-CE3 3.63Å; L305-W309 HydrophobicContact CG-CZ3 4.23Å; G306-W309 PolarHBondContact O-N 2.71Å; R307-W309 VanDerWaalsContact C-N 3.25Å; R307-W309 PolarHBondContact O-N 2.81Å; W309-V311 PolarHBondContact O-N 3.46Å; W309-F314 VanDerWaalsContact O-CB 3.27Å; W309-F314 WeakPolarHBondContact O-CB 3.34Å
310	T	94.4	Very high	93	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.018	18%	0.18	C	C	.	.	S	Bend	trans	-81.8	60.6	178.3	-37.5	0	0	0	0	111.4	M127 M298 A301 D302 G306 R307 F315	M127-T310 HydrophobicContact CE-CG2 4Å; M127-T310 VanDerWaalsContact SD-C 3.54Å; M127-T310 HydrophobicContact SD-CG2 3.87Å; M127-T310 VanDerWaalsContact SD-O 3.32Å; M298-T310 HydrophobicContact CG-CG2 3.73Å; A301-T310 HydrophobicContact CB-CG2 4.06Å; D302-T310 PolarHBondContact N-OG1 2.97Å; D302-T310 WeakPolarHBondContact OD1-CB 3.33Å; D302-T310 WeakPolarHBondContact OD1-CG2 3.37Å; D302-T310 PolarHBondContact OD1-OG1 3.16Å; G306-T310 PolarHBondContact O-N 2.65Å; G306-T310 PolarHBondContact O-OG1 3.31Å; R307-T310 PolarHBondContact O-N 3.22Å; T310-F315 HydrophobicContact CG2-CB 4.45Å; T310-F315 HydrophobicContact CG2-CD1 3.99Å; T310-F315 HydrophobicContact CG2-CG 4.31Å
311	V	93.7	Very high	92.5	Very high	61 Å²	61	41.1 Å²	41.1	37%	0.37	19%	0.194	S	C	.	.	S	Bend	trans	-133.9	160.4	177.8	-63.3	0	0	0	0	109.7	W309 D313 F314 F315	W309-V311 PolarHBondContact O-N 3.46Å; V311-D313 PolarHBondContact O-N 3.44Å; V311-F314 HydrophobicContact CG2-CD2 3.74Å; V311-F314 HydrophobicContact CG2-CE2 4.46Å; V311-F314 PolarHBondContact O-N 3.33Å; V311-F315 PolarHBondContact O-N 2.93Å
312	K	91.6	Very high	92.2	Very high	72 Å²	72	41.1 Å²	41.1	31%	0.313	19%	0.194	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-20	-172.7	71.8	-179.9	-179	-178.3	0	116	K126 A168 R316	K126-K312 WeakPolarHBondContact O-CB 3.41Å; A168-K312 HydrophobicContact CB-CB 3.94Å; K312-R316 VanDerWaalsContact O-CZ 3.29Å; K312-R316 PolarHBondContact O-NE 2.97Å; K312-R316 PolarHBondContact O-NH2 2.81Å
313	D	89.7	Confident	92	Very high	56 Å²	56	39.8 Å²	39.8	30%	0.299	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89	-11.6	179.4	-64	-50.2	0	0	0	113.2	R197 F245 V311	R197-D313 IonicContact CZ-OD1 2.98Å; R197-D313 IonicContact NH2-OD1 3.77Å; R197-D313 PolarHBondContact NH2-OD1 2.94Å; F245-D313 WeakPolarHBondContact CZ-O 3.27Å; V311-D313 PolarHBondContact O-N 3.44Å
314	F	93.1	Very high	91.6	Very high	36 Å²	36	44.1 Å²	44.1	16%	0.158	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-133.9	-8.7	-178.6	-55.9	-68.8	0	0	0	113.9	H243 I279 G281 V282 W309 V311	H243-F314 AromaticContact CD2-CE1 3.34Å; H243-F314 WeakPolarHBondContact CD2-CE1 3.12Å; H243-F314 AromaticContact CD2-CZ 3.99Å; H243-F314 AromaticContact NE2-CE1 3.44Å; H243-F314 WeakPolarHBondContact NE2-CE1 2.95Å; H243-F314 AromaticContact NE2-CZ 3.64Å; I279-F314 HydrophobicContact CB-CD1 4.23Å; I279-F314 HydrophobicContact CB-CE1 3.73Å; I279-F314 HydrophobicContact CB-CZ 4.38Å; I279-F314 HydrophobicContact CG2-CD1 3.41Å; I279-F314 VanDerWaalsContact CG2-CD1 3.41Å; I279-F314 HydrophobicContact CG2-CE1 3.35Å; I279-F314 HydrophobicContact CG2-CG 4.08Å; I279-F314 HydrophobicContact CG2-CZ 4.04Å; G281-F314 CarbonylContact C-O 3.57Å; G281-F314 WeakPolarHBondContact CA-O 3.23Å; V282-F314 PolarHBondContact N-O 2.91Å; W309-F314 VanDerWaalsContact O-CB 3.27Å; W309-F314 WeakPolarHBondContact O-CB 3.34Å; V311-F314 HydrophobicContact CG2-CD2 3.74Å; V311-F314 HydrophobicContact CG2-CE2 4.46Å; V311-F314 PolarHBondContact O-N 3.33Å
315	F	95	Very high	91.3	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	133.1	174	-169.1	-106	0	0	0	111.5	M127 L262 V282 M298 A301 T310 V311 I317	M127-F315 HydrophobicContact CE-CD1 4.17Å; M127-F315 HydrophobicContact SD-CB 4.22Å; M127-F315 HydrophobicContact SD-CD1 3.76Å; M127-F315 HydrophobicContact SD-CG 4.48Å; L262-F315 HydrophobicContact CD1-CE2 4.23Å; V282-F315 HydrophobicContact CB-CD2 4.19Å; V282-F315 HydrophobicContact CG1-CE2 4.47Å; V282-F315 VanDerWaalsContact O-CA 3.26Å; V282-F315 WeakPolarHBondContact O-CA 3.39Å; V282-F315 WeakPolarHBondContact O-CD2 3.06Å; M298-F315 HydrophobicContact CB-CE1 4.47Å; A301-F315 HydrophobicContact CB-CD2 3.82Å; A301-F315 HydrophobicContact CB-CE1 4.31Å; A301-F315 HydrophobicContact CB-CE2 3.62Å; A301-F315 HydrophobicContact CB-CG 4.28Å; A301-F315 HydrophobicContact CB-CZ 3.87Å; T310-F315 HydrophobicContact CG2-CB 4.45Å; T310-F315 HydrophobicContact CG2-CD1 3.99Å; T310-F315 HydrophobicContact CG2-CG 4.31Å; V311-F315 PolarHBondContact O-N 2.93Å; F315-I317 HydrophobicContact CD1-CG1 4.44Å; F315-I317 HydrophobicContact CE1-CD1 3.86Å; F315-I317 HydrophobicContact CE1-CG1 3.62Å; F315-I317 HydrophobicContact CZ-CD1 4.23Å; F315-I317 HydrophobicContact CZ-CG1 4.05Å
316	R	94.5	Very high	91.1	Very high	1 Å²	1	46.9 Å²	46.9	0%	0.004	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	152.1	174.9	-62.6	-69	-179.2	77	17.2	112.1	M127 E224 F245 V282 K283 M284 K312	M127-R316 VanDerWaalsContact O-CA 3.29Å; M127-R316 WeakPolarHBondContact O-CA 3.22Å; M127-R316 WeakPolarHBondContact O-CD 3.29Å; E224-R316 IonicContact OE1-CZ 3.75Å; E224-R316 IonicContact OE1-NH1 2.76Å; E224-R316 IonicContact OE1-NH2 3.78Å; E224-R316 PolarHBondContact OE1-NH2 3.42Å; E224-R316 IonicContact OE2-NH1 2.63Å; F245-R316 HydrophobicContact CE1-CG 4.01Å; F245-R316 HydrophobicContact CZ-CG 4.26Å; V282-R316 PolarHBondContact O-N 3.18Å; K283-R316 CarbonylContact C-O 3.6Å; K283-R316 WeakPolarHBondContact CA-O 3.16Å; K283-R316 HydrophobicContact CB-CB 4.16Å; K283-R316 HydrophobicContact CD-CB 4.26Å; K283-R316 HydrophobicContact CD-CG 4.41Å; K283-R316 HydrophobicContact CG-CB 3.84Å; K283-R316 HydrophobicContact CG-CG 4.19Å; M284-R316 PolarHBondContact N-O 3.45Å; K312-R316 VanDerWaalsContact O-CZ 3.29Å; K312-R316 PolarHBondContact O-NE 2.97Å; K312-R316 PolarHBondContact O-NH2 2.81Å
317	I	94.2	Very high	90.9	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	119.3	168.5	-58.4	-160.7	0	0	0	110.5	I124 M127 A128 E129 M284 I288 G294 Y297 F315 F322	I124-I317 HydrophobicContact CD1-CD1 3.37Å; I124-I317 HydrophobicContact CD1-CG1 4.04Å; I124-I317 HydrophobicContact CG1-CD1 4.29Å; M127-I317 PolarHBondContact O-N 2.75Å; A128-I317 CarbonylContact C-O 3.55Å; A128-I317 WeakPolarHBondContact CA-O 3.29Å; E129-I317 PolarHBondContact N-O 2.73Å; M284-I317 CarbonylContact O-C 3.58Å; M284-I317 VanDerWaalsContact O-CA 3.28Å; M284-I317 WeakPolarHBondContact O-CA 3.45Å; I288-I317 HydrophobicContact CB-CG2 3.79Å; I288-I317 HydrophobicContact CG1-CG2 3.3Å; I288-I317 HydrophobicContact CG2-CG2 4.3Å; G294-I317 WeakPolarHBondContact O-CD1 3.15Å; Y297-I317 HydrophobicContact CD2-CD1 4.38Å; F315-I317 HydrophobicContact CD1-CG1 4.44Å; F315-I317 HydrophobicContact CE1-CD1 3.86Å; F315-I317 HydrophobicContact CE1-CG1 3.62Å; F315-I317 HydrophobicContact CZ-CD1 4.23Å; F315-I317 HydrophobicContact CZ-CG1 4.05Å; I317-F322 HydrophobicContact CG2-CE1 3.94Å
318	G	93	Very high	90.7	Very high	1 Å²	1	39.8 Å²	39.8	1%	0.01	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	121.5	173.5	0	0	0	0	0	111.6	E129 M284 I288	E129-G318 WeakPolarHBondContact O-CA 3.06Å; M284-G318 PolarHBondContact O-N 3.46Å; I288-G318 PolarHBondContact N-O 2.7Å
319	T	91.4	Very high	90.6	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	160.5	-179.8	-169.5	0	0	0	0	113	A128 E129 V130 M131 I288 Y321 F322 L323	A128-T319 HydrophobicContact CB-CG2 4.12Å; E129-T319 PolarHBondContact O-N 2.81Å; V130-T319 CarbonylContact C-O 3.5Å; V130-T319 VanDerWaalsContact CA-O 3.27Å; V130-T319 WeakPolarHBondContact CA-O 3.32Å; M131-T319 PolarHBondContact N-O 3.46Å; I288-T319 PolarHBondContact O-OG1 3.07Å; T319-Y321 PolarHBondContact OG1-N 3.42Å; T319-F322 VanDerWaalsContact CB-CE1 3.43Å; T319-F322 HydrophobicContact CG2-CD1 3.61Å; T319-F322 HydrophobicContact CG2-CE1 3.3Å; T319-F322 HydrophobicContact CG2-CG 4.38Å; T319-F322 HydrophobicContact CG2-CZ 3.85Å; T319-F322 WeakPolarHBondContact OG1-CD1 3.47Å; T319-F322 PolarHBondContact OG1-N 2.96Å; T319-L323 HydrophobicContact CG2-CD1 4.43Å; T319-L323 HydrophobicContact CG2-CG 4.06Å
320	T	77	Confident	90.5	Very high	31 Å²	31	32.1 Å²	32.1	19%	0.19	17%	0.172	C	C	.	.	S	Bend	trans	-127.9	-29.6	158.5	39.2	0	0	0	0	111.4	M131	M131-T320 HydrophobicContact CB-CG2 4.02Å; M131-T320 WeakPolarHBondContact O-CG2 3.21Å
321	Y	83.5	Confident	90.2	Very high	78 Å²	78	34.3 Å²	34.3	31%	0.306	18%	0.183	S	C	.	.	S	Bend	trans	-89.7	-47.9	-166.1	-53.7	-79.4	0	0	0	113.6	L33 E287 R289 T319 L323 K324	L33-Y321 HydrophobicContact CD2-CE1 4.36Å; E287-Y321 HydrophobicContact CB-CE2 4.06Å; E287-Y321 HydrophobicContact CG-CE2 4.07Å; E287-Y321 VanDerWaalsContact OE1-CE2 3.29Å; E287-Y321 WeakPolarHBondContact OE1-CE2 3.5Å; E287-Y321 PolarHBondContact OE1-OH 3.4Å; R289-Y321 HydrophobicContact CG-CD2 4.38Å; R289-Y321 WeakPolarHBondContact O-CB 3.26Å; T319-Y321 PolarHBondContact OG1-N 3.42Å; Y321-L323 PolarHBondContact O-N 3.48Å; Y321-K324 PolarHBondContact O-N 3.18Å; Y321-K324 VanDerWaalsContact O-N 3.13Å
322	F	89.6	Confident	90	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-67.8	-18.1	-169.1	86	-112.9	0	0	0	113.1	I124 V125 A128 I288 R289 T290 L291 I317 T319 K324 D325 S326	I124-F322 HydrophobicContact CG1-CE2 4.37Å; I124-F322 HydrophobicContact CG1-CZ 4.07Å; I124-F322 HydrophobicContact CG2-CE2 4.24Å; V125-F322 HydrophobicContact CG2-CE2 4.42Å; A128-F322 HydrophobicContact CB-CZ 4.01Å; I288-F322 HydrophobicContact CB-CD1 4.27Å; I288-F322 HydrophobicContact CG2-CD1 4.06Å; R289-F322 PolarHBondContact O-N 3.01Å; T290-F322 WeakPolarHBondContact O-CB 3.23Å; L291-F322 HydrophobicContact CD1-CD2 4.35Å; I317-F322 HydrophobicContact CG2-CE1 3.94Å; T319-F322 VanDerWaalsContact CB-CE1 3.43Å; T319-F322 HydrophobicContact CG2-CD1 3.61Å; T319-F322 HydrophobicContact CG2-CE1 3.3Å; T319-F322 HydrophobicContact CG2-CG 4.38Å; T319-F322 HydrophobicContact CG2-CZ 3.85Å; T319-F322 WeakPolarHBondContact OG1-CD1 3.47Å; T319-F322 PolarHBondContact OG1-N 2.96Å; F322-K324 PolarHBondContact O-N 3.19Å; F322-D325 PolarHBondContact O-N 3.19Å; F322-S326 VanDerWaalsContact O-CB 3.3Å; F322-S326 WeakPolarHBondContact O-CB 3.28Å; F322-S326 PolarHBondContact O-N 3.28Å; F322-S326 PolarHBondContact O-OG 3.48Å
323	L	91.4	Very high	90	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	18%	0.179	C	C	.	.	H	α-helix	trans	-58.6	-38.1	176.3	-68.9	-179.5	0	0	0	111.7	V125 A128 V130 L148 P152 T319 Y321 S326 A327	V125-L323 HydrophobicContact CG1-CD2 4.44Å; V125-L323 HydrophobicContact CG2-CD2 3.85Å; A128-L323 HydrophobicContact CB-CD2 4.15Å; V130-L323 HydrophobicContact CG2-CD1 3.64Å; L148-L323 HydrophobicContact CD1-CD1 4.28Å; L148-L323 HydrophobicContact CD2-CD1 3.97Å; L148-L323 HydrophobicContact CG-CD1 3.86Å; P152-L323 HydrophobicContact CB-CD2 4.29Å; T319-L323 HydrophobicContact CG2-CD1 4.43Å; T319-L323 HydrophobicContact CG2-CG 4.06Å; Y321-L323 PolarHBondContact O-N 3.48Å; L323-S326 WeakPolarHBondContact CA-OG 3.04Å; L323-S326 PolarHBondContact O-OG 3.32Å; L323-A327 PolarHBondContact O-N 3.22Å
324	K	87.6	Confident	89.9	Confident	168 Å²	168	30.9 Å²	30.9	73%	0.73	17%	0.166	S	C	*	.	H	α-helix	trans	-66	-47.4	175.8	-174.6	179.7	177.5	-177.9	0	111.6	Y321 F322 S326 A327 G328	Y321-K324 PolarHBondContact O-N 3.18Å; Y321-K324 VanDerWaalsContact O-N 3.13Å; F322-K324 PolarHBondContact O-N 3.19Å; K324-S326 VanDerWaalsContact C-N 3.3Å; K324-S326 PolarHBondContact O-N 3.04Å; K324-A327 WeakPolarHBondContact O-CB 3.18Å; K324-A327 PolarHBondContact O-N 3.21Å; K324-G328 PolarHBondContact O-N 3.15Å
325	D	87.7	Confident	89.7	Confident	81 Å²	81	35.2 Å²	35.2	43%	0.433	19%	0.185	S	C	.	.	H	α-helix	trans	-61.4	-42.5	178.9	-64.8	-7.4	0	0	0	110.9	F322 A327 G328 A329	F322-D325 PolarHBondContact O-N 3.19Å; D325-A327 VanDerWaalsContact C-N 3.3Å; D325-A327 PolarHBondContact O-N 3.02Å; D325-G328 PolarHBondContact O-N 3.28Å; D325-A329 WeakPolarHBondContact O-CB 2.96Å; D325-A329 PolarHBondContact O-N 3.29Å
326	S	91.6	Very high	89.3	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-33.5	177.7	76.3	0	0	0	0	112.8	Y153 F322 L323 K324 L330	Y153-S326 VanDerWaalsContact CE1-OG 3.27Å; Y153-S326 WeakPolarHBondContact CE1-OG 3.41Å; Y153-S326 VanDerWaalsContact OH-CB 3.3Å; Y153-S326 WeakPolarHBondContact OH-CB 3.49Å; Y153-S326 PolarHBondContact OH-OG 3.37Å; F322-S326 VanDerWaalsContact O-CB 3.3Å; F322-S326 WeakPolarHBondContact O-CB 3.28Å; F322-S326 PolarHBondContact O-N 3.28Å; F322-S326 PolarHBondContact O-OG 3.48Å; L323-S326 WeakPolarHBondContact CA-OG 3.04Å; L323-S326 PolarHBondContact O-OG 3.32Å; K324-S326 VanDerWaalsContact C-N 3.3Å; K324-S326 PolarHBondContact O-N 3.04Å; S326-L330 WeakPolarHBondContact O-CB 3.46Å; S326-L330 PolarHBondContact O-N 3.44Å
327	A	90.2	Very high	88.8	Confident	18 Å²	18	46.7 Å²	46.7	15%	0.149	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-44.3	174.6	0	0	0	0	0	111.3	Y153 L323 K324 D325 L331	Y153-A327 HydrophobicContact CD1-CB 3.4Å; Y153-A327 VanDerWaalsContact CD1-CB 3.4Å; Y153-A327 VanDerWaalsContact CE1-CA 3.48Å; Y153-A327 HydrophobicContact CE1-CB 3.67Å; Y153-A327 HydrophobicContact CG-CB 4.43Å; L323-A327 PolarHBondContact O-N 3.22Å; K324-A327 WeakPolarHBondContact O-CB 3.18Å; K324-A327 PolarHBondContact O-N 3.21Å; D325-A327 VanDerWaalsContact C-N 3.3Å; D325-A327 PolarHBondContact O-N 3.02Å; A327-L331 WeakPolarHBondContact O-CB 3.5Å; A327-L331 PolarHBondContact O-N 3.2Å
328	G	89.5	Confident	88	Confident	34 Å²	34	55.5 Å²	55.5	35%	0.351	28%	0.279	S	S	.	.	H	α-helix	trans	-64.3	-47.9	177	0	0	0	0	0	112.1	K324 D325 L330 L331 N332	K324-G328 PolarHBondContact O-N 3.15Å; D325-G328 PolarHBondContact O-N 3.28Å; G328-L330 PolarHBondContact O-N 3.27Å; G328-L331 PolarHBondContact O-N 3.38Å; G328-N332 PolarHBondContact O-N 2.91Å; G328-N332 VanDerWaalsContact O-N 3.08Å; G328-N332 PolarHBondContact O-ND2 3.07Å
329	A	90.3	Very high	87.7	Confident	32 Å²	32	58.2 Å²	58.2	26%	0.264	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-46.9	176.8	0	0	0	0	0	111.6	I121 L291 D325 L331 N332 L333	I121-A329 HydrophobicContact CD1-CB 3.96Å; L291-A329 HydrophobicContact CD2-CB 3.92Å; D325-A329 WeakPolarHBondContact O-CB 2.96Å; D325-A329 PolarHBondContact O-N 3.29Å; A329-L331 PolarHBondContact O-N 3.08Å; A329-N332 PolarHBondContact O-N 2.9Å; A329-L333 VanDerWaalsContact O-CG 3.31Å; A329-L333 WeakPolarHBondContact O-CG 3.39Å; A329-L333 PolarHBondContact O-N 2.92Å
330	L	90.7	Very high	87.5	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-63.4	-43.1	179.4	-176.1	60.2	0	0	0	112.1	I118 I121 L122 Y153 I156 L161 S326 G328 N332 L333 I334	I118-L330 HydrophobicContact CB-CD1 4.21Å; I118-L330 HydrophobicContact CG1-CD1 3.94Å; I118-L330 HydrophobicContact CG2-CD1 3.81Å; I121-L330 HydrophobicContact CG2-CB 4.31Å; L122-L330 HydrophobicContact CD2-CD2 3.91Å; Y153-L330 HydrophobicContact CD2-CD2 3.51Å; Y153-L330 HydrophobicContact CE2-CD2 3.27Å; Y153-L330 HydrophobicContact CG-CD2 4.43Å; I156-L330 HydrophobicContact CD1-CB 4Å; I156-L330 HydrophobicContact CD1-CD2 3.71Å; I156-L330 HydrophobicContact CD1-CG 3.78Å; L161-L330 HydrophobicContact CD1-CD2 4.16Å; S326-L330 WeakPolarHBondContact O-CB 3.46Å; S326-L330 PolarHBondContact O-N 3.44Å; G328-L330 PolarHBondContact O-N 3.27Å; L330-N332 VanDerWaalsContact C-N 3.32Å; L330-N332 PolarHBondContact O-N 2.78Å; L330-L333 PolarHBondContact O-N 3.35Å; L330-I334 HydrophobicContact CD1-CD1 4.13Å; L330-I334 HydrophobicContact CD1-CG1 4.35Å; L330-I334 HydrophobicContact CG-CD1 3.93Å; L330-I334 VanDerWaalsContact O-CG1 3.28Å; L330-I334 WeakPolarHBondContact O-CG1 3.39Å; L330-I334 PolarHBondContact O-N 2.94Å
331	L	88.9	Confident	88.1	Confident	50 Å²	50	62.9 Å²	62.9	26%	0.262	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-42.6	177.5	-177.4	65.1	0	0	0	111.7	I156 A327 G328 A329 I334 K335	I156-L331 HydrophobicContact CD1-CB 4.34Å; I156-L331 HydrophobicContact CG1-CD1 4.49Å; A327-L331 WeakPolarHBondContact O-CB 3.5Å; A327-L331 PolarHBondContact O-N 3.2Å; G328-L331 PolarHBondContact O-N 3.38Å; A329-L331 PolarHBondContact O-N 3.08Å; L331-I334 PolarHBondContact O-N 3.23Å; L331-K335 WeakPolarHBondContact O-CG 3.13Å; L331-K335 PolarHBondContact O-N 3.4Å; L331-K335 VanDerWaalsContact O-N 3.09Å
332	N	90.2	Very high	88.4	Confident	92 Å²	92	62.1 Å²	62.1	49%	0.492	32%	0.315	S	S	.	.	H	α-helix	trans	-65.5	-43.9	178	-71.4	-17.3	0	0	0	111.6	G328 A329 L330 I334 K335 M336	G328-N332 PolarHBondContact O-N 2.91Å; G328-N332 VanDerWaalsContact O-N 3.08Å; G328-N332 PolarHBondContact O-ND2 3.07Å; A329-N332 PolarHBondContact O-N 2.9Å; L330-N332 VanDerWaalsContact C-N 3.32Å; L330-N332 PolarHBondContact O-N 2.78Å; N332-I334 VanDerWaalsContact C-N 3.34Å; N332-I334 PolarHBondContact O-N 2.9Å; N332-K335 WeakPolarHBondContact O-CB 3.45Å; N332-K335 PolarHBondContact O-N 3.38Å; N332-M336 WeakPolarHBondContact O-CG 3.23Å; N332-M336 PolarHBondContact O-N 3.05Å
333	L	90.8	Very high	88.3	Confident	18 Å²	18	65.9 Å²	65.9	9%	0.094	34%	0.335	C	S	.	.	H	α-helix	trans	-62.1	-41.2	177.4	-70.5	166	0	0	0	112.2	I114 K117 I118 I121 A329 L330 K335 M336 K337	I114-L333 HydrophobicContact CG2-CB 4.23Å; I114-L333 HydrophobicContact CG2-CD2 4.2Å; K117-L333 HydrophobicContact CB-CD1 3.63Å; K117-L333 HydrophobicContact CB-CD2 4.02Å; K117-L333 HydrophobicContact CB-CG 4.49Å; K117-L333 HydrophobicContact CD-CD2 3.75Å; K117-L333 HydrophobicContact CG-CD2 4.49Å; I118-L333 HydrophobicContact CD1-CB 4.12Å; I118-L333 HydrophobicContact CG1-CB 3.78Å; I118-L333 HydrophobicContact CG1-CD1 4.17Å; I121-L333 HydrophobicContact CD1-CD1 3.59Å; A329-L333 VanDerWaalsContact O-CG 3.31Å; A329-L333 WeakPolarHBondContact O-CG 3.39Å; A329-L333 PolarHBondContact O-N 2.92Å; L330-L333 PolarHBondContact O-N 3.35Å; L333-K335 VanDerWaalsContact C-N 3.33Å; L333-K335 PolarHBondContact O-N 2.72Å; L333-M336 PolarHBondContact O-N 2.72Å; L333-M336 VanDerWaalsContact O-N 3.17Å; L333-K337 PolarHBondContact O-N 3.05Å
334	I	87.7	Confident	88.1	Confident	6 Å²	6	70.2 Å²	70.2	3%	0.031	36%	0.356	C	S	.	.	H	α-helix	trans	-63.9	-39.5	176.1	-66.7	166	0	0	0	111	I118 I156 K160 L161 L330 L331 N332 M336 K337 H338	I118-I334 HydrophobicContact CD1-CG1 4.17Å; I156-I334 HydrophobicContact CD1-CD1 4.49Å; I156-I334 HydrophobicContact CG2-CD1 3.83Å; K160-I334 HydrophobicContact CB-CD1 4.5Å; K160-I334 HydrophobicContact CB-CG2 4.49Å; K160-I334 HydrophobicContact CD-CG2 4.05Å; L161-I334 HydrophobicContact CD2-CD1 4.2Å; L330-I334 HydrophobicContact CD1-CD1 4.13Å; L330-I334 HydrophobicContact CD1-CG1 4.35Å; L330-I334 HydrophobicContact CG-CD1 3.93Å; L330-I334 VanDerWaalsContact O-CG1 3.28Å; L330-I334 WeakPolarHBondContact O-CG1 3.39Å; L330-I334 PolarHBondContact O-N 2.94Å; L331-I334 PolarHBondContact O-N 3.23Å; N332-I334 VanDerWaalsContact C-N 3.34Å; N332-I334 PolarHBondContact O-N 2.9Å; I334-M336 VanDerWaalsContact C-N 3.26Å; I334-M336 PolarHBondContact O-N 2.86Å; I334-K337 PolarHBondContact O-N 2.99Å; I334-H338 PolarHBondContact O-CD2 3.12Å; I334-H338 PolarHBondContact O-N 3.44Å
335	K	88	Confident	88.2	Confident	128 Å²	128	63.2 Å²	63.2	56%	0.557	33%	0.33	S	S	*	.	H	α-helix	trans	-68.1	-21.3	174.9	-73.2	176.3	-179.7	-179.8	0	114.1	L331 N332 L333	L331-K335 WeakPolarHBondContact O-CG 3.13Å; L331-K335 PolarHBondContact O-N 3.4Å; L331-K335 VanDerWaalsContact O-N 3.09Å; N332-K335 WeakPolarHBondContact O-CB 3.45Å; N332-K335 PolarHBondContact O-N 3.38Å; L333-K335 VanDerWaalsContact C-N 3.33Å; L333-K335 PolarHBondContact O-N 2.72Å
336	M	87.7	Confident	88.2	Confident	133 Å²	133	61.8 Å²	61.8	66%	0.655	32%	0.322	S	S	*	.	H	α-helix	trans	-85.2	-19.3	175.2	-68.6	174.9	70.3	0	0	112	I114 N332 L333 I334	I114-M336 HydrophobicContact CD1-CB 3.85Å; I114-M336 HydrophobicContact CD1-CE 4.41Å; N332-M336 WeakPolarHBondContact O-CG 3.23Å; N332-M336 PolarHBondContact O-N 3.05Å; L333-M336 PolarHBondContact O-N 2.72Å; L333-M336 VanDerWaalsContact O-N 3.17Å; I334-M336 VanDerWaalsContact C-N 3.26Å; I334-M336 PolarHBondContact O-N 2.86Å
337	K	83.8	Confident	87.9	Confident	109 Å²	109	67 Å²	67	47%	0.474	35%	0.348	S	S	.	.	H	α-helix	trans	-82.4	-24.3	178.6	-174.2	172.9	179.4	170.6	0	112.9	I114 D115 L333 I334	I114-K337 HydrophobicContact CG2-CB 4.37Å; D115-K337 WeakPolarHBondContact OD1-CE 3.26Å; D115-K337 IonicContact OD1-NZ 2.66Å; D115-K337 PolarHBondContact OD1-NZ 2.88Å; D115-K337 IonicContact OD2-NZ 3.49Å; D115-K337 PolarHBondContact OD2-NZ 2.99Å; L333-K337 PolarHBondContact O-N 3.05Å; I334-K337 PolarHBondContact O-N 2.99Å
338	H	77.3	Confident	87.7	Confident	184 Å²	184	71.5 Å²	71.5	85%	0.852	37%	0.366	S	S	*	.			trans	-119.6	0	-178.7	-64	-67	0	0	0	109.4	I334	I334-H338 PolarHBondContact O-CD2 3.12Å; I334-H338 PolarHBondContact O-N 3.44Å

Retrieved 338 of 338 residues in 497.9 ms (Link to these results)

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