A0A087WXP3_HUMAN Loading...

Integrin beta

AlphaFold DB , UniProt , Accession A0A087WXP3, Species HUMAN (Homo sapiens, Human), Gene ITGB6, Length 693 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	26	Very low	29.8	Very low	243 Å²	243	149.6 Å²	149.6	100%	1.197	79%	0.788	S	S	*	*				0	99.1	0	-70.1	158.6	59.5	0	0	105
2	G	30.3	Very low	30	Very low	75 Å²	75	152.8 Å²	152.8	77%	0.773	79%	0.791	S	S	*	*			cis	88.5	74.9	39.2	0	0	0	0	0	107.2
3	I	39	Very low	30.5	Very low	157 Å²	157	149.8 Å²	149.8	81%	0.805	78%	0.776	S	S	*	*			trans	-82.3	129.7	-178.5	-65.1	174.8	0	0	0	108	L5	I3-L5 PolarHBondContact O-N 2.71Å; I3-L5 VanDerWaalsContact O-N 3.07Å
4	E	25.7	Very low	30.3	Very low	179 Å²	179	144.4 Å²	144.4	84%	0.836	78%	0.776	S	S	*	*			trans	-73.3	93.9	171.5	-71.6	-176.6	125.8	0	0	110	L6	E4-L6 PolarHBondContact O-N 3.05Å
5	L	32.5	Very low	30.6	Very low	147 Å²	147	150.3 Å²	150.3	77%	0.77	78%	0.782	S	S	*	*			trans	-79.5	71.1	168.1	-152.8	84.2	0	0	0	110.2	I3 C7	I3-L5 PolarHBondContact O-N 2.71Å; I3-L5 VanDerWaalsContact O-N 3.07Å; L5-C7 VanDerWaalsContact C-N 3.32Å; L5-C7 PolarHBondContact O-N 2.98Å
6	L	30.4	Very low	30.8	Very low	156 Å²	156	150.4 Å²	150.4	82%	0.817	78%	0.784	S	S	*	*			trans	-83.5	70.5	-178.7	-158.9	111.4	0	0	0	111.9	E4	E4-L6 PolarHBondContact O-N 3.05Å
7	C	27.4	Very low	31	Very low	91 Å²	91	150.2 Å²	150.2	62%	0.615	78%	0.784	S	S	*	*			trans	-138.4	66	176.2	-94.7	0	0	0	0	113.1	L5 F9	L5-C7 VanDerWaalsContact C-N 3.32Å; L5-C7 PolarHBondContact O-N 2.98Å; C7-F9 VanDerWaalsContact C-N 3.27Å; C7-F9 HydrophobicContact CB-CD2 4.28Å; C7-F9 PolarHBondContact O-N 2.82Å; C7-F9 VanDerWaalsContact O-N 3.15Å
8	L	24.8	Very low	31.3	Very low	153 Å²	153	150.8 Å²	150.8	80%	0.801	78%	0.782	S	S	*	*			trans	-85.1	71	165.6	-130	162.3	0	0	0	109.3	F10	L8-F10 HydrophobicContact CD2-CD2 3.77Å; L8-F10 HydrophobicContact CD2-CE2 3.55Å; L8-F10 PolarHBondContact O-N 2.98Å; L8-F10 VanDerWaalsContact O-N 3.09Å
9	F	30.2	Very low	31.7	Very low	158 Å²	158	148.7 Å²	148.7	69%	0.693	78%	0.776	S	S	*	*			trans	-79.2	87.2	-179.3	-99.2	-82.1	0	0	0	111.7	C7 L11	C7-F9 VanDerWaalsContact C-N 3.27Å; C7-F9 HydrophobicContact CB-CD2 4.28Å; C7-F9 PolarHBondContact O-N 2.82Å; C7-F9 VanDerWaalsContact O-N 3.15Å; F9-L11 VanDerWaalsContact C-N 3.25Å; F9-L11 HydrophobicContact CD1-CG 4.29Å; F9-L11 PolarHBondContact O-N 2.68Å
10	F	29.8	Very low	32.3	Very low	167 Å²	167	149 Å²	149	73%	0.732	77%	0.773	S	S	*	*			trans	-69.7	86.3	156	-84.5	-83.1	0	0	0	109.2	L8 F12	L8-F10 HydrophobicContact CD2-CD2 3.77Å; L8-F10 HydrophobicContact CD2-CE2 3.55Å; L8-F10 PolarHBondContact O-N 2.98Å; L8-F10 VanDerWaalsContact O-N 3.09Å; F10-F12 PolarHBondContact O-N 3.14Å
11	L	32.1	Very low	33.3	Very low	120 Å²	120	143.8 Å²	143.8	63%	0.628	76%	0.756	S	S	*	*			trans	-70.9	90.8	170.6	-88.7	162.6	0	0	0	109.9	F9 L13 L26	F9-L11 VanDerWaalsContact C-N 3.25Å; F9-L11 HydrophobicContact CD1-CG 4.29Å; F9-L11 PolarHBondContact O-N 2.68Å; L11-L13 PolarHBondContact O-N 2.7Å; L11-L26 HydrophobicContact CD1-CD2 4.37Å
12	F	31.5	Very low	35.3	Very low	187 Å²	187	135 Å²	135	82%	0.82	73%	0.728	S	S	*	*			trans	-64	130.2	163.1	-91.8	-89	0	0	0	109.7	F10 G14	F10-F12 PolarHBondContact O-N 3.14Å; F12-G14 PolarHBondContact O-N 2.6Å
13	L	37.3	Very low	37.7	Very low	114 Å²	114	134.2 Å²	134.2	60%	0.597	71%	0.714	S	S	*	*			trans	-65.9	96.9	-177	-74.2	161.3	0	0	0	111.2	L11 R15 E356	L11-L13 PolarHBondContact O-N 2.7Å; L13-R15 VanDerWaalsContact C-N 3.34Å; L13-R15 PolarHBondContact O-N 3.24Å; L13-E356 VanDerWaalsContact CD1-CD 3.43Å; L13-E356 HydrophobicContact CD1-CG 3.91Å; L13-E356 WeakPolarHBondContact CD1-OE2 3.04Å
14	G	26.9	Very low	40	Very low	75 Å²	75	132.3 Å²	132.3	77%	0.773	70%	0.702	S	S	*	*			trans	-77.8	73.8	-178	0	0	0	0	0	113.8	F12 N16	F12-G14 PolarHBondContact O-N 2.6Å; G14-N16 PolarHBondContact O-N 2.74Å
15	R	35.7	Very low	43.1	Very low	233 Å²	233	127 Å²	127	88%	0.879	68%	0.681	S	S	*	*			trans	31.1	80.7	151.6	-164.5	-177.9	-168.3	162.2	5.4	116.5	L13	L13-R15 VanDerWaalsContact C-N 3.34Å; L13-R15 PolarHBondContact O-N 3.24Å
16	N	33.8	Very low	45.9	Very low	151 Å²	151	121.7 Å²	121.7	81%	0.807	65%	0.654	S	S	*	*	S	Bend	trans	-140.6	123.5	149.4	-102.1	-12.5	0	0	0	108.3	G14	G14-N16 PolarHBondContact O-N 2.74Å
17	D	33.6	Very low	48.9	Very low	147 Å²	147	119.1 Å²	119.1	79%	0.786	64%	0.638	S	S	*	*			trans	31.5	91.4	170.3	-57.5	-26.9	0	0	0	117.7	V19	D17-V19 PolarHBondContact O-N 3.02Å
18	H	35.9	Very low	52	Low	162 Å²	162	115.5 Å²	115.5	75%	0.75	61%	0.613	S	S	*	*			trans	-62.2	96.2	169.3	-76.3	-84.4	0	0	0	111.3
19	V	38.7	Very low	55.2	Low	110 Å²	110	114.1 Å²	114.1	67%	0.667	60%	0.602	S	S	*	*			trans	-118.2	133	164.5	-172.7	0	0	0	0	107.7	D17 G21 G22	D17-V19 PolarHBondContact O-N 3.02Å; V19-G21 PolarHBondContact O-N 3.45Å; V19-G22 PolarHBondContact O-N 3.44Å
20	Q	43.8	Very low	58.1	Low	154 Å²	154	107.2 Å²	107.2	72%	0.72	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.6	126.5	170.7	-72.9	179.2	-24.2	0	0	109
21	G	53.9	Low	60.9	Low	40 Å²	40	106.9 Å²	106.9	41%	0.412	57%	0.566	S	S	.	*	T	Hydrogen-bonded Turn	trans	100.9	15.7	-170.2	0	0	0	0	0	115.2	V19 A23 N327	V19-G21 PolarHBondContact O-N 3.45Å; G21-A23 PolarHBondContact O-N 3.29Å; G21-N327 PolarHBondContact O-OD1 3.25Å
22	G	67.4	Low	63.3	Low	58 Å²	58	102 Å²	102	60%	0.598	54%	0.541	S	S	*	.			trans	-60.9	130.9	169.4	0	0	0	0	0	112.4	V19	V19-G22 PolarHBondContact O-N 3.44Å
23	A	82	Confident	65.7	Low	59 Å²	59	96.7 Å²	96.7	49%	0.488	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	137.8	177.1	0	0	0	0	0	110.6	G21 T325 V326 N327	G21-A23 PolarHBondContact O-N 3.29Å; A23-T325 HydrophobicContact CB-CG2 3.93Å; A23-V326 WeakPolarHBondContact CA-O 3.16Å; A23-N327 HydrophobicContact CB-CB 3.87Å
24	Q	87	Confident	67.8	Low	118 Å²	118	98 Å²	98	55%	0.551	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.1	130.6	-179.3	-175.4	62.9	29.3	0	0	110.7	T325 V326	Q24-T325 WeakPolarHBondContact O-CA 3.29Å; Q24-V326 PolarHBondContact N-O 3.14Å; Q24-V326 PolarHBondContact O-N 2.92Å
25	T	90.3	Very high	70.5	Confident	66 Å²	66	98.1 Å²	98.1	41%	0.405	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	133.2	176.5	-50.2	0	0	0	0	111.4	V324 T325	T25-V324 CarbonylContact C-O 3.45Å; T25-V324 WeakPolarHBondContact CA-O 3.25Å; T25-T325 PolarHBondContact OG1-OG1 3.06Å
26	L	91.7	Very high	73	Confident	36 Å²	36	88 Å²	88	19%	0.188	47%	0.471	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	149	176.3	-59.8	169.1	0	0	0	109.2	L11 S323 V324 V326 L351	L11-L26 HydrophobicContact CD1-CD2 4.37Å; L26-S323 CarbonylContact O-C 3.57Å; L26-S323 WeakPolarHBondContact O-CA 3.38Å; L26-V324 PolarHBondContact N-O 3.45Å; L26-V324 PolarHBondContact O-N 3.1Å; L26-V326 HydrophobicContact CD1-CG2 4.31Å; L26-L351 HydrophobicContact CD1-CD1 3.77Å; L26-L351 HydrophobicContact CD1-CD2 3.77Å; L26-L351 HydrophobicContact CD1-CG 4.46Å
27	Q	92.4	Very high	75.8	Confident	103 Å²	103	82.3 Å²	82.3	48%	0.481	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	125.5	171.8	-62.5	-62.5	-17.9	0	0	109.6	S323	Q27-S323 VanDerWaalsContact CD-OG 3.26Å; Q27-S323 PolarHBondContact NE2-OG 3.46Å; Q27-S323 PolarHBondContact OE1-OG 3.34Å
28	V	93.4	Very high	78.7	Confident	15 Å²	15	75.3 Å²	75.3	9%	0.091	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.4	178.2	-174.8	0	0	0	0	108.1	V30 S321 F322 V324 L349	V28-V30 HydrophobicContact CG1-CG2 4.29Å; V28-S321 CarbonylContact O-C 3.56Å; V28-S321 WeakPolarHBondContact O-CA 3.31Å; V28-F322 HydrophobicContact CB-CB 4.46Å; V28-F322 PolarHBondContact N-O 3.24Å; V28-F322 PolarHBondContact O-N 2.95Å; V28-V324 HydrophobicContact CG2-CG2 3.96Å; V28-L349 HydrophobicContact CG2-CD2 3.85Å
29	H	92.3	Very high	81.6	Confident	124 Å²	124	67.6 Å²	67.6	57%	0.574	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.3	125.4	179.2	-57.4	-70.6	0	0	0	109.4	T319 S321	H29-T319 HydrophobicContact CB-CG2 4.34Å; H29-S321 WeakPolarHBondContact ND1-CB 3.47Å; H29-S321 PolarHBondContact ND1-OG 3.2Å
30	V	91.6	Very high	84.4	Confident	12 Å²	12	62.4 Å²	62.4	7%	0.073	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	127	-179.2	-175.6	0	0	0	0	108.6	V28 V280 L282 T319 A320 F322 P342	V28-V30 HydrophobicContact CG1-CG2 4.29Å; V30-V280 HydrophobicContact CB-CG1 3.9Å; V30-V280 HydrophobicContact CG1-CG1 3.63Å; V30-V280 HydrophobicContact CG2-CG1 4.42Å; V30-L282 HydrophobicContact CG2-CD2 4Å; V30-T319 CarbonylContact O-C 3.34Å; V30-T319 WeakPolarHBondContact O-CA 3.48Å; V30-A320 PolarHBondContact N-O 2.94Å; V30-A320 PolarHBondContact O-N 3.49Å; V30-F322 HydrophobicContact CG2-CD2 4.33Å; V30-F322 HydrophobicContact CG2-CE2 4.21Å; V30-P342 HydrophobicContact CG1-CB 4.17Å; V30-P342 HydrophobicContact CG1-CG 3.64Å; V30-P342 HydrophobicContact CG2-CG 4.02Å
31	R	88.1	Confident	87	Confident	160 Å²	160	55 Å²	55	60%	0.604	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.8	178.4	-175.4	176.8	-168.7	-159.7	-4.7	109.4	G317 D318 T319	R31-G317 PolarHBondContact NE-O 3.13Å; R31-G317 PolarHBondContact NH2-O 3.14Å; R31-D318 WeakPolarHBondContact CG-O 3.49Å; R31-T319 HydrophobicContact CB-CG2 4.34Å; R31-T319 WeakPolarHBondContact CD-OG1 3.4Å
32	Q	82	Confident	89	Confident	19 Å²	19	53.1 Å²	53.1	9%	0.089	28%	0.284	C	S	.	.			trans	-83.7	129.6	173.7	-58.1	-173.7	-2.7	0	0	110.3	R277 E279 V280 G317	Q32-R277 PolarHBondContact NE2-O 3.42Å; Q32-R277 PolarHBondContact OE1-O 2.83Å; Q32-E279 PolarHBondContact NE2-O 2.85Å; Q32-V280 HydrophobicContact CG-CG2 4.2Å; Q32-G317 WeakPolarHBondContact O-CA 3.27Å; Q32-G317 PolarHBondContact O-N 3.41Å
33	T	83	Confident	90.5	Very high	75 Å²	75	50.4 Å²	50.4	46%	0.46	26%	0.255	S	S	.	.			trans	-75	149	176.6	-177	0	0	0	0	112.1	D35 Y36 R277	T33-D35 WeakPolarHBondContact CG2-O 3.22Å; T33-Y36 HydrophobicContact CG2-CD2 3.52Å; T33-Y36 HydrophobicContact CG2-CE2 4.49Å; T33-Y36 HydrophobicContact CG2-CG 4.09Å; T33-R277 PolarHBondContact O-NH2 3.48Å
34	E	79.8	Confident	91.2	Very high	142 Å²	142	47.6 Å²	47.6	66%	0.664	23%	0.232	S	C	*	.	S	Bend	trans	-62.2	-49.1	-176.7	-70.7	172.9	-166.7	0	0	112.7	V316	E34-V316 HydrophobicContact CB-CG1 4.35Å; E34-V316 HydrophobicContact CG-CG1 4.14Å
35	D	85	Confident	91.7	Very high	76 Å²	76	42 Å²	42	41%	0.406	21%	0.206	S	C	.	.	S	Bend	trans	-108.2	108.5	174.2	-174	21.9	0	0	0	109	T33 T72 S73	T33-D35 WeakPolarHBondContact CG2-O 3.22Å; D35-T72 WeakPolarHBondContact OD1-CA 3.27Å; D35-S73 PolarHBondContact OD1-N 3.02Å; D35-S73 PolarHBondContact OD1-OG 3.13Å; D35-S73 VanDerWaalsContact OD2-CB 3.24Å; D35-S73 WeakPolarHBondContact OD2-CB 3.15Å; D35-S73 PolarHBondContact OD2-OG 3.11Å
36	Y	86.8	Confident	91.9	Very high	22 Å²	22	38.9 Å²	38.9	9%	0.086	19%	0.187	C	C	.	.			trans	-121.9	141.1	174	-160.8	-113.6	0	0	0	109.4	T33 T72 L168 L345	T33-Y36 HydrophobicContact CG2-CD2 3.52Å; T33-Y36 HydrophobicContact CG2-CE2 4.49Å; T33-Y36 HydrophobicContact CG2-CG 4.09Å; Y36-T72 WeakPolarHBondContact O-CB 3.33Å; Y36-T72 PolarHBondContact O-OG1 2.62Å; Y36-L168 HydrophobicContact CD1-CB 4.4Å; Y36-L168 HydrophobicContact CD1-CD1 3.94Å; Y36-L168 HydrophobicContact CD1-CG 3.76Å; Y36-L168 HydrophobicContact CE1-CG 3.99Å; Y36-L345 HydrophobicContact CE1-CD2 3.96Å
37	P	93.3	Very high	92	Very high	30 Å²	30	37.2 Å²	37.2	20%	0.195	18%	0.178	C	C	.	.			trans	-65.3	145.2	178.3	-19	32.8	0	0	0	111.7	N74 D166 S167 L168	P37-N74 HydrophobicContact CB-CB 4.21Å; P37-D166 WeakPolarHBondContact CG-O 3.19Å; P37-S167 WeakPolarHBondContact O-CA 3.47Å; P37-S167 WeakPolarHBondContact O-CB 3.18Å; P37-L168 PolarHBondContact O-N 2.95Å
38	V	94.6	Very high	91.9	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	129.8	178.6	-178.3	0	0	0	0	109.6	M68 T72 N74 F75 R76 R164 L168 L170 Y273	V38-M68 HydrophobicContact CB-CE 4.5Å; V38-M68 HydrophobicContact CG1-CE 4.11Å; V38-M68 HydrophobicContact CG2-CE 4.48Å; V38-T72 HydrophobicContact CB-CG2 4.13Å; V38-T72 HydrophobicContact CG2-CG2 3.86Å; V38-N74 PolarHBondContact N-O 3.41Å; V38-F75 HydrophobicContact CB-CD2 4.19Å; V38-F75 HydrophobicContact CG1-CD2 4.19Å; V38-F75 HydrophobicContact CG1-CE2 4.38Å; V38-F75 WeakPolarHBondContact O-CA 3.37Å; V38-R76 PolarHBondContact O-N 3.04Å; V38-R164 PolarHBondContact O-NH2 2.83Å; V38-L168 HydrophobicContact CG2-CB 4.44Å; V38-L170 HydrophobicContact CG1-CD1 3.69Å; V38-L170 HydrophobicContact CG1-CG 4.06Å; V38-Y273 HydrophobicContact CG2-CD2 4.46Å; V38-Y273 HydrophobicContact CG2-CE2 3.71Å
39	D	96.3	Very high	91.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	129.4	165.8	-72.9	-16.4	0	0	0	108.3	R76 L121 W163 R164 S167 L168 H169 L170	D39-R76 IonicContact OD1-CZ 3.5Å; D39-R76 IonicContact OD1-NE 3.15Å; D39-R76 PolarHBondContact OD1-NE 2.72Å; D39-R76 IonicContact OD1-NH2 2.92Å; D39-R76 PolarHBondContact OD1-NH2 2.87Å; D39-R76 IonicContact OD2-CZ 3.53Å; D39-R76 IonicContact OD2-NE 3.33Å; D39-R76 IonicContact OD2-NH2 3.71Å; D39-R76 PolarHBondContact OD2-NH2 3.41Å; D39-L121 HydrophobicContact CB-CD1 3.96Å; D39-L121 HydrophobicContact CB-CD2 3.98Å; D39-W163 HydrophobicContact CB-CE3 3.56Å; D39-W163 HydrophobicContact CB-CZ3 3.55Å; D39-R164 IonicContact OD1-CZ 2.7Å; D39-R164 IonicContact OD1-NE 3.67Å; D39-R164 PolarHBondContact OD1-NE 3.37Å; D39-R164 IonicContact OD1-NH2 2.6Å; D39-R164 PolarHBondContact OD1-NH2 3.45Å; D39-R164 PolarHBondContact OD2-N 3.34Å; D39-R164 IonicContact OD2-NE 2.74Å; D39-S167 PolarHBondContact OD2-OG 2.96Å; D39-L168 PolarHBondContact N-O 3.25Å; D39-L168 VanDerWaalsContact O-O 3.13Å; D39-H169 IonicContact OD2-CD2 2.64Å; D39-L170 PolarHBondContact O-N 2.59Å
40	L	97.3	Very high	91.8	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	117.9	176	-172.3	149.1	0	0	0	110.7	Y42 L64 F75 R76 L77 G78 L121 L170 V172 I269	L40-Y42 HydrophobicContact CD2-CD2 4.49Å; L40-L64 HydrophobicContact CD1-CD2 4.19Å; L40-L64 HydrophobicContact CD2-CD2 4.13Å; L40-F75 HydrophobicContact CB-CE2 3.66Å; L40-F75 HydrophobicContact CB-CZ 3.92Å; L40-F75 HydrophobicContact CD1-CE2 4.33Å; L40-F75 HydrophobicContact CD1-CZ 4.46Å; L40-R76 PolarHBondContact N-O 3.41Å; L40-L77 CarbonylContact O-C 3.6Å; L40-L77 VanDerWaalsContact O-CA 3.27Å; L40-L77 WeakPolarHBondContact O-CA 3.37Å; L40-G78 PolarHBondContact O-N 3.08Å; L40-L121 WeakPolarHBondContact O-CD2 3.43Å; L40-L170 CarbonylContact C-O 3.54Å; L40-L170 WeakPolarHBondContact CA-O 3.42Å; L40-L170 HydrophobicContact CD1-CD1 4.45Å; L40-L170 HydrophobicContact CG-CB 4.38Å; L40-V172 HydrophobicContact CD1-CG2 3.9Å; L40-V172 HydrophobicContact CD2-CG2 4.04Å; L40-V172 HydrophobicContact CG-CG2 3.89Å; L40-I269 HydrophobicContact CD1-CD1 4.23Å; L40-I269 HydrophobicContact CD1-CG1 4.48Å; L40-I269 HydrophobicContact CD1-CG2 3.43Å; L40-I269 VanDerWaalsContact CD1-CG2 3.43Å
41	Y	98.3	Very high	91.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	113.2	173.3	-166.8	-98.2	0	0	0	109.7	L43 F79 G80 H117 A154 I161 W163 L170 V172	Y41-L43 HydrophobicContact CD1-CB 4.34Å; Y41-L43 HydrophobicContact CE1-CB 4.42Å; Y41-L43 HydrophobicContact CE1-CD1 4.38Å; Y41-F79 PolarHBondContact OH-O 3.04Å; Y41-G80 VanDerWaalsContact OH-CA 3.26Å; Y41-G80 WeakPolarHBondContact OH-CA 3.2Å; Y41-G80 PolarHBondContact OH-N 3.01Å; Y41-H117 AromaticContact CE2-CE1 3.97Å; Y41-H117 AromaticContact CE2-ND1 3.64Å; Y41-H117 AromaticContact CZ-ND1 3.66Å; Y41-H117 PolarHBondContact OH-ND1 2.83Å; Y41-A154 HydrophobicContact CD1-CB 4.09Å; Y41-A154 HydrophobicContact CE1-CB 3.92Å; Y41-I161 HydrophobicContact CD2-CG2 3.52Å; Y41-I161 HydrophobicContact CE1-CD1 4.49Å; Y41-I161 HydrophobicContact CE2-CD1 3.93Å; Y41-I161 HydrophobicContact CE2-CG2 3.83Å; Y41-I161 HydrophobicContact CG-CG2 4.02Å; Y41-W163 VanDerWaalsContact CB-CH2 3.44Å; Y41-W163 HydrophobicContact CG-CZ2 4.43Å; Y41-L170 PolarHBondContact N-O 2.85Å; Y41-V172 PolarHBondContact O-N 3.34Å
42	Y	97.6	Very high	91.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	113.1	179.1	-162.4	-81.3	0	0	0	108.9	L40 M44 I57 L60 G78 F79 G80 F128 V174 I265 I269	L40-Y42 HydrophobicContact CD2-CD2 4.49Å; Y42-M44 HydrophobicContact CD1-CB 4.02Å; Y42-M44 HydrophobicContact CE1-CB 3.82Å; Y42-M44 HydrophobicContact CE1-CG 3.94Å; Y42-M44 HydrophobicContact CE1-SD 4.2Å; Y42-I57 HydrophobicContact CE1-CD1 4.15Å; Y42-L60 HydrophobicContact CD2-CD2 4.18Å; Y42-L60 HydrophobicContact CE2-CD2 3.47Å; Y42-L60 VanDerWaalsContact CE2-CD2 3.47Å; Y42-G78 PolarHBondContact N-O 3.16Å; Y42-F79 AromaticContact CD1-CD2 3.83Å; Y42-F79 HydrophobicContact CD1-CD2 3.83Å; Y42-F79 AromaticContact CD1-CE2 3.7Å; Y42-F79 HydrophobicContact CD1-CE2 3.7Å; Y42-F79 HydrophobicContact CE1-CE2 4.24Å; Y42-F79 HydrophobicContact CG-CD2 4.38Å; Y42-F79 WeakPolarHBondContact O-CA 3.39Å; Y42-G80 PolarHBondContact O-N 2.93Å; Y42-F128 HydrophobicContact CG-CE2 4.47Å; Y42-F128 HydrophobicContact CG-CZ 4.18Å; Y42-V174 HydrophobicContact CE1-CB 4.48Å; Y42-V174 HydrophobicContact CE1-CG2 3.91Å; Y42-V174 HydrophobicContact CE2-CG2 4.13Å; Y42-I265 HydrophobicContact CE2-CG1 3.85Å; Y42-I269 HydrophobicContact CE2-CD1 4.48Å
43	L	98.1	Very high	92.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	105.7	-178.3	-179.3	59.5	0	0	0	109.4	Y41 F82 F115 A150 I151 L171 V172 F173 V174	Y41-L43 HydrophobicContact CD1-CB 4.34Å; Y41-L43 HydrophobicContact CE1-CB 4.42Å; Y41-L43 HydrophobicContact CE1-CD1 4.38Å; L43-F82 HydrophobicContact CD1-CD1 3.79Å; L43-F82 HydrophobicContact CD1-CE1 4.42Å; L43-F82 HydrophobicContact CD2-CD1 4.45Å; L43-F82 HydrophobicContact CG-CD1 3.8Å; L43-F82 HydrophobicContact CG-CE1 3.95Å; L43-F115 HydrophobicContact CD1-CD2 4.02Å; L43-F115 HydrophobicContact CD1-CE2 3.59Å; L43-A150 HydrophobicContact CD1-CB 3.95Å; L43-A150 HydrophobicContact CD2-CB 3.86Å; L43-A150 HydrophobicContact CG-CB 4.39Å; L43-I151 HydrophobicContact CD2-CG1 3.89Å; L43-L171 HydrophobicContact CB-CD2 4.18Å; L43-L171 HydrophobicContact CD2-CD2 3.95Å; L43-V172 WeakPolarHBondContact CA-O 3.39Å; L43-V172 PolarHBondContact N-O 2.86Å; L43-F173 HydrophobicContact CD2-CD2 4.12Å; L43-F173 HydrophobicContact CG-CD2 4.49Å; L43-V174 PolarHBondContact O-N 3.19Å
44	M	96.7	Very high	92.4	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.5	-169.5	-161.6	-172.5	166.6	0	0	112.7	Y42 L46 M50 D53 L54 I57 F79 G80 S81 F82 V174	Y42-M44 HydrophobicContact CD1-CB 4.02Å; Y42-M44 HydrophobicContact CE1-CB 3.82Å; Y42-M44 HydrophobicContact CE1-CG 3.94Å; Y42-M44 HydrophobicContact CE1-SD 4.2Å; M44-L46 HydrophobicContact CE-CD2 4.18Å; M44-L46 HydrophobicContact SD-CD2 3.99Å; M44-M50 HydrophobicContact CE-CB 4.19Å; M44-M50 HydrophobicContact CE-CE 4.04Å; M44-D53 HydrophobicContact CE-CB 3.8Å; M44-L54 HydrophobicContact CE-CB 4.24Å; M44-L54 HydrophobicContact CE-CD1 4.49Å; M44-L54 HydrophobicContact SD-CD1 4.32Å; M44-I57 HydrophobicContact CE-CD1 4.23Å; M44-I57 HydrophobicContact SD-CD1 3.41Å; M44-I57 WeakPolarHBondContact SD-CD1 3.34Å; M44-I57 HydrophobicContact SD-CG1 4.38Å; M44-F79 HydrophobicContact CB-CE2 3.96Å; M44-F79 HydrophobicContact CB-CZ 4.02Å; M44-F79 HydrophobicContact SD-CE2 4.34Å; M44-F79 HydrophobicContact SD-CZ 4.3Å; M44-G80 PolarHBondContact N-O 3.03Å; M44-S81 WeakPolarHBondContact O-CA 3.34Å; M44-F82 VanDerWaalsContact C-CE1 3.49Å; M44-F82 WeakPolarHBondContact O-CD1 3.37Å; M44-F82 PolarHBondContact O-N 3.49Å; M44-V174 HydrophobicContact CG-CB 4.48Å
45	D	97	Very high	92.8	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	129.8	162.1	-168.3	-14.1	0	0	0	110.6	S47 M50 F82 V174 S175	D45-S47 WeakPolarHBondContact OD1-CB 3.17Å; D45-S47 PolarHBondContact OD1-N 2.85Å; D45-S47 PolarHBondContact OD1-OG 3.47Å; D45-S47 VanDerWaalsContact OD1-OG 3.06Å; D45-M50 HydrophobicContact CB-CG 4.02Å; D45-M50 WeakPolarHBondContact O-CB 3.4Å; D45-F82 HydrophobicContact CB-CE1 4.2Å; D45-F82 HydrophobicContact CB-CE2 3.85Å; D45-F82 HydrophobicContact CB-CZ 3.6Å; D45-F82 VanDerWaalsContact N-CE1 3.34Å; D45-V174 WeakPolarHBondContact CB-O 3.46Å; D45-V174 PolarHBondContact N-O 3.46Å; D45-S175 WeakPolarHBondContact OD2-CB 3.41Å; D45-S175 PolarHBondContact OD2-OG 3.07Å
46	L	95.9	Very high	92.9	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	13%	0.125	C	C	.	.			trans	-118.9	30.2	174	-68.6	-175	0	0	0	112.1	M44 L54 F82 V83 F113 Q135 I137 S138	M44-L46 HydrophobicContact CE-CD2 4.18Å; M44-L46 HydrophobicContact SD-CD2 3.99Å; L46-L54 HydrophobicContact CD2-CD1 4.23Å; L46-L54 HydrophobicContact CD2-CD2 4.4Å; L46-F82 PolarHBondContact N-O 3.23Å; L46-V83 HydrophobicContact CB-CG2 4.34Å; L46-F113 HydrophobicContact CD1-CZ 4.43Å; L46-Q135 HydrophobicContact CD1-CB 4.22Å; L46-I137 CarbonylContact O-C 3.54Å; L46-I137 WeakPolarHBondContact O-CA 3.22Å; L46-S138 PolarHBondContact O-N 3.4Å
47	S	93.3	Very high	93	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.007	12%	0.121	C	C	.	.	S	Bend	trans	-55.7	169.5	160.1	69.1	0	0	0	0	111.9	D45 S49 M50 S138 E145	D45-S47 WeakPolarHBondContact OD1-CB 3.17Å; D45-S47 PolarHBondContact OD1-N 2.85Å; D45-S47 PolarHBondContact OD1-OG 3.47Å; D45-S47 VanDerWaalsContact OD1-OG 3.06Å; S47-S49 VanDerWaalsContact C-N 3.29Å; S47-S49 PolarHBondContact O-N 3.41Å; S47-S49 PolarHBondContact OG-OG 3.46Å; S47-M50 PolarHBondContact O-N 2.92Å; S47-S138 CarbonylContact C-O 3.58Å; S47-E145 WeakPolarHBondContact CB-OE1 3.3Å
48	A	90.4	Very high	92.6	Very high	49 Å²	49	21.2 Å²	21.2	41%	0.405	12%	0.124	S	C	.	.	G	3₁₀ helix	trans	-74.8	-16.7	-172	0	0	0	0	0	114.1	S138 A139	A48-S138 WeakPolarHBondContact CA-O 3.24Å; A48-S138 PolarHBondContact N-O 2.84Å; A48-A139 HydrophobicContact CB-CB 4.2Å
49	S	90.6	Very high	92	Very high	54 Å²	54	26 Å²	26	38%	0.378	15%	0.146	S	C	.	.	G	3₁₀ helix	trans	-69.3	-34.8	172.7	36	0	0	0	0	111.8	S47 D51 D176	S47-S49 VanDerWaalsContact C-N 3.29Å; S47-S49 PolarHBondContact O-N 3.41Å; S47-S49 PolarHBondContact OG-OG 3.46Å; S49-D51 PolarHBondContact O-N 3.15Å; S49-D176 WeakPolarHBondContact CB-OD2 3.2Å; S49-D176 PolarHBondContact OG-OD1 3.06Å; S49-D176 PolarHBondContact OG-OD2 3.08Å
50	M	91.7	Very high	91.4	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-80.1	19.3	-171.2	-57.7	-66.4	-65.5	0	0	114.9	M44 D45 S47 D53 L54 V174 D176	M44-M50 HydrophobicContact CE-CB 4.19Å; M44-M50 HydrophobicContact CE-CE 4.04Å; D45-M50 HydrophobicContact CB-CG 4.02Å; D45-M50 WeakPolarHBondContact O-CB 3.4Å; S47-M50 PolarHBondContact O-N 2.92Å; M50-D53 HydrophobicContact CE-CB 3.9Å; M50-L54 WeakPolarHBondContact O-CB 3.24Å; M50-L54 PolarHBondContact O-N 2.94Å; M50-V174 HydrophobicContact CE-CG1 4.01Å; M50-D176 HydrophobicContact SD-CB 3.99Å
51	D	89.9	Confident	90.8	Very high	43 Å²	43	26.4 Å²	26.4	23%	0.23	15%	0.148	C	C	.	.	H	α-helix	trans	-71.6	-39.5	-178.4	-166.3	35.8	0	0	0	112	S49 L54 N55 Y107 I137	S49-D51 PolarHBondContact O-N 3.15Å; D51-L54 PolarHBondContact O-N 2.91Å; D51-N55 PolarHBondContact O-N 3.05Å; D51-N55 PolarHBondContact O-ND2 2.83Å; D51-Y107 PolarHBondContact OD1-OH 2.96Å; D51-Y107 PolarHBondContact OD2-OH 2.86Å; D51-I137 HydrophobicContact CB-CD1 3.81Å; D51-I137 HydrophobicContact CB-CG2 3.9Å
52	D	88.8	Confident	90.3	Very high	83 Å²	83	28.2 Å²	28.2	44%	0.444	16%	0.161	S	C	.	.	H	α-helix	trans	-72.4	-37.2	175.6	50.5	-46.4	0	0	0	112.8	L54 N55 T56	D52-L54 VanDerWaalsContact C-N 3.31Å; D52-L54 PolarHBondContact O-N 3.1Å; D52-N55 WeakPolarHBondContact O-CA 3.29Å; D52-N55 WeakPolarHBondContact O-CB 3.44Å; D52-N55 PolarHBondContact O-N 2.95Å; D52-T56 PolarHBondContact O-N 3.18Å; D52-T56 VanDerWaalsContact O-N 3.13Å
53	D	90.6	Very high	89.9	Confident	4 Å²	4	34.9 Å²	34.9	2%	0.021	19%	0.186	C	C	.	.	H	α-helix	trans	-54.4	-48.1	166.8	-57.4	-101	0	0	0	111.3	M44 M50 N55 T56 I57 S262	M44-D53 HydrophobicContact CE-CB 3.8Å; M50-D53 HydrophobicContact CE-CB 3.9Å; D53-N55 PolarHBondContact O-N 3.28Å; D53-N55 VanDerWaalsContact O-N 3.11Å; D53-T56 PolarHBondContact O-N 3.05Å; D53-T56 PolarHBondContact O-OG1 3.3Å; D53-I57 WeakPolarHBondContact O-CG1 3.22Å; D53-I57 PolarHBondContact O-N 2.77Å; D53-S262 WeakPolarHBondContact OD1-CB 3.37Å; D53-S262 PolarHBondContact OD1-N 2.66Å; D53-S262 PolarHBondContact OD1-OG 3.3Å
54	L	89.1	Confident	89.5	Confident	5 Å²	5	34.9 Å²	34.9	3%	0.026	19%	0.186	C	C	.	.	H	α-helix	trans	-61.2	-24.4	178	-172	64.6	0	0	0	112.1	M44 L46 M50 D51 D52 I57 K58 V132 Q135 I137	M44-L54 HydrophobicContact CE-CB 4.24Å; M44-L54 HydrophobicContact CE-CD1 4.49Å; M44-L54 HydrophobicContact SD-CD1 4.32Å; L46-L54 HydrophobicContact CD2-CD1 4.23Å; L46-L54 HydrophobicContact CD2-CD2 4.4Å; M50-L54 WeakPolarHBondContact O-CB 3.24Å; M50-L54 PolarHBondContact O-N 2.94Å; D51-L54 PolarHBondContact O-N 2.91Å; D52-L54 VanDerWaalsContact C-N 3.31Å; D52-L54 PolarHBondContact O-N 3.1Å; L54-I57 HydrophobicContact CD1-CD1 4.32Å; L54-I57 HydrophobicContact CD1-CG1 4.46Å; L54-K58 WeakPolarHBondContact O-CE 3.4Å; L54-K58 WeakPolarHBondContact O-CG 3.45Å; L54-V132 HydrophobicContact CD1-CG1 3.99Å; L54-Q135 HydrophobicContact CD1-CB 4.02Å; L54-Q135 HydrophobicContact CD2-CB 4.12Å; L54-I137 HydrophobicContact CD2-CG2 4.45Å
55	N	87.9	Confident	89.2	Confident	84 Å²	84	36.6 Å²	36.6	45%	0.449	20%	0.198	S	C	.	.	H	α-helix	trans	-76.6	-36.7	173.3	-76.7	-70.5	0	0	0	113.3	D51 D52 D53 K58	D51-N55 PolarHBondContact O-N 3.05Å; D51-N55 PolarHBondContact O-ND2 2.83Å; D52-N55 WeakPolarHBondContact O-CA 3.29Å; D52-N55 WeakPolarHBondContact O-CB 3.44Å; D52-N55 PolarHBondContact O-N 2.95Å; D53-N55 PolarHBondContact O-N 3.28Å; D53-N55 VanDerWaalsContact O-N 3.11Å; N55-K58 PolarHBondContact OD1-NZ 3Å
56	T	87.7	Confident	88.9	Confident	61 Å²	61	43.3 Å²	43.3	37%	0.374	23%	0.227	S	C	.	.	H	α-helix	trans	-76.7	-37.4	179.8	67.6	0	0	0	0	112.5	D52 D53 K58 D261	D52-T56 PolarHBondContact O-N 3.18Å; D52-T56 VanDerWaalsContact O-N 3.13Å; D53-T56 PolarHBondContact O-N 3.05Å; D53-T56 PolarHBondContact O-OG1 3.3Å; T56-K58 PolarHBondContact O-N 3.43Å; T56-K58 VanDerWaalsContact O-N 3.15Å; T56-D261 WeakPolarHBondContact CB-O 3.41Å; T56-D261 HydrophobicContact CG2-CB 4.08Å; T56-D261 WeakPolarHBondContact CG2-O 3.26Å; T56-D261 PolarHBondContact OG1-O 3.34Å
57	I	87.4	Confident	88.7	Confident	1 Å²	1	46 Å²	46	1%	0.005	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-76.5	-0.1	-173.9	66.4	146.6	0	0	0	115.1	Y42 M44 D53 L54 E59 L60 F79 V132 I265	Y42-I57 HydrophobicContact CE1-CD1 4.15Å; M44-I57 HydrophobicContact CE-CD1 4.23Å; M44-I57 HydrophobicContact SD-CD1 3.41Å; M44-I57 WeakPolarHBondContact SD-CD1 3.34Å; M44-I57 HydrophobicContact SD-CG1 4.38Å; D53-I57 WeakPolarHBondContact O-CG1 3.22Å; D53-I57 PolarHBondContact O-N 2.77Å; L54-I57 HydrophobicContact CD1-CD1 4.32Å; L54-I57 HydrophobicContact CD1-CG1 4.46Å; I57-E59 PolarHBondContact O-N 2.97Å; I57-E59 VanDerWaalsContact O-N 3.08Å; I57-L60 HydrophobicContact CB-CB 4.04Å; I57-L60 HydrophobicContact CB-CD2 4.19Å; I57-L60 HydrophobicContact CG2-CD2 4.02Å; I57-L60 VanDerWaalsContact O-CB 3.28Å; I57-L60 WeakPolarHBondContact O-CB 3.28Å; I57-L60 PolarHBondContact O-N 3.3Å; I57-F79 HydrophobicContact CD1-CE2 4.39Å; I57-V132 HydrophobicContact CD1-CG1 3.55Å; I57-V132 HydrophobicContact CD1-CG2 4.25Å; I57-V132 HydrophobicContact CG1-CG1 3.67Å; I57-I265 HydrophobicContact CG2-CG2 4.42Å
58	K	85.5	Confident	88.5	Confident	59 Å²	59	46 Å²	46	26%	0.257	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-60.3	-17.8	178.9	-73.1	170.5	-178.5	167.7	0	115.1	L54 N55 T56 V132 K133	L54-K58 WeakPolarHBondContact O-CE 3.4Å; L54-K58 WeakPolarHBondContact O-CG 3.45Å; N55-K58 PolarHBondContact OD1-NZ 3Å; T56-K58 PolarHBondContact O-N 3.43Å; T56-K58 VanDerWaalsContact O-N 3.15Å; K58-V132 HydrophobicContact CG-CG1 4.36Å; K58-K133 HydrophobicContact CB-CG 3.95Å; K58-K133 HydrophobicContact CD-CG 4.23Å; K58-K133 HydrophobicContact CG-CG 3.81Å; K58-K133 WeakPolarHBondContact O-CE 3.45Å
59	E	81.1	Confident	88.3	Confident	99 Å²	99	47.2 Å²	47.2	46%	0.463	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-120.2	10	173.8	-61.2	-171.8	168.3	0	0	112.6	I57 G61 R63	I57-E59 PolarHBondContact O-N 2.97Å; I57-E59 VanDerWaalsContact O-N 3.08Å; E59-G61 PolarHBondContact O-N 3.01Å; E59-R63 VanDerWaalsContact O-CG 3.31Å; E59-R63 WeakPolarHBondContact O-CG 3.49Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 IonicContact OE2-CZ 2.67Å; E59-R63 IonicContact OE2-NE 3.69Å; E59-R63 IonicContact OE2-NH2 2.76Å; E59-R63 PolarHBondContact OE2-NH2 3.05Å
60	L	85.1	Confident	88.3	Confident	10 Å²	10	51.3 Å²	51.3	5%	0.052	26%	0.257	C	S	.	.	H	α-helix	trans	-65	-40.1	-175.4	-179.9	62.7	0	0	0	111.6	Y42 I57 S62 R63 L64 F128 I265 L266	Y42-L60 HydrophobicContact CD2-CD2 4.18Å; Y42-L60 HydrophobicContact CE2-CD2 3.47Å; Y42-L60 VanDerWaalsContact CE2-CD2 3.47Å; I57-L60 HydrophobicContact CB-CB 4.04Å; I57-L60 HydrophobicContact CB-CD2 4.19Å; I57-L60 HydrophobicContact CG2-CD2 4.02Å; I57-L60 VanDerWaalsContact O-CB 3.28Å; I57-L60 WeakPolarHBondContact O-CB 3.28Å; I57-L60 PolarHBondContact O-N 3.3Å; L60-S62 PolarHBondContact O-N 2.96Å; L60-R63 PolarHBondContact O-N 2.75Å; L60-L64 HydrophobicContact CD1-CB 4.45Å; L60-L64 WeakPolarHBondContact O-CB 3.31Å; L60-L64 PolarHBondContact O-N 3.36Å; L60-F128 HydrophobicContact CB-CE1 4.46Å; L60-I265 HydrophobicContact CD1-CG2 3.79Å; L60-I265 HydrophobicContact CD2-CG1 4.49Å; L60-I265 HydrophobicContact CD2-CG2 3.64Å; L60-I265 HydrophobicContact CG-CG2 4.36Å; L60-L266 HydrophobicContact CD1-CB 4.02Å
61	G	84.1	Confident	88.1	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-58.4	-48.8	-173.3	0	0	0	0	0	113.3	E59 S65 F128 N129	E59-G61 PolarHBondContact O-N 3.01Å; G61-S65 VanDerWaalsContact O-CB 3.29Å; G61-S65 WeakPolarHBondContact O-CB 3.31Å; G61-S65 PolarHBondContact O-N 2.93Å; G61-F128 VanDerWaalsContact CA-CD1 3.5Å; G61-N129 WeakPolarHBondContact CA-OD1 3.32Å; G61-N129 PolarHBondContact N-OD1 2.85Å
62	S	88.2	Confident	88	Confident	38 Å²	38	51.9 Å²	51.9	27%	0.266	26%	0.26	S	S	.	.	H	α-helix	trans	-75.6	-31.4	180	56.3	0	0	0	0	113.3	L60 K66 E126 N129	L60-S62 PolarHBondContact O-N 2.96Å; S62-K66 WeakPolarHBondContact O-CB 3.13Å; S62-K66 PolarHBondContact O-N 2.68Å; S62-K66 VanDerWaalsContact O-N 3.14Å; S62-E126 WeakPolarHBondContact CB-OE1 3.45Å; S62-N129 WeakPolarHBondContact CB-ND2 3.34Å; S62-N129 PolarHBondContact N-OD1 2.91Å; S62-N129 PolarHBondContact OG-ND2 2.83Å
63	R	89.8	Confident	88.1	Confident	140 Å²	140	52.5 Å²	52.5	53%	0.528	27%	0.27	S	S	.	.	H	α-helix	trans	-66.5	-46.1	171.2	-67.1	177.1	-172.4	-162.2	5.9	111.4	E59 L60 K66 E67 L266	E59-R63 VanDerWaalsContact O-CG 3.31Å; E59-R63 WeakPolarHBondContact O-CG 3.49Å; E59-R63 PolarHBondContact O-N 3.03Å; E59-R63 IonicContact OE2-CZ 2.67Å; E59-R63 IonicContact OE2-NE 3.69Å; E59-R63 IonicContact OE2-NH2 2.76Å; E59-R63 PolarHBondContact OE2-NH2 3.05Å; L60-R63 PolarHBondContact O-N 2.75Å; R63-K66 PolarHBondContact O-N 2.92Å; R63-E67 PolarHBondContact O-N 2.94Å; R63-L266 HydrophobicContact CB-CD2 4.2Å
64	L	89.5	Confident	88.2	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-49.1	178.2	179.6	62.3	0	0	0	111.5	L40 L60 K66 E67 M68 F75 L266 I269	L40-L64 HydrophobicContact CD1-CD2 4.19Å; L40-L64 HydrophobicContact CD2-CD2 4.13Å; L60-L64 HydrophobicContact CD1-CB 4.45Å; L60-L64 WeakPolarHBondContact O-CB 3.31Å; L60-L64 PolarHBondContact O-N 3.36Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 2.83Å; L64-E67 PolarHBondContact O-N 2.93Å; L64-M68 HydrophobicContact CD1-CG 3.75Å; L64-M68 HydrophobicContact CD1-SD 4.37Å; L64-M68 HydrophobicContact CG-CG 4.15Å; L64-M68 WeakPolarHBondContact O-CB 3.28Å; L64-M68 VanDerWaalsContact O-CG 3.28Å; L64-M68 WeakPolarHBondContact O-CG 3.36Å; L64-M68 PolarHBondContact O-N 2.92Å; L64-F75 HydrophobicContact CD2-CZ 4.01Å; L64-F75 HydrophobicContact CG-CE1 4.34Å; L64-F75 HydrophobicContact CG-CZ 3.97Å; L64-L266 HydrophobicContact CB-CD1 3.99Å; L64-L266 HydrophobicContact CD1-CD1 3.6Å; L64-L266 HydrophobicContact CG-CD1 4.42Å; L64-I269 HydrophobicContact CD1-CB 4.38Å; L64-I269 HydrophobicContact CD1-CD1 4.25Å; L64-I269 HydrophobicContact CD1-CG2 3.88Å; L64-I269 HydrophobicContact CD2-CD1 4.13Å
65	S	89.8	Confident	88.5	Confident	35 Å²	35	56 Å²	56	25%	0.245	29%	0.288	C	S	.	.	H	α-helix	trans	-56.4	-41.3	175.6	176.8	0	0	0	0	112.1	G61 S69	G61-S65 VanDerWaalsContact O-CB 3.29Å; G61-S65 WeakPolarHBondContact O-CB 3.31Å; G61-S65 PolarHBondContact O-N 2.93Å; S65-S69 VanDerWaalsContact O-CB 3.31Å; S65-S69 WeakPolarHBondContact O-CB 3.32Å; S65-S69 PolarHBondContact O-N 3.09Å
66	K	90.8	Very high	88.8	Confident	141 Å²	141	53.7 Å²	53.7	61%	0.613	27%	0.273	S	S	*	.	H	α-helix	trans	-65.3	-41.9	177	-177.8	-179.1	177.3	-174.5	0	112.9	S62 R63 L64 S69	S62-K66 WeakPolarHBondContact O-CB 3.13Å; S62-K66 PolarHBondContact O-N 2.68Å; S62-K66 VanDerWaalsContact O-N 3.14Å; R63-K66 PolarHBondContact O-N 2.92Å; L64-K66 VanDerWaalsContact C-N 3.26Å; L64-K66 PolarHBondContact O-N 2.83Å; K66-S69 PolarHBondContact O-OG 3.22Å
67	E	90.9	Very high	89.2	Confident	58 Å²	58	50.8 Å²	50.8	27%	0.271	26%	0.255	S	S	.	.	H	α-helix	trans	-73.3	-43.7	177.7	-66.3	-58.6	121.5	0	0	111.9	R63 L64 S69 K70 L266 I270	R63-E67 PolarHBondContact O-N 2.94Å; L64-E67 PolarHBondContact O-N 2.93Å; E67-S69 VanDerWaalsContact C-N 3.26Å; E67-S69 PolarHBondContact O-N 3.39Å; E67-K70 VanDerWaalsContact O-CB 3.32Å; E67-K70 WeakPolarHBondContact O-CB 3.38Å; E67-K70 WeakPolarHBondContact O-CG 3.46Å; E67-K70 PolarHBondContact O-N 2.74Å; E67-K70 WeakPolarHBondContact OE1-CE 3.4Å; E67-K70 IonicContact OE1-NZ 3.92Å; E67-K70 PolarHBondContact OE1-NZ 3.44Å; E67-K70 WeakPolarHBondContact OE2-CE 3.21Å; E67-K70 IonicContact OE2-NZ 2.71Å; E67-K70 PolarHBondContact OE2-NZ 2.65Å; E67-L266 HydrophobicContact CB-CD1 4.31Å; E67-L266 HydrophobicContact CG-CD1 4.36Å; E67-L266 HydrophobicContact CG-CD2 4.26Å; E67-I270 HydrophobicContact CB-CD1 3.79Å; E67-I270 HydrophobicContact CG-CD1 4.32Å
68	M	89.3	Confident	89.7	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-61.8	-30.7	176	-67.4	-58.2	-65.6	0	0	113	V38 L64 K70 L71 T72 F75 Y273	V38-M68 HydrophobicContact CB-CE 4.5Å; V38-M68 HydrophobicContact CG1-CE 4.11Å; V38-M68 HydrophobicContact CG2-CE 4.48Å; L64-M68 HydrophobicContact CD1-CG 3.75Å; L64-M68 HydrophobicContact CD1-SD 4.37Å; L64-M68 HydrophobicContact CG-CG 4.15Å; L64-M68 WeakPolarHBondContact O-CB 3.28Å; L64-M68 VanDerWaalsContact O-CG 3.28Å; L64-M68 WeakPolarHBondContact O-CG 3.36Å; L64-M68 PolarHBondContact O-N 2.92Å; M68-K70 PolarHBondContact O-N 2.84Å; M68-K70 VanDerWaalsContact O-N 3.1Å; M68-L71 PolarHBondContact O-N 3.04Å; M68-L71 HydrophobicContact SD-CD1 4.3Å; M68-T72 HydrophobicContact CE-CG2 4.48Å; M68-T72 WeakPolarHBondContact O-CG2 3.47Å; M68-T72 PolarHBondContact O-N 3.01Å; M68-F75 HydrophobicContact CB-CB 4.35Å; M68-F75 HydrophobicContact CB-CD1 4.2Å; M68-F75 HydrophobicContact CB-CD2 3.83Å; M68-F75 HydrophobicContact CB-CE1 4.46Å; M68-F75 HydrophobicContact CB-CE2 4.12Å; M68-F75 HydrophobicContact CB-CG 3.87Å; M68-F75 HydrophobicContact CB-CZ 4.43Å; M68-F75 HydrophobicContact CE-CD2 4.14Å; M68-F75 HydrophobicContact CE-CE2 4.17Å; M68-F75 HydrophobicContact CG-CD2 3.97Å; M68-F75 HydrophobicContact CG-CE1 4.43Å; M68-F75 HydrophobicContact CG-CE2 3.75Å; M68-F75 HydrophobicContact CG-CG 4.41Å; M68-F75 HydrophobicContact CG-CZ 4Å; M68-Y273 HydrophobicContact CE-CD2 4.43Å; M68-Y273 HydrophobicContact CE-CG 4.44Å
69	S	87.4	Confident	90.2	Very high	76 Å²	76	47.9 Å²	47.9	53%	0.531	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-14.5	173.9	75.2	0	0	0	0	114.9	S65 K66 E67 T72	S65-S69 VanDerWaalsContact O-CB 3.31Å; S65-S69 WeakPolarHBondContact O-CB 3.32Å; S65-S69 PolarHBondContact O-N 3.09Å; K66-S69 PolarHBondContact O-OG 3.22Å; E67-S69 VanDerWaalsContact C-N 3.26Å; E67-S69 PolarHBondContact O-N 3.39Å; S69-T72 WeakPolarHBondContact CA-O 3.46Å
70	K	89.5	Confident	91	Very high	140 Å²	140	43.2 Å²	43.2	61%	0.609	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-19	172.3	-55.5	175.2	-171.1	168.8	0	112.7	E67 M68	E67-K70 VanDerWaalsContact O-CB 3.32Å; E67-K70 WeakPolarHBondContact O-CB 3.38Å; E67-K70 WeakPolarHBondContact O-CG 3.46Å; E67-K70 PolarHBondContact O-N 2.74Å; E67-K70 WeakPolarHBondContact OE1-CE 3.4Å; E67-K70 IonicContact OE1-NZ 3.92Å; E67-K70 PolarHBondContact OE1-NZ 3.44Å; E67-K70 WeakPolarHBondContact OE2-CE 3.21Å; E67-K70 IonicContact OE2-NZ 2.71Å; E67-K70 PolarHBondContact OE2-NZ 2.65Å; M68-K70 PolarHBondContact O-N 2.84Å; M68-K70 VanDerWaalsContact O-N 3.1Å
71	L	87	Confident	91.6	Very high	52 Å²	52	42.8 Å²	42.8	27%	0.272	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	-27.9	-171.6	-58.1	177	0	0	0	112.8	M68 I270 Y273	M68-L71 PolarHBondContact O-N 3.04Å; M68-L71 HydrophobicContact SD-CD1 4.3Å; L71-I270 HydrophobicContact CD1-CG2 4.28Å; L71-Y273 HydrophobicContact CB-CE1 3.94Å; L71-Y273 HydrophobicContact CD1-CD1 3.8Å; L71-Y273 HydrophobicContact CD1-CE1 3.95Å; L71-Y273 HydrophobicContact CG-CE1 4.43Å
72	T	89.4	Confident	92.3	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.018	22%	0.219	C	C	.	.			trans	-146.1	141.6	177.2	174.8	0	0	0	0	110.1	D35 Y36 V38 M68 S69 N74 F75	D35-T72 WeakPolarHBondContact OD1-CA 3.27Å; Y36-T72 WeakPolarHBondContact O-CB 3.33Å; Y36-T72 PolarHBondContact O-OG1 2.62Å; V38-T72 HydrophobicContact CB-CG2 4.13Å; V38-T72 HydrophobicContact CG2-CG2 3.86Å; M68-T72 HydrophobicContact CE-CG2 4.48Å; M68-T72 WeakPolarHBondContact O-CG2 3.47Å; M68-T72 PolarHBondContact O-N 3.01Å; S69-T72 WeakPolarHBondContact CA-O 3.46Å; T72-N74 PolarHBondContact O-N 2.97Å; T72-N74 PolarHBondContact OG1-N 3.18Å; T72-F75 HydrophobicContact CG2-CB 4.03Å
73	S	90.3	Very high	92.7	Very high	96 Å²	96	41 Å²	41	67%	0.671	21%	0.206	S	C	*	.	S	Bend	trans	-75.3	-13.6	174	67.8	0	0	0	0	113.2	D35	D35-S73 PolarHBondContact OD1-N 3.02Å; D35-S73 PolarHBondContact OD1-OG 3.13Å; D35-S73 VanDerWaalsContact OD2-CB 3.24Å; D35-S73 WeakPolarHBondContact OD2-CB 3.15Å; D35-S73 PolarHBondContact OD2-OG 3.11Å
74	N	92.4	Very high	93.1	Very high	65 Å²	65	34.3 Å²	34.3	35%	0.348	18%	0.181	S	C	.	.			trans	-138.4	67.1	-163.1	-161.4	-14.4	0	0	0	113.1	P37 V38 T72 R164	P37-N74 HydrophobicContact CB-CB 4.21Å; V38-N74 PolarHBondContact N-O 3.41Å; T72-N74 PolarHBondContact O-N 2.97Å; T72-N74 PolarHBondContact OG1-N 3.18Å; N74-R164 PolarHBondContact ND2-NH1 2.84Å; N74-R164 PolarHBondContact O-NH2 2.79Å; N74-R164 PolarHBondContact OD1-NH1 3.4Å
75	F	94.8	Very high	93.5	Very high	16 Å²	16	34.2 Å²	34.2	7%	0.07	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	132.4	-179.3	179.3	-108.8	0	0	0	112.8	V38 L40 L64 M68 T72 L77 N123	V38-F75 HydrophobicContact CB-CD2 4.19Å; V38-F75 HydrophobicContact CG1-CD2 4.19Å; V38-F75 HydrophobicContact CG1-CE2 4.38Å; V38-F75 WeakPolarHBondContact O-CA 3.37Å; L40-F75 HydrophobicContact CB-CE2 3.66Å; L40-F75 HydrophobicContact CB-CZ 3.92Å; L40-F75 HydrophobicContact CD1-CE2 4.33Å; L40-F75 HydrophobicContact CD1-CZ 4.46Å; L64-F75 HydrophobicContact CD2-CZ 4.01Å; L64-F75 HydrophobicContact CG-CE1 4.34Å; L64-F75 HydrophobicContact CG-CZ 3.97Å; M68-F75 HydrophobicContact CB-CB 4.35Å; M68-F75 HydrophobicContact CB-CD1 4.2Å; M68-F75 HydrophobicContact CB-CD2 3.83Å; M68-F75 HydrophobicContact CB-CE1 4.46Å; M68-F75 HydrophobicContact CB-CE2 4.12Å; M68-F75 HydrophobicContact CB-CG 3.87Å; M68-F75 HydrophobicContact CB-CZ 4.43Å; M68-F75 HydrophobicContact CE-CD2 4.14Å; M68-F75 HydrophobicContact CE-CE2 4.17Å; M68-F75 HydrophobicContact CG-CD2 3.97Å; M68-F75 HydrophobicContact CG-CE1 4.43Å; M68-F75 HydrophobicContact CG-CE2 3.75Å; M68-F75 HydrophobicContact CG-CG 4.41Å; M68-F75 HydrophobicContact CG-CZ 4Å; T72-F75 HydrophobicContact CG2-CB 4.03Å; F75-L77 HydrophobicContact CD1-CD2 4.49Å; F75-L77 HydrophobicContact CE1-CB 3.93Å; F75-L77 HydrophobicContact CE1-CD1 4.47Å; F75-L77 HydrophobicContact CE1-CD2 4.09Å; F75-L77 HydrophobicContact CE1-CG 4.4Å; F75-L77 HydrophobicContact CZ-CB 4.07Å; F75-N123 PolarHBondContact O-OD1 2.88Å
76	R	95.7	Very high	93.7	Very high	36 Å²	36	35.2 Å²	35.2	14%	0.136	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	146.9	167	-67.6	-169.6	-55.4	157.8	-3.7	111.5	V38 D39 L40 L121 T122 N123 G162	V38-R76 PolarHBondContact O-N 3.04Å; D39-R76 IonicContact OD1-CZ 3.5Å; D39-R76 IonicContact OD1-NE 3.15Å; D39-R76 PolarHBondContact OD1-NE 2.72Å; D39-R76 IonicContact OD1-NH2 2.92Å; D39-R76 PolarHBondContact OD1-NH2 2.87Å; D39-R76 IonicContact OD2-CZ 3.53Å; D39-R76 IonicContact OD2-NE 3.33Å; D39-R76 IonicContact OD2-NH2 3.71Å; D39-R76 PolarHBondContact OD2-NH2 3.41Å; L40-R76 PolarHBondContact N-O 3.41Å; R76-L121 HydrophobicContact CB-CB 4.29Å; R76-L121 HydrophobicContact CB-CD2 4.4Å; R76-L121 PolarHBondContact NH1-O 3.42Å; R76-T122 CarbonylContact C-O 3.56Å; R76-T122 WeakPolarHBondContact CA-O 3.38Å; R76-T122 WeakPolarHBondContact CB-O 3.41Å; R76-N123 WeakPolarHBondContact CG-OD1 3.47Å; R76-G162 VanDerWaalsContact CZ-O 3.27Å; R76-G162 PolarHBondContact NH1-O 3.33Å; R76-G162 PolarHBondContact NH2-O 2.86Å
77	L	95.5	Very high	94	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	145.2	174.8	67.6	173.6	0	0	0	112.4	L40 F75 T122 A125 F128	L40-L77 CarbonylContact O-C 3.6Å; L40-L77 VanDerWaalsContact O-CA 3.27Å; L40-L77 WeakPolarHBondContact O-CA 3.37Å; F75-L77 HydrophobicContact CD1-CD2 4.49Å; F75-L77 HydrophobicContact CE1-CB 3.93Å; F75-L77 HydrophobicContact CE1-CD1 4.47Å; F75-L77 HydrophobicContact CE1-CD2 4.09Å; F75-L77 HydrophobicContact CE1-CG 4.4Å; F75-L77 HydrophobicContact CZ-CB 4.07Å; L77-T122 PolarHBondContact N-O 2.96Å; L77-T122 PolarHBondContact O-N 2.89Å; L77-A125 HydrophobicContact CD1-CB 4.41Å; L77-A125 HydrophobicContact CD2-CB 4.15Å; L77-F128 HydrophobicContact CD1-CB 3.63Å; L77-F128 HydrophobicContact CD1-CD1 4.27Å; L77-F128 HydrophobicContact CD1-CD2 3.75Å; L77-F128 HydrophobicContact CD1-CE2 4.46Å; L77-F128 HydrophobicContact CD1-CG 3.64Å; L77-F128 HydrophobicContact CG-CB 4.15Å; L77-F128 HydrophobicContact CG-CD2 4.13Å; L77-F128 HydrophobicContact CG-CG 4.35Å
78	G	97.1	Very high	94.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	167	176.4	0	0	0	0	0	111	L40 Y42 L119	L40-G78 PolarHBondContact O-N 3.08Å; Y42-G78 PolarHBondContact N-O 3.16Å; G78-L119 VanDerWaalsContact CA-O 3.26Å; G78-L119 WeakPolarHBondContact CA-O 3.19Å
79	F	97.6	Very high	94.4	Very high	0 Å²	0	33 Å²	33	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	137	-175.8	-172.6	-95.8	0	0	0	111.8	Y41 Y42 M44 I57 I118 L119 F128 I131 V132 Q135	Y41-F79 PolarHBondContact OH-O 3.04Å; Y42-F79 AromaticContact CD1-CD2 3.83Å; Y42-F79 HydrophobicContact CD1-CD2 3.83Å; Y42-F79 AromaticContact CD1-CE2 3.7Å; Y42-F79 HydrophobicContact CD1-CE2 3.7Å; Y42-F79 HydrophobicContact CE1-CE2 4.24Å; Y42-F79 HydrophobicContact CG-CD2 4.38Å; Y42-F79 WeakPolarHBondContact O-CA 3.39Å; M44-F79 HydrophobicContact CB-CE2 3.96Å; M44-F79 HydrophobicContact CB-CZ 4.02Å; M44-F79 HydrophobicContact SD-CE2 4.34Å; M44-F79 HydrophobicContact SD-CZ 4.3Å; I57-F79 HydrophobicContact CD1-CE2 4.39Å; F79-I118 HydrophobicContact CD1-CB 4.21Å; F79-I118 HydrophobicContact CD1-CD1 3.7Å; F79-I118 HydrophobicContact CE1-CD1 3.63Å; F79-I118 PolarHBondContact O-N 3.48Å; F79-I118 VanDerWaalsContact O-N 3.09Å; F79-L119 HydrophobicContact CB-CB 3.99Å; F79-L119 PolarHBondContact N-O 3.32Å; F79-L119 PolarHBondContact O-N 2.89Å; F79-F128 HydrophobicContact CB-CD2 4.1Å; F79-F128 HydrophobicContact CB-CE2 3.85Å; F79-F128 AromaticContact CD2-CE2 3.77Å; F79-F128 HydrophobicContact CD2-CE2 3.77Å; F79-F128 AromaticContact CD2-CZ 3.91Å; F79-F128 HydrophobicContact CD2-CZ 3.91Å; F79-F128 HydrophobicContact CG-CE2 4.24Å; F79-I131 HydrophobicContact CD1-CG2 4.28Å; F79-V132 HydrophobicContact CD2-CG2 4.06Å; F79-V132 HydrophobicContact CE2-CG2 4.02Å; F79-V132 HydrophobicContact CZ-CG2 4.44Å; F79-Q135 HydrophobicContact CE1-CG 3.85Å; F79-Q135 HydrophobicContact CZ-CG 4.3Å
80	G	97.8	Very high	94.8	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	163.4	165.7	0	0	0	0	0	110.9	Y41 Y42 M44 K116	Y41-G80 VanDerWaalsContact OH-CA 3.26Å; Y41-G80 WeakPolarHBondContact OH-CA 3.2Å; Y41-G80 PolarHBondContact OH-N 3.01Å; Y42-G80 PolarHBondContact O-N 2.93Å; M44-G80 PolarHBondContact N-O 3.03Å; G80-K116 CarbonylContact C-O 3.57Å; G80-K116 VanDerWaalsContact CA-O 3.27Å; G80-K116 WeakPolarHBondContact CA-O 3.31Å
81	S	97.4	Very high	94.9	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.007	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	154.5	179.1	56.2	0	0	0	0	112.8	M44 F115 K116 I118	M44-S81 WeakPolarHBondContact O-CA 3.34Å; S81-F115 VanDerWaalsContact O-CD2 3.23Å; S81-F115 WeakPolarHBondContact O-CD2 3.18Å; S81-K116 PolarHBondContact N-O 3.27Å; S81-K116 PolarHBondContact O-N 3.26Å; S81-I118 WeakPolarHBondContact OG-CD1 3.43Å
82	F	98.1	Very high	95.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	164.3	174.7	66.9	-88.4	0	0	0	110.9	L43 M44 D45 L46 G114 E145 G147 A150 F173	L43-F82 HydrophobicContact CD1-CD1 3.79Å; L43-F82 HydrophobicContact CD1-CE1 4.42Å; L43-F82 HydrophobicContact CD2-CD1 4.45Å; L43-F82 HydrophobicContact CG-CD1 3.8Å; L43-F82 HydrophobicContact CG-CE1 3.95Å; M44-F82 VanDerWaalsContact C-CE1 3.49Å; M44-F82 WeakPolarHBondContact O-CD1 3.37Å; M44-F82 PolarHBondContact O-N 3.49Å; D45-F82 HydrophobicContact CB-CE1 4.2Å; D45-F82 HydrophobicContact CB-CE2 3.85Å; D45-F82 HydrophobicContact CB-CZ 3.6Å; D45-F82 VanDerWaalsContact N-CE1 3.34Å; L46-F82 PolarHBondContact N-O 3.23Å; F82-G114 WeakPolarHBondContact CA-O 3.42Å; F82-G114 VanDerWaalsContact CB-O 3.23Å; F82-G114 WeakPolarHBondContact CB-O 3.32Å; F82-E145 HydrophobicContact CD2-CB 4.46Å; F82-E145 HydrophobicContact CE2-CB 4.07Å; F82-G147 VanDerWaalsContact CE2-CA 3.48Å; F82-A150 HydrophobicContact CB-CB 3.64Å; F82-A150 HydrophobicContact CD1-CB 4.07Å; F82-A150 HydrophobicContact CG-CB 4.01Å; F82-F173 HydrophobicContact CD1-CE2 4.45Å; F82-F173 AromaticContact CE1-CD2 3.98Å; F82-F173 HydrophobicContact CE1-CD2 3.98Å; F82-F173 AromaticContact CE1-CE2 3.5Å; F82-F173 HydrophobicContact CE1-CE2 3.5Å; F82-F173 HydrophobicContact CE1-CZ 4.13Å; F82-F173 HydrophobicContact CE2-CE2 4.08Å; F82-F173 HydrophobicContact CE2-CZ 4.09Å; F82-F173 HydrophobicContact CZ-CD2 4.12Å; F82-F173 HydrophobicContact CZ-CE1 4.37Å; F82-F173 AromaticContact CZ-CE2 3.26Å; F82-F173 HydrophobicContact CZ-CE2 3.26Å; F82-F173 AromaticContact CZ-CZ 3.43Å; F82-F173 HydrophobicContact CZ-CZ 3.43Å; F82-F173 VanDerWaalsContact CZ-CZ 3.43Å
83	V	97	Very high	95.2	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	17%	0.171	C	C	.	.			trans	-142	-101.5	165.9	-165.9	0	0	0	0	104.7	L46 T112 F113 G114 E145 G146	L46-V83 HydrophobicContact CB-CG2 4.34Å; V83-T112 HydrophobicContact CB-CG2 4.15Å; V83-T112 HydrophobicContact CG1-CG2 3.9Å; V83-F113 WeakPolarHBondContact CB-O 3.49Å; V83-F113 HydrophobicContact CG2-CD1 4.08Å; V83-F113 HydrophobicContact CG2-CE1 3.63Å; V83-F113 HydrophobicContact CG2-CE2 4.2Å; V83-F113 HydrophobicContact CG2-CZ 3.69Å; V83-F113 PolarHBondContact N-O 2.95Å; V83-G114 PolarHBondContact N-O 2.78Å; V83-E145 WeakPolarHBondContact CG1-OE2 3.45Å; V83-G146 WeakPolarHBondContact O-CA 3.3Å; V83-G146 PolarHBondContact O-N 2.89Å
84	E	97.4	Very high	95.3	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.16	C	C	.	.			trans	-146.6	158.2	-176.7	-171.6	47.5	-94.5	0	0	111.5	P86 F90 F113 G114 N140 E145 G146 H180 Y214	E84-P86 WeakPolarHBondContact O-CD 3.08Å; E84-F90 HydrophobicContact CG-CB 3.61Å; E84-F90 HydrophobicContact CG-CG 4.04Å; E84-F113 PolarHBondContact N-O 3.07Å; E84-F113 CarbonylContact O-C 3.33Å; E84-F113 VanDerWaalsContact O-O 3.12Å; E84-G114 PolarHBondContact O-N 3.04Å; E84-N140 HydrophobicContact CB-CB 4.22Å; E84-E145 WeakPolarHBondContact OE2-CA 3.45Å; E84-G146 WeakPolarHBondContact OE2-CA 3.19Å; E84-G146 PolarHBondContact OE2-N 3.36Å; E84-H180 IonicContact OE2-CD2 2.71Å; E84-H180 PolarHBondContact OE2-CD2 2.7Å; E84-Y214 VanDerWaalsContact OE1-CE1 3.26Å; E84-Y214 WeakPolarHBondContact OE1-CE1 3.15Å; E84-Y214 VanDerWaalsContact OE1-CZ 3.3Å; E84-Y214 PolarHBondContact OE1-OH 2.69Å; E84-Y214 PolarHBondContact OE2-OH 2.81Å
85	K	97.4	Very high	95.3	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	18%	0.178	C	C	.	.			trans	-48.1	119.7	170.6	-66.6	-175	-178.7	-60.4	0	109.6	V87 F90 D149 I190 S209 L212 Y214	K85-V87 PolarHBondContact O-N 2.81Å; K85-F90 HydrophobicContact CB-CD2 4.16Å; K85-F90 HydrophobicContact CD-CE2 4.44Å; K85-D149 IonicContact NZ-OD1 3.4Å; K85-D149 IonicContact NZ-OD2 3.52Å; K85-D149 PolarHBondContact NZ-OD2 3.04Å; K85-I190 HydrophobicContact CD-CD1 3.95Å; K85-S209 VanDerWaalsContact CD-O 3.27Å; K85-S209 WeakPolarHBondContact CD-O 3.39Å; K85-S209 VanDerWaalsContact CG-O 3.31Å; K85-S209 WeakPolarHBondContact CG-O 3.41Å; K85-S209 PolarHBondContact NZ-O 2.66Å; K85-L212 PolarHBondContact NZ-O 3.03Å; K85-Y214 HydrophobicContact CD-CD1 4.45Å; K85-Y214 HydrophobicContact CD-CE1 3.77Å; K85-Y214 HydrophobicContact CD-CE2 4.1Å; K85-Y214 WeakPolarHBondContact CD-OH 3.46Å; K85-Y214 VanDerWaalsContact CE-CZ 3.4Å; K85-Y214 HydrophobicContact CG-CE1 3.88Å
86	P	95.8	Very high	95.1	Very high	56 Å²	56	36.6 Å²	36.6	36%	0.364	21%	0.209	S	C	.	.	S	Bend	trans	-78.9	60.4	-174	32.1	-36.6	0	0	0	112.4	E84 T210	E84-P86 WeakPolarHBondContact O-CD 3.08Å; P86-T210 HydrophobicContact CG-CG2 3.91Å
87	V	95.6	Very high	94.8	Very high	37 Å²	37	36.3 Å²	36.3	22%	0.224	21%	0.209	C	C	.	.	S	Bend	trans	-141	148.7	-175.3	-164.7	0	0	0	0	109.3	K85 F90 V91 A188 T210	K85-V87 PolarHBondContact O-N 2.81Å; V87-F90 WeakPolarHBondContact O-CB 3.3Å; V87-F90 PolarHBondContact O-N 2.89Å; V87-V91 PolarHBondContact O-N 3.4Å; V87-V91 VanDerWaalsContact O-N 3.16Å; V87-A188 HydrophobicContact CB-CB 4.34Å; V87-A188 HydrophobicContact CG1-CB 4.11Å; V87-T210 HydrophobicContact CG2-CG2 3.5Å; V87-T210 VanDerWaalsContact CG2-CG2 3.5Å
88	S	95	Very high	94.7	Very high	62 Å²	62	40.7 Å²	40.7	43%	0.434	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	138.8	168.7	178.3	0	0	0	0	110.3	A188	S88-A188 VanDerWaalsContact O-CA 3.31Å; S88-A188 WeakPolarHBondContact O-CA 3.47Å; S88-A188 VanDerWaalsContact O-CB 3.23Å; S88-A188 WeakPolarHBondContact O-CB 3.02Å
89	P	94.8	Very high	94.5	Very high	53 Å²	53	43.8 Å²	43.8	34%	0.344	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	cis	-90.2	-5.5	12.6	35.7	-36.4	0	0	0	115.8	V91 I141 L187	P89-V91 VanDerWaalsContact C-N 3.29Å; P89-V91 PolarHBondContact O-N 2.92Å; P89-I141 WeakPolarHBondContact O-CD1 3.23Å; P89-L187 HydrophobicContact CG-CB 4.02Å
90	F	94.4	Very high	94.3	Very high	1 Å²	1	45.2 Å²	45.2	0%	0.004	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-30.4	-174.5	-47.3	-61.5	0	0	0	113.7	E84 K85 V87 I141 D142 H180 A188 Y214	E84-F90 HydrophobicContact CG-CB 3.61Å; E84-F90 HydrophobicContact CG-CG 4.04Å; K85-F90 HydrophobicContact CB-CD2 4.16Å; K85-F90 HydrophobicContact CD-CE2 4.44Å; V87-F90 WeakPolarHBondContact O-CB 3.3Å; V87-F90 PolarHBondContact O-N 2.89Å; F90-I141 WeakPolarHBondContact O-CB 3.46Å; F90-I141 PolarHBondContact O-N 3.01Å; F90-D142 WeakPolarHBondContact CA-OD1 3.39Å; F90-D142 WeakPolarHBondContact CD1-OD2 3.26Å; F90-H180 AromaticContact CD1-NE2 3.83Å; F90-H180 AromaticContact CE1-CD2 3.89Å; F90-H180 AromaticContact CE1-NE2 3.47Å; F90-H180 WeakPolarHBondContact CE1-NE2 3.35Å; F90-A188 HydrophobicContact CD2-CB 4.11Å; F90-A188 HydrophobicContact CE2-CB 3.49Å; F90-A188 VanDerWaalsContact CE2-CB 3.49Å; F90-A188 HydrophobicContact CZ-CB 4.26Å; F90-Y214 WeakPolarHBondContact CE2-OH 3.49Å; F90-Y214 HydrophobicContact CZ-CE2 4.28Å; F90-Y214 WeakPolarHBondContact CZ-OH 3.45Å
91	V	92.9	Very high	94	Very high	13 Å²	13	46.1 Å²	46.1	8%	0.079	27%	0.27	C	S	.	.	S	Bend	trans	-129	144.4	-178.3	-173.4	0	0	0	0	111.3	V87 P89 T93 T112	V87-V91 PolarHBondContact O-N 3.4Å; V87-V91 VanDerWaalsContact O-N 3.16Å; P89-V91 VanDerWaalsContact C-N 3.29Å; P89-V91 PolarHBondContact O-N 2.92Å; V91-T93 PolarHBondContact O-N 2.86Å; V91-T112 WeakPolarHBondContact CG1-OG1 3.36Å; V91-T112 HydrophobicContact CG2-CG2 3.66Å
92	K	89.9	Confident	93.7	Very high	90 Å²	90	46.6 Å²	46.6	39%	0.391	27%	0.273	S	S	.	.			trans	-70.4	122.9	174.9	-67.9	-179.7	-174.9	164.4	0	109.7	E97 I141	K92-E97 HydrophobicContact CB-CB 3.7Å; K92-E97 HydrophobicContact CB-CG 3.85Å; K92-E97 HydrophobicContact CD-CB 4.43Å; K92-E97 HydrophobicContact CD-CG 3.66Å; K92-E97 HydrophobicContact CG-CG 4.39Å; K92-I141 HydrophobicContact CB-CD1 4.27Å; K92-I141 HydrophobicContact CG-CD1 3.37Å; K92-I141 HydrophobicContact CG-CG1 3.72Å
93	T	92.1	Very high	93.2	Very high	86 Å²	86	48.6 Å²	48.6	53%	0.528	29%	0.287	S	S	.	.			trans	-95.7	17.2	-177	52.5	0	0	0	0	114	V91 I98	V91-T93 PolarHBondContact O-N 2.86Å; T93-I98 WeakPolarHBondContact O-CD1 3.4Å
94	T	92.4	Very high	92.4	Very high	71 Å²	71	52.7 Å²	52.7	44%	0.436	32%	0.316	S	S	.	.	S	Bend	trans	-74.9	144.5	171.1	34.2	0	0	0	0	110.8	E96 E97 I98	T94-E96 VanDerWaalsContact C-N 3.27Å; T94-E96 PolarHBondContact O-N 3.09Å; T94-E97 WeakPolarHBondContact CB-OE2 3.34Å; T94-E97 PolarHBondContact O-N 3.07Å; T94-E97 PolarHBondContact OG1-OE2 3.02Å; T94-I98 WeakPolarHBondContact O-CG1 3.36Å; T94-I98 PolarHBondContact O-N 3.12Å
95	P	93	Very high	91.6	Very high	112 Å²	112	57.9 Å²	57.9	73%	0.727	34%	0.343	S	S	*	.	H	α-helix	trans	-61.2	-29.4	-171.6	-27.1	35.9	0	0	0	115.6	A99	P95-A99 PolarHBondContact O-N 3.36Å
96	E	90.5	Very high	90.8	Very high	151 Å²	151	64.7 Å²	64.7	71%	0.706	39%	0.386	S	S	*	.	H	α-helix	trans	-73.4	-46.8	178.6	-63.2	-179.9	-161.8	0	0	110.5	T94 A99 N100	T94-E96 VanDerWaalsContact C-N 3.27Å; T94-E96 PolarHBondContact O-N 3.09Å; E96-A99 PolarHBondContact O-N 3.19Å; E96-N100 PolarHBondContact O-N 2.98Å
97	E	90	Very high	90.3	Very high	30 Å²	30	67.1 Å²	67.1	14%	0.14	39%	0.389	C	S	.	.	H	α-helix	trans	-67.8	-35.1	176.4	-73.1	60.7	-146.7	0	0	113.5	K92 T94 A99 N100 P101 S103	K92-E97 HydrophobicContact CB-CB 3.7Å; K92-E97 HydrophobicContact CB-CG 3.85Å; K92-E97 HydrophobicContact CD-CB 4.43Å; K92-E97 HydrophobicContact CD-CG 3.66Å; K92-E97 HydrophobicContact CG-CG 4.39Å; T94-E97 WeakPolarHBondContact CB-OE2 3.34Å; T94-E97 PolarHBondContact O-N 3.07Å; T94-E97 PolarHBondContact OG1-OE2 3.02Å; E97-A99 PolarHBondContact O-N 3.47Å; E97-N100 WeakPolarHBondContact CA-O 3.48Å; E97-N100 CarbonylContact O-C 3.58Å; E97-N100 PolarHBondContact O-N 3.37Å; E97-P101 WeakPolarHBondContact O-CA 3.28Å; E97-S103 VanDerWaalsContact CD-OG 3.23Å; E97-S103 WeakPolarHBondContact CG-OG 3.44Å; E97-S103 PolarHBondContact OE1-OG 2.96Å
98	I	91.8	Very high	90	Very high	92 Å²	92	71.5 Å²	71.5	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-61.9	-34.5	173.3	-70.9	170.3	0	0	0	110.7	T93 T94 P111	T93-I98 WeakPolarHBondContact O-CD1 3.4Å; T94-I98 WeakPolarHBondContact O-CG1 3.36Å; T94-I98 PolarHBondContact O-N 3.12Å; I98-P111 WeakPolarHBondContact O-CB 3.19Å
99	A	92.6	Very high	89.8	Confident	64 Å²	64	68.6 Å²	68.6	53%	0.529	39%	0.385	S	S	.	.	H	α-helix	trans	-80.4	-33.9	178.8	0	0	0	0	0	113	P95 E96 E97	P95-A99 PolarHBondContact O-N 3.36Å; E96-A99 PolarHBondContact O-N 3.19Å; E97-A99 PolarHBondContact O-N 3.47Å
100	N	93.9	Very high	89.8	Confident	31 Å²	31	68.9 Å²	68.9	17%	0.166	38%	0.383	C	S	.	.			trans	-148.6	102.7	172.6	174.5	20.7	0	0	0	109.1	E96 E97 C102 S103 Y107 C109	E96-N100 PolarHBondContact O-N 2.98Å; E97-N100 WeakPolarHBondContact CA-O 3.48Å; E97-N100 CarbonylContact O-C 3.58Å; E97-N100 PolarHBondContact O-N 3.37Å; N100-C102 PolarHBondContact O-N 2.96Å; N100-C102 VanDerWaalsContact O-N 3.09Å; N100-C102 PolarHBondContact OD1-N 3.02Å; N100-S103 VanDerWaalsContact O-CB 3.3Å; N100-S103 WeakPolarHBondContact O-CB 3.26Å; N100-S103 PolarHBondContact O-N 2.94Å; N100-S103 PolarHBondContact O-OG 3.32Å; N100-Y107 PolarHBondContact ND2-O 2.85Å; N100-C109 PolarHBondContact OD1-N 2.96Å; N100-C109 PolarHBondContact OD1-O 2.78Å
101	P	92.9	Very high	89.8	Confident	19 Å²	19	71.9 Å²	71.9	12%	0.123	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-16.2	-174.9	28.2	-35.8	0	0	0	112.6	E97 S103 C109 L110 A139	E97-P101 WeakPolarHBondContact O-CA 3.28Å; P101-S103 VanDerWaalsContact C-N 3.35Å; P101-C109 HydrophobicContact CG-CB 4.13Å; P101-L110 VanDerWaalsContact CD-O 3.22Å; P101-L110 WeakPolarHBondContact CD-O 3.35Å; P101-L110 WeakPolarHBondContact CG-O 3.35Å; P101-A139 HydrophobicContact CB-CB 4.05Å; P101-A139 HydrophobicContact CG-CB 4.12Å
102	C	90.6	Very high	89.9	Confident	11 Å²	11	72 Å²	72	7%	0.074	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.2	7.1	173.5	-62.6	0	0	0	0	114.1	N100 S104 I105 C109	N100-C102 PolarHBondContact O-N 2.96Å; N100-C102 VanDerWaalsContact O-N 3.09Å; N100-C102 PolarHBondContact OD1-N 3.02Å; C102-S104 PolarHBondContact O-N 2.93Å; C102-I105 CarbonylContact O-C 3.58Å; C102-I105 WeakPolarHBondContact O-CA 3.48Å; C102-I105 PolarHBondContact O-N 2.02Å; C102-C109 HydrophobicContact CB-CB 3.68Å; C102-C109 WeakPolarHBondContact CB-SG 3.34Å; C102-C109 WeakPolarHBondContact SG-CB 3Å; C102-C109 CovalentContact SG-SG 2.02Å; C102-C109 PolarHBondContact SG-SG 2.75Å
103	S	87.7	Confident	90.3	Very high	42 Å²	42	67.9 Å²	67.9	29%	0.294	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-43.7	-33.3	179.8	57.3	0	0	0	0	116	E97 N100 P101 I105	E97-S103 VanDerWaalsContact CD-OG 3.23Å; E97-S103 WeakPolarHBondContact CG-OG 3.44Å; E97-S103 PolarHBondContact OE1-OG 2.96Å; N100-S103 VanDerWaalsContact O-CB 3.3Å; N100-S103 WeakPolarHBondContact O-CB 3.26Å; N100-S103 PolarHBondContact O-N 2.94Å; N100-S103 PolarHBondContact O-OG 3.32Å; P101-S103 VanDerWaalsContact C-N 3.35Å; S103-I105 PolarHBondContact O-N 2.95Å
104	S	80.5	Confident	90.5	Very high	85 Å²	85	64 Å²	64	59%	0.594	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.4	-11.3	179.3	-57.2	0	0	0	0	113.4	C102	C102-S104 PolarHBondContact O-N 2.93Å
105	I	80.4	Confident	90.8	Very high	110 Å²	110	60.6 Å²	60.6	56%	0.564	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-124.1	148.4	179.4	-58.7	176.4	0	0	0	106.4	C102 S103 Y107	C102-I105 CarbonylContact O-C 3.58Å; C102-I105 WeakPolarHBondContact O-CA 3.48Å; C102-I105 PolarHBondContact O-N 2.02Å; S103-I105 PolarHBondContact O-N 2.95Å; I105-Y107 PolarHBondContact O-N 2.88Å
106	P	80.2	Confident	91	Very high	142 Å²	142	57.8 Å²	57.8	92%	0.922	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	51.8	176.7	32.1	-37.6	0	0	0	112.8
107	Y	85.4	Confident	91.4	Very high	108 Å²	108	50.9 Å²	50.9	42%	0.424	29%	0.286	S	S	.	.			trans	-128.5	151.8	-179.7	-154.8	-82.7	0	0	0	110.4	D51 N100 I105 I137	D51-Y107 PolarHBondContact OD1-OH 2.96Å; D51-Y107 PolarHBondContact OD2-OH 2.86Å; N100-Y107 PolarHBondContact ND2-O 2.85Å; I105-Y107 PolarHBondContact O-N 2.88Å; Y107-I137 HydrophobicContact CD1-CD1 4.14Å; Y107-I137 HydrophobicContact CE1-CD1 3.52Å; Y107-I137 HydrophobicContact CE1-CG1 4.09Å
108	F	88.4	Confident	91.7	Very high	129 Å²	129	51.8 Å²	51.8	57%	0.566	29%	0.291	S	S	*	.			trans	-106.9	116	177.2	175.9	-94.3	0	0	0	110.3	L110	F108-L110 HydrophobicContact CE1-CD2 4.3Å
109	C	91.3	Very high	92	Very high	0 Å²	0	48 Å²	48	0%	0	27%	0.271	C	S	.	.			trans	-116.2	154.8	175.9	-62.1	0	0	0	0	110	N100 P101 C102 I137	N100-C109 PolarHBondContact OD1-N 2.96Å; N100-C109 PolarHBondContact OD1-O 2.78Å; P101-C109 HydrophobicContact CG-CB 4.13Å; C102-C109 HydrophobicContact CB-CB 3.68Å; C102-C109 WeakPolarHBondContact CB-SG 3.34Å; C102-C109 WeakPolarHBondContact SG-CB 3Å; C102-C109 CovalentContact SG-SG 2.02Å; C102-C109 PolarHBondContact SG-SG 2.75Å; C109-I137 WeakPolarHBondContact CA-O 3.22Å
110	L	94.3	Very high	92.2	Very high	60 Å²	60	47.9 Å²	47.9	31%	0.314	27%	0.265	S	S	.	.	P	Polyproline II helix	trans	-71.7	155.5	170.8	-66.8	-179	0	0	0	111	P101 F108 K136 I137 S138	P101-L110 VanDerWaalsContact CD-O 3.22Å; P101-L110 WeakPolarHBondContact CD-O 3.35Å; P101-L110 WeakPolarHBondContact CG-O 3.35Å; F108-L110 HydrophobicContact CE1-CD2 4.3Å; L110-K136 HydrophobicContact CD1-CB 3.79Å; L110-K136 HydrophobicContact CG-CB 3.78Å; L110-I137 PolarHBondContact N-O 2.87Å; L110-S138 PolarHBondContact O-OG 2.56Å
111	P	95.3	Very high	92.4	Very high	63 Å²	63	46.9 Å²	46.9	41%	0.409	26%	0.26	S	S	.	.	P	Polyproline II helix	trans	-56.7	140.6	168.2	-25.1	35.2	0	0	0	112	I98	I98-P111 WeakPolarHBondContact O-CB 3.19Å
112	T	95.8	Very high	92.6	Very high	17 Å²	17	48 Å²	48	10%	0.104	27%	0.267	C	S	.	.	P	Polyproline II helix	trans	-59.3	145.6	-178.6	-31.5	0	0	0	0	112.6	V83 V91 S138 A139	V83-T112 HydrophobicContact CB-CG2 4.15Å; V83-T112 HydrophobicContact CG1-CG2 3.9Å; V91-T112 WeakPolarHBondContact CG1-OG1 3.36Å; V91-T112 HydrophobicContact CG2-CG2 3.66Å; T112-S138 VanDerWaalsContact CA-OG 3.32Å; T112-S138 WeakPolarHBondContact CA-OG 3.46Å; T112-A139 WeakPolarHBondContact CG2-O 3.47Å; T112-A139 PolarHBondContact OG1-O 3.03Å
113	F	96.5	Very high	92.7	Very high	3 Å²	3	52.6 Å²	52.6	1%	0.013	29%	0.291	C	S	.	.			trans	-150.7	149.7	-178.5	62.4	-86.6	0	0	0	110.2	L46 V83 E84 K116	L46-F113 HydrophobicContact CD1-CZ 4.43Å; V83-F113 WeakPolarHBondContact CB-O 3.49Å; V83-F113 HydrophobicContact CG2-CD1 4.08Å; V83-F113 HydrophobicContact CG2-CE1 3.63Å; V83-F113 HydrophobicContact CG2-CE2 4.2Å; V83-F113 HydrophobicContact CG2-CZ 3.69Å; V83-F113 PolarHBondContact N-O 2.95Å; E84-F113 PolarHBondContact N-O 3.07Å; E84-F113 CarbonylContact O-C 3.33Å; E84-F113 VanDerWaalsContact O-O 3.12Å; F113-K116 HydrophobicContact CB-CD 4.37Å; F113-K116 VanDerWaalsContact CB-NZ 3.27Å; F113-K116 HydrophobicContact CD1-CD 4.25Å; F113-K116 VanDerWaalsContact CD1-NZ 3.28Å; F113-K116 HydrophobicContact CD2-CB 4.17Å; F113-K116 HydrophobicContact CD2-CD 3.51Å; F113-K116 HydrophobicContact CD2-CG 3.62Å; F113-K116 HydrophobicContact CE1-CD 4.46Å; F113-K116 HydrophobicContact CE2-CB 4.01Å; F113-K116 HydrophobicContact CE2-CD 3.76Å; F113-K116 HydrophobicContact CE2-CG 3.95Å; F113-K116 HydrophobicContact CG-CD 3.78Å; F113-K116 VanDerWaalsContact CG-CE 3.49Å; F113-K116 HydrophobicContact CG-CG 4.3Å; F113-K116 HydrophobicContact CZ-CD 4.24Å
114	G	96.9	Very high	93.1	Very high	3 Å²	3	54.5 Å²	54.5	3%	0.031	30%	0.297	C	S	.	.	S	Bend	trans	-69.7	-74.9	179.3	0	0	0	0	0	112.2	F82 V83 E84	F82-G114 WeakPolarHBondContact CA-O 3.42Å; F82-G114 VanDerWaalsContact CB-O 3.23Å; F82-G114 WeakPolarHBondContact CB-O 3.32Å; V83-G114 PolarHBondContact N-O 2.78Å; E84-G114 PolarHBondContact O-N 3.04Å
115	F	98.5	Very high	93.6	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	137.4	178.8	170.2	-122.1	0	0	0	111.6	L43 S81 H117 A150 Q153 A154 L200 Y206	L43-F115 HydrophobicContact CD1-CD2 4.02Å; L43-F115 HydrophobicContact CD1-CE2 3.59Å; S81-F115 VanDerWaalsContact O-CD2 3.23Å; S81-F115 WeakPolarHBondContact O-CD2 3.18Å; F115-H117 HydrophobicContact CE1-CB 4.27Å; F115-H117 HydrophobicContact CZ-CB 4.01Å; F115-A150 HydrophobicContact CB-CB 3.87Å; F115-A150 HydrophobicContact CD2-CB 3.48Å; F115-A150 VanDerWaalsContact CD2-CB 3.48Å; F115-A150 HydrophobicContact CE2-CB 4.2Å; F115-A150 HydrophobicContact CG-CB 3.75Å; F115-Q153 HydrophobicContact CD1-CB 3.52Å; F115-Q153 HydrophobicContact CD1-CG 4.1Å; F115-Q153 HydrophobicContact CE1-CB 3.56Å; F115-A154 HydrophobicContact CZ-CB 4.38Å; F115-L200 HydrophobicContact CD1-CD2 3.78Å; F115-L200 HydrophobicContact CE1-CD1 4.2Å; F115-L200 HydrophobicContact CE1-CD2 3.76Å; F115-L200 HydrophobicContact CE1-CG 4.38Å; F115-Y206 PolarHBondContact O-N 3.43Å
116	K	98.2	Very high	94.2	Very high	54 Å²	54	50.7 Å²	50.7	24%	0.235	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	121.8	173.8	-75.2	172.2	-176.2	155.7	0	110.6	G80 S81 F113 I118 E205	G80-K116 CarbonylContact C-O 3.57Å; G80-K116 VanDerWaalsContact CA-O 3.27Å; G80-K116 WeakPolarHBondContact CA-O 3.31Å; S81-K116 PolarHBondContact N-O 3.27Å; S81-K116 PolarHBondContact O-N 3.26Å; F113-K116 HydrophobicContact CB-CD 4.37Å; F113-K116 VanDerWaalsContact CB-NZ 3.27Å; F113-K116 HydrophobicContact CD1-CD 4.25Å; F113-K116 VanDerWaalsContact CD1-NZ 3.28Å; F113-K116 HydrophobicContact CD2-CB 4.17Å; F113-K116 HydrophobicContact CD2-CD 3.51Å; F113-K116 HydrophobicContact CD2-CG 3.62Å; F113-K116 HydrophobicContact CE1-CD 4.46Å; F113-K116 HydrophobicContact CE2-CB 4.01Å; F113-K116 HydrophobicContact CE2-CD 3.76Å; F113-K116 HydrophobicContact CE2-CG 3.95Å; F113-K116 HydrophobicContact CG-CD 3.78Å; F113-K116 VanDerWaalsContact CG-CE 3.49Å; F113-K116 HydrophobicContact CG-CG 4.3Å; F113-K116 HydrophobicContact CZ-CD 4.24Å; K116-I118 HydrophobicContact CB-CG1 4.4Å; K116-E205 WeakPolarHBondContact CE-OE1 3.45Å; K116-E205 HydrophobicContact CG-CB 4.27Å; K116-E205 HydrophobicContact CG-CG 4.01Å; K116-E205 IonicContact NZ-OE1 3.27Å; K116-E205 PolarHBondContact NZ-OE1 2.92Å
117	H	98.3	Very high	94.8	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.028	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	127.5	167.8	167.4	63.6	0	0	0	109.7	Y41 F115 L119 K160 I161 L200 N204	Y41-H117 AromaticContact CE2-CE1 3.97Å; Y41-H117 AromaticContact CE2-ND1 3.64Å; Y41-H117 AromaticContact CZ-ND1 3.66Å; Y41-H117 PolarHBondContact OH-ND1 2.83Å; F115-H117 HydrophobicContact CE1-CB 4.27Å; F115-H117 HydrophobicContact CZ-CB 4.01Å; H117-L119 PolarHBondContact CE1-O 3.38Å; H117-K160 PolarHBondContact NE2-O 2.87Å; H117-I161 HydrophobicContact CB-CD1 4.28Å; H117-I161 WeakPolarHBondContact ND1-CD1 3.36Å; H117-L200 HydrophobicContact CB-CD1 3.82Å; H117-L200 HydrophobicContact CB-CD2 4.46Å; H117-N204 HydrophobicContact CB-CB 4.1Å; H117-N204 PolarHBondContact N-O 2.92Å; H117-N204 WeakPolarHBondContact O-CB 3.15Å
118	I	97.1	Very high	95.2	Very high	49 Å²	49	44.6 Å²	44.6	25%	0.251	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	-44.3	-167.8	-56.6	158.7	0	0	0	112.2	F79 S81 K116 I131	F79-I118 HydrophobicContact CD1-CB 4.21Å; F79-I118 HydrophobicContact CD1-CD1 3.7Å; F79-I118 HydrophobicContact CE1-CD1 3.63Å; F79-I118 PolarHBondContact O-N 3.48Å; F79-I118 VanDerWaalsContact O-N 3.09Å; S81-I118 WeakPolarHBondContact OG-CD1 3.43Å; K116-I118 HydrophobicContact CB-CG1 4.4Å; I118-I131 HydrophobicContact CB-CG2 4.41Å; I118-I131 HydrophobicContact CG2-CG2 3.44Å; I118-I131 VanDerWaalsContact CG2-CG2 3.44Å
119	L	97.3	Very high	95.4	Very high	11 Å²	11	38.6 Å²	38.6	6%	0.058	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	112	179.8	178.5	57.5	0	0	0	110.8	G78 F79 H117 T122 R127 F128 I131	G78-L119 VanDerWaalsContact CA-O 3.26Å; G78-L119 WeakPolarHBondContact CA-O 3.19Å; F79-L119 HydrophobicContact CB-CB 3.99Å; F79-L119 PolarHBondContact N-O 3.32Å; F79-L119 PolarHBondContact O-N 2.89Å; H117-L119 PolarHBondContact CE1-O 3.38Å; L119-T122 HydrophobicContact CD1-CG2 3.94Å; L119-T122 HydrophobicContact CD2-CG2 4.27Å; L119-T122 HydrophobicContact CG-CG2 4.31Å; L119-R127 HydrophobicContact CD1-CG 4.07Å; L119-F128 HydrophobicContact CD2-CB 3.94Å; L119-F128 HydrophobicContact CD2-CD2 4.13Å; L119-F128 HydrophobicContact CD2-CG 4.49Å; L119-I131 HydrophobicContact CB-CD1 3.86Å; L119-I131 HydrophobicContact CD1-CD1 3.84Å; L119-I131 HydrophobicContact CD2-CD1 4.18Å; L119-I131 HydrophobicContact CG-CD1 4.16Å
120	P	97.9	Very high	95.6	Very high	62 Å²	62	43.1 Å²	43.1	40%	0.403	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	151.1	165.4	-22.7	32.4	0	0	0	112.3	T122	P120-T122 PolarHBondContact O-N 3.27Å
121	L	97.5	Very high	95.6	Very high	11 Å²	11	41.1 Å²	41.1	6%	0.058	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.9	108.5	-179.7	-74.8	160.5	0	0	0	112.2	D39 L40 R76 I161 W163	D39-L121 HydrophobicContact CB-CD1 3.96Å; D39-L121 HydrophobicContact CB-CD2 3.98Å; L40-L121 WeakPolarHBondContact O-CD2 3.43Å; R76-L121 HydrophobicContact CB-CB 4.29Å; R76-L121 HydrophobicContact CB-CD2 4.4Å; R76-L121 PolarHBondContact NH1-O 3.42Å; L121-I161 WeakPolarHBondContact CB-O 3.41Å; L121-I161 HydrophobicContact CD1-CG2 3.93Å; L121-I161 HydrophobicContact CG-CG2 4.36Å; L121-I161 WeakPolarHBondContact CG-O 3.17Å; L121-I161 PolarHBondContact N-O 2.65Å; L121-W163 HydrophobicContact CD1-CD2 3.7Å; L121-W163 HydrophobicContact CD1-CE3 3.4Å; L121-W163 HydrophobicContact CD1-CG 4.21Å; L121-W163 HydrophobicContact CD1-CZ3 3.86Å
122	T	96.1	Very high	95.4	Very high	43 Å²	43	38.1 Å²	38.1	26%	0.264	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	160.8	-176.7	-175.2	0	0	0	0	111.7	R76 L77 L119 P120 D124	R76-T122 CarbonylContact C-O 3.56Å; R76-T122 WeakPolarHBondContact CA-O 3.38Å; R76-T122 WeakPolarHBondContact CB-O 3.41Å; L77-T122 PolarHBondContact N-O 2.96Å; L77-T122 PolarHBondContact O-N 2.89Å; L119-T122 HydrophobicContact CD1-CG2 3.94Å; L119-T122 HydrophobicContact CD2-CG2 4.27Å; L119-T122 HydrophobicContact CG-CG2 4.31Å; P120-T122 PolarHBondContact O-N 3.27Å; T122-D124 VanDerWaalsContact C-N 3.3Å; T122-D124 HydrophobicContact CG2-CB 4.2Å; T122-D124 PolarHBondContact OG1-N 3.5Å
123	N	94.2	Very high	95.3	Very high	107 Å²	107	42 Å²	42	57%	0.572	21%	0.208	S	C	*	.	S	Bend	trans	-81.3	-11.2	169.9	-57.6	-52.9	0	0	0	112.3	F75 R76 A125	F75-N123 PolarHBondContact O-OD1 2.88Å; R76-N123 WeakPolarHBondContact CG-OD1 3.47Å; N123-A125 PolarHBondContact O-N 3.25Å
124	D	94.3	Very high	95.1	Very high	81 Å²	81	47.9 Å²	47.9	43%	0.433	24%	0.239	S	C	.	.			trans	-83.3	96.9	-176.3	-172.6	-13.8	0	0	0	111.7	T122 E126 R127	T122-D124 VanDerWaalsContact C-N 3.3Å; T122-D124 HydrophobicContact CG2-CB 4.2Å; T122-D124 PolarHBondContact OG1-N 3.5Å; D124-E126 PolarHBondContact OD1-N 2.88Å; D124-R127 HydrophobicContact CB-CB 3.97Å; D124-R127 PolarHBondContact O-N 3.47Å; D124-R127 PolarHBondContact OD1-N 3.48Å
125	A	91.3	Very high	94.9	Very high	11 Å²	11	49.3 Å²	49.3	9%	0.091	25%	0.245	C	C	.	.	H	α-helix	trans	-72.5	-22.9	178.9	0	0	0	0	0	114.6	L77 N123 N129	L77-A125 HydrophobicContact CD1-CB 4.41Å; L77-A125 HydrophobicContact CD2-CB 4.15Å; N123-A125 PolarHBondContact O-N 3.25Å; A125-N129 PolarHBondContact O-N 3.48Å
126	E	92.9	Very high	94.6	Very high	105 Å²	105	54.5 Å²	54.5	49%	0.491	27%	0.268	S	S	.	.	H	α-helix	trans	-76.8	-32.2	174.8	-66.8	-56.2	155.3	0	0	110.8	S62 D124 F128 N129 E130	S62-E126 WeakPolarHBondContact CB-OE1 3.45Å; D124-E126 PolarHBondContact OD1-N 2.88Å; E126-F128 PolarHBondContact O-N 3.32Å; E126-N129 WeakPolarHBondContact O-CB 3.28Å; E126-N129 PolarHBondContact O-N 3.04Å; E126-N129 PolarHBondContact OE2-ND2 2.97Å; E126-E130 WeakPolarHBondContact O-CG 3.28Å; E126-E130 PolarHBondContact O-N 3.07Å
127	R	93.9	Very high	94.4	Very high	121 Å²	121	52.2 Å²	52.2	46%	0.457	26%	0.258	S	S	.	.	H	α-helix	trans	-60.1	-33.7	172.8	-172.2	54.5	171.7	-174.7	-0.1	113.2	L119 D124 E130 I131	L119-R127 HydrophobicContact CD1-CG 4.07Å; D124-R127 HydrophobicContact CB-CB 3.97Å; D124-R127 PolarHBondContact O-N 3.47Å; D124-R127 PolarHBondContact OD1-N 3.48Å; R127-E130 VanDerWaalsContact CD-OE2 3.29Å; R127-E130 WeakPolarHBondContact CD-OE2 3.09Å; R127-E130 IonicContact CZ-OE2 2.8Å; R127-E130 IonicContact NE-OE2 3.52Å; R127-E130 IonicContact NH1-OE2 3.68Å; R127-E130 PolarHBondContact NH1-OE2 3.07Å; R127-I131 HydrophobicContact CG-CD1 4.16Å; R127-I131 WeakPolarHBondContact O-CB 2.86Å; R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 3.16Å; R127-I131 VanDerWaalsContact O-N 3.14Å
128	F	93.9	Very high	94.2	Very high	1 Å²	1	52 Å²	52	0%	0.004	26%	0.257	C	S	.	.	H	α-helix	trans	-62.6	-50.8	170.7	-177.9	-82.7	0	0	0	111.1	Y42 L60 G61 L77 F79 L119 E126 E130 I131 V132	Y42-F128 HydrophobicContact CG-CE2 4.47Å; Y42-F128 HydrophobicContact CG-CZ 4.18Å; L60-F128 HydrophobicContact CB-CE1 4.46Å; G61-F128 VanDerWaalsContact CA-CD1 3.5Å; L77-F128 HydrophobicContact CD1-CB 3.63Å; L77-F128 HydrophobicContact CD1-CD1 4.27Å; L77-F128 HydrophobicContact CD1-CD2 3.75Å; L77-F128 HydrophobicContact CD1-CE2 4.46Å; L77-F128 HydrophobicContact CD1-CG 3.64Å; L77-F128 HydrophobicContact CG-CB 4.15Å; L77-F128 HydrophobicContact CG-CD2 4.13Å; L77-F128 HydrophobicContact CG-CG 4.35Å; F79-F128 HydrophobicContact CB-CD2 4.1Å; F79-F128 HydrophobicContact CB-CE2 3.85Å; F79-F128 AromaticContact CD2-CE2 3.77Å; F79-F128 HydrophobicContact CD2-CE2 3.77Å; F79-F128 AromaticContact CD2-CZ 3.91Å; F79-F128 HydrophobicContact CD2-CZ 3.91Å; F79-F128 HydrophobicContact CG-CE2 4.24Å; L119-F128 HydrophobicContact CD2-CB 3.94Å; L119-F128 HydrophobicContact CD2-CD2 4.13Å; L119-F128 HydrophobicContact CD2-CG 4.49Å; E126-F128 PolarHBondContact O-N 3.32Å; F128-E130 VanDerWaalsContact C-N 3.31Å; F128-E130 PolarHBondContact O-N 2.8Å; F128-I131 PolarHBondContact O-N 3.24Å; F128-I131 VanDerWaalsContact O-N 3.1Å; F128-V132 HydrophobicContact CD1-CG2 3.88Å; F128-V132 HydrophobicContact CE1-CG2 3.55Å; F128-V132 HydrophobicContact CG-CG2 4.48Å; F128-V132 HydrophobicContact CZ-CG2 3.9Å; F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 2.91Å
129	N	92.8	Very high	93.9	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.011	25%	0.249	C	C	.	.	H	α-helix	trans	-57.9	-41.3	178.8	-64.6	-24.4	0	0	0	112.2	G61 S62 A125 E126 K133	G61-N129 WeakPolarHBondContact CA-OD1 3.32Å; G61-N129 PolarHBondContact N-OD1 2.85Å; S62-N129 WeakPolarHBondContact CB-ND2 3.34Å; S62-N129 PolarHBondContact N-OD1 2.91Å; S62-N129 PolarHBondContact OG-ND2 2.83Å; A125-N129 PolarHBondContact O-N 3.48Å; E126-N129 WeakPolarHBondContact O-CB 3.28Å; E126-N129 PolarHBondContact O-N 3.04Å; E126-N129 PolarHBondContact OE2-ND2 2.97Å; N129-K133 VanDerWaalsContact O-CD 3.3Å; N129-K133 WeakPolarHBondContact O-CD 3.46Å; N129-K133 WeakPolarHBondContact O-CG 3.34Å; N129-K133 PolarHBondContact O-N 3.01Å
130	E	94	Very high	93.3	Very high	96 Å²	96	51.3 Å²	51.3	45%	0.449	26%	0.256	S	S	.	.	H	α-helix	trans	-60.2	-45.6	174.3	-71.3	-176.7	162.6	0	0	112.3	E126 R127 F128 N134	E126-E130 WeakPolarHBondContact O-CG 3.28Å; E126-E130 PolarHBondContact O-N 3.07Å; R127-E130 VanDerWaalsContact CD-OE2 3.29Å; R127-E130 WeakPolarHBondContact CD-OE2 3.09Å; R127-E130 IonicContact CZ-OE2 2.8Å; R127-E130 IonicContact NE-OE2 3.52Å; R127-E130 IonicContact NH1-OE2 3.68Å; R127-E130 PolarHBondContact NH1-OE2 3.07Å; F128-E130 VanDerWaalsContact C-N 3.31Å; F128-E130 PolarHBondContact O-N 2.8Å; E130-N134 PolarHBondContact O-N 2.69Å; E130-N134 PolarHBondContact O-ND2 3.03Å
131	I	94.3	Very high	92.6	Very high	18 Å²	18	52.8 Å²	52.8	9%	0.092	26%	0.259	C	S	.	.	H	α-helix	trans	-70.5	-43	-175.6	-78.3	173.8	0	0	0	111.6	F79 I118 L119 R127 F128 K133 N134 Q135	F79-I131 HydrophobicContact CD1-CG2 4.28Å; I118-I131 HydrophobicContact CB-CG2 4.41Å; I118-I131 HydrophobicContact CG2-CG2 3.44Å; I118-I131 VanDerWaalsContact CG2-CG2 3.44Å; L119-I131 HydrophobicContact CB-CD1 3.86Å; L119-I131 HydrophobicContact CD1-CD1 3.84Å; L119-I131 HydrophobicContact CD2-CD1 4.18Å; L119-I131 HydrophobicContact CG-CD1 4.16Å; R127-I131 HydrophobicContact CG-CD1 4.16Å; R127-I131 WeakPolarHBondContact O-CB 2.86Å; R127-I131 WeakPolarHBondContact O-CG1 3.27Å; R127-I131 PolarHBondContact O-N 3.16Å; R127-I131 VanDerWaalsContact O-N 3.14Å; F128-I131 PolarHBondContact O-N 3.24Å; F128-I131 VanDerWaalsContact O-N 3.1Å; I131-K133 PolarHBondContact O-N 2.73Å; I131-N134 PolarHBondContact O-N 2.82Å; I131-N134 VanDerWaalsContact O-N 3.14Å; I131-Q135 PolarHBondContact O-N 3.13Å; I131-Q135 PolarHBondContact O-NE2 3.43Å
132	V	92.6	Very high	92	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-61.4	-43	177.2	170.4	0	0	0	0	111.1	L54 I57 K58 F79 F128 N134 Q135	L54-V132 HydrophobicContact CD1-CG1 3.99Å; I57-V132 HydrophobicContact CD1-CG1 3.55Å; I57-V132 HydrophobicContact CD1-CG2 4.25Å; I57-V132 HydrophobicContact CG1-CG1 3.67Å; K58-V132 HydrophobicContact CG-CG1 4.36Å; F79-V132 HydrophobicContact CD2-CG2 4.06Å; F79-V132 HydrophobicContact CE2-CG2 4.02Å; F79-V132 HydrophobicContact CZ-CG2 4.44Å; F128-V132 HydrophobicContact CD1-CG2 3.88Å; F128-V132 HydrophobicContact CE1-CG2 3.55Å; F128-V132 HydrophobicContact CG-CG2 4.48Å; F128-V132 HydrophobicContact CZ-CG2 3.9Å; F128-V132 WeakPolarHBondContact O-CG2 3.27Å; F128-V132 PolarHBondContact O-N 2.91Å; V132-N134 PolarHBondContact O-N 2.93Å; V132-N134 VanDerWaalsContact O-N 3.13Å; V132-Q135 PolarHBondContact O-N 2.98Å; V132-Q135 VanDerWaalsContact O-N 3.09Å
133	K	92.4	Very high	91.5	Very high	99 Å²	99	58 Å²	58	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-24.9	176.2	-74.1	166.5	-171.2	167.1	0	113.9	K58 N129 I131	K58-K133 HydrophobicContact CB-CG 3.95Å; K58-K133 HydrophobicContact CD-CG 4.23Å; K58-K133 HydrophobicContact CG-CG 3.81Å; K58-K133 WeakPolarHBondContact O-CE 3.45Å; N129-K133 VanDerWaalsContact O-CD 3.3Å; N129-K133 WeakPolarHBondContact O-CD 3.46Å; N129-K133 WeakPolarHBondContact O-CG 3.34Å; N129-K133 PolarHBondContact O-N 3.01Å; I131-K133 PolarHBondContact O-N 2.73Å
134	N	92.8	Very high	91.4	Very high	125 Å²	125	54 Å²	54	67%	0.668	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-9.5	-179.9	-68.4	-33	0	0	0	113.9	E130 I131 V132	E130-N134 PolarHBondContact O-N 2.69Å; E130-N134 PolarHBondContact O-ND2 3.03Å; I131-N134 PolarHBondContact O-N 2.82Å; I131-N134 VanDerWaalsContact O-N 3.14Å; V132-N134 PolarHBondContact O-N 2.93Å; V132-N134 VanDerWaalsContact O-N 3.13Å
135	Q	93.1	Very high	91.5	Very high	33 Å²	33	50.4 Å²	50.4	15%	0.154	25%	0.25	C	S	.	.			trans	-70.4	162.8	176.8	-57.6	-46.8	-58.4	0	0	112	L46 L54 F79 I131 V132	L46-Q135 HydrophobicContact CD1-CB 4.22Å; L54-Q135 HydrophobicContact CD1-CB 4.02Å; L54-Q135 HydrophobicContact CD2-CB 4.12Å; F79-Q135 HydrophobicContact CE1-CG 3.85Å; F79-Q135 HydrophobicContact CZ-CG 4.3Å; I131-Q135 PolarHBondContact O-N 3.13Å; I131-Q135 PolarHBondContact O-NE2 3.43Å; V132-Q135 PolarHBondContact O-N 2.98Å; V132-Q135 VanDerWaalsContact O-N 3.09Å
136	K	92.6	Very high	91.7	Very high	110 Å²	110	49.9 Å²	49.9	48%	0.478	25%	0.246	S	C	.	.			trans	-143.9	143.5	175.6	-64.4	-65	164.2	-150.9	0	108.7	L110	L110-K136 HydrophobicContact CD1-CB 3.79Å; L110-K136 HydrophobicContact CG-CB 3.78Å
137	I	93.5	Very high	91.9	Very high	6 Å²	6	44.9 Å²	44.9	3%	0.031	22%	0.223	C	C	.	.			trans	-64.6	163.4	171.9	68.9	-176.2	0	0	0	111.9	L46 D51 L54 Y107 C109 L110	L46-I137 CarbonylContact O-C 3.54Å; L46-I137 WeakPolarHBondContact O-CA 3.22Å; D51-I137 HydrophobicContact CB-CD1 3.81Å; D51-I137 HydrophobicContact CB-CG2 3.9Å; L54-I137 HydrophobicContact CD2-CG2 4.45Å; Y107-I137 HydrophobicContact CD1-CD1 4.14Å; Y107-I137 HydrophobicContact CE1-CD1 3.52Å; Y107-I137 HydrophobicContact CE1-CG1 4.09Å; C109-I137 WeakPolarHBondContact CA-O 3.22Å; L110-I137 PolarHBondContact N-O 2.87Å
138	S	94.1	Very high	92.1	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	20%	0.201	C	C	.	.			trans	-131.9	-175.4	177.4	173.4	0	0	0	0	107.9	L46 S47 A48 L110 T112	L46-S138 PolarHBondContact O-N 3.4Å; S47-S138 CarbonylContact C-O 3.58Å; A48-S138 WeakPolarHBondContact CA-O 3.24Å; A48-S138 PolarHBondContact N-O 2.84Å; L110-S138 PolarHBondContact O-OG 2.56Å; T112-S138 VanDerWaalsContact CA-OG 3.32Å; T112-S138 WeakPolarHBondContact CA-OG 3.46Å
139	A	89.4	Confident	92.4	Very high	11 Å²	11	39.2 Å²	39.2	9%	0.091	20%	0.202	C	C	.	.			trans	-148.2	160.5	168.2	0	0	0	0	0	112.5	A48 P101 T112	A48-A139 HydrophobicContact CB-CB 4.2Å; P101-A139 HydrophobicContact CB-CB 4.05Å; P101-A139 HydrophobicContact CG-CB 4.12Å; T112-A139 WeakPolarHBondContact CG2-O 3.47Å; T112-A139 PolarHBondContact OG1-O 3.03Å
140	N	85.2	Confident	92.6	Very high	36 Å²	36	39.1 Å²	39.1	19%	0.193	20%	0.201	C	C	.	.			trans	-124	-175	173.1	53.6	-20.5	0	0	0	109.2	E84 D142 E145	E84-N140 HydrophobicContact CB-CB 4.22Å; N140-D142 PolarHBondContact ND2-O 2.91Å; N140-D142 VanDerWaalsContact ND2-O 3.07Å; N140-E145 VanDerWaalsContact CG-OE1 3.28Å; N140-E145 PolarHBondContact ND2-OE1 3.39Å; N140-E145 PolarHBondContact ND2-OE2 3.37Å; N140-E145 PolarHBondContact OD1-OE1 2.98Å
141	I	83.8	Confident	92.9	Very high	92 Å²	92	34.6 Å²	34.6	47%	0.472	18%	0.18	S	C	.	.	S	Bend	trans	-98.9	-50.7	176.9	-60.9	-175.5	0	0	0	112	P89 F90 K92	P89-I141 WeakPolarHBondContact O-CD1 3.23Å; F90-I141 WeakPolarHBondContact O-CB 3.46Å; F90-I141 PolarHBondContact O-N 3.01Å; K92-I141 HydrophobicContact CB-CD1 4.27Å; K92-I141 HydrophobicContact CG-CD1 3.37Å; K92-I141 HydrophobicContact CG-CG1 3.72Å
142	D	84.7	Confident	93.1	Very high	48 Å²	48	33.8 Å²	33.8	26%	0.257	18%	0.176	S	C	.	.	S	Bend	trans	-90.2	174.4	-173.6	47.7	-24.9	0	0	0	112.1	F90 N140 H180	F90-D142 WeakPolarHBondContact CA-OD1 3.39Å; F90-D142 WeakPolarHBondContact CD1-OD2 3.26Å; N140-D142 PolarHBondContact ND2-O 2.91Å; N140-D142 VanDerWaalsContact ND2-O 3.07Å; D142-H180 IonicContact OD2-NE2 2.65Å
143	T	84.9	Confident	93.3	Very high	117 Å²	117	33.8 Å²	33.8	72%	0.718	18%	0.176	S	C	*	.	S	Bend	trans	-90.8	-24.5	-172.4	52.7	0	0	0	0	115.8	A177	T143-A177 WeakPolarHBondContact O-CB 3.43Å
144	P	93.3	Very high	93.6	Very high	22 Å²	22	29 Å²	29	14%	0.143	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	150.5	170.6	-8.8	28.2	0	0	0	111	D178	P144-D178 CarbonylContact C-O 3.31Å; P144-D178 WeakPolarHBondContact CA-O 3.38Å; P144-D178 HydrophobicContact CB-CB 4.3Å
145	E	95.3	Very high	93.9	Very high	5 Å²	5	23.1 Å²	23.1	2%	0.023	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	164.4	-178.9	-63.6	-73.7	168.4	0	0	112	S47 F82 V83 E84 N140 G147 A177 D178 S179 H180	S47-E145 WeakPolarHBondContact CB-OE1 3.3Å; F82-E145 HydrophobicContact CD2-CB 4.46Å; F82-E145 HydrophobicContact CE2-CB 4.07Å; V83-E145 WeakPolarHBondContact CG1-OE2 3.45Å; E84-E145 WeakPolarHBondContact OE2-CA 3.45Å; N140-E145 VanDerWaalsContact CG-OE1 3.28Å; N140-E145 PolarHBondContact ND2-OE1 3.39Å; N140-E145 PolarHBondContact ND2-OE2 3.37Å; N140-E145 PolarHBondContact OD1-OE1 2.98Å; E145-G147 PolarHBondContact O-N 3Å; E145-A177 HydrophobicContact CG-CB 3.94Å; E145-D178 PolarHBondContact N-O 2.85Å; E145-S179 CarbonylContact O-C 3.6Å; E145-S179 WeakPolarHBondContact O-CA 3.17Å; E145-H180 PolarHBondContact O-N 3.33Å
146	G	96.5	Very high	94.1	Very high	1 Å²	1	23 Å²	23	1%	0.01	13%	0.125	C	C	.	.	S	Bend	trans	-79.7	23.3	-177	0	0	0	0	0	114.1	V83 E84 F148 D149	V83-G146 WeakPolarHBondContact O-CA 3.3Å; V83-G146 PolarHBondContact O-N 2.89Å; E84-G146 WeakPolarHBondContact OE2-CA 3.19Å; E84-G146 PolarHBondContact OE2-N 3.36Å; G146-F148 PolarHBondContact O-N 3.23Å; G146-F148 VanDerWaalsContact O-N 3.15Å; G146-D149 WeakPolarHBondContact O-CB 2.99Å; G146-D149 PolarHBondContact O-N 3.35Å; G146-D149 VanDerWaalsContact O-N 3.14Å
147	G	97.4	Very high	94.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-56.1	-34.7	-170.4	0	0	0	0	0	114.5	F82 E145 A150 I151	F82-G147 VanDerWaalsContact CE2-CA 3.48Å; E145-G147 PolarHBondContact O-N 3Å; G147-A150 WeakPolarHBondContact O-CB 3.46Å; G147-A150 PolarHBondContact O-N 2.92Å; G147-A150 VanDerWaalsContact O-N 3.16Å; G147-I151 WeakPolarHBondContact O-CG1 3.3Å; G147-I151 PolarHBondContact O-N 3.07Å
148	F	98.4	Very high	94.5	Very high	1 Å²	1	21.9 Å²	21.9	0%	0.004	12%	0.12	C	C	.	.	H	α-helix	trans	-69.9	-33	-179.3	-79.4	13	0	0	0	113.6	G146 A150 I151 M152 F181 P215 I217 L220 F233 Y243 Y246	G146-F148 PolarHBondContact O-N 3.23Å; G146-F148 VanDerWaalsContact O-N 3.15Å; F148-A150 PolarHBondContact O-N 3.41Å; F148-I151 HydrophobicContact CD1-CD1 3.9Å; F148-I151 HydrophobicContact CE1-CD1 4.31Å; F148-I151 PolarHBondContact O-N 3.39Å; F148-M152 PolarHBondContact O-N 3.44Å; F148-M152 VanDerWaalsContact O-N 3.08Å; F148-F181 HydrophobicContact CD2-CB 3.72Å; F148-F181 HydrophobicContact CE2-CB 3.87Å; F148-P215 HydrophobicContact CB-CG 3.99Å; F148-P215 VanDerWaalsContact O-CG 3.28Å; F148-P215 WeakPolarHBondContact O-CG 3.27Å; F148-I217 HydrophobicContact CE2-CG1 4.18Å; F148-L220 HydrophobicContact CB-CD1 4.09Å; F148-L220 HydrophobicContact CD1-CD1 4.16Å; F148-L220 HydrophobicContact CD2-CD1 3.61Å; F148-L220 HydrophobicContact CE2-CD1 4.01Å; F148-L220 HydrophobicContact CG-CD1 3.69Å; F148-L220 HydrophobicContact CZ-CD1 4.44Å; F148-F233 HydrophobicContact CE1-CE1 4.48Å; F148-Y243 HydrophobicContact CE1-CE1 4.49Å; F148-Y246 HydrophobicContact CZ-CD2 4Å; F148-Y246 HydrophobicContact CZ-CE2 4Å
149	D	98.6	Very high	94.6	Very high	2 Å²	2	31.1 Å²	31.1	1%	0.011	16%	0.163	C	C	.	.	H	α-helix	trans	-59.4	-41.3	170.2	-93.7	-11.9	0	0	0	110.3	K85 G146 M152 Q153 Y206 P215	K85-D149 IonicContact NZ-OD1 3.4Å; K85-D149 IonicContact NZ-OD2 3.52Å; K85-D149 PolarHBondContact NZ-OD2 3.04Å; G146-D149 WeakPolarHBondContact O-CB 2.99Å; G146-D149 PolarHBondContact O-N 3.35Å; G146-D149 VanDerWaalsContact O-N 3.14Å; D149-M152 PolarHBondContact O-N 2.89Å; D149-Q153 WeakPolarHBondContact O-CG 3.42Å; D149-Q153 PolarHBondContact O-N 2.78Å; D149-Y206 HydrophobicContact CB-CD1 4.3Å; D149-Y206 HydrophobicContact CB-CE1 3.96Å; D149-Y206 WeakPolarHBondContact OD2-CE1 3.16Å; D149-P215 VanDerWaalsContact OD1-CD 3.3Å; D149-P215 WeakPolarHBondContact OD1-CD 3.49Å
150	A	98.6	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-70.9	-40.4	-177.7	0	0	0	0	0	112.8	L43 F82 F115 G147 F148 Q153 A154	L43-A150 HydrophobicContact CD1-CB 3.95Å; L43-A150 HydrophobicContact CD2-CB 3.86Å; L43-A150 HydrophobicContact CG-CB 4.39Å; F82-A150 HydrophobicContact CB-CB 3.64Å; F82-A150 HydrophobicContact CD1-CB 4.07Å; F82-A150 HydrophobicContact CG-CB 4.01Å; F115-A150 HydrophobicContact CB-CB 3.87Å; F115-A150 HydrophobicContact CD2-CB 3.48Å; F115-A150 VanDerWaalsContact CD2-CB 3.48Å; F115-A150 HydrophobicContact CE2-CB 4.2Å; F115-A150 HydrophobicContact CG-CB 3.75Å; G147-A150 WeakPolarHBondContact O-CB 3.46Å; G147-A150 PolarHBondContact O-N 2.92Å; G147-A150 VanDerWaalsContact O-N 3.16Å; F148-A150 PolarHBondContact O-N 3.41Å; A150-Q153 PolarHBondContact O-N 2.95Å; A150-A154 VanDerWaalsContact O-CB 3.24Å; A150-A154 WeakPolarHBondContact O-CB 3.46Å; A150-A154 PolarHBondContact O-N 3.24Å
151	I	98.7	Very high	95.5	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.1	-47.4	171.7	-64.2	168.9	0	0	0	110.1	L43 G147 F148 Q153 A154 A155 L171 F173 L220 L224 L231 F233	L43-I151 HydrophobicContact CD2-CG1 3.89Å; G147-I151 WeakPolarHBondContact O-CG1 3.3Å; G147-I151 PolarHBondContact O-N 3.07Å; F148-I151 HydrophobicContact CD1-CD1 3.9Å; F148-I151 HydrophobicContact CE1-CD1 4.31Å; F148-I151 PolarHBondContact O-N 3.39Å; I151-Q153 PolarHBondContact O-N 2.84Å; I151-A154 PolarHBondContact O-N 3.39Å; I151-A155 WeakPolarHBondContact O-CB 3.49Å; I151-A155 PolarHBondContact O-N 3.09Å; I151-L171 HydrophobicContact CG1-CD2 4.27Å; I151-F173 HydrophobicContact CD1-CD2 3.64Å; I151-F173 HydrophobicContact CD1-CE2 4.01Å; I151-F173 HydrophobicContact CD1-CG 4.18Å; I151-F173 HydrophobicContact CG1-CD2 3.74Å; I151-F173 HydrophobicContact CG1-CE2 4.22Å; I151-L220 HydrophobicContact CB-CD2 4.22Å; I151-L220 HydrophobicContact CG2-CD2 3.95Å; I151-L224 HydrophobicContact CG2-CD1 4.5Å; I151-L224 HydrophobicContact CG2-CD2 4.12Å; I151-L231 HydrophobicContact CD1-CD1 4.08Å; I151-L231 HydrophobicContact CD1-CD2 4.2Å; I151-L231 HydrophobicContact CG1-CD1 4.36Å; I151-L231 HydrophobicContact CG2-CD1 4.31Å; I151-L231 HydrophobicContact CG2-CD2 4.42Å; I151-F233 HydrophobicContact CD1-CE1 4.17Å
152	M	98.6	Very high	96.2	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-49.7	179.5	176.8	60.5	80.7	0	0	111.8	F148 D149 A154 A155 V156 P215 Q219 L220 K223	F148-M152 PolarHBondContact O-N 3.44Å; F148-M152 VanDerWaalsContact O-N 3.08Å; D149-M152 PolarHBondContact O-N 2.89Å; M152-A154 PolarHBondContact O-N 3.05Å; M152-A155 PolarHBondContact O-N 2.94Å; M152-V156 WeakPolarHBondContact O-CG2 3.37Å; M152-V156 PolarHBondContact O-N 2.59Å; M152-V156 HydrophobicContact SD-CG2 3.66Å; M152-P215 HydrophobicContact CB-CB 4.34Å; M152-P215 HydrophobicContact CB-CG 3.94Å; M152-P215 HydrophobicContact CE-CB 3.59Å; M152-P215 HydrophobicContact CE-CG 4.41Å; M152-P215 HydrophobicContact CG-CB 4.45Å; M152-Q219 HydrophobicContact CE-CB 3.9Å; M152-L220 HydrophobicContact CB-CD2 3.97Å; M152-L220 HydrophobicContact CE-CD2 4.17Å; M152-K223 HydrophobicContact CE-CB 4.29Å; M152-K223 HydrophobicContact CE-CG 4.01Å; M152-K223 HydrophobicContact SD-CB 3.86Å; M152-K223 HydrophobicContact SD-CG 3.74Å
153	Q	98.6	Very high	96.8	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-64.5	-40.8	178.9	-68.1	-56.9	-62.4	0	0	112.1	F115 D149 A150 I151 A155 V156 C157 L197 Y206	F115-Q153 HydrophobicContact CD1-CB 3.52Å; F115-Q153 HydrophobicContact CD1-CG 4.1Å; F115-Q153 HydrophobicContact CE1-CB 3.56Å; D149-Q153 WeakPolarHBondContact O-CG 3.42Å; D149-Q153 PolarHBondContact O-N 2.78Å; A150-Q153 PolarHBondContact O-N 2.95Å; I151-Q153 PolarHBondContact O-N 2.84Å; Q153-A155 VanDerWaalsContact C-N 3.33Å; Q153-A155 PolarHBondContact O-N 2.96Å; Q153-V156 PolarHBondContact O-N 3.29Å; Q153-C157 WeakPolarHBondContact O-CB 3.48Å; Q153-C157 PolarHBondContact O-N 3.22Å; Q153-C157 PolarHBondContact O-SG 3.28Å; Q153-L197 PolarHBondContact NE2-O 2.9Å; Q153-Y206 VanDerWaalsContact CD-CD2 3.46Å; Q153-Y206 VanDerWaalsContact CD-CE2 3.43Å; Q153-Y206 HydrophobicContact CG-CD1 4.39Å; Q153-Y206 HydrophobicContact CG-CD2 3.54Å; Q153-Y206 HydrophobicContact CG-CE2 3.77Å; Q153-Y206 HydrophobicContact CG-CG 3.88Å
154	A	98.5	Very high	97.2	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-67.7	-29.2	177.5	0	0	0	0	0	113.5	Y41 F115 A150 I151 M152 W163 L171	Y41-A154 HydrophobicContact CD1-CB 4.09Å; Y41-A154 HydrophobicContact CE1-CB 3.92Å; F115-A154 HydrophobicContact CZ-CB 4.38Å; A150-A154 VanDerWaalsContact O-CB 3.24Å; A150-A154 WeakPolarHBondContact O-CB 3.46Å; A150-A154 PolarHBondContact O-N 3.24Å; I151-A154 PolarHBondContact O-N 3.39Å; M152-A154 PolarHBondContact O-N 3.05Å; A154-W163 PolarHBondContact O-NE1 3.01Å; A154-L171 HydrophobicContact CB-CD1 3.68Å
155	A	97.9	Very high	97	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.008	15%	0.146	C	C	.	.	H	α-helix	trans	-76.2	-43.8	173.6	0	0	0	0	0	112.8	I151 M152 Q153 L224 N227 V229	I151-A155 WeakPolarHBondContact O-CB 3.49Å; I151-A155 PolarHBondContact O-N 3.09Å; M152-A155 PolarHBondContact O-N 2.94Å; Q153-A155 VanDerWaalsContact C-N 3.33Å; Q153-A155 PolarHBondContact O-N 2.96Å; A155-L224 HydrophobicContact CB-CD2 4.03Å; A155-N227 PolarHBondContact O-ND2 3.49Å; A155-V229 HydrophobicContact CB-CG2 4.37Å
156	V	98.2	Very high	96.6	Very high	29 Å²	29	34.8 Å²	34.8	18%	0.176	17%	0.173	C	C	.	.	H	α-helix	trans	-84.9	-32.9	-171.6	-179.6	0	0	0	0	113.3	M152 Q153 K158 C198 K223	M152-V156 WeakPolarHBondContact O-CG2 3.37Å; M152-V156 PolarHBondContact O-N 2.59Å; M152-V156 HydrophobicContact SD-CG2 3.66Å; Q153-V156 PolarHBondContact O-N 3.29Å; V156-K158 PolarHBondContact O-N 3.5Å; V156-C198 HydrophobicContact CG1-CB 4.2Å; V156-K223 HydrophobicContact CG2-CB 3.93Å; V156-K223 HydrophobicContact CG2-CD 3.95Å; V156-K223 HydrophobicContact CG2-CG 3.96Å
157	C	98	Very high	96.3	Very high	3 Å²	3	34.8 Å²	34.8	2%	0.02	17%	0.173	C	C	.	.			trans	-77	50.1	-177.3	-67	0	0	0	0	114.2	Q153 E159 K160 I161 C198 L200	Q153-C157 WeakPolarHBondContact O-CB 3.48Å; Q153-C157 PolarHBondContact O-N 3.22Å; Q153-C157 PolarHBondContact O-SG 3.28Å; C157-E159 VanDerWaalsContact C-N 3.33Å; C157-E159 PolarHBondContact O-N 3.49Å; C157-E159 VanDerWaalsContact O-N 3.13Å; C157-K160 HydrophobicContact CB-CB 4.4Å; C157-K160 PolarHBondContact O-N 2.83Å; C157-I161 HydrophobicContact CB-CG1 4.25Å; C157-I161 PolarHBondContact O-N 2.94Å; C157-C198 VanDerWaalsContact CA-SG 3.51Å; C157-C198 HydrophobicContact CB-CB 3.99Å; C157-C198 WeakPolarHBondContact CB-SG 3.38Å; C157-C198 VanDerWaalsContact SG-CA 3.51Å; C157-C198 WeakPolarHBondContact SG-CB 3.36Å; C157-C198 CovalentContact SG-SG 2.03Å; C157-C198 PolarHBondContact SG-SG 3.24Å; C157-L200 HydrophobicContact CB-CD1 3.94Å
158	K	95.8	Very high	96.1	Very high	90 Å²	90	35.2 Å²	35.2	39%	0.391	18%	0.175	S	C	.	.	H	α-helix	trans	-45	-49.3	-172.8	-68.2	-172.6	-179	173.1	0	114.6	V156 K160 G162 W163 N227	V156-K158 PolarHBondContact O-N 3.5Å; K158-K160 VanDerWaalsContact C-N 3.35Å; K158-K160 PolarHBondContact O-N 2.87Å; K158-G162 VanDerWaalsContact O-CA 3.3Å; K158-G162 WeakPolarHBondContact O-CA 3.47Å; K158-G162 PolarHBondContact O-N 3.06Å; K158-W163 PolarHBondContact O-N 3.07Å; K158-N227 WeakPolarHBondContact CE-OD1 3.37Å; K158-N227 PolarHBondContact NZ-OD1 2.9Å
159	E	95.6	Very high	96	Very high	194 Å²	194	35.6 Å²	35.6	91%	0.907	18%	0.177	S	C	*	.	H	α-helix	trans	-66.9	-32.4	-177	-63	-175.2	171.8	0	0	113.5	C157	C157-E159 VanDerWaalsContact C-N 3.33Å; C157-E159 PolarHBondContact O-N 3.49Å; C157-E159 VanDerWaalsContact O-N 3.13Å
160	K	97	Very high	95.9	Very high	66 Å²	66	35.5 Å²	35.5	29%	0.287	18%	0.177	S	C	.	.	H	α-helix	trans	-82.5	-45.5	-179.3	-72.2	-166.4	169.5	-169	0	112.3	H117 C157 K158 G162 L200 D201	H117-K160 PolarHBondContact NE2-O 2.87Å; C157-K160 HydrophobicContact CB-CB 4.4Å; C157-K160 PolarHBondContact O-N 2.83Å; K158-K160 VanDerWaalsContact C-N 3.35Å; K158-K160 PolarHBondContact O-N 2.87Å; K160-G162 VanDerWaalsContact C-N 3.26Å; K160-G162 PolarHBondContact O-N 2.82Å; K160-L200 HydrophobicContact CB-CD1 4.33Å; K160-L200 HydrophobicContact CD-CB 3.75Å; K160-L200 HydrophobicContact CD-CD1 4.05Å; K160-L200 PolarHBondContact NZ-O 2.9Å; K160-D201 PolarHBondContact NZ-O 2.91Å
161	I	98.1	Very high	95.9	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-65.8	-37	175	-55.1	-52.1	0	0	0	110.1	Y41 H117 L121 C157 W163	Y41-I161 HydrophobicContact CD2-CG2 3.52Å; Y41-I161 HydrophobicContact CE1-CD1 4.49Å; Y41-I161 HydrophobicContact CE2-CD1 3.93Å; Y41-I161 HydrophobicContact CE2-CG2 3.83Å; Y41-I161 HydrophobicContact CG-CG2 4.02Å; H117-I161 HydrophobicContact CB-CD1 4.28Å; H117-I161 WeakPolarHBondContact ND1-CD1 3.36Å; L121-I161 WeakPolarHBondContact CB-O 3.41Å; L121-I161 HydrophobicContact CD1-CG2 3.93Å; L121-I161 HydrophobicContact CG-CG2 4.36Å; L121-I161 WeakPolarHBondContact CG-O 3.17Å; L121-I161 PolarHBondContact N-O 2.65Å; C157-I161 HydrophobicContact CB-CG1 4.25Å; C157-I161 PolarHBondContact O-N 2.94Å; I161-W163 HydrophobicContact CG2-CD2 4.18Å; I161-W163 HydrophobicContact CG2-CG 4.38Å; I161-W163 HydrophobicContact CG2-CZ2 4.05Å
162	G	97.1	Very high	95.8	Very high	21 Å²	21	35.5 Å²	35.5	22%	0.216	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	91.2	25.5	173.5	0	0	0	0	0	114.3	R76 K158 K160	R76-G162 VanDerWaalsContact CZ-O 3.27Å; R76-G162 PolarHBondContact NH1-O 3.33Å; R76-G162 PolarHBondContact NH2-O 2.86Å; K158-G162 VanDerWaalsContact O-CA 3.3Å; K158-G162 WeakPolarHBondContact O-CA 3.47Å; K158-G162 PolarHBondContact O-N 3.06Å; K160-G162 VanDerWaalsContact C-N 3.26Å; K160-G162 PolarHBondContact O-N 2.82Å
163	W	97	Very high	95.8	Very high	20 Å²	20	35.5 Å²	35.5	8%	0.076	18%	0.176	C	C	.	.			trans	-52.7	136.7	178	-64.2	119.8	0	0	0	111.1	D39 Y41 L121 A154 K158 I161 H169	D39-W163 HydrophobicContact CB-CE3 3.56Å; D39-W163 HydrophobicContact CB-CZ3 3.55Å; Y41-W163 VanDerWaalsContact CB-CH2 3.44Å; Y41-W163 HydrophobicContact CG-CZ2 4.43Å; L121-W163 HydrophobicContact CD1-CD2 3.7Å; L121-W163 HydrophobicContact CD1-CE3 3.4Å; L121-W163 HydrophobicContact CD1-CG 4.21Å; L121-W163 HydrophobicContact CD1-CZ3 3.86Å; A154-W163 PolarHBondContact O-NE1 3.01Å; K158-W163 PolarHBondContact O-N 3.07Å; I161-W163 HydrophobicContact CG2-CD2 4.18Å; I161-W163 HydrophobicContact CG2-CG 4.38Å; I161-W163 HydrophobicContact CG2-CZ2 4.05Å; W163-H169 HydrophobicContact CD2-CB 4.13Å; W163-H169 AromaticContact CD2-CG 3.96Å; W163-H169 HydrophobicContact CE3-CB 3.53Å; W163-H169 AromaticContact CE3-CD2 3.45Å; W163-H169 VanDerWaalsContact CE3-CD2 3.45Å; W163-H169 AromaticContact CE3-CG 3.47Å; W163-H169 VanDerWaalsContact CE3-CG 3.47Å; W163-H169 HydrophobicContact CH2-CB 4.08Å; W163-H169 HydrophobicContact CZ3-CB 3.51Å; W163-H169 AromaticContact CZ3-CG 3.99Å
164	R	94.6	Very high	95.8	Very high	56 Å²	56	35.5 Å²	35.5	21%	0.211	18%	0.176	C	C	.	.			trans	-71.8	171.8	171.8	-98.2	172.1	-63.9	-167	5.9	110.2	V38 D39 N74 S167 H169	V38-R164 PolarHBondContact O-NH2 2.83Å; D39-R164 IonicContact OD1-CZ 2.7Å; D39-R164 IonicContact OD1-NE 3.67Å; D39-R164 PolarHBondContact OD1-NE 3.37Å; D39-R164 IonicContact OD1-NH2 2.6Å; D39-R164 PolarHBondContact OD1-NH2 3.45Å; D39-R164 PolarHBondContact OD2-N 3.34Å; D39-R164 IonicContact OD2-NE 2.74Å; N74-R164 PolarHBondContact ND2-NH1 2.84Å; N74-R164 PolarHBondContact O-NH2 2.79Å; N74-R164 PolarHBondContact OD1-NH1 3.4Å; R164-S167 VanDerWaalsContact CB-OG 3.28Å; R164-S167 WeakPolarHBondContact CB-OG 3.43Å; R164-H169 PolarHBondContact O-CE1 3.19Å; R164-H169 PolarHBondContact O-NE2 3.1Å
165	N	88.1	Confident	95.7	Very high	134 Å²	134	35.5 Å²	35.5	72%	0.717	18%	0.176	S	C	*	.	S	Bend	trans	-86.1	-44.7	166.6	-72.9	-11.4	0	0	0	110.5	S167	N165-S167 PolarHBondContact O-N 3.18Å
166	D	86.4	Confident	95.5	Very high	112 Å²	112	37.6 Å²	37.6	60%	0.599	19%	0.188	S	C	*	.	S	Bend	trans	-104.4	63.3	-172.6	-44.4	-57.6	0	0	0	111.1	P37	P37-D166 WeakPolarHBondContact CG-O 3.19Å
167	S	91.8	Very high	95.4	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-154.1	159.3	176.4	69.6	0	0	0	0	113.1	P37 D39 R164 N165 H169	P37-S167 WeakPolarHBondContact O-CA 3.47Å; P37-S167 WeakPolarHBondContact O-CB 3.18Å; D39-S167 PolarHBondContact OD2-OG 2.96Å; R164-S167 VanDerWaalsContact CB-OG 3.28Å; R164-S167 WeakPolarHBondContact CB-OG 3.43Å; N165-S167 PolarHBondContact O-N 3.18Å; S167-H169 PolarHBondContact O-CD2 2.74Å; S167-H169 PolarHBondContact O-N 2.85Å; S167-H169 PolarHBondContact O-NE2 2.82Å; S167-H169 PolarHBondContact OG-CD2 3.27Å; S167-H169 PolarHBondContact OG-NE2 2.84Å
168	L	92.3	Very high	95.3	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.052	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	121	167.5	-79.7	160.2	0	0	0	109.2	Y36 P37 V38 D39 L230 Y273 G344 L345	Y36-L168 HydrophobicContact CD1-CB 4.4Å; Y36-L168 HydrophobicContact CD1-CD1 3.94Å; Y36-L168 HydrophobicContact CD1-CG 3.76Å; Y36-L168 HydrophobicContact CE1-CG 3.99Å; P37-L168 PolarHBondContact O-N 2.95Å; V38-L168 HydrophobicContact CG2-CB 4.44Å; D39-L168 PolarHBondContact N-O 3.25Å; D39-L168 VanDerWaalsContact O-O 3.13Å; L168-L230 HydrophobicContact CD2-CD1 3.63Å; L168-Y273 HydrophobicContact CD1-CE2 3.96Å; L168-G344 WeakPolarHBondContact CD2-O 3.45Å; L168-L345 HydrophobicContact CD2-CD2 4.46Å
169	H	96	Very high	95.3	Very high	8 Å²	8	35 Å²	35	4%	0.037	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	99.1	178.1	-56.8	152.3	0	0	0	109.7	D39 W163 R164 S167 N227 N228 V229 L230	D39-H169 IonicContact OD2-CD2 2.64Å; W163-H169 HydrophobicContact CD2-CB 4.13Å; W163-H169 AromaticContact CD2-CG 3.96Å; W163-H169 HydrophobicContact CE3-CB 3.53Å; W163-H169 AromaticContact CE3-CD2 3.45Å; W163-H169 VanDerWaalsContact CE3-CD2 3.45Å; W163-H169 AromaticContact CE3-CG 3.47Å; W163-H169 VanDerWaalsContact CE3-CG 3.47Å; W163-H169 HydrophobicContact CH2-CB 4.08Å; W163-H169 HydrophobicContact CZ3-CB 3.51Å; W163-H169 AromaticContact CZ3-CG 3.99Å; R164-H169 PolarHBondContact O-CE1 3.19Å; R164-H169 PolarHBondContact O-NE2 3.1Å; S167-H169 PolarHBondContact O-CD2 2.74Å; S167-H169 PolarHBondContact O-N 2.85Å; S167-H169 PolarHBondContact O-NE2 2.82Å; S167-H169 PolarHBondContact OG-CD2 3.27Å; S167-H169 PolarHBondContact OG-NE2 2.84Å; H169-N227 PolarHBondContact ND1-O 2.94Å; H169-N228 WeakPolarHBondContact CB-O 3.1Å; H169-N228 PolarHBondContact ND1-O 3.48Å; H169-V229 HydrophobicContact CB-CB 4.48Å; H169-V229 HydrophobicContact CB-CG2 4.15Å; H169-L230 PolarHBondContact O-N 3.4Å
170	L	96.9	Very high	95.4	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	115.1	177.3	-53.3	-177.7	0	0	0	109.2	V38 D39 L40 Y41 L230 I232 Y273 L276	V38-L170 HydrophobicContact CG1-CD1 3.69Å; V38-L170 HydrophobicContact CG1-CG 4.06Å; D39-L170 PolarHBondContact O-N 2.59Å; L40-L170 CarbonylContact C-O 3.54Å; L40-L170 WeakPolarHBondContact CA-O 3.42Å; L40-L170 HydrophobicContact CD1-CD1 4.45Å; L40-L170 HydrophobicContact CG-CB 4.38Å; Y41-L170 PolarHBondContact N-O 2.85Å; L170-L230 HydrophobicContact CD2-CB 4.18Å; L170-L230 HydrophobicContact CD2-CD1 4.13Å; L170-I232 HydrophobicContact CB-CD1 4.24Å; L170-I232 HydrophobicContact CD1-CD1 4.48Å; L170-I232 HydrophobicContact CD2-CD1 4.37Å; L170-Y273 HydrophobicContact CD1-CD2 4.14Å; L170-L276 HydrophobicContact CD2-CD1 3.88Å
171	L	98.2	Very high	95.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	107.7	172.2	-166	156.8	0	0	0	108.1	L43 I151 A154 V229 L230 L231 I232	L43-L171 HydrophobicContact CB-CD2 4.18Å; L43-L171 HydrophobicContact CD2-CD2 3.95Å; I151-L171 HydrophobicContact CG1-CD2 4.27Å; A154-L171 HydrophobicContact CB-CD1 3.68Å; L171-V229 HydrophobicContact CB-CG1 3.58Å; L171-V229 HydrophobicContact CD1-CG1 4.01Å; L171-V229 HydrophobicContact CG-CG1 4.47Å; L171-L230 PolarHBondContact N-O 3.13Å; L171-L231 HydrophobicContact CD2-CD1 3.65Å; L171-I232 PolarHBondContact O-N 2.89Å
172	V	98	Very high	95.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	107.5	-178.9	-174.5	0	0	0	0	108	L40 Y41 L43 V174 I232 A234 I265 I269	L40-V172 HydrophobicContact CD1-CG2 3.9Å; L40-V172 HydrophobicContact CD2-CG2 4.04Å; L40-V172 HydrophobicContact CG-CG2 3.89Å; Y41-V172 PolarHBondContact O-N 3.34Å; L43-V172 WeakPolarHBondContact CA-O 3.39Å; L43-V172 PolarHBondContact N-O 2.86Å; V172-V174 HydrophobicContact CG1-CG2 3.86Å; V172-I232 HydrophobicContact CG2-CB 4.49Å; V172-I232 HydrophobicContact CG2-CD1 4.27Å; V172-A234 HydrophobicContact CG1-CB 4.47Å; V172-I265 HydrophobicContact CG1-CD1 4.13Å; V172-I269 HydrophobicContact CG1-CD1 4.35Å; V172-I269 HydrophobicContact CG1-CG1 4.21Å; V172-I269 HydrophobicContact CG2-CD1 4.24Å; V172-I269 HydrophobicContact CG2-CG1 4.02Å
173	F	98.3	Very high	95.2	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	124.8	175.3	-179.6	-92.1	0	0	0	109.5	L43 F82 I151 L231 I232 F233 A234 V235 Y243	L43-F173 HydrophobicContact CD2-CD2 4.12Å; L43-F173 HydrophobicContact CG-CD2 4.49Å; F82-F173 HydrophobicContact CD1-CE2 4.45Å; F82-F173 AromaticContact CE1-CD2 3.98Å; F82-F173 HydrophobicContact CE1-CD2 3.98Å; F82-F173 AromaticContact CE1-CE2 3.5Å; F82-F173 HydrophobicContact CE1-CE2 3.5Å; F82-F173 HydrophobicContact CE1-CZ 4.13Å; F82-F173 HydrophobicContact CE2-CE2 4.08Å; F82-F173 HydrophobicContact CE2-CZ 4.09Å; F82-F173 HydrophobicContact CZ-CD2 4.12Å; F82-F173 HydrophobicContact CZ-CE1 4.37Å; F82-F173 AromaticContact CZ-CE2 3.26Å; F82-F173 HydrophobicContact CZ-CE2 3.26Å; F82-F173 AromaticContact CZ-CZ 3.43Å; F82-F173 HydrophobicContact CZ-CZ 3.43Å; F82-F173 VanDerWaalsContact CZ-CZ 3.43Å; I151-F173 HydrophobicContact CD1-CD2 3.64Å; I151-F173 HydrophobicContact CD1-CE2 4.01Å; I151-F173 HydrophobicContact CD1-CG 4.18Å; I151-F173 HydrophobicContact CG1-CD2 3.74Å; I151-F173 HydrophobicContact CG1-CE2 4.22Å; F173-L231 HydrophobicContact CB-CD1 4.12Å; F173-I232 PolarHBondContact N-O 2.76Å; F173-F233 HydrophobicContact CB-CD1 4.06Å; F173-F233 AromaticContact CD1-CD1 3.72Å; F173-F233 HydrophobicContact CD1-CD1 3.72Å; F173-F233 HydrophobicContact CD1-CE1 4.24Å; F173-F233 HydrophobicContact CE1-CD1 4.49Å; F173-F233 HydrophobicContact CG-CD1 4.09Å; F173-F233 HydrophobicContact CG-CE1 4.41Å; F173-A234 PolarHBondContact O-N 3.23Å; F173-V235 HydrophobicContact CD1-CG1 4.48Å; F173-Y243 HydrophobicContact CD1-CE1 4.36Å; F173-Y243 AromaticContact CE1-CE1 3.86Å; F173-Y243 HydrophobicContact CE1-CE1 3.86Å
174	V	97.4	Very high	95.2	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	116.7	-174.4	-170.4	0	0	0	0	109.7	Y42 L43 M44 D45 M50 V172 A234 L258 I265	Y42-V174 HydrophobicContact CE1-CB 4.48Å; Y42-V174 HydrophobicContact CE1-CG2 3.91Å; Y42-V174 HydrophobicContact CE2-CG2 4.13Å; L43-V174 PolarHBondContact O-N 3.19Å; M44-V174 HydrophobicContact CG-CB 4.48Å; D45-V174 WeakPolarHBondContact CB-O 3.46Å; D45-V174 PolarHBondContact N-O 3.46Å; M50-V174 HydrophobicContact CE-CG1 4.01Å; V172-V174 HydrophobicContact CG1-CG2 3.86Å; V174-A234 WeakPolarHBondContact CA-O 2.92Å; V174-A234 HydrophobicContact CG2-CB 4.34Å; V174-L258 HydrophobicContact CG1-CD2 3.56Å; V174-I265 HydrophobicContact CG2-CD1 4.24Å
175	S	96.4	Very high	95.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.1	153.1	177.8	178.8	0	0	0	0	111.5	D45 A177 A234 V235	D45-S175 WeakPolarHBondContact OD2-CB 3.41Å; D45-S175 PolarHBondContact OD2-OG 3.07Å; S175-A177 PolarHBondContact OG-N 3.44Å; S175-A177 VanDerWaalsContact OG-N 3.08Å; S175-A234 PolarHBondContact N-O 3.01Å; S175-V235 WeakPolarHBondContact O-CA 3.1Å
176	D	94.9	Very high	95.8	Very high	46 Å²	46	31.5 Å²	31.5	25%	0.246	16%	0.156	C	C	.	.	S	Bend	trans	-100.6	14.2	170.4	78.5	-41.3	0	0	0	113.6	S49 M50 T236 Q239	S49-D176 WeakPolarHBondContact CB-OD2 3.2Å; S49-D176 PolarHBondContact OG-OD1 3.06Å; S49-D176 PolarHBondContact OG-OD2 3.08Å; M50-D176 HydrophobicContact SD-CB 3.99Å; D176-T236 HydrophobicContact CB-CG2 3.51Å; D176-Q239 PolarHBondContact O-NE2 3.28Å; D176-Q239 PolarHBondContact O-OE1 3.34Å; D176-Q239 VanDerWaalsContact O-OE1 3.13Å
177	A	94.8	Very high	96.2	Very high	11 Å²	11	32.5 Å²	32.5	9%	0.091	16%	0.161	C	C	.	.	S	Bend	trans	-133	171.6	-170.2	0	0	0	0	0	114.1	T143 E145 S175 Y243	T143-A177 WeakPolarHBondContact O-CB 3.43Å; E145-A177 HydrophobicContact CG-CB 3.94Å; S175-A177 PolarHBondContact OG-N 3.44Å; S175-A177 VanDerWaalsContact OG-N 3.08Å; A177-Y243 WeakPolarHBondContact O-CE2 3.36Å; A177-Y243 PolarHBondContact O-OH 3Å
178	D	95.7	Very high	96.4	Very high	54 Å²	54	33.5 Å²	33.5	29%	0.289	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	164	171	-164.3	2.9	0	0	0	110.4	P144 E145 L242	P144-D178 CarbonylContact C-O 3.31Å; P144-D178 WeakPolarHBondContact CA-O 3.38Å; P144-D178 HydrophobicContact CB-CB 4.3Å; E145-D178 PolarHBondContact N-O 2.85Å; D178-L242 HydrophobicContact CB-CD2 4.27Å; D178-L242 WeakPolarHBondContact OD1-CD2 3.37Å
179	S	96.4	Very high	96.6	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	131.2	176.5	-70.8	0	0	0	0	111.5	E145 Y243	E145-S179 CarbonylContact O-C 3.6Å; E145-S179 WeakPolarHBondContact O-CA 3.17Å; S179-Y243 PolarHBondContact N-OH 3.45Å; S179-Y243 PolarHBondContact OG-OH 3.16Å
180	H	97.5	Very high	96.7	Very high	16 Å²	16	35.9 Å²	35.9	7%	0.074	20%	0.195	C	C	.	.			trans	-65.6	144.9	170.6	-91	-45.4	0	0	0	112.6	E84 F90 D142 E145 D184 Y214	E84-H180 IonicContact OE2-CD2 2.71Å; E84-H180 PolarHBondContact OE2-CD2 2.7Å; F90-H180 AromaticContact CD1-NE2 3.83Å; F90-H180 AromaticContact CE1-CD2 3.89Å; F90-H180 AromaticContact CE1-NE2 3.47Å; F90-H180 WeakPolarHBondContact CE1-NE2 3.35Å; D142-H180 IonicContact OD2-NE2 2.65Å; E145-H180 PolarHBondContact O-N 3.33Å; H180-D184 HydrophobicContact CB-CB 4.38Å; H180-D184 IonicContact CE1-OD2 2.85Å; H180-D184 IonicContact CG-OD2 3.37Å; H180-D184 VanDerWaalsContact ND1-CB 3.33Å; H180-D184 WeakPolarHBondContact ND1-CB 3.17Å; H180-D184 VanDerWaalsContact ND1-CG 3.32Å; H180-D184 IonicContact ND1-OD2 2.76Å; H180-D184 PolarHBondContact ND1-OD2 3.39Å; H180-Y214 HydrophobicContact CB-CD1 3.91Å; H180-Y214 HydrophobicContact CB-CD2 3.86Å; H180-Y214 HydrophobicContact CB-CE1 3.61Å; H180-Y214 HydrophobicContact CB-CE2 3.56Å; H180-Y214 HydrophobicContact CB-CG 4.04Å; H180-Y214 VanDerWaalsContact CB-CZ 3.44Å; H180-Y214 AromaticContact CD2-CZ 3.95Å; H180-Y214 AromaticContact CG-CE2 3.95Å; H180-Y214 AromaticContact CG-CZ 3.88Å
181	F	96.3	Very high	96.7	Very high	85 Å²	85	40 Å²	40	37%	0.373	22%	0.221	S	C	.	.			trans	-143	148.1	-177.5	62.6	-93.3	0	0	0	113.6	F148 M183 D184	F148-F181 HydrophobicContact CD2-CB 3.72Å; F148-F181 HydrophobicContact CE2-CB 3.87Å; F181-M183 PolarHBondContact O-N 3.31Å; F181-M183 VanDerWaalsContact O-N 3.13Å; F181-D184 PolarHBondContact N-OD2 3.08Å; F181-D184 VanDerWaalsContact N-OD2 3.08Å; F181-D184 PolarHBondContact O-N 3.05Å
182	G	95.6	Very high	96.7	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.01	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	46	-118.3	178.6	0	0	0	0	0	114.5	D184 Y214 P215	G182-D184 VanDerWaalsContact C-N 3.3Å; G182-D184 PolarHBondContact O-N 2.03Å; G182-Y214 VanDerWaalsContact CA-O 3.26Å; G182-Y214 WeakPolarHBondContact CA-O 3.25Å; G182-Y214 PolarHBondContact N-O 2.77Å; G182-Y214 PolarHBondContact O-N 3.35Å; G182-P215 PolarHBondContact N-O 3.36Å
183	M	96.6	Very high	96.7	Very high	124 Å²	124	48.2 Å²	48.2	61%	0.611	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-78.5	3.5	-167.7	-54.8	89.8	179.4	0	0	115.6	F181 S185 K186	F181-M183 PolarHBondContact O-N 3.31Å; F181-M183 VanDerWaalsContact O-N 3.13Å; M183-S185 PolarHBondContact O-N 3.32Å; M183-K186 WeakPolarHBondContact O-CB 3.36Å; M183-K186 PolarHBondContact O-N 2.92Å
184	D	97.3	Very high	96.8	Very high	49 Å²	49	48.4 Å²	48.4	26%	0.262	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-56.6	-37.5	177.4	-70	-23	0	0	0	112.2	H180 F181 G182 K186 L187 Y214	H180-D184 HydrophobicContact CB-CB 4.38Å; H180-D184 IonicContact CE1-OD2 2.85Å; H180-D184 IonicContact CG-OD2 3.37Å; H180-D184 VanDerWaalsContact ND1-CB 3.33Å; H180-D184 WeakPolarHBondContact ND1-CB 3.17Å; H180-D184 VanDerWaalsContact ND1-CG 3.32Å; H180-D184 IonicContact ND1-OD2 2.76Å; H180-D184 PolarHBondContact ND1-OD2 3.39Å; F181-D184 PolarHBondContact N-OD2 3.08Å; F181-D184 VanDerWaalsContact N-OD2 3.08Å; F181-D184 PolarHBondContact O-N 3.05Å; G182-D184 VanDerWaalsContact C-N 3.3Å; G182-D184 PolarHBondContact O-N 2.03Å; D184-K186 PolarHBondContact O-N 3.47Å; D184-L187 WeakPolarHBondContact O-CB 3.36Å; D184-L187 WeakPolarHBondContact O-CG 3.48Å; D184-L187 PolarHBondContact O-N 3.11Å; D184-Y214 HydrophobicContact CB-CD2 4.15Å; D184-Y214 HydrophobicContact CB-CE2 4.01Å
185	S	96.8	Very high	96.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-58.9	-13.4	175.9	63.2	0	0	0	0	114.9	M183 L187 A188 G189 I190 E213	M183-S185 PolarHBondContact O-N 3.32Å; S185-L187 PolarHBondContact O-N 2.91Å; S185-A188 WeakPolarHBondContact O-CA 3.36Å; S185-A188 WeakPolarHBondContact O-CB 3.01Å; S185-A188 PolarHBondContact O-N 2.94Å; S185-G189 PolarHBondContact O-N 3.25Å; S185-I190 CarbonylContact C-O 3.53Å; S185-I190 PolarHBondContact O-N 3.47Å; S185-I190 VanDerWaalsContact O-N 3.14Å; S185-E213 VanDerWaalsContact OG-CA 3.27Å; S185-E213 WeakPolarHBondContact OG-CA 3.44Å; S185-E213 WeakPolarHBondContact OG-CB 3.34Å; S185-E213 WeakPolarHBondContact OG-CG 3.33Å
186	K	97.5	Very high	96.8	Very high	143 Å²	143	51.7 Å²	51.7	62%	0.622	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-58.1	-27.7	170.4	-175.5	173.9	-179.5	176.7	0	112.6	M183 D184 A188 G189 I190 V191	M183-K186 WeakPolarHBondContact O-CB 3.36Å; M183-K186 PolarHBondContact O-N 2.92Å; D184-K186 PolarHBondContact O-N 3.47Å; K186-A188 VanDerWaalsContact C-N 3.27Å; K186-A188 PolarHBondContact O-N 2.9Å; K186-G189 PolarHBondContact O-N 2.95Å; K186-I190 VanDerWaalsContact CA-O 3.31Å; K186-I190 WeakPolarHBondContact CA-O 3.48Å; K186-I190 PolarHBondContact N-O 3.45Å; K186-V191 HydrophobicContact CB-CG1 4.41Å; K186-V191 HydrophobicContact CG-CG1 4.02Å
187	L	95.8	Very high	97	Very high	133 Å²	133	54.2 Å²	54.2	70%	0.696	30%	0.3	S	S	*	.	G	3₁₀ helix	trans	-63.3	-32.5	173.1	-64.7	178.3	0	0	0	112.4	P89 D184 S185 G189	P89-L187 HydrophobicContact CG-CB 4.02Å; D184-L187 WeakPolarHBondContact O-CB 3.36Å; D184-L187 WeakPolarHBondContact O-CG 3.48Å; D184-L187 PolarHBondContact O-N 3.11Å; S185-L187 PolarHBondContact O-N 2.91Å; L187-G189 VanDerWaalsContact C-N 3.29Å
188	A	95.4	Very high	97.2	Very high	21 Å²	21	56.3 Å²	56.3	17%	0.174	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-85.9	6.1	172.4	0	0	0	0	0	113.7	V87 S88 F90 S185 K186 I190	V87-A188 HydrophobicContact CB-CB 4.34Å; V87-A188 HydrophobicContact CG1-CB 4.11Å; S88-A188 VanDerWaalsContact O-CA 3.31Å; S88-A188 WeakPolarHBondContact O-CA 3.47Å; S88-A188 VanDerWaalsContact O-CB 3.23Å; S88-A188 WeakPolarHBondContact O-CB 3.02Å; F90-A188 HydrophobicContact CD2-CB 4.11Å; F90-A188 HydrophobicContact CE2-CB 3.49Å; F90-A188 VanDerWaalsContact CE2-CB 3.49Å; F90-A188 HydrophobicContact CZ-CB 4.26Å; S185-A188 WeakPolarHBondContact O-CA 3.36Å; S185-A188 WeakPolarHBondContact O-CB 3.01Å; S185-A188 PolarHBondContact O-N 2.94Å; K186-A188 VanDerWaalsContact C-N 3.27Å; K186-A188 PolarHBondContact O-N 2.9Å; A188-I190 VanDerWaalsContact C-N 3.26Å; A188-I190 HydrophobicContact CB-CD1 4.25Å; A188-I190 HydrophobicContact CB-CG1 4.36Å; A188-I190 PolarHBondContact O-N 2.99Å
189	G	97.3	Very high	97.3	Very high	57 Å²	57	55.5 Å²	55.5	59%	0.588	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	9.1	-175.8	0	0	0	0	0	114.7	S185 K186 L187	S185-G189 PolarHBondContact O-N 3.25Å; K186-G189 PolarHBondContact O-N 2.95Å; L187-G189 VanDerWaalsContact C-N 3.29Å
190	I	98.1	Very high	97.4	Very high	11 Å²	11	56.1 Å²	56.1	6%	0.056	31%	0.311	C	S	.	.			trans	-85.6	118.8	176.3	-60.8	170.3	0	0	0	107.9	K85 S185 K186 A188 L212 E213	K85-I190 HydrophobicContact CD-CD1 3.95Å; S185-I190 CarbonylContact C-O 3.53Å; S185-I190 PolarHBondContact O-N 3.47Å; S185-I190 VanDerWaalsContact O-N 3.14Å; K186-I190 VanDerWaalsContact CA-O 3.31Å; K186-I190 WeakPolarHBondContact CA-O 3.48Å; K186-I190 PolarHBondContact N-O 3.45Å; A188-I190 VanDerWaalsContact C-N 3.26Å; A188-I190 HydrophobicContact CB-CD1 4.25Å; A188-I190 HydrophobicContact CB-CG1 4.36Å; A188-I190 PolarHBondContact O-N 2.99Å; I190-L212 WeakPolarHBondContact CG2-O 3.23Å; I190-E213 HydrophobicContact CG2-CG 4.3Å
191	V	97.6	Very high	97.3	Very high	88 Å²	88	57.5 Å²	57.5	53%	0.533	32%	0.319	S	S	.	.			trans	-139.7	22	-171.9	-63.1	0	0	0	0	112.9	K186	K186-V191 HydrophobicContact CB-CG1 4.41Å; K186-V191 HydrophobicContact CG-CG1 4.02Å
192	I	98.1	Very high	97.1	Very high	93 Å²	93	59.1 Å²	59.1	48%	0.477	34%	0.341	S	S	.	.	S	Bend	trans	-104	108.8	175.8	-55.2	177.3	0	0	0	106.8	V211 L212 E213	I192-V211 HydrophobicContact CD1-CG1 4.26Å; I192-L212 HydrophobicContact CB-CD2 4.12Å; I192-L212 HydrophobicContact CG2-CD2 3.6Å; I192-L212 CarbonylContact O-C 3.56Å; I192-L212 WeakPolarHBondContact O-CA 3.48Å; I192-E213 WeakPolarHBondContact O-CG 3.45Å; I192-E213 PolarHBondContact O-N 3.23Å
193	P	98.2	Very high	97.1	Very high	79 Å²	79	66.8 Å²	66.8	51%	0.513	37%	0.374	S	S	.	.			trans	-53.7	145.1	-176.7	-29.1	36.2	0	0	0	113.1	D195 E213	P193-D195 PolarHBondContact O-N 3.47Å; P193-E213 WeakPolarHBondContact CA-OE2 3.48Å
194	N	98.6	Very high	97.1	Very high	4 Å²	4	63.1 Å²	63.1	2%	0.021	36%	0.357	C	S	.	.			trans	-53.7	134.6	173.6	-159.9	-77.9	0	0	0	110.3	G196 E213 P215 Q219	N194-G196 PolarHBondContact OD1-N 3.5Å; N194-G196 VanDerWaalsContact OD1-N 3.09Å; N194-E213 WeakPolarHBondContact CB-O 3.32Å; N194-E213 PolarHBondContact ND2-O 3.49Å; N194-E213 VanDerWaalsContact ND2-O 3.08Å; N194-P215 HydrophobicContact CB-CB 4.19Å; N194-Q219 PolarHBondContact O-NE2 3.32Å
195	D	97.9	Very high	97.1	Very high	66 Å²	66	63.9 Å²	63.9	35%	0.353	36%	0.359	S	S	.	.			trans	-93.8	-7	-176	63.1	4.3	0	0	0	113.7	P193 L197 H199	P193-D195 PolarHBondContact O-N 3.47Å; D195-L197 VanDerWaalsContact C-N 3.27Å; D195-L197 HydrophobicContact CB-CD1 4.44Å; D195-L197 HydrophobicContact CB-CG 4.27Å; D195-L197 PolarHBondContact O-N 3.29Å; D195-L197 WeakPolarHBondContact OD1-CB 3.13Å; D195-L197 PolarHBondContact OD1-N 3.02Å; D195-H199 VanDerWaalsContact CG-NE2 3.26Å; D195-H199 IonicContact OD1-CD2 3.88Å; D195-H199 IonicContact OD1-NE2 2.66Å; D195-H199 PolarHBondContact OD1-NE2 3.15Å; D195-H199 IonicContact OD2-CE1 3.03Å; D195-H199 PolarHBondContact OD2-CE1 3.09Å; D195-H199 VanDerWaalsContact OD2-CE1 3.23Å; D195-H199 IonicContact OD2-NE2 3.95Å; D195-H199 PolarHBondContact OD2-NE2 3.24Å
196	G	97.8	Very high	97.2	Very high	4 Å²	4	64 Å²	64	4%	0.041	36%	0.359	C	S	.	.	S	Bend	trans	65.8	27.1	-176.2	0	0	0	0	0	113.7	N194 K223	N194-G196 PolarHBondContact OD1-N 3.5Å; N194-G196 VanDerWaalsContact OD1-N 3.09Å; G196-K223 WeakPolarHBondContact O-CE 2.86Å
197	L	98.3	Very high	97.2	Very high	98 Å²	98	60.3 Å²	60.3	51%	0.513	35%	0.352	S	S	.	.			trans	-109.1	164.2	177.7	-57.7	-179	0	0	0	112.4	Q153 D195 H199	Q153-L197 PolarHBondContact NE2-O 2.9Å; D195-L197 VanDerWaalsContact C-N 3.27Å; D195-L197 HydrophobicContact CB-CD1 4.44Å; D195-L197 HydrophobicContact CB-CG 4.27Å; D195-L197 PolarHBondContact O-N 3.29Å; D195-L197 WeakPolarHBondContact OD1-CB 3.13Å; D195-L197 PolarHBondContact OD1-N 3.02Å; L197-H199 PolarHBondContact O-CD2 2.56Å
198	C	98.4	Very high	97.3	Very high	55 Å²	55	56.4 Å²	56.4	37%	0.372	33%	0.331	S	S	.	.			trans	-84.5	120.6	176.7	179.4	0	0	0	0	111.4	V156 C157	V156-C198 HydrophobicContact CG1-CB 4.2Å; C157-C198 VanDerWaalsContact CA-SG 3.51Å; C157-C198 HydrophobicContact CB-CB 3.99Å; C157-C198 WeakPolarHBondContact CB-SG 3.38Å; C157-C198 VanDerWaalsContact SG-CA 3.51Å; C157-C198 WeakPolarHBondContact SG-CB 3.36Å; C157-C198 CovalentContact SG-SG 2.03Å; C157-C198 PolarHBondContact SG-SG 3.24Å
199	H	98.3	Very high	97.3	Very high	38 Å²	38	56 Å²	56	18%	0.176	33%	0.326	C	S	.	.			trans	-128	36.3	178.4	-53.2	-80.5	0	0	0	112.8	D195 L197 Y206 S207 M208	D195-H199 VanDerWaalsContact CG-NE2 3.26Å; D195-H199 IonicContact OD1-CD2 3.88Å; D195-H199 IonicContact OD1-NE2 2.66Å; D195-H199 PolarHBondContact OD1-NE2 3.15Å; D195-H199 IonicContact OD2-CE1 3.03Å; D195-H199 PolarHBondContact OD2-CE1 3.09Å; D195-H199 VanDerWaalsContact OD2-CE1 3.23Å; D195-H199 IonicContact OD2-NE2 3.95Å; D195-H199 PolarHBondContact OD2-NE2 3.24Å; L197-H199 PolarHBondContact O-CD2 2.56Å; H199-Y206 HydrophobicContact CB-CD2 3.98Å; H199-Y206 HydrophobicContact CB-CE2 3.84Å; H199-S207 PolarHBondContact O-N 3.18Å; H199-S207 PolarHBondContact O-OG 3.41Å; H199-S207 VanDerWaalsContact O-OG 3.08Å; H199-M208 HydrophobicContact CB-CB 4.05Å; H199-M208 HydrophobicContact CB-CG 3.59Å
200	L	97.8	Very high	97.3	Very high	14 Å²	14	56.4 Å²	56.4	7%	0.073	32%	0.317	C	S	.	.	B	Isolated β-bridge	trans	-74.7	123.9	167.5	-73.8	-179.3	0	0	0	110.2	F115 H117 C157 K160 E205	F115-L200 HydrophobicContact CD1-CD2 3.78Å; F115-L200 HydrophobicContact CE1-CD1 4.2Å; F115-L200 HydrophobicContact CE1-CD2 3.76Å; F115-L200 HydrophobicContact CE1-CG 4.38Å; H117-L200 HydrophobicContact CB-CD1 3.82Å; H117-L200 HydrophobicContact CB-CD2 4.46Å; C157-L200 HydrophobicContact CB-CD1 3.94Å; K160-L200 HydrophobicContact CB-CD1 4.33Å; K160-L200 HydrophobicContact CD-CB 3.75Å; K160-L200 HydrophobicContact CD-CD1 4.05Å; K160-L200 PolarHBondContact NZ-O 2.9Å; L200-E205 WeakPolarHBondContact CA-O 3.32Å
201	D	95.2	Very high	97.3	Very high	44 Å²	44	58.5 Å²	58.5	24%	0.235	33%	0.331	C	S	.	.			trans	-76	-175.1	179.9	88.4	-26.1	0	0	0	113.3	K160 K203 N204 E205	K160-D201 PolarHBondContact NZ-O 2.91Å; D201-K203 PolarHBondContact O-N 2.85Å; D201-K203 VanDerWaalsContact OD1-C 3.31Å; D201-K203 VanDerWaalsContact OD1-CA 3.28Å; D201-K203 WeakPolarHBondContact OD1-CA 3.36Å; D201-K203 VanDerWaalsContact OD1-CB 3.32Å; D201-K203 WeakPolarHBondContact OD1-CB 3.38Å; D201-K203 PolarHBondContact OD1-N 3.28Å; D201-N204 PolarHBondContact O-N 3.41Å; D201-N204 VanDerWaalsContact O-N 3.07Å; D201-N204 PolarHBondContact OD1-N 3.09Å; D201-E205 PolarHBondContact N-O 3.35Å; D201-E205 PolarHBondContact OD1-N 3.35Å
202	S	93.9	Very high	97.4	Very high	119 Å²	119	54.6 Å²	54.6	83%	0.832	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-10.2	177.3	54.7	0	0	0	0	114.8
203	K	94.3	Very high	97.4	Very high	162 Å²	162	51 Å²	51	70%	0.704	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	3.1	172.4	-53.3	172.4	-174.1	167.2	0	112.4	D201 E205	D201-K203 PolarHBondContact O-N 2.85Å; D201-K203 VanDerWaalsContact OD1-C 3.31Å; D201-K203 VanDerWaalsContact OD1-CA 3.28Å; D201-K203 WeakPolarHBondContact OD1-CA 3.36Å; D201-K203 VanDerWaalsContact OD1-CB 3.32Å; D201-K203 WeakPolarHBondContact OD1-CB 3.38Å; D201-K203 PolarHBondContact OD1-N 3.28Å; K203-E205 VanDerWaalsContact C-N 3.32Å
204	N	96.5	Very high	97.4	Very high	48 Å²	48	47.3 Å²	47.3	26%	0.257	26%	0.264	S	S	.	.	S	Bend	trans	63.2	31	-174.7	-60.4	-25.9	0	0	0	114.3	H117 D201	H117-N204 HydrophobicContact CB-CB 4.1Å; H117-N204 PolarHBondContact N-O 2.92Å; H117-N204 WeakPolarHBondContact O-CB 3.15Å; D201-N204 PolarHBondContact O-N 3.41Å; D201-N204 VanDerWaalsContact O-N 3.07Å; D201-N204 PolarHBondContact OD1-N 3.09Å
205	E	97.4	Very high	97.4	Very high	65 Å²	65	47.1 Å²	47.1	30%	0.304	26%	0.263	S	S	.	.	B	Isolated β-bridge	trans	-105.9	145.6	173.4	-172.4	162.3	-158.6	0	0	110.6	K116 L200 D201 K203 S207	K116-E205 WeakPolarHBondContact CE-OE1 3.45Å; K116-E205 HydrophobicContact CG-CB 4.27Å; K116-E205 HydrophobicContact CG-CG 4.01Å; K116-E205 IonicContact NZ-OE1 3.27Å; K116-E205 PolarHBondContact NZ-OE1 2.92Å; L200-E205 WeakPolarHBondContact CA-O 3.32Å; D201-E205 PolarHBondContact N-O 3.35Å; D201-E205 PolarHBondContact OD1-N 3.35Å; K203-E205 VanDerWaalsContact C-N 3.32Å; E205-S207 PolarHBondContact O-N 3.16Å; E205-S207 VanDerWaalsContact O-N 3.11Å
206	Y	98.4	Very high	97.4	Very high	1 Å²	1	46.2 Å²	46.2	0%	0.004	26%	0.26	C	S	.	.	B	Isolated β-bridge	trans	-75.1	99	-179.9	177.1	-135.8	0	0	0	111.3	F115 D149 Q153 H199 M208 S209	F115-Y206 PolarHBondContact O-N 3.43Å; D149-Y206 HydrophobicContact CB-CD1 4.3Å; D149-Y206 HydrophobicContact CB-CE1 3.96Å; D149-Y206 WeakPolarHBondContact OD2-CE1 3.16Å; Q153-Y206 VanDerWaalsContact CD-CD2 3.46Å; Q153-Y206 VanDerWaalsContact CD-CE2 3.43Å; Q153-Y206 HydrophobicContact CG-CD1 4.39Å; Q153-Y206 HydrophobicContact CG-CD2 3.54Å; Q153-Y206 HydrophobicContact CG-CE2 3.77Å; Q153-Y206 HydrophobicContact CG-CG 3.88Å; H199-Y206 HydrophobicContact CB-CD2 3.98Å; H199-Y206 HydrophobicContact CB-CE2 3.84Å; Y206-M208 VanDerWaalsContact C-N 3.28Å; Y206-M208 HydrophobicContact CD2-CB 4.47Å; Y206-M208 HydrophobicContact CE2-CB 3.77Å; Y206-M208 PolarHBondContact O-N 3.08Å; Y206-S209 VanDerWaalsContact CE1-CA 3.46Å; Y206-S209 WeakPolarHBondContact O-CB 3.19Å; Y206-S209 PolarHBondContact O-N 3.47Å; Y206-S209 PolarHBondContact O-OG 3Å
207	S	97.4	Very high	97.4	Very high	66 Å²	66	47.6 Å²	47.6	46%	0.462	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-21	-170.9	63.4	0	0	0	0	114.3	H199 E205	H199-S207 PolarHBondContact O-N 3.18Å; H199-S207 PolarHBondContact O-OG 3.41Å; H199-S207 VanDerWaalsContact O-OG 3.08Å; E205-S207 PolarHBondContact O-N 3.16Å; E205-S207 VanDerWaalsContact O-N 3.11Å
208	M	97.8	Very high	97.3	Very high	52 Å²	52	45.3 Å²	45.3	26%	0.256	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	5.9	-177.9	-63.3	-66.2	-100.1	0	0	113.6	H199 Y206 T210 V211 L212	H199-M208 HydrophobicContact CB-CB 4.05Å; H199-M208 HydrophobicContact CB-CG 3.59Å; Y206-M208 VanDerWaalsContact C-N 3.28Å; Y206-M208 HydrophobicContact CD2-CB 4.47Å; Y206-M208 HydrophobicContact CE2-CB 3.77Å; Y206-M208 PolarHBondContact O-N 3.08Å; M208-T210 PolarHBondContact O-N 3.14Å; M208-T210 VanDerWaalsContact O-N 3.14Å; M208-V211 HydrophobicContact CE-CB 4.5Å; M208-V211 HydrophobicContact CE-CG1 4.07Å; M208-V211 PolarHBondContact O-N 3.15Å; M208-V211 HydrophobicContact SD-CB 4.07Å; M208-V211 HydrophobicContact SD-CG1 4.19Å; M208-V211 HydrophobicContact SD-CG2 4.26Å; M208-L212 HydrophobicContact CB-CD1 3.79Å; M208-L212 HydrophobicContact CB-CG 3.98Å; M208-L212 HydrophobicContact CE-CD1 4.33Å; M208-L212 HydrophobicContact CE-CG 4.29Å; M208-L212 HydrophobicContact CG-CD1 4.3Å; M208-L212 PolarHBondContact O-N 3.17Å
209	S	97.1	Very high	97.2	Very high	11 Å²	11	45.3 Å²	45.3	8%	0.077	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-37.3	176.6	47.5	0	0	0	0	113.6	K85 Y206	K85-S209 VanDerWaalsContact CD-O 3.27Å; K85-S209 WeakPolarHBondContact CD-O 3.39Å; K85-S209 VanDerWaalsContact CG-O 3.31Å; K85-S209 WeakPolarHBondContact CG-O 3.41Å; K85-S209 PolarHBondContact NZ-O 2.66Å; Y206-S209 VanDerWaalsContact CE1-CA 3.46Å; Y206-S209 WeakPolarHBondContact O-CB 3.19Å; Y206-S209 PolarHBondContact O-N 3.47Å; Y206-S209 PolarHBondContact O-OG 3Å
210	T	97.3	Very high	97.2	Very high	66 Å²	66	43.6 Å²	43.6	41%	0.405	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	6.5	-179.4	65.3	0	0	0	0	114.2	P86 V87 M208	P86-T210 HydrophobicContact CG-CG2 3.91Å; V87-T210 HydrophobicContact CG2-CG2 3.5Å; V87-T210 VanDerWaalsContact CG2-CG2 3.5Å; M208-T210 PolarHBondContact O-N 3.14Å; M208-T210 VanDerWaalsContact O-N 3.14Å
211	V	98.1	Very high	97.1	Very high	55 Å²	55	44.9 Å²	44.9	33%	0.333	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-38.8	-171.5	-178.4	0	0	0	0	112.5	I192 M208	I192-V211 HydrophobicContact CD1-CG1 4.26Å; M208-V211 HydrophobicContact CE-CB 4.5Å; M208-V211 HydrophobicContact CE-CG1 4.07Å; M208-V211 PolarHBondContact O-N 3.15Å; M208-V211 HydrophobicContact SD-CB 4.07Å; M208-V211 HydrophobicContact SD-CG1 4.19Å; M208-V211 HydrophobicContact SD-CG2 4.26Å
212	L	98.4	Very high	97.1	Very high	7 Å²	7	47 Å²	47	4%	0.037	27%	0.27	C	S	.	.	S	Bend	trans	-104.4	145.5	-178.7	-62.8	178.3	0	0	0	111.6	K85 I190 I192 M208	K85-L212 PolarHBondContact NZ-O 3.03Å; I190-L212 WeakPolarHBondContact CG2-O 3.23Å; I192-L212 HydrophobicContact CB-CD2 4.12Å; I192-L212 HydrophobicContact CG2-CD2 3.6Å; I192-L212 CarbonylContact O-C 3.56Å; I192-L212 WeakPolarHBondContact O-CA 3.48Å; M208-L212 HydrophobicContact CB-CD1 3.79Å; M208-L212 HydrophobicContact CB-CG 3.98Å; M208-L212 HydrophobicContact CE-CD1 4.33Å; M208-L212 HydrophobicContact CE-CG 4.29Å; M208-L212 HydrophobicContact CG-CD1 4.3Å; M208-L212 PolarHBondContact O-N 3.17Å
213	E	98.5	Very high	97.1	Very high	18 Å²	18	43.1 Å²	43.1	8%	0.084	24%	0.238	C	C	.	.	P	Polyproline II helix	trans	-59.4	159.9	170.5	-64.6	-175.8	148.2	0	0	111.1	S185 I190 I192 P193 N194	S185-E213 VanDerWaalsContact OG-CA 3.27Å; S185-E213 WeakPolarHBondContact OG-CA 3.44Å; S185-E213 WeakPolarHBondContact OG-CB 3.34Å; S185-E213 WeakPolarHBondContact OG-CG 3.33Å; I190-E213 HydrophobicContact CG2-CG 4.3Å; I192-E213 WeakPolarHBondContact O-CG 3.45Å; I192-E213 PolarHBondContact O-N 3.23Å; P193-E213 WeakPolarHBondContact CA-OE2 3.48Å; N194-E213 WeakPolarHBondContact CB-O 3.32Å; N194-E213 PolarHBondContact ND2-O 3.49Å; N194-E213 VanDerWaalsContact ND2-O 3.08Å
214	Y	98.6	Very high	97.2	Very high	1 Å²	1	35.6 Å²	35.6	0%	0.004	21%	0.206	C	C	.	.	P	Polyproline II helix	trans	-60.3	149.1	167.7	-53.8	-84	0	0	0	109	E84 K85 F90 H180 G182 D184	E84-Y214 VanDerWaalsContact OE1-CE1 3.26Å; E84-Y214 WeakPolarHBondContact OE1-CE1 3.15Å; E84-Y214 VanDerWaalsContact OE1-CZ 3.3Å; E84-Y214 PolarHBondContact OE1-OH 2.69Å; E84-Y214 PolarHBondContact OE2-OH 2.81Å; K85-Y214 HydrophobicContact CD-CD1 4.45Å; K85-Y214 HydrophobicContact CD-CE1 3.77Å; K85-Y214 HydrophobicContact CD-CE2 4.1Å; K85-Y214 WeakPolarHBondContact CD-OH 3.46Å; K85-Y214 VanDerWaalsContact CE-CZ 3.4Å; K85-Y214 HydrophobicContact CG-CE1 3.88Å; F90-Y214 WeakPolarHBondContact CE2-OH 3.49Å; F90-Y214 HydrophobicContact CZ-CE2 4.28Å; F90-Y214 WeakPolarHBondContact CZ-OH 3.45Å; H180-Y214 HydrophobicContact CB-CD1 3.91Å; H180-Y214 HydrophobicContact CB-CD2 3.86Å; H180-Y214 HydrophobicContact CB-CE1 3.61Å; H180-Y214 HydrophobicContact CB-CE2 3.56Å; H180-Y214 HydrophobicContact CB-CG 4.04Å; H180-Y214 VanDerWaalsContact CB-CZ 3.44Å; H180-Y214 AromaticContact CD2-CZ 3.95Å; H180-Y214 AromaticContact CG-CE2 3.95Å; H180-Y214 AromaticContact CG-CZ 3.88Å; G182-Y214 VanDerWaalsContact CA-O 3.26Å; G182-Y214 WeakPolarHBondContact CA-O 3.25Å; G182-Y214 PolarHBondContact N-O 2.77Å; G182-Y214 PolarHBondContact O-N 3.35Å; D184-Y214 HydrophobicContact CB-CD2 4.15Å; D184-Y214 HydrophobicContact CB-CE2 4.01Å
215	P	98.4	Very high	97	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-66.4	148.7	174.8	31.2	-36.2	0	0	0	110.3	F148 D149 M152 G182 N194 L220	F148-P215 HydrophobicContact CB-CG 3.99Å; F148-P215 VanDerWaalsContact O-CG 3.28Å; F148-P215 WeakPolarHBondContact O-CG 3.27Å; D149-P215 VanDerWaalsContact OD1-CD 3.3Å; D149-P215 WeakPolarHBondContact OD1-CD 3.49Å; M152-P215 HydrophobicContact CB-CB 4.34Å; M152-P215 HydrophobicContact CB-CG 3.94Å; M152-P215 HydrophobicContact CE-CB 3.59Å; M152-P215 HydrophobicContact CE-CG 4.41Å; M152-P215 HydrophobicContact CG-CB 4.45Å; G182-P215 PolarHBondContact N-O 3.36Å; N194-P215 HydrophobicContact CB-CB 4.19Å; P215-L220 HydrophobicContact CB-CD2 4.23Å; P215-L220 HydrophobicContact CB-CG 4.16Å; P215-L220 HydrophobicContact CG-CD1 4.42Å; P215-L220 HydrophobicContact CG-CD2 3.87Å; P215-L220 HydrophobicContact CG-CG 4.06Å
216	T	98.1	Very high	96.7	Very high	47 Å²	47	36.8 Å²	36.8	29%	0.288	21%	0.211	S	C	.	.	P	Polyproline II helix	trans	-78.9	157.3	168.3	60.9	0	0	0	0	110.5	G218 Q219 L220	T216-G218 PolarHBondContact O-N 3.19Å; T216-Q219 PolarHBondContact O-N 3.27Å; T216-Q219 VanDerWaalsContact OG1-CG 3.31Å; T216-Q219 WeakPolarHBondContact OG1-CG 3.37Å; T216-Q219 PolarHBondContact OG1-N 3.45Å; T216-Q219 PolarHBondContact OG1-OE1 3Å; T216-L220 PolarHBondContact O-N 3.23Å
217	I	96.8	Very high	96.4	Very high	33 Å²	33	37.4 Å²	37.4	17%	0.169	22%	0.215	C	C	.	.	H	α-helix	trans	-54.6	-39.4	175.3	-59.8	173.4	0	0	0	111	F148 Q219 L220 I221 Y246 L249 I250	F148-I217 HydrophobicContact CE2-CG1 4.18Å; I217-Q219 PolarHBondContact O-N 2.65Å; I217-L220 PolarHBondContact O-N 3.24Å; I217-I221 HydrophobicContact CG2-CD1 3.88Å; I217-I221 HydrophobicContact CG2-CG1 4.39Å; I217-I221 VanDerWaalsContact O-CG1 3.25Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.07Å; I217-Y246 HydrophobicContact CD1-CD1 3.66Å; I217-Y246 HydrophobicContact CD1-CE1 3.76Å; I217-L249 HydrophobicContact CD1-CD1 4.37Å; I217-L249 HydrophobicContact CG2-CB 4.33Å; I217-L249 HydrophobicContact CG2-CD1 4.28Å; I217-I250 HydrophobicContact CG2-CG1 4.33Å
218	G	96.2	Very high	96.2	Very high	49 Å²	49	35 Å²	35	51%	0.505	20%	0.197	S	C	.	.	H	α-helix	trans	-62.6	-37.5	176.4	0	0	0	0	0	114	T216 D222	T216-G218 PolarHBondContact O-N 3.19Å; G218-D222 PolarHBondContact O-N 2.86Å
219	Q	97.4	Very high	96.1	Very high	56 Å²	56	32.9 Å²	32.9	26%	0.262	19%	0.187	S	C	.	.	H	α-helix	trans	-72.6	-37	175.1	-69.8	168.2	-58.1	0	0	112.1	M152 N194 T216 I217 D222 K223	M152-Q219 HydrophobicContact CE-CB 3.9Å; N194-Q219 PolarHBondContact O-NE2 3.32Å; T216-Q219 PolarHBondContact O-N 3.27Å; T216-Q219 VanDerWaalsContact OG1-CG 3.31Å; T216-Q219 WeakPolarHBondContact OG1-CG 3.37Å; T216-Q219 PolarHBondContact OG1-N 3.45Å; T216-Q219 PolarHBondContact OG1-OE1 3Å; I217-Q219 PolarHBondContact O-N 2.65Å; Q219-D222 PolarHBondContact O-N 2.93Å; Q219-K223 WeakPolarHBondContact O-CG 3.4Å; Q219-K223 PolarHBondContact O-N 3.36Å
220	L	97.6	Very high	96.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-60.5	-47.2	171.6	-72.4	174	0	0	0	110.7	F148 I151 M152 P215 T216 I217 D222 K223 L224	F148-L220 HydrophobicContact CB-CD1 4.09Å; F148-L220 HydrophobicContact CD1-CD1 4.16Å; F148-L220 HydrophobicContact CD2-CD1 3.61Å; F148-L220 HydrophobicContact CE2-CD1 4.01Å; F148-L220 HydrophobicContact CG-CD1 3.69Å; F148-L220 HydrophobicContact CZ-CD1 4.44Å; I151-L220 HydrophobicContact CB-CD2 4.22Å; I151-L220 HydrophobicContact CG2-CD2 3.95Å; M152-L220 HydrophobicContact CB-CD2 3.97Å; M152-L220 HydrophobicContact CE-CD2 4.17Å; P215-L220 HydrophobicContact CB-CD2 4.23Å; P215-L220 HydrophobicContact CB-CG 4.16Å; P215-L220 HydrophobicContact CG-CD1 4.42Å; P215-L220 HydrophobicContact CG-CD2 3.87Å; P215-L220 HydrophobicContact CG-CG 4.06Å; T216-L220 PolarHBondContact O-N 3.23Å; I217-L220 PolarHBondContact O-N 3.24Å; L220-D222 PolarHBondContact O-N 2.72Å; L220-K223 PolarHBondContact O-N 3.12Å; L220-L224 HydrophobicContact CB-CD1 4.37Å; L220-L224 VanDerWaalsContact O-CB 3.27Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 WeakPolarHBondContact O-CD1 3.39Å; L220-L224 WeakPolarHBondContact O-CG 3.48Å; L220-L224 PolarHBondContact O-N 2.99Å
221	I	95.8	Very high	96.1	Very high	42 Å²	42	29.7 Å²	29.7	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-56.5	-53.2	176.5	-68.1	163	0	0	0	110.6	I217 K223 L224 V225 L249 I250	I217-I221 HydrophobicContact CG2-CD1 3.88Å; I217-I221 HydrophobicContact CG2-CG1 4.39Å; I217-I221 VanDerWaalsContact O-CG1 3.25Å; I217-I221 WeakPolarHBondContact O-CG1 3.17Å; I217-I221 PolarHBondContact O-N 3.07Å; I221-K223 VanDerWaalsContact C-N 3.31Å; I221-K223 PolarHBondContact O-N 3.34Å; I221-L224 PolarHBondContact O-N 2.87Å; I221-V225 HydrophobicContact CG2-CG2 4.23Å; I221-V225 VanDerWaalsContact O-CB 3.31Å; I221-V225 WeakPolarHBondContact O-CB 3.39Å; I221-V225 VanDerWaalsContact O-CG2 3.24Å; I221-V225 WeakPolarHBondContact O-CG2 3.32Å; I221-V225 PolarHBondContact O-N 3.47Å; I221-L249 HydrophobicContact CD1-CB 4.4Å; I221-L249 WeakPolarHBondContact CD1-O 3.45Å; I221-I250 HydrophobicContact CD1-CG1 4.35Å; I221-I250 HydrophobicContact CG1-CB 4.32Å; I221-I250 HydrophobicContact CG1-CG1 3.83Å; I221-I250 HydrophobicContact CG1-CG2 4.46Å
222	D	94.1	Very high	96.1	Very high	88 Å²	88	27.2 Å²	27.2	47%	0.471	15%	0.151	S	C	.	.	H	α-helix	trans	-53.5	-46.5	179.1	177.4	68.8	0	0	0	112	G218 Q219 L220 Q226	G218-D222 PolarHBondContact O-N 2.86Å; Q219-D222 PolarHBondContact O-N 2.93Å; L220-D222 PolarHBondContact O-N 2.72Å; D222-Q226 WeakPolarHBondContact O-CB 3.48Å; D222-Q226 PolarHBondContact O-N 2.83Å
223	K	95.9	Very high	96	Very high	37 Å²	37	26.9 Å²	26.9	16%	0.161	15%	0.149	C	C	.	.	H	α-helix	trans	-80.1	-30.1	-177.4	-63.5	-64.4	172.5	-115.4	0	114.5	M152 V156 G196 Q219 L220 I221 N227	M152-K223 HydrophobicContact CE-CB 4.29Å; M152-K223 HydrophobicContact CE-CG 4.01Å; M152-K223 HydrophobicContact SD-CB 3.86Å; M152-K223 HydrophobicContact SD-CG 3.74Å; V156-K223 HydrophobicContact CG2-CB 3.93Å; V156-K223 HydrophobicContact CG2-CD 3.95Å; V156-K223 HydrophobicContact CG2-CG 3.96Å; G196-K223 WeakPolarHBondContact O-CE 2.86Å; Q219-K223 WeakPolarHBondContact O-CG 3.4Å; Q219-K223 PolarHBondContact O-N 3.36Å; L220-K223 PolarHBondContact O-N 3.12Å; I221-K223 VanDerWaalsContact C-N 3.31Å; I221-K223 PolarHBondContact O-N 3.34Å; K223-N227 WeakPolarHBondContact O-CB 3.34Å; K223-N227 PolarHBondContact O-N 3.08Å; K223-N227 VanDerWaalsContact O-N 3.09Å; K223-N227 PolarHBondContact O-ND2 2.8Å
224	L	95.4	Very high	96	Very high	5 Å²	5	26 Å²	26	3%	0.026	15%	0.145	C	C	.	.	H	α-helix	trans	-68	-46.3	172.3	-70.1	167.7	0	0	0	110.3	I151 A155 L220 I221 N227 N228 V229 L231 I250	I151-L224 HydrophobicContact CG2-CD1 4.5Å; I151-L224 HydrophobicContact CG2-CD2 4.12Å; A155-L224 HydrophobicContact CB-CD2 4.03Å; L220-L224 HydrophobicContact CB-CD1 4.37Å; L220-L224 VanDerWaalsContact O-CB 3.27Å; L220-L224 WeakPolarHBondContact O-CB 3.44Å; L220-L224 WeakPolarHBondContact O-CD1 3.39Å; L220-L224 WeakPolarHBondContact O-CG 3.48Å; L220-L224 PolarHBondContact O-N 2.99Å; I221-L224 PolarHBondContact O-N 2.87Å; L224-N227 CarbonylContact O-C 3.53Å; L224-N227 PolarHBondContact O-N 2.86Å; L224-N228 WeakPolarHBondContact O-CA 3.38Å; L224-N228 PolarHBondContact O-N 2.82Å; L224-V229 HydrophobicContact CD2-CB 3.78Å; L224-V229 HydrophobicContact CD2-CG1 3.74Å; L224-V229 PolarHBondContact O-N 2.67Å; L224-L231 HydrophobicContact CD1-CB 4.37Å; L224-L231 HydrophobicContact CD1-CD2 3.93Å; L224-I250 HydrophobicContact CD1-CG2 3.85Å
225	V	92.1	Very high	95.9	Very high	22 Å²	22	26 Å²	26	13%	0.133	15%	0.145	C	C	.	.	H	α-helix	trans	-64.2	-48.1	176.7	172.2	0	0	0	0	111.5	I221 N227 N228 P251 E283 L285	I221-V225 HydrophobicContact CG2-CG2 4.23Å; I221-V225 VanDerWaalsContact O-CB 3.31Å; I221-V225 WeakPolarHBondContact O-CB 3.39Å; I221-V225 VanDerWaalsContact O-CG2 3.24Å; I221-V225 WeakPolarHBondContact O-CG2 3.32Å; I221-V225 PolarHBondContact O-N 3.47Å; V225-N227 PolarHBondContact O-N 3.07Å; V225-N228 PolarHBondContact O-N 2.88Å; V225-P251 HydrophobicContact CG2-CG 4.47Å; V225-E283 WeakPolarHBondContact CG2-OE1 3.06Å; V225-L285 HydrophobicContact CG1-CD2 3.9Å
226	Q	91.2	Very high	95.8	Very high	115 Å²	115	26.5 Å²	26.5	54%	0.537	15%	0.148	S	C	.	.	H	α-helix	trans	-61.3	-31.9	177.9	-177	177.9	24.9	0	0	112.8	D222	D222-Q226 WeakPolarHBondContact O-CB 3.48Å; D222-Q226 PolarHBondContact O-N 2.83Å
227	N	93.1	Very high	95.6	Very high	14 Å²	14	31 Å²	31	8%	0.075	17%	0.166	C	C	.	.	H	α-helix	trans	-101	4	-177.5	-58	-39.1	0	0	0	113.5	A155 K158 H169 K223 L224 V225 V229	A155-N227 PolarHBondContact O-ND2 3.49Å; K158-N227 WeakPolarHBondContact CE-OD1 3.37Å; K158-N227 PolarHBondContact NZ-OD1 2.9Å; H169-N227 PolarHBondContact ND1-O 2.94Å; K223-N227 WeakPolarHBondContact O-CB 3.34Å; K223-N227 PolarHBondContact O-N 3.08Å; K223-N227 VanDerWaalsContact O-N 3.09Å; K223-N227 PolarHBondContact O-ND2 2.8Å; L224-N227 CarbonylContact O-C 3.53Å; L224-N227 PolarHBondContact O-N 2.86Å; V225-N227 PolarHBondContact O-N 3.07Å; N227-V229 VanDerWaalsContact C-N 3.29Å; N227-V229 HydrophobicContact CB-CG2 4.07Å; N227-V229 PolarHBondContact O-N 2.86Å
228	N	93.1	Very high	95.4	Very high	17 Å²	17	36.6 Å²	36.6	9%	0.091	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	56	40.8	178.2	-162.4	60.2	0	0	0	112.9	H169 L224 V225 K341 G344 L345	H169-N228 WeakPolarHBondContact CB-O 3.1Å; H169-N228 PolarHBondContact ND1-O 3.48Å; L224-N228 WeakPolarHBondContact O-CA 3.38Å; L224-N228 PolarHBondContact O-N 2.82Å; V225-N228 PolarHBondContact O-N 2.88Å; N228-K341 PolarHBondContact OD1-NZ 2.86Å; N228-G344 PolarHBondContact ND2-O 3.21Å; N228-G344 WeakPolarHBondContact OD1-CA 3.27Å; N228-G344 PolarHBondContact OD1-N 3.34Å; N228-L345 PolarHBondContact ND2-N 2.89Å; N228-L345 PolarHBondContact OD1-N 2.87Å; N228-L345 PolarHBondContact OD1-O 2.84Å
229	V	95.8	Very high	95.4	Very high	7 Å²	7	35.9 Å²	35.9	4%	0.042	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.5	-177.3	-179.2	0	0	0	0	110.3	A155 H169 L171 L224 N227	A155-V229 HydrophobicContact CB-CG2 4.37Å; H169-V229 HydrophobicContact CB-CB 4.48Å; H169-V229 HydrophobicContact CB-CG2 4.15Å; L171-V229 HydrophobicContact CB-CG1 3.58Å; L171-V229 HydrophobicContact CD1-CG1 4.01Å; L171-V229 HydrophobicContact CG-CG1 4.47Å; L224-V229 HydrophobicContact CD2-CB 3.78Å; L224-V229 HydrophobicContact CD2-CG1 3.74Å; L224-V229 PolarHBondContact O-N 2.67Å; N227-V229 VanDerWaalsContact C-N 3.29Å; N227-V229 HydrophobicContact CB-CG2 4.07Å; N227-V229 PolarHBondContact O-N 2.86Å
230	L	95.6	Very high	95.3	Very high	8 Å²	8	34.1 Å²	34.1	4%	0.042	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	123.9	176.6	-56.7	175.5	0	0	0	109	L168 H169 L170 L171 L276 V343	L168-L230 HydrophobicContact CD2-CD1 3.63Å; H169-L230 PolarHBondContact O-N 3.4Å; L170-L230 HydrophobicContact CD2-CB 4.18Å; L170-L230 HydrophobicContact CD2-CD1 4.13Å; L171-L230 PolarHBondContact N-O 3.13Å; L230-L276 HydrophobicContact CB-CD1 4.22Å; L230-L276 HydrophobicContact CD1-CD1 4.03Å; L230-L276 HydrophobicContact CD1-CD2 4.26Å; L230-V343 HydrophobicContact CD2-CG1 3.81Å
231	L	97.2	Very high	95.3	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.01	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	121.4	-172.4	-178.9	59.1	0	0	0	110.7	I151 L171 F173 L224 F233 I250 A253 T254	I151-L231 HydrophobicContact CD1-CD1 4.08Å; I151-L231 HydrophobicContact CD1-CD2 4.2Å; I151-L231 HydrophobicContact CG1-CD1 4.36Å; I151-L231 HydrophobicContact CG2-CD1 4.31Å; I151-L231 HydrophobicContact CG2-CD2 4.42Å; L171-L231 HydrophobicContact CD2-CD1 3.65Å; F173-L231 HydrophobicContact CB-CD1 4.12Å; L224-L231 HydrophobicContact CD1-CB 4.37Å; L224-L231 HydrophobicContact CD1-CD2 3.93Å; L231-F233 HydrophobicContact CD1-CE1 4.34Å; L231-F233 HydrophobicContact CD2-CD1 4.48Å; L231-F233 HydrophobicContact CD2-CE1 3.67Å; L231-F233 HydrophobicContact CD2-CE2 3.82Å; L231-F233 HydrophobicContact CD2-CZ 3.31Å; L231-F233 HydrophobicContact CG-CD1 4.37Å; L231-F233 HydrophobicContact CG-CE1 4.03Å; L231-F233 HydrophobicContact CG-CE2 4.2Å; L231-F233 HydrophobicContact CG-CZ 3.97Å; L231-I250 HydrophobicContact CD2-CD1 4.06Å; L231-A253 HydrophobicContact CB-CB 4.2Å; L231-A253 CarbonylContact O-C 3.5Å; L231-A253 WeakPolarHBondContact O-CA 3.3Å; L231-T254 PolarHBondContact O-N 3.46Å
232	I	97.8	Very high	95.3	Very high	2 Å²	2	41.4 Å²	41.4	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	108.8	177.3	-55.6	173.7	0	0	0	107.5	L170 L171 V172 F173 A234 A272 L276	L170-I232 HydrophobicContact CB-CD1 4.24Å; L170-I232 HydrophobicContact CD1-CD1 4.48Å; L170-I232 HydrophobicContact CD2-CD1 4.37Å; L171-I232 PolarHBondContact O-N 2.89Å; V172-I232 HydrophobicContact CG2-CB 4.49Å; V172-I232 HydrophobicContact CG2-CD1 4.27Å; F173-I232 PolarHBondContact N-O 2.76Å; I232-A234 PolarHBondContact O-N 2.75Å; I232-A272 HydrophobicContact CD1-CB 3.83Å; I232-A272 HydrophobicContact CG1-CB 4.2Å; I232-A272 HydrophobicContact CG2-CB 3.9Å; I232-L276 HydrophobicContact CD1-CD1 4.44Å
233	F	97.9	Very high	95.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	102	173.6	-67	-61.7	0	0	0	109.9	F148 I151 F173 L231 V235 Y243 A247 I250 T254 V255 G256	F148-F233 HydrophobicContact CE1-CE1 4.48Å; I151-F233 HydrophobicContact CD1-CE1 4.17Å; F173-F233 HydrophobicContact CB-CD1 4.06Å; F173-F233 AromaticContact CD1-CD1 3.72Å; F173-F233 HydrophobicContact CD1-CD1 3.72Å; F173-F233 HydrophobicContact CD1-CE1 4.24Å; F173-F233 HydrophobicContact CE1-CD1 4.49Å; F173-F233 HydrophobicContact CG-CD1 4.09Å; F173-F233 HydrophobicContact CG-CE1 4.41Å; L231-F233 HydrophobicContact CD1-CE1 4.34Å; L231-F233 HydrophobicContact CD2-CD1 4.48Å; L231-F233 HydrophobicContact CD2-CE1 3.67Å; L231-F233 HydrophobicContact CD2-CE2 3.82Å; L231-F233 HydrophobicContact CD2-CZ 3.31Å; L231-F233 HydrophobicContact CG-CD1 4.37Å; L231-F233 HydrophobicContact CG-CE1 4.03Å; L231-F233 HydrophobicContact CG-CE2 4.2Å; L231-F233 HydrophobicContact CG-CZ 3.97Å; F233-V235 HydrophobicContact CB-CG1 4.38Å; F233-Y243 HydrophobicContact CB-CD1 4.24Å; F233-Y243 HydrophobicContact CB-CG 4.43Å; F233-Y243 AromaticContact CD1-CD1 3.37Å; F233-Y243 HydrophobicContact CD1-CD1 3.37Å; F233-Y243 AromaticContact CD1-CE1 3.83Å; F233-Y243 HydrophobicContact CD1-CE1 3.83Å; F233-Y243 HydrophobicContact CD1-CG 4.34Å; F233-Y243 HydrophobicContact CD2-CD1 4.12Å; F233-Y243 AromaticContact CE1-CD1 3.53Å; F233-Y243 HydrophobicContact CE1-CD1 3.53Å; F233-Y243 AromaticContact CE1-CE1 3.82Å; F233-Y243 HydrophobicContact CE1-CE1 3.82Å; F233-Y243 HydrophobicContact CE2-CD1 4.24Å; F233-Y243 AromaticContact CG-CD1 3.68Å; F233-Y243 HydrophobicContact CG-CD1 3.68Å; F233-Y243 HydrophobicContact CG-CG 4.27Å; F233-Y243 AromaticContact CZ-CD1 3.95Å; F233-Y243 HydrophobicContact CZ-CD1 3.95Å; F233-A247 HydrophobicContact CD2-CB 4.43Å; F233-I250 HydrophobicContact CE2-CD1 4.23Å; F233-I250 HydrophobicContact CZ-CD1 4.15Å; F233-T254 PolarHBondContact N-O 2.04Å; F233-V255 HydrophobicContact CB-CG1 4.36Å; F233-V255 HydrophobicContact CB-CG2 4.26Å; F233-V255 HydrophobicContact CD2-CG2 4.23Å; F233-V255 CarbonylContact O-C 3.52Å; F233-V255 WeakPolarHBondContact O-CA 3.05Å; F233-G256 PolarHBondContact O-N 3Å
234	A	97.4	Very high	95.4	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	99.7	169.7	0	0	0	0	0	108.6	V172 F173 V174 S175 I232 G256 L258 I265 L268	V172-A234 HydrophobicContact CG1-CB 4.47Å; F173-A234 PolarHBondContact O-N 3.23Å; V174-A234 WeakPolarHBondContact CA-O 2.92Å; V174-A234 HydrophobicContact CG2-CB 4.34Å; S175-A234 PolarHBondContact N-O 3.01Å; I232-A234 PolarHBondContact O-N 2.75Å; A234-G256 WeakPolarHBondContact CA-O 3.43Å; A234-L258 HydrophobicContact CB-CD1 4.35Å; A234-I265 HydrophobicContact CB-CD1 3.54Å; A234-L268 HydrophobicContact CB-CD1 4.26Å
235	V	96.9	Very high	95.4	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	151.5	-170.9	-61.2	0	0	0	0	111.8	F173 S175 F233 Q239 V240 Y243 V255 G256 L258	F173-V235 HydrophobicContact CD1-CG1 4.48Å; S175-V235 WeakPolarHBondContact O-CA 3.1Å; F233-V235 HydrophobicContact CB-CG1 4.38Å; V235-Q239 HydrophobicContact CB-CB 4.23Å; V235-Q239 HydrophobicContact CG2-CB 4.28Å; V235-V240 HydrophobicContact CG2-CG2 4.23Å; V235-Y243 HydrophobicContact CB-CD2 4.16Å; V235-Y243 HydrophobicContact CB-CE2 4.42Å; V235-Y243 HydrophobicContact CG1-CD1 4.35Å; V235-Y243 HydrophobicContact CG1-CD2 3.79Å; V235-Y243 HydrophobicContact CG1-CE1 4.41Å; V235-Y243 HydrophobicContact CG1-CE2 3.86Å; V235-Y243 HydrophobicContact CG1-CG 4.03Å; V235-Y243 HydrophobicContact CG2-CD2 3.89Å; V235-Y243 HydrophobicContact CG2-CG 4.2Å; V235-V255 HydrophobicContact CG2-CG1 4.17Å; V235-G256 PolarHBondContact N-O 2.97Å; V235-G256 VanDerWaalsContact N-O 3.1Å; V235-L258 WeakPolarHBondContact O-CB 3.44Å; V235-L258 PolarHBondContact O-N 2.85Å
236	T	95.4	Very high	95.6	Very high	11 Å²	11	42.6 Å²	42.6	7%	0.067	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	165.6	-177.8	87.6	0	0	0	0	112.5	D176 E238 Q239 V240 L258	D176-T236 HydrophobicContact CB-CG2 3.51Å; T236-E238 PolarHBondContact O-N 3.21Å; T236-E238 VanDerWaalsContact O-N 3.08Å; T236-Q239 PolarHBondContact O-N 3.24Å; T236-Q239 PolarHBondContact O-OE1 3.2Å; T236-Q239 PolarHBondContact OG1-OE1 2.97Å; T236-V240 PolarHBondContact O-N 3Å; T236-L258 HydrophobicContact CG2-CB 4.49Å
237	Q	94.8	Very high	95.7	Very high	141 Å²	141	37.9 Å²	37.9	66%	0.659	19%	0.187	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-35.3	-170.1	-171.2	172	-14.2	0	0	114.7	Q239 L257	Q237-Q239 PolarHBondContact O-N 3.08Å; Q237-L257 HydrophobicContact CB-CD1 3.71Å; Q237-L257 HydrophobicContact CG-CD1 4.34Å
238	E	93.4	Very high	95.6	Very high	151 Å²	151	44.4 Å²	44.4	71%	0.706	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-26	-178.2	-51.4	-61.3	155.6	0	0	112	T236	T236-E238 PolarHBondContact O-N 3.21Å; T236-E238 VanDerWaalsContact O-N 3.08Å
239	Q	96	Very high	95.6	Very high	34 Å²	34	48.5 Å²	48.5	16%	0.159	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-14.6	-176.8	-68.6	79.4	18.9	0	0	114.6	D176 V235 T236 Q237 H241 L242 Y243	D176-Q239 PolarHBondContact O-NE2 3.28Å; D176-Q239 PolarHBondContact O-OE1 3.34Å; D176-Q239 VanDerWaalsContact O-OE1 3.13Å; V235-Q239 HydrophobicContact CB-CB 4.23Å; V235-Q239 HydrophobicContact CG2-CB 4.28Å; T236-Q239 PolarHBondContact O-N 3.24Å; T236-Q239 PolarHBondContact O-OE1 3.2Å; T236-Q239 PolarHBondContact OG1-OE1 2.97Å; Q237-Q239 PolarHBondContact O-N 3.08Å; Q239-H241 VanDerWaalsContact C-N 3.31Å; Q239-H241 PolarHBondContact O-N 3.35Å; Q239-L242 WeakPolarHBondContact O-CB 3.45Å; Q239-L242 PolarHBondContact O-N 3.36Å; Q239-Y243 HydrophobicContact CB-CD2 3.84Å; Q239-Y243 HydrophobicContact CB-CE2 3.83Å; Q239-Y243 HydrophobicContact CG-CE2 4.27Å; Q239-Y243 WeakPolarHBondContact O-CD2 3.38Å; Q239-Y243 PolarHBondContact O-N 3.44Å; Q239-Y243 VanDerWaalsContact O-N 3.17Å
240	V	95.3	Very high	95.5	Very high	20 Å²	20	48.4 Å²	48.4	12%	0.121	24%	0.235	C	C	.	.	H	α-helix	trans	-47.5	-51.2	-175.5	169.8	0	0	0	0	112.1	V235 T236 L242 Y243 E244 V255 L257	V235-V240 HydrophobicContact CG2-CG2 4.23Å; T236-V240 PolarHBondContact O-N 3Å; V240-L242 PolarHBondContact O-N 2.8Å; V240-Y243 PolarHBondContact O-N 3.12Å; V240-E244 HydrophobicContact CG1-CG 4.07Å; V240-E244 WeakPolarHBondContact O-CB 3.28Å; V240-E244 VanDerWaalsContact O-CG 3.28Å; V240-E244 WeakPolarHBondContact O-CG 3.38Å; V240-E244 PolarHBondContact O-N 3.28Å; V240-V255 HydrophobicContact CG1-CG1 4.42Å; V240-L257 HydrophobicContact CG2-CB 4.3Å; V240-L257 HydrophobicContact CG2-CD1 3.89Å
241	H	96.1	Very high	95.1	Very high	134 Å²	134	50.3 Å²	50.3	62%	0.62	25%	0.248	S	C	*	.	H	α-helix	trans	-63.9	-25.5	-178.6	-67.4	-41.2	0	0	0	114.7	Q239 E244 N245	Q239-H241 VanDerWaalsContact C-N 3.31Å; Q239-H241 PolarHBondContact O-N 3.35Å; H241-E244 IonicContact CE1-OE2 3.76Å; H241-E244 IonicContact CG-OE2 3.38Å; H241-E244 IonicContact ND1-OE2 3.17Å; H241-E244 PolarHBondContact ND1-OE2 2.83Å; H241-N245 PolarHBondContact O-ND2 3.48Å
242	L	95.8	Very high	94.5	Very high	61 Å²	61	51 Å²	51	32%	0.319	26%	0.256	S	S	.	.	H	α-helix	trans	-75.4	-51.2	176.8	-174.5	60.1	0	0	0	110.4	D178 Q239 V240 E244 N245 Y246	D178-L242 HydrophobicContact CB-CD2 4.27Å; D178-L242 WeakPolarHBondContact OD1-CD2 3.37Å; Q239-L242 WeakPolarHBondContact O-CB 3.45Å; Q239-L242 PolarHBondContact O-N 3.36Å; V240-L242 PolarHBondContact O-N 2.8Å; L242-E244 VanDerWaalsContact C-N 3.32Å; L242-E244 PolarHBondContact O-N 2.67Å; L242-N245 WeakPolarHBondContact O-CB 3.44Å; L242-N245 PolarHBondContact O-N 2.91Å; L242-Y246 HydrophobicContact CD1-CE2 4.44Å; L242-Y246 HydrophobicContact CD2-CE2 4.48Å; L242-Y246 HydrophobicContact CG-CE2 3.96Å; L242-Y246 PolarHBondContact O-N 3.38Å; L242-Y246 VanDerWaalsContact O-N 3.15Å
243	Y	97	Very high	94.3	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70	-26.4	178.2	-70.3	-92	0	0	0	112.8	F148 F173 A177 S179 F233 V235 Q239 V240 N245 Y246 A247	F148-Y243 HydrophobicContact CE1-CE1 4.49Å; F173-Y243 HydrophobicContact CD1-CE1 4.36Å; F173-Y243 AromaticContact CE1-CE1 3.86Å; F173-Y243 HydrophobicContact CE1-CE1 3.86Å; A177-Y243 WeakPolarHBondContact O-CE2 3.36Å; A177-Y243 PolarHBondContact O-OH 3Å; S179-Y243 PolarHBondContact N-OH 3.45Å; S179-Y243 PolarHBondContact OG-OH 3.16Å; F233-Y243 HydrophobicContact CB-CD1 4.24Å; F233-Y243 HydrophobicContact CB-CG 4.43Å; F233-Y243 AromaticContact CD1-CD1 3.37Å; F233-Y243 HydrophobicContact CD1-CD1 3.37Å; F233-Y243 AromaticContact CD1-CE1 3.83Å; F233-Y243 HydrophobicContact CD1-CE1 3.83Å; F233-Y243 HydrophobicContact CD1-CG 4.34Å; F233-Y243 HydrophobicContact CD2-CD1 4.12Å; F233-Y243 AromaticContact CE1-CD1 3.53Å; F233-Y243 HydrophobicContact CE1-CD1 3.53Å; F233-Y243 AromaticContact CE1-CE1 3.82Å; F233-Y243 HydrophobicContact CE1-CE1 3.82Å; F233-Y243 HydrophobicContact CE2-CD1 4.24Å; F233-Y243 AromaticContact CG-CD1 3.68Å; F233-Y243 HydrophobicContact CG-CD1 3.68Å; F233-Y243 HydrophobicContact CG-CG 4.27Å; F233-Y243 AromaticContact CZ-CD1 3.95Å; F233-Y243 HydrophobicContact CZ-CD1 3.95Å; V235-Y243 HydrophobicContact CB-CD2 4.16Å; V235-Y243 HydrophobicContact CB-CE2 4.42Å; V235-Y243 HydrophobicContact CG1-CD1 4.35Å; V235-Y243 HydrophobicContact CG1-CD2 3.79Å; V235-Y243 HydrophobicContact CG1-CE1 4.41Å; V235-Y243 HydrophobicContact CG1-CE2 3.86Å; V235-Y243 HydrophobicContact CG1-CG 4.03Å; V235-Y243 HydrophobicContact CG2-CD2 3.89Å; V235-Y243 HydrophobicContact CG2-CG 4.2Å; Q239-Y243 HydrophobicContact CB-CD2 3.84Å; Q239-Y243 HydrophobicContact CB-CE2 3.83Å; Q239-Y243 HydrophobicContact CG-CE2 4.27Å; Q239-Y243 WeakPolarHBondContact O-CD2 3.38Å; Q239-Y243 PolarHBondContact O-N 3.44Å; Q239-Y243 VanDerWaalsContact O-N 3.17Å; V240-Y243 PolarHBondContact O-N 3.12Å; Y243-N245 PolarHBondContact O-N 3.23Å; Y243-Y246 AromaticContact CD1-CD2 3.85Å; Y243-Y246 HydrophobicContact CD1-CD2 3.85Å; Y243-Y246 HydrophobicContact CD1-CE2 4.46Å; Y243-Y246 HydrophobicContact CE1-CD2 4.26Å; Y243-Y246 HydrophobicContact CG-CD2 4.24Å; Y243-Y246 PolarHBondContact O-N 2.94Å; Y243-A247 WeakPolarHBondContact O-CB 3.27Å; Y243-A247 PolarHBondContact O-N 3.14Å
244	E	96.1	Very high	94.2	Very high	71 Å²	71	52.2 Å²	52.2	33%	0.332	27%	0.265	S	S	.	.	H	α-helix	trans	-57.8	-36.9	166.2	-82	177.4	163.5	0	0	111.9	V240 H241 L242 K248 V255	V240-E244 HydrophobicContact CG1-CG 4.07Å; V240-E244 WeakPolarHBondContact O-CB 3.28Å; V240-E244 VanDerWaalsContact O-CG 3.28Å; V240-E244 WeakPolarHBondContact O-CG 3.38Å; V240-E244 PolarHBondContact O-N 3.28Å; H241-E244 IonicContact CE1-OE2 3.76Å; H241-E244 IonicContact CG-OE2 3.38Å; H241-E244 IonicContact ND1-OE2 3.17Å; H241-E244 PolarHBondContact ND1-OE2 2.83Å; L242-E244 VanDerWaalsContact C-N 3.32Å; L242-E244 PolarHBondContact O-N 2.67Å; E244-K248 WeakPolarHBondContact O-CD 3.38Å; E244-K248 VanDerWaalsContact O-CE 3.3Å; E244-K248 WeakPolarHBondContact O-CE 3.5Å; E244-K248 VanDerWaalsContact O-CG 3.25Å; E244-K248 WeakPolarHBondContact O-CG 3.31Å; E244-K248 PolarHBondContact O-N 3.45Å; E244-V255 HydrophobicContact CG-CB 4.42Å; E244-V255 HydrophobicContact CG-CG1 4.44Å; E244-V255 HydrophobicContact CG-CG2 4.4Å
245	N	95.3	Very high	94.1	Very high	84 Å²	84	54.1 Å²	54.1	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-77.3	-31.1	177.4	-67.8	-38	0	0	0	112.3	H241 L242 Y243 K248	H241-N245 PolarHBondContact O-ND2 3.48Å; L242-N245 WeakPolarHBondContact O-CB 3.44Å; L242-N245 PolarHBondContact O-N 2.91Å; Y243-N245 PolarHBondContact O-N 3.23Å; N245-K248 PolarHBondContact OD1-NZ 2.77Å
246	Y	95.3	Very high	94	Very high	23 Å²	23	54.7 Å²	54.7	9%	0.09	28%	0.282	C	S	.	.	H	α-helix	trans	-68.4	-43.9	169.1	-61.5	-32.2	0	0	0	112	F148 I217 L242 Y243 K248 L249 I250	F148-Y246 HydrophobicContact CZ-CD2 4Å; F148-Y246 HydrophobicContact CZ-CE2 4Å; I217-Y246 HydrophobicContact CD1-CD1 3.66Å; I217-Y246 HydrophobicContact CD1-CE1 3.76Å; L242-Y246 HydrophobicContact CD1-CE2 4.44Å; L242-Y246 HydrophobicContact CD2-CE2 4.48Å; L242-Y246 HydrophobicContact CG-CE2 3.96Å; L242-Y246 PolarHBondContact O-N 3.38Å; L242-Y246 VanDerWaalsContact O-N 3.15Å; Y243-Y246 AromaticContact CD1-CD2 3.85Å; Y243-Y246 HydrophobicContact CD1-CD2 3.85Å; Y243-Y246 HydrophobicContact CD1-CE2 4.46Å; Y243-Y246 HydrophobicContact CE1-CD2 4.26Å; Y243-Y246 HydrophobicContact CG-CD2 4.24Å; Y243-Y246 PolarHBondContact O-N 2.94Å; Y246-K248 VanDerWaalsContact C-N 3.31Å; Y246-K248 PolarHBondContact O-N 2.7Å; Y246-L249 WeakPolarHBondContact O-CB 3.48Å; Y246-L249 PolarHBondContact O-N 2.95Å; Y246-I250 WeakPolarHBondContact O-CG1 3.44Å; Y246-I250 PolarHBondContact O-N 2.88Å
247	A	93.9	Very high	94	Very high	15 Å²	15	58.2 Å²	58.2	12%	0.124	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-34.7	178.8	0	0	0	0	0	112.8	F233 Y243 L249 I250 A253 V255	F233-A247 HydrophobicContact CD2-CB 4.43Å; Y243-A247 WeakPolarHBondContact O-CB 3.27Å; Y243-A247 PolarHBondContact O-N 3.14Å; A247-L249 PolarHBondContact O-N 2.86Å; A247-L249 VanDerWaalsContact O-N 3.13Å; A247-I250 PolarHBondContact O-N 3.07Å; A247-I250 VanDerWaalsContact O-N 3.15Å; A247-A253 HydrophobicContact CB-CB 4.11Å; A247-V255 HydrophobicContact CB-CG2 3.59Å
248	K	92.4	Very high	94	Very high	151 Å²	151	51.7 Å²	51.7	66%	0.657	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-21	171.7	-72.3	163	-155.5	162.8	0	114	E244 N245 Y246	E244-K248 WeakPolarHBondContact O-CD 3.38Å; E244-K248 VanDerWaalsContact O-CE 3.3Å; E244-K248 WeakPolarHBondContact O-CE 3.5Å; E244-K248 VanDerWaalsContact O-CG 3.25Å; E244-K248 WeakPolarHBondContact O-CG 3.31Å; E244-K248 PolarHBondContact O-N 3.45Å; N245-K248 PolarHBondContact OD1-NZ 2.77Å; Y246-K248 VanDerWaalsContact C-N 3.31Å; Y246-K248 PolarHBondContact O-N 2.7Å
249	L	93	Very high	93.9	Very high	103 Å²	103	49.3 Å²	49.3	54%	0.539	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-25.6	177.3	-58.2	176	0	0	0	112.7	I217 I221 Y246 A247 P251	I217-L249 HydrophobicContact CD1-CD1 4.37Å; I217-L249 HydrophobicContact CG2-CB 4.33Å; I217-L249 HydrophobicContact CG2-CD1 4.28Å; I221-L249 HydrophobicContact CD1-CB 4.4Å; I221-L249 WeakPolarHBondContact CD1-O 3.45Å; Y246-L249 WeakPolarHBondContact O-CB 3.48Å; Y246-L249 PolarHBondContact O-N 2.95Å; A247-L249 PolarHBondContact O-N 2.86Å; A247-L249 VanDerWaalsContact O-N 3.13Å; L249-P251 WeakPolarHBondContact O-CD 3.1Å
250	I	92.1	Very high	93.4	Very high	6 Å²	6	55.1 Å²	55.1	3%	0.031	28%	0.284	C	S	.	.	S	Bend	trans	-100.6	110	-173.5	-56.8	170.6	0	0	0	109.5	I217 I221 L224 L231 F233 Y246 A247 G252 A253	I217-I250 HydrophobicContact CG2-CG1 4.33Å; I221-I250 HydrophobicContact CD1-CG1 4.35Å; I221-I250 HydrophobicContact CG1-CB 4.32Å; I221-I250 HydrophobicContact CG1-CG1 3.83Å; I221-I250 HydrophobicContact CG1-CG2 4.46Å; L224-I250 HydrophobicContact CD1-CG2 3.85Å; L231-I250 HydrophobicContact CD2-CD1 4.06Å; F233-I250 HydrophobicContact CE2-CD1 4.23Å; F233-I250 HydrophobicContact CZ-CD1 4.15Å; Y246-I250 WeakPolarHBondContact O-CG1 3.44Å; Y246-I250 PolarHBondContact O-N 2.88Å; A247-I250 PolarHBondContact O-N 3.07Å; A247-I250 VanDerWaalsContact O-N 3.15Å; I250-G252 PolarHBondContact O-N 3.16Å; I250-A253 HydrophobicContact CB-CB 3.77Å; I250-A253 HydrophobicContact CG2-CB 3.79Å; I250-A253 WeakPolarHBondContact O-CB 3.28Å; I250-A253 PolarHBondContact O-N 2.76Å; I250-A253 VanDerWaalsContact O-N 3.12Å
251	P	87.6	Confident	92.9	Very high	47 Å²	47	57.3 Å²	57.3	31%	0.305	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	131.2	-179.8	-23.1	34	0	0	0	111.9	V225 L249 A253	V225-P251 HydrophobicContact CG2-CG 4.47Å; L249-P251 WeakPolarHBondContact O-CD 3.1Å; P251-A253 VanDerWaalsContact C-N 3.26Å; P251-A253 PolarHBondContact O-N 3.39Å
252	G	85.9	Confident	92.5	Very high	18 Å²	18	51 Å²	51	19%	0.186	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.5	14.3	-179.4	0	0	0	0	0	115.4	I250 L276	I250-G252 PolarHBondContact O-N 3.16Å; G252-L276 WeakPolarHBondContact O-CD2 3.47Å
253	A	93.5	Very high	92.2	Very high	17 Å²	17	50.3 Å²	50.3	14%	0.14	27%	0.273	C	S	.	.			trans	-86.9	140.4	170.1	0	0	0	0	0	112	L231 A247 I250 P251	L231-A253 HydrophobicContact CB-CB 4.2Å; L231-A253 CarbonylContact O-C 3.5Å; L231-A253 WeakPolarHBondContact O-CA 3.3Å; A247-A253 HydrophobicContact CB-CB 4.11Å; I250-A253 HydrophobicContact CB-CB 3.77Å; I250-A253 HydrophobicContact CG2-CB 3.79Å; I250-A253 WeakPolarHBondContact O-CB 3.28Å; I250-A253 PolarHBondContact O-N 2.76Å; I250-A253 VanDerWaalsContact O-N 3.12Å; P251-A253 VanDerWaalsContact C-N 3.26Å; P251-A253 PolarHBondContact O-N 3.39Å
254	T	94.4	Very high	91.9	Very high	9 Å²	9	51.4 Å²	51.4	6%	0.055	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	159.3	177.2	58.8	0	0	0	0	111.1	L231 F233 L276	L231-T254 PolarHBondContact O-N 3.46Å; F233-T254 PolarHBondContact N-O 2.04Å; T254-L276 HydrophobicContact CG2-CD2 3.97Å; T254-L276 HydrophobicContact CG2-CG 4.14Å
255	V	96.3	Very high	91.7	Very high	40 Å²	40	48.2 Å²	48.2	24%	0.242	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	134.1	179.5	-171	0	0	0	0	109.8	F233 V235 V240 E244 A247	F233-V255 HydrophobicContact CB-CG1 4.36Å; F233-V255 HydrophobicContact CB-CG2 4.26Å; F233-V255 HydrophobicContact CD2-CG2 4.23Å; F233-V255 CarbonylContact O-C 3.52Å; F233-V255 WeakPolarHBondContact O-CA 3.05Å; V235-V255 HydrophobicContact CG2-CG1 4.17Å; V240-V255 HydrophobicContact CG1-CG1 4.42Å; E244-V255 HydrophobicContact CG-CB 4.42Å; E244-V255 HydrophobicContact CG-CG1 4.44Å; E244-V255 HydrophobicContact CG-CG2 4.4Å; A247-V255 HydrophobicContact CB-CG2 3.59Å
256	G	94.8	Very high	91.4	Very high	12 Å²	12	46 Å²	46	12%	0.124	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	133.7	177.2	0	0	0	0	0	111.6	F233 A234 V235 L258	F233-G256 PolarHBondContact O-N 3Å; A234-G256 WeakPolarHBondContact CA-O 3.43Å; V235-G256 PolarHBondContact N-O 2.97Å; V235-G256 VanDerWaalsContact N-O 3.1Å; G256-L258 PolarHBondContact O-N 2.91Å
257	L	95.9	Very high	91.1	Very high	86 Å²	86	51.7 Å²	51.7	45%	0.45	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	108.5	175	170.3	60.3	0	0	0	110.7	Q237 V240 N264 L268	Q237-L257 HydrophobicContact CB-CD1 3.71Å; Q237-L257 HydrophobicContact CG-CD1 4.34Å; V240-L257 HydrophobicContact CG2-CB 4.3Å; V240-L257 HydrophobicContact CG2-CD1 3.89Å; L257-N264 PolarHBondContact O-ND2 3.4Å; L257-L268 WeakPolarHBondContact O-CD1 3.21Å
258	L	94.6	Very high	91.1	Very high	4 Å²	4	52 Å²	52	2%	0.021	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	134.9	174.6	-164.9	64.2	0	0	0	111.2	V174 A234 V235 T236 G256 I265 L268	V174-L258 HydrophobicContact CG1-CD2 3.56Å; A234-L258 HydrophobicContact CB-CD1 4.35Å; V235-L258 WeakPolarHBondContact O-CB 3.44Å; V235-L258 PolarHBondContact O-N 2.85Å; T236-L258 HydrophobicContact CG2-CB 4.49Å; G256-L258 PolarHBondContact O-N 2.91Å; L258-I265 HydrophobicContact CD1-CB 4.04Å; L258-I265 HydrophobicContact CD1-CD1 3.94Å; L258-I265 HydrophobicContact CD1-CG1 4.46Å; L258-L268 HydrophobicContact CB-CD1 4.42Å; L258-L268 HydrophobicContact CD1-CD1 3.95Å
259	Q	91.4	Very high	91.1	Very high	101 Å²	101	44.8 Å²	44.8	47%	0.472	25%	0.247	S	C	.	.			trans	-70.4	151.9	165.6	-74.1	178.5	-31	0	0	110.3	D261 S262 N264	Q259-D261 WeakPolarHBondContact CB-OD1 3.44Å; Q259-D261 PolarHBondContact O-N 3.35Å; Q259-S262 PolarHBondContact O-N 2.79Å; Q259-N264 HydrophobicContact CG-CB 4.17Å; Q259-N264 PolarHBondContact N-OD1 2.87Å
260	K	85.8	Confident	91	Very high	156 Å²	156	41.3 Å²	41.3	68%	0.678	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-14.5	-175.3	-63.1	-164.2	175.3	-158.4	0	115.4
261	D	84.1	Confident	90.9	Very high	66 Å²	66	43.9 Å²	43.9	35%	0.353	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111	13.4	176.9	68.2	-19.7	0	0	0	112	T56 Q259 G263	T56-D261 WeakPolarHBondContact CB-O 3.41Å; T56-D261 HydrophobicContact CG2-CB 4.08Å; T56-D261 WeakPolarHBondContact CG2-O 3.26Å; T56-D261 PolarHBondContact OG1-O 3.34Å; Q259-D261 WeakPolarHBondContact CB-OD1 3.44Å; Q259-D261 PolarHBondContact O-N 3.35Å; D261-G263 PolarHBondContact O-N 3.05Å; D261-G263 PolarHBondContact OD1-N 3.3Å
262	S	88.4	Confident	91.1	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	24%	0.235	C	C	.	.			trans	53.9	16.2	-168.9	-77.2	0	0	0	0	115.4	D53 Q259 N264 I265	D53-S262 WeakPolarHBondContact OD1-CB 3.37Å; D53-S262 PolarHBondContact OD1-N 2.66Å; D53-S262 PolarHBondContact OD1-OG 3.3Å; Q259-S262 PolarHBondContact O-N 2.79Å; S262-N264 PolarHBondContact O-N 3.49Å; S262-I265 WeakPolarHBondContact O-CB 3.33Å; S262-I265 WeakPolarHBondContact O-CG2 3.49Å; S262-I265 PolarHBondContact O-N 3.34Å
263	G	87.5	Confident	91.3	Very high	46 Å²	46	41.5 Å²	41.5	47%	0.474	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.5	-171.8	0	0	0	0	0	115.3	D261	D261-G263 PolarHBondContact O-N 3.05Å; D261-G263 PolarHBondContact OD1-N 3.3Å
264	N	92.3	Very high	91	Very high	23 Å²	23	46 Å²	46	12%	0.123	25%	0.246	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.1	1.3	179.7	71.5	-30.3	0	0	0	115.4	L257 Q259 S262 L266 Q267 L268	L257-N264 PolarHBondContact O-ND2 3.4Å; Q259-N264 HydrophobicContact CG-CB 4.17Å; Q259-N264 PolarHBondContact N-OD1 2.87Å; S262-N264 PolarHBondContact O-N 3.49Å; N264-L266 PolarHBondContact O-N 2.86Å; N264-L266 VanDerWaalsContact O-N 3.08Å; N264-Q267 WeakPolarHBondContact O-CB 3.48Å; N264-Q267 PolarHBondContact O-N 3.1Å; N264-L268 PolarHBondContact O-N 2.56Å; N264-L268 VanDerWaalsContact O-N 3.16Å
265	I	90.8	Very high	90.8	Very high	5 Å²	5	50 Å²	50	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-54.1	-35.9	-173.5	-172.6	58.7	0	0	0	113.8	Y42 I57 L60 V172 V174 A234 L258 S262 Q267 L268 I269	Y42-I265 HydrophobicContact CE2-CG1 3.85Å; I57-I265 HydrophobicContact CG2-CG2 4.42Å; L60-I265 HydrophobicContact CD1-CG2 3.79Å; L60-I265 HydrophobicContact CD2-CG1 4.49Å; L60-I265 HydrophobicContact CD2-CG2 3.64Å; L60-I265 HydrophobicContact CG-CG2 4.36Å; V172-I265 HydrophobicContact CG1-CD1 4.13Å; V174-I265 HydrophobicContact CG2-CD1 4.24Å; A234-I265 HydrophobicContact CB-CD1 3.54Å; L258-I265 HydrophobicContact CD1-CB 4.04Å; L258-I265 HydrophobicContact CD1-CD1 3.94Å; L258-I265 HydrophobicContact CD1-CG1 4.46Å; S262-I265 WeakPolarHBondContact O-CB 3.33Å; S262-I265 WeakPolarHBondContact O-CG2 3.49Å; S262-I265 PolarHBondContact O-N 3.34Å; I265-Q267 VanDerWaalsContact C-N 3.32Å; I265-Q267 PolarHBondContact O-N 2.94Å; I265-L268 HydrophobicContact CD1-CD1 4.4Å; I265-L268 PolarHBondContact O-N 3.49Å; I265-I269 HydrophobicContact CD1-CD1 4.37Å; I265-I269 HydrophobicContact CD1-CG1 4.38Å; I265-I269 HydrophobicContact CG1-CD1 4.03Å; I265-I269 WeakPolarHBondContact O-CG1 3.31Å; I265-I269 PolarHBondContact O-N 2.91Å
266	L	88.8	Confident	90.4	Very high	37 Å²	37	49 Å²	49	19%	0.194	26%	0.258	C	S	.	.	H	α-helix	trans	-59.6	-41.5	175.5	176.5	59.5	0	0	0	112.4	L60 R63 L64 E67 N264 I270	L60-L266 HydrophobicContact CD1-CB 4.02Å; R63-L266 HydrophobicContact CB-CD2 4.2Å; L64-L266 HydrophobicContact CB-CD1 3.99Å; L64-L266 HydrophobicContact CD1-CD1 3.6Å; L64-L266 HydrophobicContact CG-CD1 4.42Å; E67-L266 HydrophobicContact CB-CD1 4.31Å; E67-L266 HydrophobicContact CG-CD1 4.36Å; E67-L266 HydrophobicContact CG-CD2 4.26Å; N264-L266 PolarHBondContact O-N 2.86Å; N264-L266 VanDerWaalsContact O-N 3.08Å; L266-I270 HydrophobicContact CD1-CD1 4.06Å; L266-I270 HydrophobicContact CG-CD1 4.22Å; L266-I270 WeakPolarHBondContact O-CD1 3.27Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.49Å; L266-I270 PolarHBondContact O-N 2.88Å
267	Q	90.4	Very high	90	Very high	142 Å²	142	48.9 Å²	48.9	66%	0.664	25%	0.253	S	S	*	.	H	α-helix	trans	-71.8	-40.1	179.5	-64.6	177.3	-4	0	0	110.7	N264 I265 I269 I270 S271	N264-Q267 WeakPolarHBondContact O-CB 3.48Å; N264-Q267 PolarHBondContact O-N 3.1Å; I265-Q267 VanDerWaalsContact C-N 3.32Å; I265-Q267 PolarHBondContact O-N 2.94Å; Q267-I269 PolarHBondContact O-N 2.85Å; Q267-I270 PolarHBondContact O-N 2.87Å; Q267-S271 PolarHBondContact O-N 2.91Å; Q267-S271 PolarHBondContact O-OG 2.9Å
268	L	93	Very high	89.6	Confident	21 Å²	21	46 Å²	46	11%	0.11	24%	0.241	C	C	.	.	H	α-helix	trans	-60.1	-43.8	176.9	-63.1	178.1	0	0	0	112.4	A234 L257 L258 N264 I265 I270 S271 A272	A234-L268 HydrophobicContact CB-CD1 4.26Å; L257-L268 WeakPolarHBondContact O-CD1 3.21Å; L258-L268 HydrophobicContact CB-CD1 4.42Å; L258-L268 HydrophobicContact CD1-CD1 3.95Å; N264-L268 PolarHBondContact O-N 2.56Å; N264-L268 VanDerWaalsContact O-N 3.16Å; I265-L268 HydrophobicContact CD1-CD1 4.4Å; I265-L268 PolarHBondContact O-N 3.49Å; L268-I270 VanDerWaalsContact C-N 3.33Å; L268-I270 PolarHBondContact O-N 2.81Å; L268-S271 WeakPolarHBondContact CA-OG 3.4Å; L268-S271 PolarHBondContact O-N 3.15Å; L268-S271 PolarHBondContact O-OG 2.92Å; L268-S271 VanDerWaalsContact O-OG 3.07Å; L268-A272 WeakPolarHBondContact O-CB 3.39Å; L268-A272 PolarHBondContact O-N 3.21Å
269	I	92	Very high	89.3	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-62.6	-42.5	177.7	-69.2	166.8	0	0	0	110.8	L40 Y42 L64 V172 I265 Q267 Y273	L40-I269 HydrophobicContact CD1-CD1 4.23Å; L40-I269 HydrophobicContact CD1-CG1 4.48Å; L40-I269 HydrophobicContact CD1-CG2 3.43Å; L40-I269 VanDerWaalsContact CD1-CG2 3.43Å; Y42-I269 HydrophobicContact CE2-CD1 4.48Å; L64-I269 HydrophobicContact CD1-CB 4.38Å; L64-I269 HydrophobicContact CD1-CD1 4.25Å; L64-I269 HydrophobicContact CD1-CG2 3.88Å; L64-I269 HydrophobicContact CD2-CD1 4.13Å; V172-I269 HydrophobicContact CG1-CD1 4.35Å; V172-I269 HydrophobicContact CG1-CG1 4.21Å; V172-I269 HydrophobicContact CG2-CD1 4.24Å; V172-I269 HydrophobicContact CG2-CG1 4.02Å; I265-I269 HydrophobicContact CD1-CD1 4.37Å; I265-I269 HydrophobicContact CD1-CG1 4.38Å; I265-I269 HydrophobicContact CG1-CD1 4.03Å; I265-I269 WeakPolarHBondContact O-CG1 3.31Å; I265-I269 PolarHBondContact O-N 2.91Å; Q267-I269 PolarHBondContact O-N 2.85Å; I269-Y273 WeakPolarHBondContact O-CB 3.16Å; I269-Y273 PolarHBondContact O-N 2.88Å
270	I	90.8	Very high	89.2	Confident	30 Å²	30	43.8 Å²	43.8	15%	0.154	23%	0.231	C	C	.	.	H	α-helix	trans	-67.5	-46.8	179.2	-66	164.7	0	0	0	110.5	E67 L71 L266 Q267 L268 A272 Y273 E274	E67-I270 HydrophobicContact CB-CD1 3.79Å; E67-I270 HydrophobicContact CG-CD1 4.32Å; L71-I270 HydrophobicContact CD1-CG2 4.28Å; L266-I270 HydrophobicContact CD1-CD1 4.06Å; L266-I270 HydrophobicContact CG-CD1 4.22Å; L266-I270 WeakPolarHBondContact O-CD1 3.27Å; L266-I270 VanDerWaalsContact O-CG1 3.3Å; L266-I270 WeakPolarHBondContact O-CG1 3.49Å; L266-I270 PolarHBondContact O-N 2.88Å; Q267-I270 PolarHBondContact O-N 2.87Å; L268-I270 VanDerWaalsContact C-N 3.33Å; L268-I270 PolarHBondContact O-N 2.81Å; I270-A272 PolarHBondContact O-N 2.78Å; I270-Y273 PolarHBondContact O-N 2.91Å; I270-E274 WeakPolarHBondContact O-CG 3.24Å; I270-E274 PolarHBondContact O-N 3.13Å
271	S	90.9	Very high	89.5	Confident	60 Å²	60	38.4 Å²	38.4	42%	0.42	21%	0.208	S	C	.	.	H	α-helix	trans	-65.5	-40	179.2	59.4	0	0	0	0	112.3	Q267 L268 E274 E275	Q267-S271 PolarHBondContact O-N 2.91Å; Q267-S271 PolarHBondContact O-OG 2.9Å; L268-S271 WeakPolarHBondContact CA-OG 3.4Å; L268-S271 PolarHBondContact O-N 3.15Å; L268-S271 PolarHBondContact O-OG 2.92Å; L268-S271 VanDerWaalsContact O-OG 3.07Å; S271-E274 PolarHBondContact O-N 2.8Å; S271-E275 WeakPolarHBondContact O-CB 3.49Å; S271-E275 PolarHBondContact O-N 2.96Å
272	A	91.6	Very high	89.8	Confident	6 Å²	6	35.3 Å²	35.3	5%	0.05	19%	0.191	C	C	.	.	H	α-helix	trans	-65.5	-38.3	175	0	0	0	0	0	111.7	I232 L268 I270 E275 L276	I232-A272 HydrophobicContact CD1-CB 3.83Å; I232-A272 HydrophobicContact CG1-CB 4.2Å; I232-A272 HydrophobicContact CG2-CB 3.9Å; L268-A272 WeakPolarHBondContact O-CB 3.39Å; L268-A272 PolarHBondContact O-N 3.21Å; I270-A272 PolarHBondContact O-N 2.78Å; A272-E275 PolarHBondContact O-N 2.81Å; A272-L276 WeakPolarHBondContact O-CB 3.48Å; A272-L276 WeakPolarHBondContact O-CD1 3.12Å; A272-L276 WeakPolarHBondContact O-CG 3.47Å; A272-L276 PolarHBondContact O-N 3.15Å
273	Y	89.6	Confident	89.9	Confident	10 Å²	10	35.9 Å²	35.9	4%	0.039	19%	0.194	C	C	.	.	H	α-helix	trans	-62.7	-47.6	171.5	173.9	-97.8	0	0	0	111.6	V38 M68 L71 L168 L170 I269 I270 E275 L276 R277	V38-Y273 HydrophobicContact CG2-CD2 4.46Å; V38-Y273 HydrophobicContact CG2-CE2 3.71Å; M68-Y273 HydrophobicContact CE-CD2 4.43Å; M68-Y273 HydrophobicContact CE-CG 4.44Å; L71-Y273 HydrophobicContact CB-CE1 3.94Å; L71-Y273 HydrophobicContact CD1-CD1 3.8Å; L71-Y273 HydrophobicContact CD1-CE1 3.95Å; L71-Y273 HydrophobicContact CG-CE1 4.43Å; L168-Y273 HydrophobicContact CD1-CE2 3.96Å; L170-Y273 HydrophobicContact CD1-CD2 4.14Å; I269-Y273 WeakPolarHBondContact O-CB 3.16Å; I269-Y273 PolarHBondContact O-N 2.88Å; I270-Y273 PolarHBondContact O-N 2.91Å; Y273-E275 VanDerWaalsContact C-N 3.32Å; Y273-E275 PolarHBondContact O-N 2.87Å; Y273-L276 PolarHBondContact O-N 3.34Å; Y273-R277 HydrophobicContact CD1-CG 4.2Å; Y273-R277 HydrophobicContact CD2-CG 4.11Å; Y273-R277 HydrophobicContact CE1-CG 3.85Å; Y273-R277 HydrophobicContact CE2-CG 3.74Å; Y273-R277 HydrophobicContact CG-CG 4.35Å; Y273-R277 VanDerWaalsContact O-CB 3.31Å; Y273-R277 WeakPolarHBondContact O-CB 3.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.38Å; Y273-R277 PolarHBondContact O-N 3.21Å
274	E	88.8	Confident	90.1	Very high	110 Å²	110	35.8 Å²	35.8	51%	0.514	18%	0.184	S	C	.	.	H	α-helix	trans	-61	-39.4	177.2	-72.6	179.6	175.5	0	0	112.2	I270 S271 R277 S278	I270-E274 WeakPolarHBondContact O-CG 3.24Å; I270-E274 PolarHBondContact O-N 3.13Å; S271-E274 PolarHBondContact O-N 2.8Å; E274-R277 CarbonylContact O-C 3.42Å; E274-R277 PolarHBondContact O-N 3.37Å; E274-S278 WeakPolarHBondContact O-CB 3.35Å; E274-S278 PolarHBondContact O-N 3.17Å
275	E	89.1	Confident	89.9	Confident	93 Å²	93	37.5 Å²	37.5	44%	0.435	19%	0.193	S	C	.	.	H	α-helix	trans	-63	-53	174.6	-176.6	175	-166.2	0	0	111.6	S271 A272 Y273 R277 S278 E279	S271-E275 WeakPolarHBondContact O-CB 3.49Å; S271-E275 PolarHBondContact O-N 2.96Å; A272-E275 PolarHBondContact O-N 2.81Å; Y273-E275 VanDerWaalsContact C-N 3.32Å; Y273-E275 PolarHBondContact O-N 2.87Å; E275-R277 PolarHBondContact O-N 3.01Å; E275-S278 WeakPolarHBondContact O-CA 3.5Å; E275-S278 WeakPolarHBondContact O-CB 3.39Å; E275-S278 PolarHBondContact O-N 3.32Å; E275-S278 PolarHBondContact O-OG 3.22Å; E275-E279 PolarHBondContact O-N 3.18Å
276	L	87.3	Confident	89.7	Confident	21 Å²	21	40 Å²	40	11%	0.11	22%	0.22	C	C	.	.	H	α-helix	trans	-58.9	-33.4	176.3	-70.3	167.2	0	0	0	112.3	L170 L230 I232 G252 T254 A272 Y273 S278	L170-L276 HydrophobicContact CD2-CD1 3.88Å; L230-L276 HydrophobicContact CB-CD1 4.22Å; L230-L276 HydrophobicContact CD1-CD1 4.03Å; L230-L276 HydrophobicContact CD1-CD2 4.26Å; I232-L276 HydrophobicContact CD1-CD1 4.44Å; G252-L276 WeakPolarHBondContact O-CD2 3.47Å; T254-L276 HydrophobicContact CG2-CD2 3.97Å; T254-L276 HydrophobicContact CG2-CG 4.14Å; A272-L276 WeakPolarHBondContact O-CB 3.48Å; A272-L276 WeakPolarHBondContact O-CD1 3.12Å; A272-L276 WeakPolarHBondContact O-CG 3.47Å; A272-L276 PolarHBondContact O-N 3.15Å; Y273-L276 PolarHBondContact O-N 3.34Å; L276-S278 VanDerWaalsContact C-N 3.32Å
277	R	86.2	Confident	89.3	Confident	8 Å²	8	41.8 Å²	41.8	3%	0.03	23%	0.23	C	C	.	.	H	α-helix	trans	-79	-10.9	173.1	-67	-56.9	-51.7	-119.3	-17.8	113.7	Q32 T33 Y273 E274 E275 V316	Q32-R277 PolarHBondContact NE2-O 3.42Å; Q32-R277 PolarHBondContact OE1-O 2.83Å; T33-R277 PolarHBondContact O-NH2 3.48Å; Y273-R277 HydrophobicContact CD1-CG 4.2Å; Y273-R277 HydrophobicContact CD2-CG 4.11Å; Y273-R277 HydrophobicContact CE1-CG 3.85Å; Y273-R277 HydrophobicContact CE2-CG 3.74Å; Y273-R277 HydrophobicContact CG-CG 4.35Å; Y273-R277 VanDerWaalsContact O-CB 3.31Å; Y273-R277 WeakPolarHBondContact O-CB 3.34Å; Y273-R277 WeakPolarHBondContact O-CG 3.38Å; Y273-R277 PolarHBondContact O-N 3.21Å; E274-R277 CarbonylContact O-C 3.42Å; E274-R277 PolarHBondContact O-N 3.37Å; E275-R277 PolarHBondContact O-N 3.01Å; R277-V316 HydrophobicContact CB-CG2 4.11Å
278	S	88.3	Confident	88.9	Confident	26 Å²	26	37.6 Å²	37.6	18%	0.182	21%	0.214	C	C	.	.	H	α-helix	trans	-91.5	-8.2	171.9	84.1	0	0	0	0	113.5	E274 E275 L276 S312 H313 M314	E274-S278 WeakPolarHBondContact O-CB 3.35Å; E274-S278 PolarHBondContact O-N 3.17Å; E275-S278 WeakPolarHBondContact O-CA 3.5Å; E275-S278 WeakPolarHBondContact O-CB 3.39Å; E275-S278 PolarHBondContact O-N 3.32Å; E275-S278 PolarHBondContact O-OG 3.22Å; L276-S278 VanDerWaalsContact C-N 3.32Å; S278-S312 CarbonylContact O-C 3.07Å; S278-H313 PolarHBondContact O-N 2.91Å; S278-M314 WeakPolarHBondContact CA-O 3.45Å; S278-M314 WeakPolarHBondContact O-CB 3.45Å; S278-M314 PolarHBondContact O-N 3Å
279	E	88.4	Confident	88.3	Confident	49 Å²	49	44.3 Å²	44.3	23%	0.229	25%	0.245	C	C	.	.			trans	-114.8	144.6	-177.3	-59.2	-157.8	130.7	0	0	112.5	Q32 E275 K310 C311	Q32-E279 PolarHBondContact NE2-O 2.85Å; E275-E279 PolarHBondContact O-N 3.18Å; E279-K310 WeakPolarHBondContact OE1-CE 3.39Å; E279-K310 IonicContact OE1-NZ 2.83Å; E279-K310 PolarHBondContact OE1-NZ 2.82Å; E279-K310 WeakPolarHBondContact OE2-CE 3.49Å; E279-K310 IonicContact OE2-NZ 2.89Å; E279-K310 PolarHBondContact OE2-NZ 3.07Å; E279-C311 WeakPolarHBondContact CA-O 3.43Å
280	V	89.9	Confident	87.5	Confident	9 Å²	9	46.7 Å²	46.7	6%	0.055	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	106.7	171.6	179.3	0	0	0	0	107.7	V30 Q32 K310 C311 M314 A320 F322	V30-V280 HydrophobicContact CB-CG1 3.9Å; V30-V280 HydrophobicContact CG1-CG1 3.63Å; V30-V280 HydrophobicContact CG2-CG1 4.42Å; Q32-V280 HydrophobicContact CG-CG2 4.2Å; V280-K310 CarbonylContact O-C 3.39Å; V280-K310 WeakPolarHBondContact O-CA 3.37Å; V280-C311 PolarHBondContact N-O 2.99Å; V280-C311 PolarHBondContact O-N 2.79Å; V280-M314 HydrophobicContact CG2-CG 4.44Å; V280-A320 HydrophobicContact CB-CB 4.26Å; V280-A320 HydrophobicContact CG1-CB 4.19Å; V280-F322 HydrophobicContact CG1-CE2 3.92Å; V280-F322 HydrophobicContact CG1-CZ 4.08Å
281	E	91.1	Very high	87.1	Confident	43 Å²	43	46.1 Å²	46.1	20%	0.201	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	145.3	173.7	178.5	165.4	-177.6	0	0	110.8	K309 K310 P342 V343	E281-K309 WeakPolarHBondContact CA-O 3.44Å; E281-K309 HydrophobicContact CG-CG 4.32Å; E281-K309 IonicContact OE1-NZ 2.67Å; E281-K309 PolarHBondContact OE1-NZ 2.92Å; E281-K310 HydrophobicContact CB-CB 3.99Å; E281-K310 HydrophobicContact CB-CD 4.39Å; E281-K310 HydrophobicContact CB-CG 4.02Å; E281-K310 HydrophobicContact CG-CB 4.08Å; E281-P342 CarbonylContact O-C 3.6Å; E281-P342 VanDerWaalsContact O-CA 3.27Å; E281-P342 WeakPolarHBondContact O-CA 3.46Å; E281-V343 HydrophobicContact CB-CG2 3.75Å; E281-V343 HydrophobicContact CG-CG2 3.92Å; E281-V343 PolarHBondContact O-N 2.99Å
282	L	90.9	Very high	86.9	Confident	1 Å²	1	47.4 Å²	47.4	1%	0.005	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	137.9	174.2	-66.1	-176.9	0	0	0	112.7	V30 K309 F322 I340 K341 P342	V30-L282 HydrophobicContact CG2-CD2 4Å; L282-K309 PolarHBondContact N-O 2.79Å; L282-K309 WeakPolarHBondContact O-CD 3.38Å; L282-K309 PolarHBondContact O-NZ 2.93Å; L282-F322 HydrophobicContact CD1-CB 3.62Å; L282-F322 HydrophobicContact CD1-CD1 4.03Å; L282-F322 HydrophobicContact CD1-CD2 3.62Å; L282-F322 HydrophobicContact CD1-CE2 4.27Å; L282-F322 HydrophobicContact CD1-CG 3.47Å; L282-F322 VanDerWaalsContact CD1-CG 3.47Å; L282-F322 HydrophobicContact CD2-CD2 4.39Å; L282-F322 HydrophobicContact CD2-CE2 4.44Å; L282-F322 HydrophobicContact CG-CD1 4.41Å; L282-F322 HydrophobicContact CG-CD2 3.95Å; L282-F322 HydrophobicContact CG-CE2 4.08Å; L282-F322 HydrophobicContact CG-CG 4.12Å; L282-F322 HydrophobicContact CG-CZ 4.38Å; L282-I340 HydrophobicContact CB-CG2 4.41Å; L282-I340 HydrophobicContact CD1-CG2 4.02Å; L282-I340 HydrophobicContact CD2-CG2 4.28Å; L282-I340 HydrophobicContact CG-CG2 4.49Å; L282-K341 WeakPolarHBondContact CA-O 3.49Å; L282-P342 HydrophobicContact CD2-CG 4.43Å
283	E	90.3	Very high	86.7	Confident	14 Å²	14	49.4 Å²	49.4	7%	0.065	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	154	169.1	-67.6	172.9	153.9	0	0	110.2	V225 I340 K341 V343	V225-E283 WeakPolarHBondContact CG2-OE1 3.06Å; E283-I340 WeakPolarHBondContact O-CA 3.42Å; E283-K341 HydrophobicContact CB-CG 4.36Å; E283-K341 PolarHBondContact N-O 2.67Å; E283-K341 PolarHBondContact O-N 2.8Å; E283-K341 VanDerWaalsContact O-N 3.1Å; E283-K341 WeakPolarHBondContact OE2-CE 3.43Å; E283-K341 IonicContact OE2-NZ 3.94Å; E283-K341 PolarHBondContact OE2-NZ 2.84Å; E283-V343 HydrophobicContact CG-CG2 3.62Å
284	V	91.1	Very high	86.8	Confident	43 Å²	43	51.4 Å²	51.4	26%	0.261	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	127.2	172	-170.6	0	0	0	0	108.6	T288 L293 F295 I338 I339 I340	V284-T288 HydrophobicContact CG1-CG2 3.72Å; V284-L293 HydrophobicContact CB-CD1 4.48Å; V284-L293 HydrophobicContact CG1-CD1 3.88Å; V284-L293 HydrophobicContact CG2-CD1 4.2Å; V284-F295 HydrophobicContact CG2-CE1 4.35Å; V284-F295 HydrophobicContact CG2-CE2 4.47Å; V284-F295 HydrophobicContact CG2-CZ 3.62Å; V284-I338 HydrophobicContact CG1-CG2 3.38Å; V284-I339 CarbonylContact C-O 3.53Å; V284-I339 WeakPolarHBondContact CA-O 3.32Å; V284-I340 HydrophobicContact CG2-CG1 4.42Å
285	L	87.9	Confident	86.9	Confident	60 Å²	60	47.4 Å²	47.4	31%	0.314	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	159.6	178.8	-54	176.6	0	0	0	110	V225 I338 I339 K341	V225-L285 HydrophobicContact CG1-CD2 3.9Å; L285-I338 CarbonylContact O-C 3.52Å; L285-I338 WeakPolarHBondContact O-CA 3.4Å; L285-I339 HydrophobicContact CB-CB 4.36Å; L285-I339 PolarHBondContact N-O 2.8Å; L285-I339 PolarHBondContact O-N 3.08Å; L285-K341 HydrophobicContact CD1-CD 4.2Å
286	G	86.4	Confident	87	Confident	58 Å²	58	44.6 Å²	44.6	60%	0.598	26%	0.264	S	S	*	.	E	Extended strand (participates in β ladder)	trans	99.1	-157.9	179.4	0	0	0	0	0	113.3	T288	G286-T288 PolarHBondContact O-N 2.9Å
287	D	81.6	Confident	87.2	Confident	73 Å²	73	43.6 Å²	43.6	39%	0.39	26%	0.259	S	S	.	.			trans	-86.4	94.9	-172.1	179.2	10.3	0	0	0	111.6	L291 R336 H337	D287-L291 VanDerWaalsContact O-CD1 3.31Å; D287-L291 WeakPolarHBondContact O-CD1 3.42Å; D287-R336 VanDerWaalsContact CG-NH1 3.33Å; D287-R336 IonicContact OD1-CZ 3.61Å; D287-R336 IonicContact OD1-NH1 2.83Å; D287-R336 PolarHBondContact OD1-NH1 2.97Å; D287-R336 WeakPolarHBondContact OD2-CG 3.21Å; D287-R336 IonicContact OD2-CZ 3.28Å; D287-R336 IonicContact OD2-NE 2.91Å; D287-R336 IonicContact OD2-NH1 3.67Å; D287-H337 PolarHBondContact N-O 3.2Å
288	T	81.6	Confident	87.4	Confident	55 Å²	55	45 Å²	45	34%	0.337	27%	0.267	S	S	.	.			trans	-107.9	-0.6	-178.7	58.7	0	0	0	0	114.3	V284 G286 G290 L291 L293 I338	V284-T288 HydrophobicContact CG1-CG2 3.72Å; G286-T288 PolarHBondContact O-N 2.9Å; T288-G290 PolarHBondContact O-N 3.09Å; T288-G290 VanDerWaalsContact O-N 3.08Å; T288-L291 PolarHBondContact O-N 3.09Å; T288-L293 HydrophobicContact CG2-CD1 4.29Å; T288-I338 HydrophobicContact CG2-CG2 4.24Å
289	E	79.5	Confident	87.4	Confident	161 Å²	161	44.3 Å²	44.3	75%	0.752	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	111	-173	-72	-167.2	168	0	0	112.2	R336	E289-R336 PolarHBondContact O-NH1 3.43Å; E289-R336 PolarHBondContact O-NH2 3.01Å
290	G	76.3	Confident	86.7	Confident	51 Å²	51	45 Å²	45	53%	0.526	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	4.6	-177.4	0	0	0	0	0	114.8	T288 P329	T288-G290 PolarHBondContact O-N 3.09Å; T288-G290 VanDerWaalsContact O-N 3.08Å; G290-P329 WeakPolarHBondContact O-CD 3.3Å; G290-P329 WeakPolarHBondContact O-CG 3.35Å
291	L	82.6	Confident	85.7	Confident	18 Å²	18	53.1 Å²	53.1	9%	0.094	31%	0.31	C	S	.	.			trans	-89.1	133.9	165.3	-79	141.1	0	0	0	110.4	D287 T288 V326 I328 I338 V353	D287-L291 VanDerWaalsContact O-CD1 3.31Å; D287-L291 WeakPolarHBondContact O-CD1 3.42Å; T288-L291 PolarHBondContact O-N 3.09Å; L291-V326 HydrophobicContact CD2-CG1 3.82Å; L291-I328 HydrophobicContact CD2-CG1 3.92Å; L291-I338 HydrophobicContact CD1-CD1 3.64Å; L291-I338 HydrophobicContact CD1-CG1 4.49Å; L291-I338 HydrophobicContact CD2-CD1 4.45Å; L291-V353 HydrophobicContact CD2-CG1 4.3Å
292	N	86.1	Confident	84.7	Confident	87 Å²	87	53.2 Å²	53.2	47%	0.465	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	110.9	173.9	-71.8	-29.6	0	0	0	109	N327	N292-N327 HydrophobicContact CB-CB 4.03Å; N292-N327 PolarHBondContact N-O 2.93Å; N292-N327 PolarHBondContact O-N 3.24Å
293	L	88.6	Confident	84.3	Confident	48 Å²	48	56.3 Å²	56.3	25%	0.251	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	130.2	178.3	-60.6	176.8	0	0	0	110.3	V284 T288 F295 T325 V326	V284-L293 HydrophobicContact CB-CD1 4.48Å; V284-L293 HydrophobicContact CG1-CD1 3.88Å; V284-L293 HydrophobicContact CG2-CD1 4.2Å; T288-L293 HydrophobicContact CG2-CD1 4.29Å; L293-F295 HydrophobicContact CB-CE2 3.9Å; L293-F295 HydrophobicContact CB-CZ 4.29Å; L293-T325 WeakPolarHBondContact CA-O 3.39Å; L293-V326 HydrophobicContact CD2-CB 4.14Å; L293-V326 HydrophobicContact CD2-CG1 3.93Å; L293-V326 HydrophobicContact CD2-CG2 3.77Å
294	S	90.5	Very high	84	Confident	52 Å²	52	61.5 Å²	61.5	36%	0.364	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	142.2	171.2	73.5	0	0	0	0	111.8	V324 T325	S294-V324 WeakPolarHBondContact O-CA 3.36Å; S294-T325 PolarHBondContact N-O 3.45Å; S294-T325 PolarHBondContact O-N 3.4Å; S294-T325 WeakPolarHBondContact OG-CB 3.33Å
295	F	91.8	Very high	83.8	Confident	26 Å²	26	63.5 Å²	63.5	11%	0.114	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	137.9	-173.9	-62.4	-93.5	0	0	0	110.2	V284 L293 H307 Q308 K309 V324	V284-F295 HydrophobicContact CG2-CE1 4.35Å; V284-F295 HydrophobicContact CG2-CE2 4.47Å; V284-F295 HydrophobicContact CG2-CZ 3.62Å; L293-F295 HydrophobicContact CB-CE2 3.9Å; L293-F295 HydrophobicContact CB-CZ 4.29Å; F295-H307 CarbonylContact O-C 3.43Å; F295-H307 WeakPolarHBondContact O-CA 3.45Å; F295-H307 PolarHBondContact O-N 2.84Å; F295-Q308 CarbonylContact C-O 3.56Å; F295-Q308 WeakPolarHBondContact CB-O 3.25Å; F295-Q308 PolarHBondContact O-N 2.82Å; F295-K309 HydrophobicContact CB-CB 3.84Å; F295-K309 HydrophobicContact CD1-CB 3.95Å; F295-K309 HydrophobicContact CD2-CB 4.36Å; F295-K309 HydrophobicContact CG-CB 3.77Å; F295-V324 HydrophobicContact CD1-CB 4.44Å; F295-V324 HydrophobicContact CD1-CG1 4.16Å; F295-V324 HydrophobicContact CD1-CG2 3.78Å; F295-V324 HydrophobicContact CE1-CB 4.27Å; F295-V324 HydrophobicContact CE1-CG1 3.63Å; F295-V324 HydrophobicContact CE1-CG2 3.71Å; F295-V324 HydrophobicContact CZ-CG1 3.99Å
296	T	91.3	Very high	83.7	Confident	33 Å²	33	67.9 Å²	67.9	20%	0.202	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	118.7	164.3	-56.5	0	0	0	0	107.9	L304 F305 Q308 F322 S323	T296-L304 HydrophobicContact CG2-CD2 3.81Å; T296-F305 WeakPolarHBondContact CA-O 3.5Å; T296-Q308 CarbonylContact C-O 3.55Å; T296-F322 WeakPolarHBondContact O-CA 3.26Å; T296-S323 PolarHBondContact N-O 2.88Å; T296-S323 PolarHBondContact O-N 3.5Å
297	A	91.4	Very high	83.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	136.4	176.5	0	0	0	0	0	109.9	F305 Q308 F322	A297-F305 HydrophobicContact CB-CB 4.36Å; A297-F305 PolarHBondContact N-O 3.14Å; A297-F305 PolarHBondContact O-N 3.04Å; A297-Q308 HydrophobicContact CB-CB 4.31Å; A297-Q308 HydrophobicContact CB-CG 4.33Å; A297-Q308 WeakPolarHBondContact CB-O 3.42Å; A297-Q308 PolarHBondContact N-O 2.87Å; A297-F322 HydrophobicContact CB-CD1 3.79Å; A297-F322 HydrophobicContact CB-CE1 3.64Å
298	I	90.8	Very high	83.9	Confident	39 Å²	39	72.7 Å²	72.7	20%	0.2	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	94.7	176.8	-52.5	167.8	0	0	0	106.5	T303 L304 S321	I298-T303 WeakPolarHBondContact CA-O 3.3Å; I298-L304 HydrophobicContact CD1-CD2 4.25Å; I298-L304 HydrophobicContact CG1-CD2 3.74Å; I298-L304 HydrophobicContact CG1-CG 4.5Å; I298-S321 WeakPolarHBondContact CA-O 3.45Å; I298-S321 WeakPolarHBondContact CB-O 3.31Å; I298-S321 PolarHBondContact N-O 2.84Å; I298-S321 PolarHBondContact O-N 2.79Å; I298-S321 VanDerWaalsContact O-N 3.07Å
299	C	86.9	Confident	84.4	Confident	11 Å²	11	73.4 Å²	73.4	7%	0.074	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	-170	-176.7	-45.6	0	0	0	0	110.3	N301 G302 T303 F305 C311 M314	C299-N301 PolarHBondContact O-N 3.38Å; C299-G302 PolarHBondContact O-N 2.95Å; C299-T303 PolarHBondContact N-O 2.93Å; C299-T303 PolarHBondContact O-N 3.3Å; C299-T303 PolarHBondContact O-OG1 2.83Å; C299-F305 HydrophobicContact CB-CD2 4.39Å; C299-F305 HydrophobicContact CB-CE2 4.07Å; C299-C311 VanDerWaalsContact CA-SG 3.53Å; C299-C311 HydrophobicContact CB-CB 3.88Å; C299-C311 WeakPolarHBondContact CB-SG 3.5Å; C299-C311 VanDerWaalsContact SG-CA 3.51Å; C299-C311 WeakPolarHBondContact SG-CB 3.39Å; C299-C311 CovalentContact SG-SG 2.04Å; C299-C311 PolarHBondContact SG-SG 2.88Å; C299-M314 HydrophobicContact CB-SD 4.45Å
300	N	73.9	Confident	84.9	Confident	62 Å²	62	68.6 Å²	68.6	33%	0.332	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-31.9	129.8	-176.3	-66.6	-22.2	0	0	0	114.9	G302 T303 H313	N300-G302 PolarHBondContact O-N 2.85Å; N300-T303 PolarHBondContact O-N 2.58Å; N300-T303 PolarHBondContact O-OG1 3.06Å; N300-H313 PolarHBondContact ND2-O 2.95Å; N300-H313 VanDerWaalsContact ND2-O 3.16Å
301	N	68.4	Low	85.5	Confident	180 Å²	180	66.2 Å²	66.2	96%	0.963	35%	0.348	S	S	*	.	G	3₁₀ helix	trans	55.3	23.5	-177.9	-68	-15.7	0	0	0	116.2	C299	C299-N301 PolarHBondContact O-N 3.38Å
302	G	71.2	Confident	85.8	Confident	45 Å²	45	67.5 Å²	67.5	46%	0.464	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	82.3	22.4	176.7	0	0	0	0	0	113.8	C299 N300 L304	C299-G302 PolarHBondContact O-N 2.95Å; N300-G302 PolarHBondContact O-N 2.85Å; G302-L304 PolarHBondContact O-N 2.85Å
303	T	82.1	Confident	85.8	Confident	67 Å²	67	70.6 Å²	70.6	41%	0.411	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	120.1	174.4	39.8	0	0	0	0	110.3	I298 C299 N300	I298-T303 WeakPolarHBondContact CA-O 3.3Å; C299-T303 PolarHBondContact N-O 2.93Å; C299-T303 PolarHBondContact O-N 3.3Å; C299-T303 PolarHBondContact O-OG1 2.83Å; N300-T303 PolarHBondContact O-N 2.58Å; N300-T303 PolarHBondContact O-OG1 3.06Å
304	L	85.1	Confident	85.6	Confident	122 Å²	122	68.8 Å²	68.8	64%	0.639	36%	0.36	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	118.2	-175.2	-80	149.2	0	0	0	110.9	T296 I298 G302	T296-L304 HydrophobicContact CG2-CD2 3.81Å; I298-L304 HydrophobicContact CD1-CD2 4.25Å; I298-L304 HydrophobicContact CG1-CD2 3.74Å; I298-L304 HydrophobicContact CG1-CG 4.5Å; G302-L304 PolarHBondContact O-N 2.85Å
305	F	86	Confident	85.3	Confident	86 Å²	86	73.9 Å²	73.9	38%	0.377	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	107.7	175.4	-61.2	-88.2	0	0	0	109.9	T296 A297 C299 Q308	T296-F305 WeakPolarHBondContact CA-O 3.5Å; A297-F305 HydrophobicContact CB-CB 4.36Å; A297-F305 PolarHBondContact N-O 3.14Å; A297-F305 PolarHBondContact O-N 3.04Å; C299-F305 HydrophobicContact CB-CD2 4.39Å; C299-F305 HydrophobicContact CB-CE2 4.07Å; F305-Q308 HydrophobicContact CB-CB 3.83Å; F305-Q308 HydrophobicContact CB-CG 4.26Å
306	Q	86.7	Confident	84.8	Confident	152 Å²	152	75.8 Å²	75.8	71%	0.71	39%	0.389	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-72.7	144.7	178.6	-71.1	-178	-26.8	0	0	111.6	Q308	Q306-Q308 PolarHBondContact O-N 3.27Å
307	H	85.1	Confident	84.3	Confident	163 Å²	163	74.7 Å²	74.7	76%	0.755	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.9	20	-178.4	-51.4	96.8	0	0	0	114.5	F295	F295-H307 CarbonylContact O-C 3.43Å; F295-H307 WeakPolarHBondContact O-CA 3.45Å; F295-H307 PolarHBondContact O-N 2.84Å
308	Q	87.2	Confident	84.1	Confident	68 Å²	68	77.5 Å²	77.5	32%	0.318	40%	0.4	S	S	.	.			trans	-116.8	136.8	-177.6	-172.2	164.7	-23.3	0	0	110.4	F295 T296 A297 F305 Q306 K310	F295-Q308 CarbonylContact C-O 3.56Å; F295-Q308 WeakPolarHBondContact CB-O 3.25Å; F295-Q308 PolarHBondContact O-N 2.82Å; T296-Q308 CarbonylContact C-O 3.55Å; A297-Q308 HydrophobicContact CB-CB 4.31Å; A297-Q308 HydrophobicContact CB-CG 4.33Å; A297-Q308 WeakPolarHBondContact CB-O 3.42Å; A297-Q308 PolarHBondContact N-O 2.87Å; F305-Q308 HydrophobicContact CB-CB 3.83Å; F305-Q308 HydrophobicContact CB-CG 4.26Å; Q306-Q308 PolarHBondContact O-N 3.27Å; Q308-K310 WeakPolarHBondContact CG-O 3.46Å; Q308-K310 PolarHBondContact NE2-O 3.48Å
309	K	90.5	Very high	84	Confident	70 Å²	70	79 Å²	79	30%	0.304	41%	0.411	S	S	.	.			trans	-117.7	14.9	178.9	70.9	-174.5	-177.5	75.8	0	113.4	E281 L282 F295 F322	E281-K309 WeakPolarHBondContact CA-O 3.44Å; E281-K309 HydrophobicContact CG-CG 4.32Å; E281-K309 IonicContact OE1-NZ 2.67Å; E281-K309 PolarHBondContact OE1-NZ 2.92Å; L282-K309 PolarHBondContact N-O 2.79Å; L282-K309 WeakPolarHBondContact O-CD 3.38Å; L282-K309 PolarHBondContact O-NZ 2.93Å; F295-K309 HydrophobicContact CB-CB 3.84Å; F295-K309 HydrophobicContact CD1-CB 3.95Å; F295-K309 HydrophobicContact CD2-CB 4.36Å; F295-K309 HydrophobicContact CG-CB 3.77Å; K309-F322 WeakPolarHBondContact O-CE1 3.47Å
310	K	90.8	Very high	84.2	Confident	61 Å²	61	78.5 Å²	78.5	27%	0.265	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.3	-175.2	178.2	174.2	-173.6	172.3	0	110.8	E279 V280 E281 Q308	E279-K310 WeakPolarHBondContact OE1-CE 3.39Å; E279-K310 IonicContact OE1-NZ 2.83Å; E279-K310 PolarHBondContact OE1-NZ 2.82Å; E279-K310 WeakPolarHBondContact OE2-CE 3.49Å; E279-K310 IonicContact OE2-NZ 2.89Å; E279-K310 PolarHBondContact OE2-NZ 3.07Å; V280-K310 CarbonylContact O-C 3.39Å; V280-K310 WeakPolarHBondContact O-CA 3.37Å; E281-K310 HydrophobicContact CB-CB 3.99Å; E281-K310 HydrophobicContact CB-CD 4.39Å; E281-K310 HydrophobicContact CB-CG 4.02Å; E281-K310 HydrophobicContact CG-CB 4.08Å; Q308-K310 WeakPolarHBondContact CG-O 3.46Å; Q308-K310 PolarHBondContact NE2-O 3.48Å
311	C	89.8	Confident	85.1	Confident	0 Å²	0	76.6 Å²	76.6	0%	0	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	142.2	161.9	-70.1	0	0	0	0	109.3	E279 V280 C299 M314 A320	E279-C311 WeakPolarHBondContact CA-O 3.43Å; V280-C311 PolarHBondContact N-O 2.99Å; V280-C311 PolarHBondContact O-N 2.79Å; C299-C311 VanDerWaalsContact CA-SG 3.53Å; C299-C311 HydrophobicContact CB-CB 3.88Å; C299-C311 WeakPolarHBondContact CB-SG 3.5Å; C299-C311 VanDerWaalsContact SG-CA 3.51Å; C299-C311 WeakPolarHBondContact SG-CB 3.39Å; C299-C311 CovalentContact SG-SG 2.04Å; C299-C311 PolarHBondContact SG-SG 2.88Å; C311-M314 HydrophobicContact CB-CG 4Å; C311-M314 HydrophobicContact CB-SD 3.7Å; C311-A320 HydrophobicContact CB-CB 4.35Å
312	S	88.3	Confident	86.3	Confident	46 Å²	46	68 Å²	68	32%	0.322	35%	0.354	S	S	.	.			trans	-125.3	166.3	174.7	58.9	0	0	0	0	110.6	S278 M314	S278-S312 CarbonylContact O-C 3.07Å; S312-M314 PolarHBondContact O-N 3.09Å
313	H	85.9	Confident	87.3	Confident	151 Å²	151	66.6 Å²	66.6	70%	0.699	34%	0.336	S	S	*	.	S	Bend	trans	55.9	31	-175.7	-46.4	-65.4	0	0	0	113.8	S278 N300	S278-H313 PolarHBondContact O-N 2.91Å; N300-H313 PolarHBondContact ND2-O 2.95Å; N300-H313 VanDerWaalsContact ND2-O 3.16Å
314	M	84.8	Confident	87.8	Confident	10 Å²	10	63.4 Å²	63.4	5%	0.049	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-70.7	149.6	167.5	-56.3	-62.1	-61.1	0	0	109.2	S278 V280 C299 C311 S312 D318 A320	S278-M314 WeakPolarHBondContact CA-O 3.45Å; S278-M314 WeakPolarHBondContact O-CB 3.45Å; S278-M314 PolarHBondContact O-N 3Å; V280-M314 HydrophobicContact CG2-CG 4.44Å; C299-M314 HydrophobicContact CB-SD 4.45Å; C311-M314 HydrophobicContact CB-CG 4Å; C311-M314 HydrophobicContact CB-SD 3.7Å; S312-M314 PolarHBondContact O-N 3.09Å; M314-D318 HydrophobicContact CE-CB 3.66Å; M314-A320 HydrophobicContact CE-CB 4.03Å
315	K	84.6	Confident	88.1	Confident	159 Å²	159	59 Å²	59	69%	0.691	30%	0.295	S	S	*	.	P	Polyproline II helix	trans	-96.4	153.5	165.7	-59.9	-179	179.9	179.8	0	109.9	G317 D318	K315-G317 PolarHBondContact O-N 3.08Å; K315-D318 WeakPolarHBondContact CA-OD2 3.39Å; K315-D318 VanDerWaalsContact CB-OD2 3.28Å; K315-D318 WeakPolarHBondContact CB-OD2 3.23Å; K315-D318 PolarHBondContact N-OD2 2.81Å; K315-D318 VanDerWaalsContact O-CB 3.27Å; K315-D318 WeakPolarHBondContact O-CB 3.46Å; K315-D318 PolarHBondContact O-N 2.76Å
316	V	80.8	Confident	88.3	Confident	66 Å²	66	55.7 Å²	55.7	40%	0.4	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	128.4	170.9	174.4	0	0	0	0	109.4	E34 R277	E34-V316 HydrophobicContact CB-CG1 4.35Å; E34-V316 HydrophobicContact CG-CG1 4.14Å; R277-V316 HydrophobicContact CB-CG2 4.11Å
317	G	81.1	Confident	88.2	Confident	11 Å²	11	50.5 Å²	50.5	11%	0.113	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.1	-14.1	-174.1	0	0	0	0	0	115.3	R31 Q32 K315	R31-G317 PolarHBondContact NE-O 3.13Å; R31-G317 PolarHBondContact NH2-O 3.14Å; Q32-G317 WeakPolarHBondContact O-CA 3.27Å; Q32-G317 PolarHBondContact O-N 3.41Å; K315-G317 PolarHBondContact O-N 3.08Å
318	D	85.9	Confident	88.1	Confident	59 Å²	59	44.9 Å²	44.9	32%	0.316	23%	0.234	S	C	.	.			trans	-71.4	158.6	173.5	-68.5	-23.5	0	0	0	111.7	R31 M314 K315	R31-D318 WeakPolarHBondContact CG-O 3.49Å; M314-D318 HydrophobicContact CE-CB 3.66Å; K315-D318 WeakPolarHBondContact CA-OD2 3.39Å; K315-D318 VanDerWaalsContact CB-OD2 3.28Å; K315-D318 WeakPolarHBondContact CB-OD2 3.23Å; K315-D318 PolarHBondContact N-OD2 2.81Å; K315-D318 VanDerWaalsContact O-CB 3.27Å; K315-D318 WeakPolarHBondContact O-CB 3.46Å; K315-D318 PolarHBondContact O-N 2.76Å
319	T	88.3	Confident	87.5	Confident	70 Å²	70	44.1 Å²	44.1	43%	0.429	24%	0.235	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.9	180	-54	0	0	0	0	110.6	H29 V30 R31	H29-T319 HydrophobicContact CB-CG2 4.34Å; V30-T319 CarbonylContact O-C 3.34Å; V30-T319 WeakPolarHBondContact O-CA 3.48Å; R31-T319 HydrophobicContact CB-CG2 4.34Å; R31-T319 WeakPolarHBondContact CD-OG1 3.4Å
320	A	91.2	Very high	86.8	Confident	1 Å²	1	47.7 Å²	47.7	1%	0.008	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	142.5	168.8	0	0	0	0	0	109.8	V30 V280 C311 M314 F322	V30-A320 PolarHBondContact N-O 2.94Å; V30-A320 PolarHBondContact O-N 3.49Å; V280-A320 HydrophobicContact CB-CB 4.26Å; V280-A320 HydrophobicContact CG1-CB 4.19Å; C311-A320 HydrophobicContact CB-CB 4.35Å; M314-A320 HydrophobicContact CE-CB 4.03Å; A320-F322 HydrophobicContact CB-CE2 3.73Å; A320-F322 HydrophobicContact CB-CZ 4.04Å
321	S	92.6	Very high	86.1	Confident	22 Å²	22	47.3 Å²	47.3	15%	0.154	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	141.5	175.2	-55.9	0	0	0	0	110.3	V28 H29 I298	V28-S321 CarbonylContact O-C 3.56Å; V28-S321 WeakPolarHBondContact O-CA 3.31Å; H29-S321 WeakPolarHBondContact ND1-CB 3.47Å; H29-S321 PolarHBondContact ND1-OG 3.2Å; I298-S321 WeakPolarHBondContact CA-O 3.45Å; I298-S321 WeakPolarHBondContact CB-O 3.31Å; I298-S321 PolarHBondContact N-O 2.84Å; I298-S321 PolarHBondContact O-N 2.79Å; I298-S321 VanDerWaalsContact O-N 3.07Å
322	F	93.6	Very high	85.2	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.5	-177.8	-60	-87.8	0	0	0	110	V28 V30 V280 L282 T296 A297 K309 A320 V324	V28-F322 HydrophobicContact CB-CB 4.46Å; V28-F322 PolarHBondContact N-O 3.24Å; V28-F322 PolarHBondContact O-N 2.95Å; V30-F322 HydrophobicContact CG2-CD2 4.33Å; V30-F322 HydrophobicContact CG2-CE2 4.21Å; V280-F322 HydrophobicContact CG1-CE2 3.92Å; V280-F322 HydrophobicContact CG1-CZ 4.08Å; L282-F322 HydrophobicContact CD1-CB 3.62Å; L282-F322 HydrophobicContact CD1-CD1 4.03Å; L282-F322 HydrophobicContact CD1-CD2 3.62Å; L282-F322 HydrophobicContact CD1-CE2 4.27Å; L282-F322 HydrophobicContact CD1-CG 3.47Å; L282-F322 VanDerWaalsContact CD1-CG 3.47Å; L282-F322 HydrophobicContact CD2-CD2 4.39Å; L282-F322 HydrophobicContact CD2-CE2 4.44Å; L282-F322 HydrophobicContact CG-CD1 4.41Å; L282-F322 HydrophobicContact CG-CD2 3.95Å; L282-F322 HydrophobicContact CG-CE2 4.08Å; L282-F322 HydrophobicContact CG-CG 4.12Å; L282-F322 HydrophobicContact CG-CZ 4.38Å; T296-F322 WeakPolarHBondContact O-CA 3.26Å; A297-F322 HydrophobicContact CB-CD1 3.79Å; A297-F322 HydrophobicContact CB-CE1 3.64Å; K309-F322 WeakPolarHBondContact O-CE1 3.47Å; A320-F322 HydrophobicContact CB-CE2 3.73Å; A320-F322 HydrophobicContact CB-CZ 4.04Å; F322-V324 HydrophobicContact CB-CG2 4.49Å
323	S	92.6	Very high	84.4	Confident	15 Å²	15	60.1 Å²	60.1	11%	0.105	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	111.5	168.8	-55.4	0	0	0	0	108.8	L26 Q27 T296	L26-S323 CarbonylContact O-C 3.57Å; L26-S323 WeakPolarHBondContact O-CA 3.38Å; Q27-S323 VanDerWaalsContact CD-OG 3.26Å; Q27-S323 PolarHBondContact NE2-OG 3.46Å; Q27-S323 PolarHBondContact OE1-OG 3.34Å; T296-S323 PolarHBondContact N-O 2.88Å; T296-S323 PolarHBondContact O-N 3.5Å
324	V	93.5	Very high	84.2	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	115.1	-179.9	-173	0	0	0	0	108.8	T25 L26 V28 S294 F295 F322 I340	T25-V324 CarbonylContact C-O 3.45Å; T25-V324 WeakPolarHBondContact CA-O 3.25Å; L26-V324 PolarHBondContact N-O 3.45Å; L26-V324 PolarHBondContact O-N 3.1Å; V28-V324 HydrophobicContact CG2-CG2 3.96Å; S294-V324 WeakPolarHBondContact O-CA 3.36Å; F295-V324 HydrophobicContact CD1-CB 4.44Å; F295-V324 HydrophobicContact CD1-CG1 4.16Å; F295-V324 HydrophobicContact CD1-CG2 3.78Å; F295-V324 HydrophobicContact CE1-CB 4.27Å; F295-V324 HydrophobicContact CE1-CG1 3.63Å; F295-V324 HydrophobicContact CE1-CG2 3.71Å; F295-V324 HydrophobicContact CZ-CG1 3.99Å; F322-V324 HydrophobicContact CB-CG2 4.49Å; V324-I340 HydrophobicContact CB-CD1 4.43Å; V324-I340 HydrophobicContact CG1-CD1 3.87Å; V324-I340 HydrophobicContact CG2-CD1 4.28Å
325	T	90.7	Very high	84.2	Confident	30 Å²	30	65.8 Å²	65.8	18%	0.184	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	126	175.1	-51.4	0	0	0	0	110.1	A23 Q24 T25 L293 S294	A23-T325 HydrophobicContact CB-CG2 3.93Å; Q24-T325 WeakPolarHBondContact O-CA 3.29Å; T25-T325 PolarHBondContact OG1-OG1 3.06Å; L293-T325 WeakPolarHBondContact CA-O 3.39Å; S294-T325 PolarHBondContact N-O 3.45Å; S294-T325 PolarHBondContact O-N 3.4Å; S294-T325 WeakPolarHBondContact OG-CB 3.33Å
326	V	89.8	Confident	84.2	Confident	16 Å²	16	59.5 Å²	59.5	10%	0.097	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.5	176.7	-171.9	0	0	0	0	108.6	A23 Q24 L26 L291 L293	A23-V326 WeakPolarHBondContact CA-O 3.16Å; Q24-V326 PolarHBondContact N-O 3.14Å; Q24-V326 PolarHBondContact O-N 2.92Å; L26-V326 HydrophobicContact CD1-CG2 4.31Å; L291-V326 HydrophobicContact CD2-CG1 3.82Å; L293-V326 HydrophobicContact CD2-CB 4.14Å; L293-V326 HydrophobicContact CD2-CG1 3.93Å; L293-V326 HydrophobicContact CD2-CG2 3.77Å
327	N	86.1	Confident	84.7	Confident	43 Å²	43	60.3 Å²	60.3	23%	0.23	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	137.3	177.4	174.8	21.9	0	0	0	110.4	G21 A23 N292	G21-N327 PolarHBondContact O-OD1 3.25Å; A23-N327 HydrophobicContact CB-CB 3.87Å; N292-N327 HydrophobicContact CB-CB 4.03Å; N292-N327 PolarHBondContact N-O 2.93Å; N292-N327 PolarHBondContact O-N 3.24Å
328	I	82.3	Confident	85.2	Confident	44 Å²	44	59.9 Å²	59.9	23%	0.226	29%	0.294	C	S	.	.			trans	-113	109.7	-179.9	-51.2	177.2	0	0	0	108.4	L291 H330 V353 P355	L291-I328 HydrophobicContact CD2-CG1 3.92Å; I328-H330 WeakPolarHBondContact CG2-O 3.41Å; I328-V353 HydrophobicContact CD1-CG1 3.57Å; I328-V353 HydrophobicContact CG1-CG1 4.34Å; I328-P355 HydrophobicContact CD1-CB 4.35Å
329	P	75.4	Confident	85.5	Confident	53 Å²	53	59 Å²	59	34%	0.344	29%	0.289	S	S	.	.	S	Bend	trans	-75.2	-26.3	-175.8	30.1	-34.7	0	0	0	113.6	G290	G290-P329 WeakPolarHBondContact O-CD 3.3Å; G290-P329 WeakPolarHBondContact O-CG 3.35Å
330	H	75.3	Confident	85.7	Confident	144 Å²	144	55.8 Å²	55.8	67%	0.667	27%	0.269	S	S	*	.	S	Bend	trans	-133.9	138.3	-175.8	-64.2	-33.1	0	0	0	111.3	I328 E332	I328-H330 WeakPolarHBondContact CG2-O 3.41Å; H330-E332 PolarHBondContact O-N 2.85Å; H330-E332 VanDerWaalsContact O-N 3.1Å
331	C	75.1	Confident	85.7	Confident	53 Å²	53	56.6 Å²	56.6	36%	0.358	27%	0.272	S	S	.	.			trans	-83.1	96	-173.1	-144.9	0	0	0	0	111.8	C357	C331-C357 VanDerWaalsContact CA-SG 3.55Å; C331-C357 HydrophobicContact CB-CB 3.88Å; C331-C357 WeakPolarHBondContact CB-SG 3.48Å; C331-C357 WeakPolarHBondContact SG-CA 3.46Å; C331-C357 WeakPolarHBondContact SG-CB 3.43Å; C331-C357 CovalentContact SG-SG 2.02Å; C331-C357 PolarHBondContact SG-SG 2.87Å
332	E	71.6	Confident	85.6	Confident	68 Å²	68	56.2 Å²	56.2	32%	0.318	27%	0.269	S	S	.	.			trans	-82.8	166.2	-179.2	-66.8	179.9	-179.1	0	0	113	H330 R336 P355 C357	H330-E332 PolarHBondContact O-N 2.85Å; H330-E332 VanDerWaalsContact O-N 3.1Å; E332-R336 IonicContact OE1-CZ 2.67Å; E332-R336 IonicContact OE1-NH2 3.76Å; E332-R336 PolarHBondContact OE1-NH2 3.22Å; E332-R336 IonicContact OE2-CZ 3.53Å; E332-R336 VanDerWaalsContact OE2-CZ 3.27Å; E332-R336 IonicContact OE2-NE 3.39Å; E332-R336 PolarHBondContact OE2-NE 3.07Å; E332-R336 IonicContact OE2-NH2 3.6Å; E332-R336 PolarHBondContact OE2-NH2 3.28Å; E332-P355 HydrophobicContact CB-CG 4.37Å; E332-P355 WeakPolarHBondContact O-CG 3.1Å; E332-C357 PolarHBondContact O-SG 2.88Å
333	R	72.2	Confident	85.4	Confident	247 Å²	247	57.5 Å²	57.5	93%	0.932	28%	0.277	S	S	*	.	S	Bend	trans	-100.3	0.2	179.1	-68.5	-171.1	177.2	-176.6	-0	114.8
334	R	81	Confident	84.8	Confident	204 Å²	204	56.9 Å²	56.9	77%	0.77	27%	0.273	S	S	*	.	S	Bend	trans	-116.3	141.3	-176.4	-67.3	-176.6	178.5	178.9	0.5	109.9	P355	R334-P355 WeakPolarHBondContact O-CD 3.49Å
335	S	84.8	Confident	84.4	Confident	77 Å²	77	58 Å²	58	54%	0.538	28%	0.278	S	S	.	.			trans	-76.5	141.8	165	54.4	0	0	0	0	110	V353	S335-V353 CarbonylContact C-O 3.46Å; S335-V353 VanDerWaalsContact CA-O 3.22Å; S335-V353 WeakPolarHBondContact CA-O 3.47Å
336	R	85.3	Confident	84	Confident	27 Å²	27	58.5 Å²	58.5	10%	0.102	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	148	179.8	-62.8	176.7	171.5	-134.4	19.3	110.8	D287 E289 E332 V353	D287-R336 VanDerWaalsContact CG-NH1 3.33Å; D287-R336 IonicContact OD1-CZ 3.61Å; D287-R336 IonicContact OD1-NH1 2.83Å; D287-R336 PolarHBondContact OD1-NH1 2.97Å; D287-R336 WeakPolarHBondContact OD2-CG 3.21Å; D287-R336 IonicContact OD2-CZ 3.28Å; D287-R336 IonicContact OD2-NE 2.91Å; D287-R336 IonicContact OD2-NH1 3.67Å; E289-R336 PolarHBondContact O-NH1 3.43Å; E289-R336 PolarHBondContact O-NH2 3.01Å; E332-R336 IonicContact OE1-CZ 2.67Å; E332-R336 IonicContact OE1-NH2 3.76Å; E332-R336 PolarHBondContact OE1-NH2 3.22Å; E332-R336 IonicContact OE2-CZ 3.53Å; E332-R336 VanDerWaalsContact OE2-CZ 3.27Å; E332-R336 IonicContact OE2-NE 3.39Å; E332-R336 PolarHBondContact OE2-NE 3.07Å; E332-R336 IonicContact OE2-NH2 3.6Å; E332-R336 PolarHBondContact OE2-NH2 3.28Å; R336-V353 PolarHBondContact N-O 3.24Å; R336-V353 PolarHBondContact O-N 2.81Å
337	H	90.3	Very high	83.8	Confident	82 Å²	82	62.8 Å²	62.8	38%	0.38	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	123.5	175.7	-168.4	-96.7	0	0	0	109.6	D287	D287-H337 PolarHBondContact N-O 3.2Å
338	I	92.1	Very high	84	Confident	2 Å²	2	63.1 Å²	63.1	1%	0.01	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	142.6	-178.3	-50.8	173.3	0	0	0	107.3	V284 L285 T288 L291 L351 V353	V284-I338 HydrophobicContact CG1-CG2 3.38Å; L285-I338 CarbonylContact O-C 3.52Å; L285-I338 WeakPolarHBondContact O-CA 3.4Å; T288-I338 HydrophobicContact CG2-CG2 4.24Å; L291-I338 HydrophobicContact CD1-CD1 3.64Å; L291-I338 HydrophobicContact CD1-CG1 4.49Å; L291-I338 HydrophobicContact CD2-CD1 4.45Å; I338-L351 HydrophobicContact CB-CB 4.33Å; I338-L351 PolarHBondContact N-O 2.82Å; I338-L351 PolarHBondContact O-N 3.01Å; I338-V353 HydrophobicContact CD1-CG2 3.72Å; I338-V353 HydrophobicContact CG1-CG2 4.43Å
339	I	91.8	Very high	84.5	Confident	41 Å²	41	64.1 Å²	64.1	21%	0.21	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	126.6	175.9	-56.8	178.1	0	0	0	107.9	V284 L285 A348 L349 E350	V284-I339 CarbonylContact C-O 3.53Å; V284-I339 WeakPolarHBondContact CA-O 3.32Å; L285-I339 HydrophobicContact CB-CB 4.36Å; L285-I339 PolarHBondContact N-O 2.8Å; L285-I339 PolarHBondContact O-N 3.08Å; I339-A348 HydrophobicContact CG2-CB 3.62Å; I339-L349 WeakPolarHBondContact CA-O 3.42Å; I339-E350 HydrophobicContact CG1-CG 4.41Å
340	I	92.9	Very high	85.4	Confident	3 Å²	3	68.2 Å²	68.2	2%	0.015	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.1	170.8	-57.1	-177.7	0	0	0	107.4	L282 E283 V284 V324 L349 L351	L282-I340 HydrophobicContact CB-CG2 4.41Å; L282-I340 HydrophobicContact CD1-CG2 4.02Å; L282-I340 HydrophobicContact CD2-CG2 4.28Å; L282-I340 HydrophobicContact CG-CG2 4.49Å; E283-I340 WeakPolarHBondContact O-CA 3.42Å; V284-I340 HydrophobicContact CG2-CG1 4.42Å; V324-I340 HydrophobicContact CB-CD1 4.43Å; V324-I340 HydrophobicContact CG1-CD1 3.87Å; V324-I340 HydrophobicContact CG2-CD1 4.28Å; I340-L349 HydrophobicContact CB-CB 4.39Å; I340-L349 HydrophobicContact CB-CD2 4.33Å; I340-L349 HydrophobicContact CD1-CD2 4.43Å; I340-L349 PolarHBondContact N-O 2.86Å; I340-L349 WeakPolarHBondContact O-CB 3.46Å; I340-L349 PolarHBondContact O-N 2.96Å; I340-L351 HydrophobicContact CD1-CD1 3.62Å; I340-L351 HydrophobicContact CG1-CD1 4.09Å
341	K	90.4	Very high	86.1	Confident	18 Å²	18	62.7 Å²	62.7	8%	0.078	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	156.3	179.1	73.3	173.5	-166.7	71.6	0	111.6	N228 L282 E283 L285 A348	N228-K341 PolarHBondContact OD1-NZ 2.86Å; L282-K341 WeakPolarHBondContact CA-O 3.49Å; E283-K341 HydrophobicContact CB-CG 4.36Å; E283-K341 PolarHBondContact N-O 2.67Å; E283-K341 PolarHBondContact O-N 2.8Å; E283-K341 VanDerWaalsContact O-N 3.1Å; E283-K341 WeakPolarHBondContact OE2-CE 3.43Å; E283-K341 IonicContact OE2-NZ 3.94Å; E283-K341 PolarHBondContact OE2-NZ 2.84Å; L285-K341 HydrophobicContact CD1-CD 4.2Å; K341-A348 HydrophobicContact CB-CB 3.75Å
342	P	90.8	Very high	86.9	Confident	13 Å²	13	66 Å²	66	8%	0.084	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	148.2	166.9	-14.8	31.4	0	0	0	111.2	V30 E281 L282 G344 L345 D347	V30-P342 HydrophobicContact CG1-CB 4.17Å; V30-P342 HydrophobicContact CG1-CG 3.64Å; V30-P342 HydrophobicContact CG2-CG 4.02Å; E281-P342 CarbonylContact O-C 3.6Å; E281-P342 VanDerWaalsContact O-CA 3.27Å; E281-P342 WeakPolarHBondContact O-CA 3.46Å; L282-P342 HydrophobicContact CD2-CG 4.43Å; P342-G344 PolarHBondContact O-N 2.94Å; P342-L345 HydrophobicContact CB-CB 4.13Å; P342-L345 HydrophobicContact CB-CD1 3.95Å; P342-L345 HydrophobicContact CB-CG 4.21Å; P342-L345 HydrophobicContact CG-CB 4.3Å; P342-L345 HydrophobicContact CG-CD1 4.05Å; P342-D347 VanDerWaalsContact CD-O 3.25Å; P342-D347 WeakPolarHBondContact CD-O 3.02Å
343	V	88.6	Confident	87.6	Confident	28 Å²	28	63.9 Å²	63.9	17%	0.17	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	132.7	166.4	-176.5	0	0	0	0	108.5	L230 E281 E283 L345	L230-V343 HydrophobicContact CD2-CG1 3.81Å; E281-V343 HydrophobicContact CB-CG2 3.75Å; E281-V343 HydrophobicContact CG-CG2 3.92Å; E281-V343 PolarHBondContact O-N 2.99Å; E283-V343 HydrophobicContact CG-CG2 3.62Å; V343-L345 VanDerWaalsContact C-N 3.3Å; V343-L345 PolarHBondContact O-N 2.95Å
344	G	81.2	Confident	88.3	Confident	1 Å²	1	55.5 Å²	55.5	1%	0.01	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.3	-2.5	174.7	0	0	0	0	0	116.8	L168 N228 P342	L168-G344 WeakPolarHBondContact CD2-O 3.45Å; N228-G344 PolarHBondContact ND2-O 3.21Å; N228-G344 WeakPolarHBondContact OD1-CA 3.27Å; N228-G344 PolarHBondContact OD1-N 3.34Å; P342-G344 PolarHBondContact O-N 2.94Å
345	L	84.4	Confident	88.3	Confident	23 Å²	23	47.3 Å²	47.3	12%	0.12	27%	0.274	C	S	.	.			trans	-112.2	146.6	176.5	-60.1	-179	0	0	0	112.4	Y36 L168 N228 P342 V343	Y36-L345 HydrophobicContact CE1-CD2 3.96Å; L168-L345 HydrophobicContact CD2-CD2 4.46Å; N228-L345 PolarHBondContact ND2-N 2.89Å; N228-L345 PolarHBondContact OD1-N 2.87Å; N228-L345 PolarHBondContact OD1-O 2.84Å; P342-L345 HydrophobicContact CB-CB 4.13Å; P342-L345 HydrophobicContact CB-CD1 3.95Å; P342-L345 HydrophobicContact CB-CG 4.21Å; P342-L345 HydrophobicContact CG-CB 4.3Å; P342-L345 HydrophobicContact CG-CD1 4.05Å; V343-L345 VanDerWaalsContact C-N 3.3Å; V343-L345 PolarHBondContact O-N 2.95Å
346	G	82	Confident	88.2	Confident	42 Å²	42	49.3 Å²	49.3	43%	0.433	28%	0.275	S	S	.	.	S	Bend	trans	-76.9	-28.5	177.5	0	0	0	0	0	114.2
347	D	86.9	Confident	88	Confident	105 Å²	105	50 Å²	50	56%	0.561	28%	0.283	S	S	*	.			trans	-66.2	135.5	177.9	-60.7	-94.4	0	0	0	112.1	P342	P342-D347 VanDerWaalsContact CD-O 3.25Å; P342-D347 WeakPolarHBondContact CD-O 3.02Å
348	A	90.4	Very high	87.5	Confident	50 Å²	50	52.3 Å²	52.3	41%	0.413	30%	0.299	S	S	.	.			trans	-143.8	152.5	-175.1	0	0	0	0	0	113.1	I339 K341	I339-A348 HydrophobicContact CG2-CB 3.62Å; K341-A348 HydrophobicContact CB-CB 3.75Å
349	L	92.8	Very high	87	Confident	65 Å²	65	55.8 Å²	55.8	34%	0.34	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	111.3	172.6	-178	90.3	0	0	0	109.4	V28 I339 I340 L351	V28-L349 HydrophobicContact CG2-CD2 3.85Å; I339-L349 WeakPolarHBondContact CA-O 3.42Å; I340-L349 HydrophobicContact CB-CB 4.39Å; I340-L349 HydrophobicContact CB-CD2 4.33Å; I340-L349 HydrophobicContact CD1-CD2 4.43Å; I340-L349 PolarHBondContact N-O 2.86Å; I340-L349 WeakPolarHBondContact O-CB 3.46Å; I340-L349 PolarHBondContact O-N 2.96Å; L349-L351 HydrophobicContact CD2-CD1 4.17Å; L349-L351 HydrophobicContact CD2-CD2 3.91Å; L349-L351 HydrophobicContact CD2-CG 4Å; L349-L351 HydrophobicContact CG-CD2 4.29Å; L349-L351 HydrophobicContact CG-CG 4.41Å
350	E	92.7	Very high	86.5	Confident	139 Å²	139	59.5 Å²	59.5	65%	0.65	34%	0.343	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.7	133.8	173	-62.2	-172.3	155.8	0	0	111.1	I339	I339-E350 HydrophobicContact CG1-CG 4.41Å
351	L	90.8	Very high	86	Confident	28 Å²	28	62.2 Å²	62.2	15%	0.147	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	118	179.7	-66.7	178.3	0	0	0	110.3	L26 I338 I340 L349	L26-L351 HydrophobicContact CD1-CD1 3.77Å; L26-L351 HydrophobicContact CD1-CD2 3.77Å; L26-L351 HydrophobicContact CD1-CG 4.46Å; I338-L351 HydrophobicContact CB-CB 4.33Å; I338-L351 PolarHBondContact N-O 2.82Å; I338-L351 PolarHBondContact O-N 3.01Å; I340-L351 HydrophobicContact CD1-CD1 3.62Å; I340-L351 HydrophobicContact CG1-CD1 4.09Å; L349-L351 HydrophobicContact CD2-CD1 4.17Å; L349-L351 HydrophobicContact CD2-CD2 3.91Å; L349-L351 HydrophobicContact CD2-CG 4Å; L349-L351 HydrophobicContact CG-CD2 4.29Å; L349-L351 HydrophobicContact CG-CG 4.41Å
352	L	90.9	Very high	85.5	Confident	123 Å²	123	65.2 Å²	65.2	64%	0.644	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	107.3	169.3	-177.6	65.1	0	0	0	109.3
353	V	87.2	Confident	85.1	Confident	24 Å²	24	72.3 Å²	72.3	15%	0.145	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	108.3	-179.5	-177.6	0	0	0	0	109.2	L291 I328 S335 R336 I338	L291-V353 HydrophobicContact CD2-CG1 4.3Å; I328-V353 HydrophobicContact CD1-CG1 3.57Å; I328-V353 HydrophobicContact CG1-CG1 4.34Å; S335-V353 CarbonylContact C-O 3.46Å; S335-V353 VanDerWaalsContact CA-O 3.22Å; S335-V353 WeakPolarHBondContact CA-O 3.47Å; R336-V353 PolarHBondContact N-O 3.24Å; R336-V353 PolarHBondContact O-N 2.81Å; I338-V353 HydrophobicContact CD1-CG2 3.72Å; I338-V353 HydrophobicContact CG1-CG2 4.43Å
354	S	86.4	Confident	84.7	Confident	71 Å²	71	78.9 Å²	78.9	50%	0.497	43%	0.434	S	S	.	.			trans	-113	109.9	178.8	55.4	0	0	0	0	111.4
355	P	82.4	Confident	84.8	Confident	32 Å²	32	81.9 Å²	81.9	21%	0.208	45%	0.452	C	S	.	.			trans	-73.8	136.2	177.7	29.4	-35.2	0	0	0	112.5	I328 E332 R334	I328-P355 HydrophobicContact CD1-CB 4.35Å; E332-P355 HydrophobicContact CB-CG 4.37Å; E332-P355 WeakPolarHBondContact O-CG 3.1Å; R334-P355 WeakPolarHBondContact O-CD 3.49Å
356	E	82.2	Confident	84.9	Confident	118 Å²	118	84.2 Å²	84.2	55%	0.551	46%	0.462	S	S	*	.			trans	-105.4	97.4	175.3	-67.7	-168.2	160.5	0	0	111.1	L13	L13-E356 VanDerWaalsContact CD1-CD 3.43Å; L13-E356 HydrophobicContact CD1-CG 3.91Å; L13-E356 WeakPolarHBondContact CD1-OE2 3.04Å
357	C	80.4	Confident	85	Confident	42 Å²	42	86.9 Å²	86.9	28%	0.284	47%	0.47	S	S	.	.			trans	-101	-18	-173.5	-52.4	0	0	0	0	115.2	C331 E332	C331-C357 VanDerWaalsContact CA-SG 3.55Å; C331-C357 HydrophobicContact CB-CB 3.88Å; C331-C357 WeakPolarHBondContact CB-SG 3.48Å; C331-C357 WeakPolarHBondContact SG-CA 3.46Å; C331-C357 WeakPolarHBondContact SG-CB 3.43Å; C331-C357 CovalentContact SG-SG 2.02Å; C331-C357 PolarHBondContact SG-SG 2.87Å; E332-C357 PolarHBondContact O-SG 2.88Å
358	N	80.4	Confident	85	Confident	131 Å²	131	86.6 Å²	86.6	70%	0.701	47%	0.468	S	S	*	.	S	Bend	trans	-101.4	133.5	-173	-59.6	-34.2	0	0	0	109.7	Q362	N358-Q362 VanDerWaalsContact CA-OE1 3.31Å
359	C	80.4	Confident	84.8	Confident	75 Å²	75	84.2 Å²	84.2	51%	0.507	45%	0.448	S	S	.	.			trans	-76.6	143.1	173.4	-57.2	0	0	0	0	110.1	C361 Q362	C359-C361 PolarHBondContact O-N 3.38Å; C359-C361 VanDerWaalsContact O-N 3.16Å; C359-Q362 HydrophobicContact CB-CG 4.21Å; C359-Q362 WeakPolarHBondContact O-CB 3.07Å; C359-Q362 PolarHBondContact O-N 2.92Å
360	D	82.8	Confident	84.6	Confident	119 Å²	119	85 Å²	85	64%	0.636	46%	0.459	S	S	*	.	G	3₁₀ helix	trans	-55.7	-36	177.8	-81.1	-41.2	0	0	0	113.2	Q362 K363	D360-Q362 PolarHBondContact O-N 3.13Å; D360-Q362 VanDerWaalsContact O-N 3.11Å; D360-K363 VanDerWaalsContact O-CB 3.29Å; D360-K363 WeakPolarHBondContact O-CB 3.4Å; D360-K363 WeakPolarHBondContact O-CG 3.4Å; D360-K363 PolarHBondContact O-N 3.14Å; D360-K363 WeakPolarHBondContact OD1-CE 3.1Å; D360-K363 IonicContact OD1-NZ 2.77Å; D360-K363 PolarHBondContact OD1-NZ 2.87Å
361	C	81.8	Confident	84.3	Confident	59 Å²	59	83.2 Å²	83.2	40%	0.399	45%	0.45	S	S	.	.	G	3₁₀ helix	trans	-62.8	-14.3	176.1	60.7	0	0	0	0	114.4	C359 K363 C381	C359-C361 PolarHBondContact O-N 3.38Å; C359-C361 VanDerWaalsContact O-N 3.16Å; C361-K363 PolarHBondContact O-N 2.91Å; C361-C381 HydrophobicContact CB-CB 4.05Å; C361-C381 WeakPolarHBondContact CB-SG 3.46Å; C361-C381 WeakPolarHBondContact SG-CB 3.41Å; C361-C381 CovalentContact SG-SG 2.04Å; C361-C381 PolarHBondContact SG-SG 3.44Å
362	Q	79.9	Confident	84.1	Confident	81 Å²	81	81.9 Å²	81.9	38%	0.379	44%	0.443	S	S	.	.	G	3₁₀ helix	trans	-76.9	-13.7	175.4	-64	178.2	-58	0	0	112.5	N358 C359 D360 E364 C381	N358-Q362 VanDerWaalsContact CA-OE1 3.31Å; C359-Q362 HydrophobicContact CB-CG 4.21Å; C359-Q362 WeakPolarHBondContact O-CB 3.07Å; C359-Q362 PolarHBondContact O-N 2.92Å; D360-Q362 PolarHBondContact O-N 3.13Å; D360-Q362 VanDerWaalsContact O-N 3.11Å; Q362-E364 VanDerWaalsContact C-N 3.29Å; Q362-C381 VanDerWaalsContact CG-SG 3.58Å; Q362-C381 PolarHBondContact N-SG 3.13Å
363	K	82	Confident	83.8	Confident	163 Å²	163	80 Å²	80	71%	0.709	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-72	-23.4	174.4	-62	167.5	179.6	167.6	0	112.3	D360 C361	D360-K363 VanDerWaalsContact O-CB 3.29Å; D360-K363 WeakPolarHBondContact O-CB 3.4Å; D360-K363 WeakPolarHBondContact O-CG 3.4Å; D360-K363 PolarHBondContact O-N 3.14Å; D360-K363 WeakPolarHBondContact OD1-CE 3.1Å; D360-K363 IonicContact OD1-NZ 2.77Å; D360-K363 PolarHBondContact OD1-NZ 2.87Å; C361-K363 PolarHBondContact O-N 2.91Å
364	E	80.9	Confident	83.6	Confident	165 Å²	165	87 Å²	87	77%	0.771	46%	0.461	S	S	*	.			trans	-117.7	101.3	-179.3	-65.7	-174.8	179.9	0	0	110.5	Q362	Q362-E364 VanDerWaalsContact C-N 3.29Å
365	V	83.5	Confident	83.5	Confident	65 Å²	65	84.2 Å²	84.2	39%	0.394	44%	0.444	S	S	.	.			trans	-110.1	119.3	177.4	-175.4	0	0	0	0	109.9	V367 Q380	V365-V367 HydrophobicContact CG1-CG2 4.31Å; V365-V367 PolarHBondContact O-N 3.27Å; V365-Q380 HydrophobicContact CG1-CB 4.4Å; V365-Q380 HydrophobicContact CG2-CB 4.44Å; V365-Q380 HydrophobicContact CG2-CG 3.99Å
366	E	86	Confident	83.7	Confident	72 Å²	72	84.8 Å²	84.8	34%	0.336	45%	0.445	S	S	.	.	B	Isolated β-bridge	trans	-87.3	88.5	176.2	-169.9	-166.8	150.8	0	0	109	S369 K371 S378 F379	E366-S369 VanDerWaalsContact CD-CB 3.44Å; E366-S369 WeakPolarHBondContact O-CB 3.35Å; E366-S369 PolarHBondContact O-N 2.99Å; E366-S369 WeakPolarHBondContact OE1-CA 3.22Å; E366-S369 VanDerWaalsContact OE1-CB 3.27Å; E366-S369 WeakPolarHBondContact OE1-CB 3.34Å; E366-S369 PolarHBondContact OE1-OG 3.23Å; E366-S369 PolarHBondContact OE2-OG 2.04Å; E366-K371 IonicContact OE2-NZ 3.82Å; E366-K371 PolarHBondContact OE2-NZ 2.88Å; E366-S378 CarbonylContact O-C 3.6Å; E366-S378 WeakPolarHBondContact O-CA 3.23Å; E366-F379 HydrophobicContact CB-CB 4.27Å; E366-F379 PolarHBondContact N-O 3.48Å; E366-F379 PolarHBondContact O-N 3.03Å
367	V	84.9	Confident	84	Confident	98 Å²	98	79.1 Å²	79.1	59%	0.594	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	136.9	176.2	-176.2	0	0	0	0	110	V365	V365-V367 HydrophobicContact CG1-CG2 4.31Å; V365-V367 PolarHBondContact O-N 3.27Å
368	N	86.1	Confident	84.4	Confident	98 Å²	98	78.3 Å²	78.3	52%	0.524	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.6	44.7	-174.1	-53.1	-9.4	0	0	0	112.9	S370 G377 H387	N368-S370 PolarHBondContact O-N 3.43Å; N368-G377 CarbonylContact C-O 3.03Å; N368-G377 VanDerWaalsContact CA-O 3.31Å; N368-G377 WeakPolarHBondContact CA-O 3.44Å; N368-G377 PolarHBondContact N-O 2.99Å; N368-H387 PolarHBondContact OD1-CE1 3.38Å; N368-H387 PolarHBondContact OD1-NE2 3.37Å
369	S	87.2	Confident	84.8	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	39%	0.39	C	S	.	.			trans	-64.4	136.5	-176.5	-179	0	0	0	0	112.7	E366 K371 C372 G375 G377	E366-S369 VanDerWaalsContact CD-CB 3.44Å; E366-S369 WeakPolarHBondContact O-CB 3.35Å; E366-S369 PolarHBondContact O-N 2.99Å; E366-S369 WeakPolarHBondContact OE1-CA 3.22Å; E366-S369 VanDerWaalsContact OE1-CB 3.27Å; E366-S369 WeakPolarHBondContact OE1-CB 3.34Å; E366-S369 PolarHBondContact OE1-OG 3.23Å; E366-S369 PolarHBondContact OE2-OG 2.04Å; S369-K371 PolarHBondContact O-N 2.93Å; S369-K371 VanDerWaalsContact O-N 3.1Å; S369-K371 WeakPolarHBondContact OG-CB 3.38Å; S369-K371 PolarHBondContact OG-N 3.33Å; S369-K371 VanDerWaalsContact OG-N 3.15Å; S369-C372 PolarHBondContact O-N 2.04Å; S369-G375 WeakPolarHBondContact O-CA 3.49Å; S369-G375 PolarHBondContact O-N 3.24Å; S369-G377 PolarHBondContact N-O 3.19Å
370	S	87.6	Confident	85.1	Confident	82 Å²	82	73.9 Å²	73.9	57%	0.573	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.1	170.6	60	0	0	0	0	113.8	N368 C372 H374	N368-S370 PolarHBondContact O-N 3.43Å; S370-C372 VanDerWaalsContact C-N 3.32Å; S370-H374 PolarHBondContact O-N 3.4Å
371	K	85.9	Confident	85.2	Confident	102 Å²	102	71.1 Å²	71.1	44%	0.443	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-24.1	178.2	-59.3	166.1	-169.4	138.7	0	112.8	E366 S369 H373 F379	E366-K371 IonicContact OE2-NZ 3.82Å; E366-K371 PolarHBondContact OE2-NZ 2.88Å; S369-K371 PolarHBondContact O-N 2.93Å; S369-K371 VanDerWaalsContact O-N 3.1Å; S369-K371 WeakPolarHBondContact OG-CB 3.38Å; S369-K371 PolarHBondContact OG-N 3.33Å; S369-K371 VanDerWaalsContact OG-N 3.15Å; K371-H373 PolarHBondContact O-N 3.46Å; K371-F379 HydrophobicContact CB-CD2 4.12Å; K371-F379 HydrophobicContact CB-CE2 4.38Å; K371-F379 HydrophobicContact CD-CD1 3.85Å; K371-F379 HydrophobicContact CD-CD2 3.99Å; K371-F379 HydrophobicContact CD-CE1 3.76Å; K371-F379 HydrophobicContact CD-CE2 3.9Å; K371-F379 HydrophobicContact CD-CG 3.95Å; K371-F379 HydrophobicContact CD-CZ 3.77Å
372	C	86.9	Confident	85.2	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	70.4	-179.3	-54.1	0	0	0	0	109.3	S369 S370 H374 G375 N376 C384 R394	S369-C372 PolarHBondContact O-N 2.04Å; S370-C372 VanDerWaalsContact C-N 3.32Å; C372-H374 PolarHBondContact O-N 2.04Å; C372-G375 PolarHBondContact O-N 3.45Å; C372-N376 PolarHBondContact O-N 3.09Å; C372-C384 WeakPolarHBondContact CA-SG 3.45Å; C372-C384 HydrophobicContact CB-CB 3.76Å; C372-C384 WeakPolarHBondContact CB-SG 3.31Å; C372-C384 VanDerWaalsContact SG-CA 3.52Å; C372-C384 WeakPolarHBondContact SG-CB 3.02Å; C372-C384 CovalentContact SG-SG 2.04Å; C372-C384 PolarHBondContact SG-SG 3.08Å; C372-R394 CarbonylContact C-O 3.55Å; C372-R394 WeakPolarHBondContact CA-O 3.31Å
373	H	84.3	Confident	85.5	Confident	84 Å²	84	71.7 Å²	71.7	39%	0.389	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	44.2	64.7	-178.1	-163.8	93.5	0	0	0	112.6	K371 G375 N376 R394 C395	K371-H373 PolarHBondContact O-N 3.46Å; H373-G375 PolarHBondContact O-N 3.02Å; H373-G375 VanDerWaalsContact O-N 3.13Å; H373-N376 HydrophobicContact CB-CB 4.42Å; H373-N376 PolarHBondContact O-N 2.76Å; H373-R394 WeakPolarHBondContact CB-O 3.48Å; H373-R394 PolarHBondContact N-O 3.26Å; H373-C395 HydrophobicContact CB-CB 4.28Å; H373-C395 WeakPolarHBondContact CB-O 3.06Å
374	H	83.6	Confident	85.7	Confident	169 Å²	169	65.2 Å²	65.2	78%	0.782	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	57.5	27.4	174.4	-59.7	-71.3	0	0	0	116	S370 C372	S370-H374 PolarHBondContact O-N 3.4Å; C372-H374 PolarHBondContact O-N 2.04Å
375	G	84.3	Confident	85.9	Confident	14 Å²	14	60.2 Å²	60.2	14%	0.144	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	111.1	9.2	174.6	0	0	0	0	0	115.1	S369 C372 H373 G377 H387	S369-G375 WeakPolarHBondContact O-CA 3.49Å; S369-G375 PolarHBondContact O-N 3.24Å; C372-G375 PolarHBondContact O-N 3.45Å; H373-G375 PolarHBondContact O-N 3.02Å; H373-G375 VanDerWaalsContact O-N 3.13Å; G375-G377 PolarHBondContact O-N 3.17Å; G375-H387 PolarHBondContact O-CE1 3.4Å; G375-H387 PolarHBondContact O-ND1 2.69Å
376	N	86.9	Confident	86	Confident	43 Å²	43	59.3 Å²	59.3	23%	0.23	35%	0.345	C	S	.	.	S	Bend	trans	-81.2	14.6	176.5	-70.2	-3.4	0	0	0	113.9	C372 H373 H387 H390 C395	C372-N376 PolarHBondContact O-N 3.09Å; H373-N376 HydrophobicContact CB-CB 4.42Å; H373-N376 PolarHBondContact O-N 2.76Å; N376-H387 PolarHBondContact O-N 3.37Å; N376-H390 HydrophobicContact CB-CB 4.34Å; N376-H390 PolarHBondContact ND2-CE1 3.25Å; N376-H390 PolarHBondContact ND2-ND1 3.33Å; N376-H390 PolarHBondContact ND2-NE2 3.14Å; N376-C395 HydrophobicContact CB-CB 4.1Å
377	G	88.3	Confident	86	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.7	168	174	0	0	0	0	0	113.1	N368 S369 G375 A385	N368-G377 CarbonylContact C-O 3.03Å; N368-G377 VanDerWaalsContact CA-O 3.31Å; N368-G377 WeakPolarHBondContact CA-O 3.44Å; N368-G377 PolarHBondContact N-O 2.99Å; S369-G377 PolarHBondContact N-O 3.19Å; G375-G377 PolarHBondContact O-N 3.17Å; G377-A385 CarbonylContact C-O 3.53Å; G377-A385 WeakPolarHBondContact CA-O 3.46Å
378	S	89.6	Confident	85.7	Confident	24 Å²	24	60.2 Å²	60.2	17%	0.168	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	136.8	171.3	-60.5	0	0	0	0	110.3	E366 A385	E366-S378 CarbonylContact O-C 3.6Å; E366-S378 WeakPolarHBondContact O-CA 3.23Å; S378-A385 PolarHBondContact N-O 3.44Å; S378-A385 PolarHBondContact O-N 3.26Å
379	F	87.5	Confident	85.1	Confident	48 Å²	48	56.8 Å²	56.8	21%	0.211	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	123.9	178.1	-174.1	-100.7	0	0	0	110.6	E366 K371 G382 V383	E366-F379 HydrophobicContact CB-CB 4.27Å; E366-F379 PolarHBondContact N-O 3.48Å; E366-F379 PolarHBondContact O-N 3.03Å; K371-F379 HydrophobicContact CB-CD2 4.12Å; K371-F379 HydrophobicContact CB-CE2 4.38Å; K371-F379 HydrophobicContact CD-CD1 3.85Å; K371-F379 HydrophobicContact CD-CD2 3.99Å; K371-F379 HydrophobicContact CD-CE1 3.76Å; K371-F379 HydrophobicContact CD-CE2 3.9Å; K371-F379 HydrophobicContact CD-CG 3.95Å; K371-F379 HydrophobicContact CD-CZ 3.77Å; F379-G382 VanDerWaalsContact CE2-C 3.43Å; F379-G382 WeakPolarHBondContact CE2-O 3.33Å; F379-G382 VanDerWaalsContact CZ-CA 3.44Å; F379-V383 WeakPolarHBondContact CA-O 3.4Å; F379-V383 WeakPolarHBondContact CD2-O 3.39Å
380	Q	87.9	Confident	84.7	Confident	66 Å²	66	60 Å²	60	31%	0.308	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	132.7	-179.8	-173.6	175.8	36.6	0	0	109.5	V365 G382 V383	V365-Q380 HydrophobicContact CG1-CB 4.4Å; V365-Q380 HydrophobicContact CG2-CB 4.44Å; V365-Q380 HydrophobicContact CG2-CG 3.99Å; Q380-G382 PolarHBondContact O-N 2.87Å; Q380-V383 PolarHBondContact N-O 3.05Å; Q380-V383 VanDerWaalsContact O-CG2 3.25Å; Q380-V383 WeakPolarHBondContact O-CG2 3.35Å; Q380-V383 PolarHBondContact O-N 2.87Å
381	C	83.3	Confident	84	Confident	60 Å²	60	59.8 Å²	59.8	41%	0.405	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.6	30.4	174.5	-65	0	0	0	0	116.1	C361 Q362	C361-C381 HydrophobicContact CB-CB 4.05Å; C361-C381 WeakPolarHBondContact CB-SG 3.46Å; C361-C381 WeakPolarHBondContact SG-CB 3.41Å; C361-C381 CovalentContact SG-SG 2.04Å; C361-C381 PolarHBondContact SG-SG 3.44Å; Q362-C381 VanDerWaalsContact CG-SG 3.58Å; Q362-C381 PolarHBondContact N-SG 3.13Å
382	G	82.6	Confident	83.4	Confident	52 Å²	52	55.6 Å²	55.6	54%	0.536	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	96.7	-7.5	179.2	0	0	0	0	0	115.8	F379 Q380	F379-G382 VanDerWaalsContact CE2-C 3.43Å; F379-G382 WeakPolarHBondContact CE2-O 3.33Å; F379-G382 VanDerWaalsContact CZ-CA 3.44Å; Q380-G382 PolarHBondContact O-N 2.87Å
383	V	85.5	Confident	82.9	Confident	101 Å²	101	60 Å²	60	61%	0.612	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-120.3	159.7	-177.7	-65.2	0	0	0	0	112.5	F379 Q380	F379-V383 WeakPolarHBondContact CA-O 3.4Å; F379-V383 WeakPolarHBondContact CD2-O 3.39Å; Q380-V383 PolarHBondContact N-O 3.05Å; Q380-V383 VanDerWaalsContact O-CG2 3.25Å; Q380-V383 WeakPolarHBondContact O-CG2 3.35Å; Q380-V383 PolarHBondContact O-N 2.87Å
384	C	86	Confident	82.8	Confident	27 Å²	27	64.1 Å²	64.1	18%	0.182	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.1	178.8	-74.7	0	0	0	0	111.8	C372	C372-C384 WeakPolarHBondContact CA-SG 3.45Å; C372-C384 HydrophobicContact CB-CB 3.76Å; C372-C384 WeakPolarHBondContact CB-SG 3.31Å; C372-C384 VanDerWaalsContact SG-CA 3.52Å; C372-C384 WeakPolarHBondContact SG-CB 3.02Å; C372-C384 CovalentContact SG-SG 2.04Å; C372-C384 PolarHBondContact SG-SG 3.08Å
385	A	87	Confident	82.8	Confident	60 Å²	60	56 Å²	56	50%	0.496	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	102.7	166.7	0	0	0	0	0	108.8	G377 S378	G377-A385 CarbonylContact C-O 3.53Å; G377-A385 WeakPolarHBondContact CA-O 3.46Å; S378-A385 PolarHBondContact N-O 3.44Å; S378-A385 PolarHBondContact O-N 3.26Å
386	C	84.9	Confident	82.6	Confident	45 Å²	45	59.4 Å²	59.4	30%	0.304	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	151.8	-172.2	-55.6	0	0	0	0	113.6	H390 C395	C386-H390 HydrophobicContact CB-CB 4.33Å; C386-H390 VanDerWaalsContact CB-O 3.27Å; C386-H390 WeakPolarHBondContact CB-O 3.08Å; C386-C395 WeakPolarHBondContact CA-SG 3.39Å; C386-C395 HydrophobicContact CB-CB 3.77Å; C386-C395 WeakPolarHBondContact CB-SG 3.45Å; C386-C395 WeakPolarHBondContact SG-CA 3.03Å; C386-C395 WeakPolarHBondContact SG-CB 3.28Å; C386-C395 CovalentContact SG-SG 2.03Å; C386-C395 PolarHBondContact SG-SG 3.05Å
387	H	85.1	Confident	82	Confident	57 Å²	57	58.1 Å²	58.1	26%	0.264	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-73.3	156.9	170.7	-60.9	158.5	0	0	0	111	N368 G375 N376 G389 H390	N368-H387 PolarHBondContact OD1-CE1 3.38Å; N368-H387 PolarHBondContact OD1-NE2 3.37Å; G375-H387 PolarHBondContact O-CE1 3.4Å; G375-H387 PolarHBondContact O-ND1 2.69Å; N376-H387 PolarHBondContact O-N 3.37Å; H387-G389 PolarHBondContact O-N 3.25Å; H387-H390 PolarHBondContact O-N 3.13Å
388	P	79.6	Confident	81.2	Confident	133 Å²	133	59.3 Å²	59.3	86%	0.864	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	133.6	175.7	-26.8	35.4	0	0	0	112.2
389	G	72.8	Confident	79.8	Confident	26 Å²	26	64.5 Å²	64.5	27%	0.268	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.6	-7.1	-176.4	0	0	0	0	0	115.6	H387	H387-G389 PolarHBondContact O-N 3.25Å
390	H	78.9	Confident	78.5	Confident	68 Å²	68	70.3 Å²	70.3	32%	0.315	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	142.9	175.9	-72.5	-72.2	0	0	0	112.9	N376 C386 H387 C395	N376-H390 HydrophobicContact CB-CB 4.34Å; N376-H390 PolarHBondContact ND2-CE1 3.25Å; N376-H390 PolarHBondContact ND2-ND1 3.33Å; N376-H390 PolarHBondContact ND2-NE2 3.14Å; C386-H390 HydrophobicContact CB-CB 4.33Å; C386-H390 VanDerWaalsContact CB-O 3.27Å; C386-H390 WeakPolarHBondContact CB-O 3.08Å; H387-H390 PolarHBondContact O-N 3.13Å; H390-C395 HydrophobicContact CB-CB 4.08Å
391	M	73.3	Confident	77.1	Confident	76 Å²	76	74.2 Å²	74.2	37%	0.374	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	160.3	-166.4	-70.6	-175.4	-176.2	0	0	112.1	C395 E396 C397 Y423	M391-C395 CarbonylContact O-C 2.86Å; M391-C395 WeakPolarHBondContact O-CA 3.48Å; M391-E396 PolarHBondContact O-N 3.37Å; M391-E396 VanDerWaalsContact O-N 3.12Å; M391-C397 HydrophobicContact CB-CB 4.35Å; M391-C397 PolarHBondContact N-O 2.99Å; M391-C397 PolarHBondContact O-N 3.45Å; M391-Y423 HydrophobicContact CB-CD1 3.71Å; M391-Y423 HydrophobicContact CB-CE1 3.59Å; M391-Y423 HydrophobicContact CG-CD1 4.33Å; M391-Y423 HydrophobicContact CG-CE1 3.83Å; M391-Y423 HydrophobicContact SD-CD1 4.16Å; M391-Y423 HydrophobicContact SD-CE1 3.76Å
392	G	73.5	Confident	75.9	Confident	14 Å²	14	76.4 Å²	76.4	14%	0.144	44%	0.437	C	S	.	.	S	Bend	trans	97.7	165	-176.9	0	0	0	0	0	113.9	R394 C395 E396	G392-R394 PolarHBondContact O-N 3Å; G392-C395 PolarHBondContact O-N 3.21Å; G392-E396 VanDerWaalsContact C-OE2 3.23Å; G392-E396 WeakPolarHBondContact CA-OE2 3.41Å
393	P	75.4	Confident	74.7	Confident	94 Å²	94	77.8 Å²	77.8	61%	0.61	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-13.8	-172	26.6	-36.3	0	0	0	114.7	E396	P393-E396 WeakPolarHBondContact CD-OE1 3.31Å; P393-E396 WeakPolarHBondContact CG-OE1 3.33Å
394	R	83.3	Confident	73.5	Confident	169 Å²	169	75.8 Å²	75.8	64%	0.638	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-127.6	12.3	172.7	-61.3	-171.5	179.5	-158.3	-0	113	C372 H373 G392 E396	C372-R394 CarbonylContact C-O 3.55Å; C372-R394 WeakPolarHBondContact CA-O 3.31Å; H373-R394 WeakPolarHBondContact CB-O 3.48Å; H373-R394 PolarHBondContact N-O 3.26Å; G392-R394 PolarHBondContact O-N 3Å; R394-E396 VanDerWaalsContact C-OE2 3.28Å; R394-E396 VanDerWaalsContact CA-OE2 3.32Å; R394-E396 WeakPolarHBondContact CA-OE2 3.44Å; R394-E396 PolarHBondContact N-OE2 2.94Å
395	C	83.4	Confident	72.5	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	45%	0.445	C	S	.	.	S	Bend	trans	67.8	31.3	-176.2	-41.3	0	0	0	0	114.2	H373 N376 C386 H390 M391 G392	H373-C395 HydrophobicContact CB-CB 4.28Å; H373-C395 WeakPolarHBondContact CB-O 3.06Å; N376-C395 HydrophobicContact CB-CB 4.1Å; C386-C395 WeakPolarHBondContact CA-SG 3.39Å; C386-C395 HydrophobicContact CB-CB 3.77Å; C386-C395 WeakPolarHBondContact CB-SG 3.45Å; C386-C395 WeakPolarHBondContact SG-CA 3.03Å; C386-C395 WeakPolarHBondContact SG-CB 3.28Å; C386-C395 CovalentContact SG-SG 2.03Å; C386-C395 PolarHBondContact SG-SG 3.05Å; H390-C395 HydrophobicContact CB-CB 4.08Å; M391-C395 CarbonylContact O-C 2.86Å; M391-C395 WeakPolarHBondContact O-CA 3.48Å; G392-C395 PolarHBondContact O-N 3.21Å
396	E	79.9	Confident	71.8	Confident	84 Å²	84	79.5 Å²	79.5	39%	0.393	44%	0.441	S	S	.	.			trans	-84.2	-24.6	-172.8	65.5	-92.3	-126.1	0	0	115.9	M391 G392 P393 R394	M391-E396 PolarHBondContact O-N 3.37Å; M391-E396 VanDerWaalsContact O-N 3.12Å; G392-E396 VanDerWaalsContact C-OE2 3.23Å; G392-E396 WeakPolarHBondContact CA-OE2 3.41Å; P393-E396 WeakPolarHBondContact CD-OE1 3.31Å; P393-E396 WeakPolarHBondContact CG-OE1 3.33Å; R394-E396 VanDerWaalsContact C-OE2 3.28Å; R394-E396 VanDerWaalsContact CA-OE2 3.32Å; R394-E396 WeakPolarHBondContact CA-OE2 3.44Å; R394-E396 PolarHBondContact N-OE2 2.94Å
397	C	74.9	Confident	71.6	Confident	17 Å²	17	77.4 Å²	77.4	12%	0.115	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	143.3	176.7	-58.8	0	0	0	0	109.4	M391 C424	M391-C397 HydrophobicContact CB-CB 4.35Å; M391-C397 PolarHBondContact N-O 2.99Å; M391-C397 PolarHBondContact O-N 3.45Å; C397-C424 WeakPolarHBondContact CB-SG 3.44Å; C397-C424 WeakPolarHBondContact SG-CB 3.35Å; C397-C424 CovalentContact SG-SG 2.06Å; C397-C424 PolarHBondContact SG-SG 3.33Å
398	G	70.1	Confident	71.6	Confident	24 Å²	24	77.2 Å²	77.2	25%	0.247	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	168.5	170.6	0	0	0	0	0	111.3	D400 M401	G398-D400 PolarHBondContact O-N 2.98Å; G398-D400 VanDerWaalsContact O-N 3.11Å; G398-M401 PolarHBondContact O-N 3.35Å
399	E	61.9	Low	71.7	Confident	133 Å²	133	75.2 Å²	75.2	62%	0.621	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-58.4	-26.3	-172.7	-64.3	-175.4	160.7	0	0	114.5	M401	E399-M401 PolarHBondContact O-N 2.86Å
400	D	59.6	Low	72.1	Confident	171 Å²	171	75.9 Å²	75.9	91%	0.914	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-73.2	-2.1	-176.3	-64.1	-39.6	0	0	0	115.5	G398	G398-D400 PolarHBondContact O-N 2.98Å; G398-D400 VanDerWaalsContact O-N 3.11Å
401	M	58.6	Low	72	Confident	147 Å²	147	78.1 Å²	78.1	72%	0.724	43%	0.428	S	S	*	.	G	3₁₀ helix	trans	-104.7	12	-172.7	-75.9	-81.9	179	0	0	114.8	G398 E399 S403	G398-M401 PolarHBondContact O-N 3.35Å; E399-M401 PolarHBondContact O-N 2.86Å; M401-S403 PolarHBondContact O-N 2.91Å
402	L	57	Low	72.3	Confident	107 Å²	107	82.1 Å²	82.1	56%	0.56	45%	0.451	S	S	*	.			trans	-85.2	107.4	-172.4	-90.2	71.9	0	0	0	114.1	T404	L402-T404 HydrophobicContact CB-CG2 4.31Å; L402-T404 HydrophobicContact CD2-CG2 3.89Å; L402-T404 HydrophobicContact CG-CG2 4.35Å
403	S	58	Low	72.7	Confident	81 Å²	81	85.6 Å²	85.6	57%	0.566	46%	0.463	S	S	*	.			trans	-102.3	89.6	150.2	-176.5	0	0	0	0	109.4	M401 D405 S406	M401-S403 PolarHBondContact O-N 2.91Å; S403-D405 PolarHBondContact O-N 2.9Å; S403-S406 PolarHBondContact O-N 2.98Å; S403-S406 PolarHBondContact O-OG 3.45Å
404	T	59.5	Low	73.1	Confident	59 Å²	59	84.9 Å²	84.9	36%	0.362	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-67.3	-13.3	-173.5	41.6	0	0	0	0	114.8	L402 S406 C407	L402-T404 HydrophobicContact CB-CG2 4.31Å; L402-T404 HydrophobicContact CD2-CG2 3.89Å; L402-T404 HydrophobicContact CG-CG2 4.35Å; T404-S406 VanDerWaalsContact C-N 3.28Å; T404-S406 PolarHBondContact O-N 3.17Å; T404-C407 PolarHBondContact O-N 2.97Å
405	D	65.3	Low	73.2	Confident	106 Å²	106	78.6 Å²	78.6	57%	0.567	44%	0.44	S	S	*	.	G	3₁₀ helix	trans	-73	-21.3	179.3	-66.4	-33	0	0	0	113.1	S403 C407 K408	S403-D405 PolarHBondContact O-N 2.9Å; D405-C407 PolarHBondContact O-N 3.47Å; D405-K408 PolarHBondContact O-N 2.72Å; D405-K408 IonicContact OD1-NZ 3.78Å; D405-K408 PolarHBondContact OD1-NZ 2.04Å
406	S	73.3	Confident	73.4	Confident	59 Å²	59	78.6 Å²	78.6	41%	0.413	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-68.2	-18	174.9	57.4	0	0	0	0	114.2	S403 T404 G425	S403-S406 PolarHBondContact O-N 2.98Å; S403-S406 PolarHBondContact O-OG 3.45Å; T404-S406 VanDerWaalsContact C-N 3.28Å; T404-S406 PolarHBondContact O-N 3.17Å; S406-G425 VanDerWaalsContact OG-CA 3.3Å; S406-G425 WeakPolarHBondContact OG-CA 3.14Å
407	C	80.1	Confident	73.8	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-105.8	13.5	-177.4	-71.5	0	0	0	0	113.4	T404 D405 S415 C416 C422	T404-C407 PolarHBondContact O-N 2.97Å; D405-C407 PolarHBondContact O-N 3.47Å; C407-S415 WeakPolarHBondContact CB-OG 3.41Å; C407-C416 PolarHBondContact O-N 3.38Å; C407-C422 HydrophobicContact CB-CB 3.5Å; C407-C422 WeakPolarHBondContact CB-SG 3.49Å; C407-C422 WeakPolarHBondContact SG-CB 3.44Å; C407-C422 CovalentContact SG-SG 2.03Å; C407-C422 PolarHBondContact SG-SG 2.99Å
408	K	84.5	Confident	74.4	Confident	54 Å²	54	77.6 Å²	77.6	24%	0.235	45%	0.451	C	S	.	.			trans	-110.8	136.3	178.6	-63.5	175.5	-172	164.1	0	110.9	D405	D405-K408 PolarHBondContact O-N 2.72Å; D405-K408 IonicContact OD1-NZ 3.78Å; D405-K408 PolarHBondContact OD1-NZ 2.04Å
409	E	81.6	Confident	75.3	Confident	91 Å²	91	80.3 Å²	80.3	43%	0.425	45%	0.454	S	S	.	.	S	Bend	trans	-69.3	-35.7	172.7	-177.5	175.3	-141.1	0	0	112.4	H413 Y441	E409-H413 IonicContact OE2-CE1 2.72Å; E409-H413 PolarHBondContact OE2-CE1 2.83Å; E409-H413 IonicContact OE2-ND1 2.58Å; E409-H413 PolarHBondContact OE2-ND1 3.35Å; E409-Y441 HydrophobicContact CB-CD2 3.68Å; E409-Y441 HydrophobicContact CB-CE2 4.18Å; E409-Y441 HydrophobicContact CB-CG 4.06Å; E409-Y441 HydrophobicContact CG-CD2 4.05Å; E409-Y441 HydrophobicContact CG-CE2 4.41Å
410	A	81.4	Confident	76.5	Confident	40 Å²	40	74.4 Å²	74.4	33%	0.331	43%	0.429	S	S	.	.	S	Bend	trans	-147.4	158.4	177	0	0	0	0	0	109.9	D412 H413	A410-D412 PolarHBondContact O-N 3.02Å; A410-H413 HydrophobicContact CB-CB 4.3Å; A410-H413 PolarHBondContact O-N 3.49Å
411	P	76.9	Confident	77.7	Confident	114 Å²	114	69.2 Å²	69.2	74%	0.74	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-35.5	-176	-26.5	35.6	0	0	0	114.5
412	D	79.9	Confident	78.7	Confident	161 Å²	161	63.3 Å²	63.3	86%	0.861	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	-3.6	179.8	-58.5	-44.4	0	0	0	113.4	A410	A410-D412 PolarHBondContact O-N 3.02Å
413	H	81.1	Confident	79.5	Confident	87 Å²	87	61.2 Å²	61.2	40%	0.403	36%	0.359	S	S	.	.	S	Bend	trans	-85.4	144.2	175.4	-94.3	-149.4	0	0	0	111.4	E409 A410	E409-H413 IonicContact OE2-CE1 2.72Å; E409-H413 PolarHBondContact OE2-CE1 2.83Å; E409-H413 IonicContact OE2-ND1 2.58Å; E409-H413 PolarHBondContact OE2-ND1 3.35Å; A410-H413 HydrophobicContact CB-CB 4.3Å; A410-H413 PolarHBondContact O-N 3.49Å
414	P	84.8	Confident	80.2	Confident	78 Å²	78	61.2 Å²	61.2	51%	0.506	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-65	149.4	172.9	27.7	-33.2	0	0	0	110.9	C416 S417	P414-C416 PolarHBondContact O-N 3.03Å; P414-S417 PolarHBondContact O-N 3.46Å; P414-S417 VanDerWaalsContact O-N 3.14Å
415	S	85.3	Confident	80.8	Confident	37 Å²	37	59.9 Å²	59.9	26%	0.259	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-55.5	133.2	175.1	-175.8	0	0	0	0	110.4	C407 S417 G418 C422	C407-S415 WeakPolarHBondContact CB-OG 3.41Å; S415-S417 PolarHBondContact O-N 3.28Å; S415-S417 VanDerWaalsContact O-N 3.13Å; S415-G418 PolarHBondContact O-N 2.98Å; S415-C422 WeakPolarHBondContact OG-CB 3.34Å
416	C	88.1	Confident	81.5	Confident	0 Å²	0	62 Å²	62	0%	0	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	48.9	36.9	-177.8	-50.9	0	0	0	0	113.6	C407 P414 G418 R419 G420 C427 Y441 C442	C407-C416 PolarHBondContact O-N 3.38Å; P414-C416 PolarHBondContact O-N 3.03Å; C416-G418 PolarHBondContact O-N 3.5Å; C416-R419 PolarHBondContact O-N 2.76Å; C416-G420 WeakPolarHBondContact CB-O 3.4Å; C416-C427 WeakPolarHBondContact CA-SG 3.02Å; C416-C427 HydrophobicContact CB-CB 3.73Å; C416-C427 WeakPolarHBondContact CB-SG 3.22Å; C416-C427 WeakPolarHBondContact SG-CA 3.48Å; C416-C427 WeakPolarHBondContact SG-CB 3.21Å; C416-C427 CovalentContact SG-SG 2.04Å; C416-C427 PolarHBondContact SG-SG 3.11Å; C416-Y441 CarbonylContact C-O 3.57Å; C416-Y441 WeakPolarHBondContact CA-O 3.48Å; C416-C442 HydrophobicContact CB-CB 4.5Å
417	S	88.7	Confident	82	Confident	24 Å²	24	60.2 Å²	60.2	17%	0.168	35%	0.35	C	S	.	.	G	3₁₀ helix	trans	51.9	20.6	-175.9	-60.9	0	0	0	0	114.3	P414 S415 R419 Y441 Q443	P414-S417 PolarHBondContact O-N 3.46Å; P414-S417 VanDerWaalsContact O-N 3.14Å; S415-S417 PolarHBondContact O-N 3.28Å; S415-S417 VanDerWaalsContact O-N 3.13Å; S417-R419 PolarHBondContact O-N 3.1Å; S417-Y441 PolarHBondContact N-O 3.38Å; S417-Y441 PolarHBondContact OG-O 2.64Å; S417-Q443 WeakPolarHBondContact OG-CB 3.23Å
418	G	87.3	Confident	82.3	Confident	56 Å²	56	64.5 Å²	64.5	58%	0.577	37%	0.372	S	S	*	.	G	3₁₀ helix	trans	66.3	14.2	-172.1	0	0	0	0	0	115.1	S415 C416	S415-G418 PolarHBondContact O-N 2.98Å; C416-G418 PolarHBondContact O-N 3.5Å
419	R	89.3	Confident	82.4	Confident	82 Å²	82	63.4 Å²	63.4	31%	0.309	37%	0.371	S	S	.	.	S	Bend	trans	-123.7	19.5	-174	-69.4	-172.3	-75	-179.6	-2	113.3	C416 S417 H430 I437 C442 Q443 D445	C416-R419 PolarHBondContact O-N 2.76Å; S417-R419 PolarHBondContact O-N 3.1Å; R419-H430 PolarHBondContact O-N 3.41Å; R419-I437 HydrophobicContact CB-CD1 4.16Å; R419-I437 HydrophobicContact CB-CG2 4.13Å; R419-C442 HydrophobicContact CB-CB 4.39Å; R419-C442 PolarHBondContact NE-O 3.36Å; R419-Q443 VanDerWaalsContact NH2-C 3.34Å; R419-Q443 PolarHBondContact NH2-O 2.75Å; R419-D445 IonicContact CZ-OD2 3.06Å; R419-D445 IonicContact NH1-OD2 3.46Å; R419-D445 PolarHBondContact NH1-OD2 2.71Å
420	G	86.9	Confident	82.6	Confident	8 Å²	8	63 Å²	63	8%	0.082	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-170.4	168.4	177.9	0	0	0	0	0	110.7	C416 I428	C416-G420 WeakPolarHBondContact CB-O 3.4Å; G420-I428 CarbonylContact C-O 3.57Å; G420-I428 WeakPolarHBondContact CA-O 3.31Å
421	D	84.3	Confident	82.6	Confident	63 Å²	63	69.3 Å²	69.3	34%	0.337	40%	0.396	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	137.9	176.1	-62.1	-45.2	0	0	0	110.2	Y423 I428 H430	D421-Y423 HydrophobicContact CB-CD2 4.03Å; D421-Y423 HydrophobicContact CB-CE1 4.04Å; D421-Y423 HydrophobicContact CB-CE2 3.4Å; D421-Y423 WeakPolarHBondContact CB-OH 3.42Å; D421-Y423 PolarHBondContact O-N 3.09Å; D421-Y423 PolarHBondContact OD2-OH 2.91Å; D421-I428 PolarHBondContact N-O 3.37Å; D421-I428 PolarHBondContact O-N 3.43Å; D421-H430 IonicContact OD1-CE1 2.78Å; D421-H430 IonicContact OD1-NE2 3.98Å; D421-H430 PolarHBondContact OD1-NE2 2.8Å; D421-H430 VanDerWaalsContact OD1-NE2 3.12Å; D421-H430 IonicContact OD2-CD2 3.7Å; D421-H430 IonicContact OD2-NE2 3.12Å; D421-H430 PolarHBondContact OD2-NE2 2.94Å
422	C	80.2	Confident	82.8	Confident	23 Å²	23	65.1 Å²	65.1	16%	0.155	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	101.3	173.6	179.8	0	0	0	0	109.5	C407 S415	C407-C422 HydrophobicContact CB-CB 3.5Å; C407-C422 WeakPolarHBondContact CB-SG 3.49Å; C407-C422 WeakPolarHBondContact SG-CB 3.44Å; C407-C422 CovalentContact SG-SG 2.03Å; C407-C422 PolarHBondContact SG-SG 2.99Å; S415-C422 WeakPolarHBondContact OG-CB 3.34Å
423	Y	74.1	Confident	82.7	Confident	62 Å²	62	63.1 Å²	63.1	24%	0.243	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	117.8	175.1	-63.5	-59.7	0	0	0	110	M391 D421 G425 Q426 I428	M391-Y423 HydrophobicContact CB-CD1 3.71Å; M391-Y423 HydrophobicContact CB-CE1 3.59Å; M391-Y423 HydrophobicContact CG-CD1 4.33Å; M391-Y423 HydrophobicContact CG-CE1 3.83Å; M391-Y423 HydrophobicContact SD-CD1 4.16Å; M391-Y423 HydrophobicContact SD-CE1 3.76Å; D421-Y423 HydrophobicContact CB-CD2 4.03Å; D421-Y423 HydrophobicContact CB-CE1 4.04Å; D421-Y423 HydrophobicContact CB-CE2 3.4Å; D421-Y423 WeakPolarHBondContact CB-OH 3.42Å; D421-Y423 PolarHBondContact O-N 3.09Å; D421-Y423 PolarHBondContact OD2-OH 2.91Å; Y423-G425 PolarHBondContact O-N 3.43Å; Y423-Q426 PolarHBondContact N-O 3.3Å; Y423-Q426 PolarHBondContact O-N 3.32Å; Y423-I428 HydrophobicContact CD2-CB 3.88Å; Y423-I428 HydrophobicContact CD2-CD1 3.71Å; Y423-I428 HydrophobicContact CD2-CG1 3.84Å; Y423-I428 HydrophobicContact CE2-CB 4.22Å; Y423-I428 HydrophobicContact CE2-CD1 4.46Å
424	C	72.6	Confident	82.6	Confident	82 Å²	82	67.5 Å²	67.5	55%	0.554	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.8	37.9	173.7	-80	0	0	0	0	113.9	C397	C397-C424 WeakPolarHBondContact CB-SG 3.44Å; C397-C424 WeakPolarHBondContact SG-CB 3.35Å; C397-C424 CovalentContact SG-SG 2.06Å; C397-C424 PolarHBondContact SG-SG 3.33Å
425	G	72.3	Confident	82.6	Confident	30 Å²	30	64.9 Å²	64.9	31%	0.309	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.4	11.3	176.3	0	0	0	0	0	116.2	S406 Y423	S406-G425 VanDerWaalsContact OG-CA 3.3Å; S406-G425 WeakPolarHBondContact OG-CA 3.14Å; Y423-G425 PolarHBondContact O-N 3.43Å
426	Q	78.5	Confident	82.6	Confident	150 Å²	150	68.1 Å²	68.1	70%	0.701	38%	0.381	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.8	142.4	172.6	-65.6	-176.7	-13.2	0	0	110.6	Y423	Y423-Q426 PolarHBondContact N-O 3.3Å; Y423-Q426 PolarHBondContact O-N 3.32Å
427	C	85	Confident	82.8	Confident	23 Å²	23	69.4 Å²	69.4	16%	0.155	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	123.1	175.1	-70.8	0	0	0	0	111.2	C416	C416-C427 WeakPolarHBondContact CA-SG 3.02Å; C416-C427 HydrophobicContact CB-CB 3.73Å; C416-C427 WeakPolarHBondContact CB-SG 3.22Å; C416-C427 WeakPolarHBondContact SG-CA 3.48Å; C416-C427 WeakPolarHBondContact SG-CB 3.21Å; C416-C427 CovalentContact SG-SG 2.04Å; C416-C427 PolarHBondContact SG-SG 3.11Å
428	I	84.8	Confident	82.7	Confident	90 Å²	90	72 Å²	72	46%	0.462	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112.1	165	-57.9	-169.4	0	0	0	107.3	G420 D421 Y423	G420-I428 CarbonylContact C-O 3.57Å; G420-I428 WeakPolarHBondContact CA-O 3.31Å; D421-I428 PolarHBondContact N-O 3.37Å; D421-I428 PolarHBondContact O-N 3.43Å; Y423-I428 HydrophobicContact CD2-CB 3.88Å; Y423-I428 HydrophobicContact CD2-CD1 3.71Å; Y423-I428 HydrophobicContact CD2-CG1 3.84Å; Y423-I428 HydrophobicContact CE2-CB 4.22Å; Y423-I428 HydrophobicContact CE2-CD1 4.46Å
429	C	87.4	Confident	82.8	Confident	31 Å²	31	70.7 Å²	70.7	21%	0.209	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.7	142.4	-176	-49.1	0	0	0	0	111.3	I437 C442	C429-I437 HydrophobicContact CB-CB 4Å; C429-I437 HydrophobicContact CB-CG2 3.94Å; C429-I437 WeakPolarHBondContact CB-O 3.47Å; C429-C442 WeakPolarHBondContact CA-SG 3.32Å; C429-C442 HydrophobicContact CB-CB 3.8Å; C429-C442 WeakPolarHBondContact CB-SG 3.35Å; C429-C442 PolarHBondContact N-SG 2.84Å; C429-C442 VanDerWaalsContact N-SG 3.39Å; C429-C442 WeakPolarHBondContact SG-CA 3.48Å; C429-C442 WeakPolarHBondContact SG-CB 3.33Å; C429-C442 CovalentContact SG-SG 2.04Å; C429-C442 PolarHBondContact SG-SG 2.73Å
430	H	86.4	Confident	82.6	Confident	83 Å²	83	71.1 Å²	71.1	38%	0.384	39%	0.394	S	S	.	.	P	Polyproline II helix	trans	-67.2	139.2	178.2	-66.4	154.6	0	0	0	110.3	R419 D421 S432	R419-H430 PolarHBondContact O-N 3.41Å; D421-H430 IonicContact OD1-CE1 2.78Å; D421-H430 IonicContact OD1-NE2 3.98Å; D421-H430 PolarHBondContact OD1-NE2 2.8Å; D421-H430 VanDerWaalsContact OD1-NE2 3.12Å; D421-H430 IonicContact OD2-CD2 3.7Å; D421-H430 IonicContact OD2-NE2 3.12Å; D421-H430 PolarHBondContact OD2-NE2 2.94Å; H430-S432 PolarHBondContact O-N 2.93Å
431	L	81.6	Confident	82.7	Confident	172 Å²	172	74.2 Å²	74.2	90%	0.901	40%	0.404	S	S	*	.	P	Polyproline II helix	trans	-67	119.9	169.7	-66.5	173.7	0	0	0	108.5
432	S	80.3	Confident	83	Confident	26 Å²	26	71.2 Å²	71.2	18%	0.182	39%	0.388	C	S	.	.	B	Isolated β-bridge	trans	-99.6	134.7	176.2	170.2	0	0	0	0	109.7	H430 Y434 G435 F447	H430-S432 PolarHBondContact O-N 2.93Å; S432-Y434 PolarHBondContact O-N 3.47Å; S432-Y434 VanDerWaalsContact O-N 3.16Å; S432-Y434 PolarHBondContact OG-N 3.14Å; S432-Y434 VanDerWaalsContact OG-N 3.15Å; S432-G435 WeakPolarHBondContact CB-O 3.39Å; S432-G435 PolarHBondContact O-N 2.94Å; S432-F447 WeakPolarHBondContact OG-CZ 3.35Å
433	P	77.9	Confident	83.5	Confident	119 Å²	119	72.4 Å²	72.4	77%	0.773	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.2	172.6	30.7	-35.6	0	0	0	112.5
434	Y	78.8	Confident	84.4	Confident	179 Å²	179	70.3 Å²	70.3	70%	0.702	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-12.6	179.9	-52.9	-69.3	0	0	0	113.6	S432 F447	S432-Y434 PolarHBondContact O-N 3.47Å; S432-Y434 VanDerWaalsContact O-N 3.16Å; S432-Y434 PolarHBondContact OG-N 3.14Å; S432-Y434 VanDerWaalsContact OG-N 3.15Å; Y434-F447 WeakPolarHBondContact O-CB 3.49Å
435	G	84.3	Confident	85.3	Confident	22 Å²	22	66.8 Å²	66.8	23%	0.227	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	151.1	-158.2	179.7	0	0	0	0	0	113.1	S432	S432-G435 WeakPolarHBondContact CB-O 3.39Å; S432-G435 PolarHBondContact O-N 2.94Å
436	N	87.1	Confident	86.2	Confident	106 Å²	106	68 Å²	68	57%	0.567	36%	0.36	S	S	*	.			trans	-97.5	132.8	-175.3	-65.1	-30.5	0	0	0	111.3	D445 N446	N436-D445 VanDerWaalsContact O-CA 3.31Å; N436-D445 WeakPolarHBondContact O-CA 3.33Å; N436-N446 PolarHBondContact N-OD1 2.76Å; N436-N446 PolarHBondContact O-N 3.27Å; N436-N446 PolarHBondContact O-OD1 3.02Å
437	I	90.6	Very high	86.7	Confident	26 Å²	26	62.4 Å²	62.4	13%	0.133	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.7	167	-53.6	-179.6	0	0	0	107.4	R419 C429 C442 C444 D445 F447	R419-I437 HydrophobicContact CB-CD1 4.16Å; R419-I437 HydrophobicContact CB-CG2 4.13Å; C429-I437 HydrophobicContact CB-CB 4Å; C429-I437 HydrophobicContact CB-CG2 3.94Å; C429-I437 WeakPolarHBondContact CB-O 3.47Å; I437-C442 HydrophobicContact CG2-CB 3.88Å; I437-C444 WeakPolarHBondContact CA-O 3.26Å; I437-C444 WeakPolarHBondContact CG2-O 3.49Å; I437-D445 HydrophobicContact CG1-CB 4.27Å; I437-F447 HydrophobicContact CD1-CE1 4.49Å; I437-F447 HydrophobicContact CD1-CZ 4.08Å; I437-F447 HydrophobicContact CG1-CE1 3.74Å; I437-F447 HydrophobicContact CG1-CZ 3.78Å
438	Y	88.1	Confident	87	Confident	78 Å²	78	64.8 Å²	64.8	31%	0.306	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	178.8	-171.3	61.9	-82.2	0	0	0	112.7	C442 Q443 C444 N446 D464 C465	Y438-C442 CarbonylContact O-C 3.59Å; Y438-C442 WeakPolarHBondContact O-CA 3.48Å; Y438-Q443 PolarHBondContact O-N 3.06Å; Y438-C444 HydrophobicContact CD1-CB 4.34Å; Y438-C444 HydrophobicContact CD2-CB 3.8Å; Y438-C444 HydrophobicContact CE1-CB 4.09Å; Y438-C444 HydrophobicContact CE2-CB 3.53Å; Y438-C444 HydrophobicContact CG-CB 4.2Å; Y438-C444 PolarHBondContact N-O 3.27Å; Y438-C444 PolarHBondContact O-N 3.23Å; Y438-C444 VanDerWaalsContact O-O 3.13Å; Y438-N446 HydrophobicContact CE1-CB 4.25Å; Y438-D464 PolarHBondContact OH-OD1 2.93Å; Y438-C465 PolarHBondContact OH-N 2.89Å
439	G	88	Confident	87.3	Confident	29 Å²	29	60.9 Å²	60.9	30%	0.299	33%	0.331	S	S	.	.	S	Bend	trans	97.4	159.7	-173	0	0	0	0	0	112.3	Y441 C442	G439-Y441 PolarHBondContact O-N 2.81Å; G439-Y441 VanDerWaalsContact O-N 3.1Å; G439-C442 PolarHBondContact O-N 2.94Å; G439-C442 VanDerWaalsContact O-N 3.1Å
440	P	84.9	Confident	87.5	Confident	91 Å²	91	61.5 Å²	61.5	59%	0.591	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-22.2	-174.4	24.5	-35.8	0	0	0	114.2
441	Y	89.8	Confident	87.7	Confident	73 Å²	73	64 Å²	64	29%	0.286	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-123	18.8	177.8	-51.2	-65.5	0	0	0	112.1	E409 C416 S417 G439 Q443	E409-Y441 HydrophobicContact CB-CD2 3.68Å; E409-Y441 HydrophobicContact CB-CE2 4.18Å; E409-Y441 HydrophobicContact CB-CG 4.06Å; E409-Y441 HydrophobicContact CG-CD2 4.05Å; E409-Y441 HydrophobicContact CG-CE2 4.41Å; C416-Y441 CarbonylContact C-O 3.57Å; C416-Y441 WeakPolarHBondContact CA-O 3.48Å; S417-Y441 PolarHBondContact N-O 3.38Å; S417-Y441 PolarHBondContact OG-O 2.64Å; G439-Y441 PolarHBondContact O-N 2.81Å; G439-Y441 VanDerWaalsContact O-N 3.1Å; Y441-Q443 PolarHBondContact O-N 2.89Å
442	C	91.2	Very high	88	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	S	Bend	trans	56.5	33.3	-176.6	-52.1	0	0	0	0	113.8	C416 R419 C429 I437 Y438 G439	C416-C442 HydrophobicContact CB-CB 4.5Å; R419-C442 HydrophobicContact CB-CB 4.39Å; R419-C442 PolarHBondContact NE-O 3.36Å; C429-C442 WeakPolarHBondContact CA-SG 3.32Å; C429-C442 HydrophobicContact CB-CB 3.8Å; C429-C442 WeakPolarHBondContact CB-SG 3.35Å; C429-C442 PolarHBondContact N-SG 2.84Å; C429-C442 VanDerWaalsContact N-SG 3.39Å; C429-C442 WeakPolarHBondContact SG-CA 3.48Å; C429-C442 WeakPolarHBondContact SG-CB 3.33Å; C429-C442 CovalentContact SG-SG 2.04Å; C429-C442 PolarHBondContact SG-SG 2.73Å; I437-C442 HydrophobicContact CG2-CB 3.88Å; Y438-C442 CarbonylContact O-C 3.59Å; Y438-C442 WeakPolarHBondContact O-CA 3.48Å; G439-C442 PolarHBondContact O-N 2.94Å; G439-C442 VanDerWaalsContact O-N 3.1Å
443	Q	90.3	Very high	88.3	Confident	48 Å²	48	66.7 Å²	66.7	22%	0.224	34%	0.342	C	S	.	.			trans	-85.2	-19.9	-176.2	75.7	-85.3	34	0	0	113.8	S417 R419 Y438 Y441	S417-Q443 WeakPolarHBondContact OG-CB 3.23Å; R419-Q443 VanDerWaalsContact NH2-C 3.34Å; R419-Q443 PolarHBondContact NH2-O 2.75Å; Y438-Q443 PolarHBondContact O-N 3.06Å; Y441-Q443 PolarHBondContact O-N 2.89Å
444	C	93.1	Very high	88.7	Confident	18 Å²	18	63.4 Å²	63.4	12%	0.122	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	151.5	178.9	-66.3	0	0	0	0	111.7	I437 Y438 C465	I437-C444 WeakPolarHBondContact CA-O 3.26Å; I437-C444 WeakPolarHBondContact CG2-O 3.49Å; Y438-C444 HydrophobicContact CD1-CB 4.34Å; Y438-C444 HydrophobicContact CD2-CB 3.8Å; Y438-C444 HydrophobicContact CE1-CB 4.09Å; Y438-C444 HydrophobicContact CE2-CB 3.53Å; Y438-C444 HydrophobicContact CG-CB 4.2Å; Y438-C444 PolarHBondContact N-O 3.27Å; Y438-C444 PolarHBondContact O-N 3.23Å; Y438-C444 VanDerWaalsContact O-O 3.13Å; C444-C465 WeakPolarHBondContact CA-SG 3.3Å; C444-C465 HydrophobicContact CB-CB 3.66Å; C444-C465 WeakPolarHBondContact CB-SG 3.28Å; C444-C465 WeakPolarHBondContact SG-CB 3.41Å; C444-C465 CovalentContact SG-SG 2.04Å; C444-C465 PolarHBondContact SG-SG 3.24Å
445	D	91.9	Very high	89.2	Confident	8 Å²	8	59.8 Å²	59.8	4%	0.043	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	162.8	168.9	68.6	80.7	0	0	0	110.5	R419 N436 I437 F447 S448 C465	R419-D445 IonicContact CZ-OD2 3.06Å; R419-D445 IonicContact NH1-OD2 3.46Å; R419-D445 PolarHBondContact NH1-OD2 2.71Å; N436-D445 VanDerWaalsContact O-CA 3.31Å; N436-D445 WeakPolarHBondContact O-CA 3.33Å; I437-D445 HydrophobicContact CG1-CB 4.27Å; D445-F447 HydrophobicContact CB-CD1 4.03Å; D445-F447 HydrophobicContact CB-CE1 3.68Å; D445-F447 HydrophobicContact CB-CE2 4.33Å; D445-F447 HydrophobicContact CB-CZ 3.84Å; D445-F447 PolarHBondContact OD1-N 3.08Å; D445-F447 VanDerWaalsContact OD1-N 3.08Å; D445-S448 WeakPolarHBondContact OD1-CB 3.43Å; D445-S448 PolarHBondContact OD1-N 2.89Å; D445-S448 PolarHBondContact OD1-OG 3.5Å; D445-S448 PolarHBondContact OD2-OG 3.27Å; D445-S448 VanDerWaalsContact OD2-OG 3.06Å; D445-C465 PolarHBondContact O-N 3.27Å
446	N	90.4	Very high	89.5	Confident	56 Å²	56	60.8 Å²	60.8	30%	0.299	32%	0.322	S	S	.	.	S	Bend	trans	-106.3	22.6	-177.8	72.7	-12.7	0	0	0	113.6	N436 Y438 L456 C463	N436-N446 PolarHBondContact N-OD1 2.76Å; N436-N446 PolarHBondContact O-N 3.27Å; N436-N446 PolarHBondContact O-OD1 3.02Å; Y438-N446 HydrophobicContact CE1-CB 4.25Å; N446-L456 WeakPolarHBondContact O-CD2 3.47Å; N446-C463 WeakPolarHBondContact CB-O 3.19Å; N446-C463 WeakPolarHBondContact O-CB 3.32Å
447	F	89.9	Confident	89.7	Confident	32 Å²	32	55.8 Å²	55.8	14%	0.14	30%	0.295	C	S	.	.	S	Bend	trans	-135.9	-9.9	-174.1	56.2	-102.6	0	0	0	115.8	S432 Y434 I437 D445 L456	S432-F447 WeakPolarHBondContact OG-CZ 3.35Å; Y434-F447 WeakPolarHBondContact O-CB 3.49Å; I437-F447 HydrophobicContact CD1-CE1 4.49Å; I437-F447 HydrophobicContact CD1-CZ 4.08Å; I437-F447 HydrophobicContact CG1-CE1 3.74Å; I437-F447 HydrophobicContact CG1-CZ 3.78Å; D445-F447 HydrophobicContact CB-CD1 4.03Å; D445-F447 HydrophobicContact CB-CE1 3.68Å; D445-F447 HydrophobicContact CB-CE2 4.33Å; D445-F447 HydrophobicContact CB-CZ 3.84Å; D445-F447 PolarHBondContact OD1-N 3.08Å; D445-F447 VanDerWaalsContact OD1-N 3.08Å; F447-L456 WeakPolarHBondContact O-CD1 3.38Å
448	S	90.3	Very high	89.5	Confident	74 Å²	74	55 Å²	55	52%	0.517	29%	0.293	S	S	.	.			trans	-92.4	0.7	-178.9	-53.9	0	0	0	0	114.8	D445	D445-S448 WeakPolarHBondContact OD1-CB 3.43Å; D445-S448 PolarHBondContact OD1-N 2.89Å; D445-S448 PolarHBondContact OD1-OG 3.5Å; D445-S448 PolarHBondContact OD2-OG 3.27Å; D445-S448 VanDerWaalsContact OD2-OG 3.06Å
449	C	91.9	Very high	89.6	Confident	7 Å²	7	53 Å²	53	5%	0.047	30%	0.296	C	S	.	.	S	Bend	trans	-63.6	167	174.3	-57.3	0	0	0	0	112.8	L456 C463 G466 E467	C449-L456 HydrophobicContact CB-CD1 3.96Å; C449-L456 VanDerWaalsContact O-CD1 3.24Å; C449-L456 WeakPolarHBondContact O-CD1 3.28Å; C449-C463 HydrophobicContact CB-CB 3.75Å; C449-C463 WeakPolarHBondContact CB-SG 3.29Å; C449-C463 PolarHBondContact N-SG 3.43Å; C449-C463 VanDerWaalsContact N-SG 3.44Å; C449-C463 WeakPolarHBondContact SG-CA 3.31Å; C449-C463 WeakPolarHBondContact SG-CB 3.36Å; C449-C463 CovalentContact SG-SG 2.02Å; C449-C463 PolarHBondContact SG-SG 2.89Å; C449-G466 VanDerWaalsContact SG-CA 3.57Å; C449-E467 PolarHBondContact SG-O 3.46Å
450	V	91.4	Very high	89.8	Confident	44 Å²	44	53.5 Å²	53.5	27%	0.267	29%	0.292	S	S	.	.			trans	-59.7	148.8	-179.2	-62.9	0	0	0	0	113.2	C457 E477 Y478	V450-C457 PolarHBondContact O-N 2.93Å; V450-E477 HydrophobicContact CG2-CG 4.45Å; V450-E477 WeakPolarHBondContact CG2-O 3.23Å; V450-Y478 HydrophobicContact CB-CD1 3.84Å; V450-Y478 HydrophobicContact CB-CE1 3.62Å; V450-Y478 HydrophobicContact CG1-CE1 4.3Å; V450-Y478 HydrophobicContact CG2-CD1 3.7Å; V450-Y478 HydrophobicContact CG2-CD2 4.39Å; V450-Y478 HydrophobicContact CG2-CE1 3.94Å; V450-Y478 HydrophobicContact CG2-CG 3.94Å
451	R	90.9	Very high	90	Very high	136 Å²	136	49.6 Å²	49.6	51%	0.513	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	138.5	-178.2	-68.5	-179.2	178.1	-110.2	-0.9	111.6	G454 L455 L456	R451-G454 PolarHBondContact NH1-O 2.97Å; R451-L455 CarbonylContact C-O 3.58Å; R451-L455 VanDerWaalsContact CA-O 3.24Å; R451-L455 WeakPolarHBondContact CA-O 3.36Å; R451-L456 HydrophobicContact CG-CD1 4.21Å
452	H	87.6	Confident	90.1	Very high	65 Å²	65	50.1 Å²	50.1	30%	0.301	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	121.5	173.5	177.1	-99.6	0	0	0	109.2	G454 L455 Y478 N480	H452-G454 PolarHBondContact O-N 3.22Å; H452-L455 PolarHBondContact N-O 2.99Å; H452-L455 PolarHBondContact O-N 2.89Å; H452-L455 VanDerWaalsContact O-N 3.14Å; H452-Y478 HydrophobicContact CB-CD1 4.08Å; H452-N480 HydrophobicContact CB-CB 4.32Å; H452-N480 PolarHBondContact CD2-ND2 2.94Å; H452-N480 VanDerWaalsContact CD2-ND2 3.32Å; H452-N480 PolarHBondContact NE2-ND2 3.06Å; H452-N480 VanDerWaalsContact NE2-ND2 3.19Å
453	K	86.8	Confident	90.1	Very high	189 Å²	189	50.9 Å²	50.9	82%	0.822	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.3	38.9	-172.3	-59.4	-176.4	176.4	-174.3	0	113.5	L455	K453-L455 VanDerWaalsContact C-N 3.25Å; K453-L455 PolarHBondContact O-N 3.49Å
454	G	84.9	Confident	90.1	Very high	50 Å²	50	52.8 Å²	52.8	52%	0.515	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	84.3	-22	-179.2	0	0	0	0	0	115.4	R451 H452	R451-G454 PolarHBondContact NH1-O 2.97Å; H452-G454 PolarHBondContact O-N 3.22Å
455	L	89.4	Confident	90	Very high	103 Å²	103	54.9 Å²	54.9	54%	0.539	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	133	178.8	-61	175.6	0	0	0	111.5	R451 H452 K453 G458	R451-L455 CarbonylContact C-O 3.58Å; R451-L455 VanDerWaalsContact CA-O 3.24Å; R451-L455 WeakPolarHBondContact CA-O 3.36Å; H452-L455 PolarHBondContact N-O 2.99Å; H452-L455 PolarHBondContact O-N 2.89Å; H452-L455 VanDerWaalsContact O-N 3.14Å; K453-L455 VanDerWaalsContact C-N 3.25Å; K453-L455 PolarHBondContact O-N 3.49Å; L455-G458 PolarHBondContact O-N 3.06Å
456	L	90.3	Very high	89.8	Confident	44 Å²	44	56.5 Å²	56.5	23%	0.23	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	130.2	172.7	-169.8	71.6	0	0	0	109.9	N446 F447 C449 R451 G458 G459 C463	N446-L456 WeakPolarHBondContact O-CD2 3.47Å; F447-L456 WeakPolarHBondContact O-CD1 3.38Å; C449-L456 HydrophobicContact CB-CD1 3.96Å; C449-L456 VanDerWaalsContact O-CD1 3.24Å; C449-L456 WeakPolarHBondContact O-CD1 3.28Å; R451-L456 HydrophobicContact CG-CD1 4.21Å; L456-G458 PolarHBondContact O-N 3.5Å; L456-G459 PolarHBondContact O-N 2.83Å; L456-C463 HydrophobicContact CD2-CB 3.78Å; L456-C463 HydrophobicContact CG-CB 4.23Å
457	C	91.8	Very high	89.8	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	46.4	37.8	-175.9	-55.5	0	0	0	0	113.2	V450 G459 N460 G461 C468 Y478 C479	V450-C457 PolarHBondContact O-N 2.93Å; C457-G459 PolarHBondContact O-N 3.38Å; C457-N460 PolarHBondContact O-N 2.87Å; C457-G461 WeakPolarHBondContact CB-O 3.4Å; C457-G461 PolarHBondContact O-N 3.37Å; C457-C468 WeakPolarHBondContact CA-SG 3.42Å; C457-C468 HydrophobicContact CB-CB 3.72Å; C457-C468 WeakPolarHBondContact CB-SG 3.39Å; C457-C468 VanDerWaalsContact SG-CA 3.51Å; C457-C468 WeakPolarHBondContact SG-CB 3.41Å; C457-C468 CovalentContact SG-SG 2.04Å; C457-C468 PolarHBondContact SG-SG 2.95Å; C457-Y478 CarbonylContact C-O 3.34Å; C457-C479 WeakPolarHBondContact O-CB 3.5Å
458	G	87.6	Confident	90	Very high	9 Å²	9	60.8 Å²	60.8	9%	0.093	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	62.9	5	-179	0	0	0	0	0	115.8	L455 L456 N460 Y478	L455-G458 PolarHBondContact O-N 3.06Å; L456-G458 PolarHBondContact O-N 3.5Å; G458-N460 VanDerWaalsContact C-N 3.3Å; G458-N460 PolarHBondContact O-ND2 3.38Å; G458-Y478 PolarHBondContact N-O 3.17Å; G458-Y478 VanDerWaalsContact N-O 3.13Å
459	G	90.1	Very high	90.1	Very high	36 Å²	36	61.3 Å²	61.3	37%	0.371	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	83.9	-6.6	-169.3	0	0	0	0	0	114.9	L456 C457 R471	L456-G459 PolarHBondContact O-N 2.83Å; C457-G459 PolarHBondContact O-N 3.38Å; G459-R471 PolarHBondContact O-NH1 2.91Å
460	N	91.2	Very high	90.1	Very high	41 Å²	41	62.9 Å²	62.9	22%	0.219	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.2	6	-171	-50.2	-58.3	0	0	0	114.2	C457 G458 R471 W474 C479	C457-N460 PolarHBondContact O-N 2.87Å; G458-N460 VanDerWaalsContact C-N 3.3Å; G458-N460 PolarHBondContact O-ND2 3.38Å; N460-R471 VanDerWaalsContact O-CB 3.28Å; N460-R471 WeakPolarHBondContact O-CB 3.32Å; N460-R471 WeakPolarHBondContact O-CG 3.5Å; N460-R471 PolarHBondContact O-N 3.3Å; N460-W474 HydrophobicContact CB-CB 4.16Å; N460-W474 HydrophobicContact CB-CD2 3.53Å; N460-W474 HydrophobicContact CB-CE3 4.1Å; N460-W474 HydrophobicContact CB-CG 3.52Å; N460-W474 HydrophobicContact CB-CZ2 4.46Å; N460-W474 WeakPolarHBondContact ND2-CH2 3.39Å; N460-W474 VanDerWaalsContact ND2-CZ3 3.31Å; N460-W474 WeakPolarHBondContact ND2-CZ3 3.18Å; N460-C479 PolarHBondContact ND2-O 2.91Å
461	G	90.3	Very high	90	Very high	8 Å²	8	66.5 Å²	66.5	8%	0.082	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	160.9	171	0	0	0	0	0	111.1	C457 V469	C457-G461 WeakPolarHBondContact CB-O 3.4Å; C457-G461 PolarHBondContact O-N 3.37Å; G461-V469 CarbonylContact C-O 3.11Å; G461-V469 WeakPolarHBondContact CA-O 3.01Å
462	D	90.9	Very high	90	Very high	85 Å²	85	65.9 Å²	65.9	46%	0.455	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	135	172.7	-64.9	-68.8	0	0	0	108.6	V469 R471	D462-V469 PolarHBondContact N-O 3.42Å; D462-V469 PolarHBondContact O-N 2.99Å; D462-R471 IonicContact OD1-CZ 3.88Å; D462-R471 IonicContact OD1-NE 3.54Å; D462-R471 IonicContact OD1-NH2 3.9Å; D462-R471 PolarHBondContact OD1-NH2 3.48Å; D462-R471 IonicContact OD2-CZ 3.4Å; D462-R471 IonicContact OD2-NE 2.9Å; D462-R471 PolarHBondContact OD2-NE 3.45Å; D462-R471 IonicContact OD2-NH2 2.93Å; D462-R471 PolarHBondContact OD2-NH2 2.97Å
463	C	91.1	Very high	89.9	Confident	15 Å²	15	64.3 Å²	64.3	10%	0.101	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87	120.7	-177.9	174.3	0	0	0	0	109.9	N446 C449 L456	N446-C463 WeakPolarHBondContact CB-O 3.19Å; N446-C463 WeakPolarHBondContact O-CB 3.32Å; C449-C463 HydrophobicContact CB-CB 3.75Å; C449-C463 WeakPolarHBondContact CB-SG 3.29Å; C449-C463 PolarHBondContact N-SG 3.43Å; C449-C463 VanDerWaalsContact N-SG 3.44Å; C449-C463 WeakPolarHBondContact SG-CA 3.31Å; C449-C463 WeakPolarHBondContact SG-CB 3.36Å; C449-C463 CovalentContact SG-SG 2.02Å; C449-C463 PolarHBondContact SG-SG 2.89Å; L456-C463 HydrophobicContact CD2-CB 3.78Å; L456-C463 HydrophobicContact CG-CB 4.23Å
464	D	90.6	Very high	90.1	Very high	89 Å²	89	59.4 Å²	59.4	48%	0.476	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	113.7	175.7	-170.1	8.8	0	0	0	109.9	Y438 G466 E467 V469	Y438-D464 PolarHBondContact OH-OD1 2.93Å; D464-G466 PolarHBondContact O-N 2.91Å; D464-E467 PolarHBondContact N-O 3.45Å; D464-E467 PolarHBondContact O-N 3.42Å; D464-V469 HydrophobicContact CB-CG2 4.3Å
465	C	91.3	Very high	90.4	Very high	62 Å²	62	60.4 Å²	60.4	42%	0.419	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.3	35.1	176	-152.8	0	0	0	0	115.7	Y438 C444 D445	Y438-C465 PolarHBondContact OH-N 2.89Å; C444-C465 WeakPolarHBondContact CA-SG 3.3Å; C444-C465 HydrophobicContact CB-CB 3.66Å; C444-C465 WeakPolarHBondContact CB-SG 3.28Å; C444-C465 WeakPolarHBondContact SG-CB 3.41Å; C444-C465 CovalentContact SG-SG 2.04Å; C444-C465 PolarHBondContact SG-SG 3.24Å; D445-C465 PolarHBondContact O-N 3.27Å
466	G	86.4	Confident	90.4	Very high	41 Å²	41	57.3 Å²	57.3	42%	0.423	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	100.3	-11.4	178.4	0	0	0	0	0	115.7	C449 D464	C449-G466 VanDerWaalsContact SG-CA 3.57Å; D464-G466 PolarHBondContact O-N 2.91Å
467	E	91.4	Very high	90.4	Very high	156 Å²	156	61.8 Å²	61.8	73%	0.729	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	144.1	174.1	-64.5	-166.4	163.9	0	0	112.2	C449 D464	C449-E467 PolarHBondContact SG-O 3.46Å; D464-E467 PolarHBondContact N-O 3.45Å; D464-E467 PolarHBondContact O-N 3.42Å
468	C	93.1	Very high	90.3	Very high	23 Å²	23	65.9 Å²	65.9	16%	0.155	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	109.7	176.3	-76.1	0	0	0	0	111.1	C457 C470 E477	C457-C468 WeakPolarHBondContact CA-SG 3.42Å; C457-C468 HydrophobicContact CB-CB 3.72Å; C457-C468 WeakPolarHBondContact CB-SG 3.39Å; C457-C468 VanDerWaalsContact SG-CA 3.51Å; C457-C468 WeakPolarHBondContact SG-CB 3.41Å; C457-C468 CovalentContact SG-SG 2.04Å; C457-C468 PolarHBondContact SG-SG 2.95Å; C468-C470 PolarHBondContact O-N 3.4Å; C468-E477 WeakPolarHBondContact CB-O 3.13Å
469	V	93.3	Very high	90.5	Very high	84 Å²	84	65.5 Å²	65.5	51%	0.509	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	100.6	174	-175.1	0	0	0	0	108.8	G461 D462 D464	G461-V469 CarbonylContact C-O 3.11Å; G461-V469 WeakPolarHBondContact CA-O 3.01Å; D462-V469 PolarHBondContact N-O 3.42Å; D462-V469 PolarHBondContact O-N 2.99Å; D464-V469 HydrophobicContact CB-CG2 4.3Å
470	C	91.7	Very high	90.6	Very high	41 Å²	41	66.7 Å²	66.7	28%	0.277	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	136	-177.3	-53	0	0	0	0	112.5	C468 W474 G476 C479	C468-C470 PolarHBondContact O-N 3.4Å; C470-W474 HydrophobicContact CB-CB 4.3Å; C470-W474 WeakPolarHBondContact CB-O 3.4Å; C470-G476 PolarHBondContact SG-O 2.88Å; C470-C479 WeakPolarHBondContact CA-SG 2.96Å; C470-C479 HydrophobicContact CB-CB 3.78Å; C470-C479 WeakPolarHBondContact CB-SG 3.45Å; C470-C479 PolarHBondContact N-SG 2.91Å; C470-C479 WeakPolarHBondContact SG-CA 3.35Å; C470-C479 WeakPolarHBondContact SG-CB 3.39Å; C470-C479 CovalentContact SG-SG 2.04Å; C470-C479 PolarHBondContact SG-SG 3.12Å
471	R	90.4	Very high	90.5	Very high	120 Å²	120	65.9 Å²	65.9	45%	0.453	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-72.4	158.3	173.6	-60.6	176.6	-170.7	143.2	1.2	110.4	G459 N460 D462 G473 W474	G459-R471 PolarHBondContact O-NH1 2.91Å; N460-R471 VanDerWaalsContact O-CB 3.28Å; N460-R471 WeakPolarHBondContact O-CB 3.32Å; N460-R471 WeakPolarHBondContact O-CG 3.5Å; N460-R471 PolarHBondContact O-N 3.3Å; D462-R471 IonicContact OD1-CZ 3.88Å; D462-R471 IonicContact OD1-NE 3.54Å; D462-R471 IonicContact OD1-NH2 3.9Å; D462-R471 PolarHBondContact OD1-NH2 3.48Å; D462-R471 IonicContact OD2-CZ 3.4Å; D462-R471 IonicContact OD2-NE 2.9Å; D462-R471 PolarHBondContact OD2-NE 3.45Å; D462-R471 IonicContact OD2-NH2 2.93Å; D462-R471 PolarHBondContact OD2-NH2 2.97Å; R471-G473 PolarHBondContact O-N 3.34Å; R471-W474 PolarHBondContact O-N 3.47Å; R471-W474 VanDerWaalsContact O-N 3.1Å
472	S	89.4	Confident	90.5	Very high	123 Å²	123	66.9 Å²	66.9	86%	0.86	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	128	179.6	55.9	0	0	0	0	112
473	G	86.8	Confident	90.3	Very high	31 Å²	31	67 Å²	67	32%	0.32	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.5	1.5	-175.8	0	0	0	0	0	114.9	R471 T482 T483	R471-G473 PolarHBondContact O-N 3.34Å; G473-T482 CarbonylContact O-C 3.58Å; G473-T482 WeakPolarHBondContact O-CA 3.28Å; G473-T482 PolarHBondContact O-OG1 3.35Å; G473-T483 WeakPolarHBondContact CA-OG1 3.42Å; G473-T483 PolarHBondContact O-N 3.23Å; G473-T483 PolarHBondContact O-OG1 2.89Å
474	W	90.7	Very high	90	Very high	86 Å²	86	68.1 Å²	68.1	33%	0.326	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	151.8	-179.6	-62.5	88.4	0	0	0	112.6	N460 C470 R471 C481	N460-W474 HydrophobicContact CB-CB 4.16Å; N460-W474 HydrophobicContact CB-CD2 3.53Å; N460-W474 HydrophobicContact CB-CE3 4.1Å; N460-W474 HydrophobicContact CB-CG 3.52Å; N460-W474 HydrophobicContact CB-CZ2 4.46Å; N460-W474 WeakPolarHBondContact ND2-CH2 3.39Å; N460-W474 VanDerWaalsContact ND2-CZ3 3.31Å; N460-W474 WeakPolarHBondContact ND2-CZ3 3.18Å; C470-W474 HydrophobicContact CB-CB 4.3Å; C470-W474 WeakPolarHBondContact CB-O 3.4Å; R471-W474 PolarHBondContact O-N 3.47Å; R471-W474 VanDerWaalsContact O-N 3.1Å; W474-C481 CarbonylContact C-O 3.54Å; W474-C481 WeakPolarHBondContact CA-O 3.41Å; W474-C481 VanDerWaalsContact CE3-C 3.49Å
475	T	89.9	Confident	89.8	Confident	72 Å²	72	67.2 Å²	67.2	44%	0.442	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.7	173.1	-177.1	-169.1	0	0	0	0	112.3	C481 T483	T475-C481 HydrophobicContact CG2-CB 3.92Å; T475-C481 PolarHBondContact N-O 3.25Å; T475-C481 WeakPolarHBondContact O-CB 3.36Å; T475-C481 PolarHBondContact O-N 3.42Å; T475-T483 HydrophobicContact CG2-CG2 3.91Å
476	G	89.3	Confident	89.5	Confident	38 Å²	38	70.2 Å²	70.2	39%	0.392	40%	0.402	S	S	.	.	S	Bend	trans	87	157.6	-175.2	0	0	0	0	0	113.3	C470 Y478 C479	C470-G476 PolarHBondContact SG-O 2.88Å; G476-Y478 PolarHBondContact O-N 3.08Å; G476-C479 PolarHBondContact O-N 3.48Å
477	E	90.6	Very high	89.3	Confident	138 Å²	138	71.7 Å²	71.7	65%	0.645	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	-30.3	-179.2	-176.2	-171.3	173.1	0	0	113.7	V450 C468	V450-E477 HydrophobicContact CG2-CG 4.45Å; V450-E477 WeakPolarHBondContact CG2-O 3.23Å; C468-E477 WeakPolarHBondContact CB-O 3.13Å
478	Y	90.7	Very high	89	Confident	86 Å²	86	64.3 Å²	64.3	34%	0.337	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	1.6	-179.2	-64.9	-104.2	0	0	0	113.5	V450 H452 C457 G458 G476 N480	V450-Y478 HydrophobicContact CB-CD1 3.84Å; V450-Y478 HydrophobicContact CB-CE1 3.62Å; V450-Y478 HydrophobicContact CG1-CE1 4.3Å; V450-Y478 HydrophobicContact CG2-CD1 3.7Å; V450-Y478 HydrophobicContact CG2-CD2 4.39Å; V450-Y478 HydrophobicContact CG2-CE1 3.94Å; V450-Y478 HydrophobicContact CG2-CG 3.94Å; H452-Y478 HydrophobicContact CB-CD1 4.08Å; C457-Y478 CarbonylContact C-O 3.34Å; G458-Y478 PolarHBondContact N-O 3.17Å; G458-Y478 VanDerWaalsContact N-O 3.13Å; G476-Y478 PolarHBondContact O-N 3.08Å; Y478-N480 PolarHBondContact O-N 3.47Å
479	C	92.1	Very high	88.7	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	38%	0.382	C	S	.	.	S	Bend	trans	46.8	31.8	-170.7	-51.3	0	0	0	0	114.2	C457 N460 C470 G476	C457-C479 WeakPolarHBondContact O-CB 3.5Å; N460-C479 PolarHBondContact ND2-O 2.91Å; C470-C479 WeakPolarHBondContact CA-SG 2.96Å; C470-C479 HydrophobicContact CB-CB 3.78Å; C470-C479 WeakPolarHBondContact CB-SG 3.45Å; C470-C479 PolarHBondContact N-SG 2.91Å; C470-C479 WeakPolarHBondContact SG-CA 3.35Å; C470-C479 WeakPolarHBondContact SG-CB 3.39Å; C470-C479 CovalentContact SG-SG 2.04Å; C470-C479 PolarHBondContact SG-SG 3.12Å; G476-C479 PolarHBondContact O-N 3.48Å
480	N	91.3	Very high	88.2	Confident	62 Å²	62	62.6 Å²	62.6	33%	0.332	36%	0.361	S	S	.	.			trans	-95.7	-8.7	-175.3	68.9	-28.7	0	0	0	113.4	H452 Y478	H452-N480 HydrophobicContact CB-CB 4.32Å; H452-N480 PolarHBondContact CD2-ND2 2.94Å; H452-N480 VanDerWaalsContact CD2-ND2 3.32Å; H452-N480 PolarHBondContact NE2-ND2 3.06Å; H452-N480 VanDerWaalsContact NE2-ND2 3.19Å; Y478-N480 PolarHBondContact O-N 3.47Å
481	C	90.3	Very high	87.5	Confident	23 Å²	23	70.6 Å²	70.6	16%	0.155	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	115.7	-179.2	-170.7	0	0	0	0	110.2	W474 T475 C504	W474-C481 CarbonylContact C-O 3.54Å; W474-C481 WeakPolarHBondContact CA-O 3.41Å; W474-C481 VanDerWaalsContact CE3-C 3.49Å; T475-C481 HydrophobicContact CG2-CB 3.92Å; T475-C481 PolarHBondContact N-O 3.25Å; T475-C481 WeakPolarHBondContact O-CB 3.36Å; T475-C481 PolarHBondContact O-N 3.42Å; C481-C504 HydrophobicContact CB-CB 3.87Å; C481-C504 WeakPolarHBondContact CB-SG 3.35Å; C481-C504 WeakPolarHBondContact SG-CA 3.4Å; C481-C504 WeakPolarHBondContact SG-CB 3.4Å; C481-C504 CovalentContact SG-SG 2.04Å; C481-C504 PolarHBondContact SG-SG 2.99Å
482	T	89.7	Confident	86.5	Confident	29 Å²	29	71.1 Å²	71.1	18%	0.178	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	146.2	173.1	-176.5	0	0	0	0	111	G473 S484 C504	G473-T482 CarbonylContact O-C 3.58Å; G473-T482 WeakPolarHBondContact O-CA 3.28Å; G473-T482 PolarHBondContact O-OG1 3.35Å; T482-S484 PolarHBondContact OG1-N 3.43Å; T482-S484 VanDerWaalsContact OG1-N 3.16Å; T482-C504 WeakPolarHBondContact O-CA 3.43Å
483	T	85.9	Confident	86	Confident	88 Å²	88	67.9 Å²	67.9	54%	0.54	39%	0.392	S	S	.	.			trans	-94.8	0.2	172.1	69.8	0	0	0	0	112.8	G473 T475	G473-T483 WeakPolarHBondContact CA-OG1 3.42Å; G473-T483 PolarHBondContact O-N 3.23Å; G473-T483 PolarHBondContact O-OG1 2.89Å; T475-T483 HydrophobicContact CG2-CG2 3.91Å
484	S	85.6	Confident	85.7	Confident	39 Å²	39	69.8 Å²	69.8	27%	0.273	40%	0.397	S	S	.	.			trans	-74.1	138.5	170.2	162.6	0	0	0	0	110.2	T482 D486	T482-S484 PolarHBondContact OG1-N 3.43Å; T482-S484 VanDerWaalsContact OG1-N 3.16Å; S484-D486 VanDerWaalsContact OG-CG 3.22Å; S484-D486 PolarHBondContact OG-N 3.37Å; S484-D486 VanDerWaalsContact OG-N 3.14Å; S484-D486 PolarHBondContact OG-OD2 3.23Å
485	T	85.5	Confident	85.4	Confident	70 Å²	70	69.1 Å²	69.1	43%	0.429	40%	0.4	S	S	.	.			trans	-101.7	-1.3	173.7	49.5	0	0	0	0	113	S487 C488 L495	T485-S487 VanDerWaalsContact C-N 3.31Å; T485-S487 PolarHBondContact O-N 2.95Å; T485-C488 WeakPolarHBondContact O-CA 3.31Å; T485-C488 VanDerWaalsContact O-CB 3.31Å; T485-C488 WeakPolarHBondContact O-CB 3.4Å; T485-C488 PolarHBondContact O-N 3.06Å; T485-L495 HydrophobicContact CG2-CD1 4.22Å
486	D	84.8	Confident	85.3	Confident	124 Å²	124	65.7 Å²	65.7	66%	0.663	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-62.9	-38.8	-167.2	-51.6	-47	0	0	0	112	S484 C488 V489	S484-D486 VanDerWaalsContact OG-CG 3.22Å; S484-D486 PolarHBondContact OG-N 3.37Å; S484-D486 VanDerWaalsContact OG-N 3.14Å; S484-D486 PolarHBondContact OG-OD2 3.23Å; D486-C488 PolarHBondContact O-N 3.07Å; D486-V489 PolarHBondContact O-N 3.42Å
487	S	82	Confident	85.1	Confident	73 Å²	73	64.9 Å²	64.9	51%	0.51	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-72.4	-7.6	175.7	45.2	0	0	0	0	114.7	T485 G505	T485-S487 VanDerWaalsContact C-N 3.31Å; T485-S487 PolarHBondContact O-N 2.95Å; S487-G505 PolarHBondContact OG-O 2.02Å
488	C	86.9	Confident	84.8	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	37%	0.365	C	S	.	.	G	3₁₀ helix	trans	-98.5	-5.4	174.7	-68.7	0	0	0	0	113.2	T485 D486 L495 C496 C502 K506	T485-C488 WeakPolarHBondContact O-CA 3.31Å; T485-C488 VanDerWaalsContact O-CB 3.31Å; T485-C488 WeakPolarHBondContact O-CB 3.4Å; T485-C488 PolarHBondContact O-N 3.06Å; D486-C488 PolarHBondContact O-N 3.07Å; C488-L495 HydrophobicContact CB-CD1 3.64Å; C488-L495 HydrophobicContact CB-CG 4.25Å; C488-C496 PolarHBondContact O-N 3.2Å; C488-C502 HydrophobicContact CB-CB 3.54Å; C488-C502 WeakPolarHBondContact CB-SG 3.4Å; C488-C502 WeakPolarHBondContact SG-CB 3.48Å; C488-C502 CovalentContact SG-SG 2.03Å; C488-C502 PolarHBondContact SG-SG 3.2Å; C488-K506 VanDerWaalsContact SG-C 3.54Å; C488-K506 PolarHBondContact SG-N 3.1Å; C488-K506 VanDerWaalsContact SG-N 3.4Å
489	V	86.9	Confident	84.5	Confident	62 Å²	62	60.9 Å²	60.9	38%	0.376	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-82.1	126.5	-178.9	-173.5	0	0	0	0	109.5	D486	D486-V489 PolarHBondContact O-N 3.42Å
490	S	80.9	Confident	84.4	Confident	10 Å²	10	61.4 Å²	61.4	7%	0.07	37%	0.37	C	S	.	.			trans	-75.2	169.4	174.3	71.8	0	0	0	0	111.9	D492 G493 V494 S497	S490-D492 PolarHBondContact O-N 3.15Å; S490-D492 VanDerWaalsContact O-N 3.16Å; S490-D492 PolarHBondContact OG-OD2 3.35Å; S490-G493 WeakPolarHBondContact O-CA 3.49Å; S490-G493 PolarHBondContact O-N 3.26Å; S490-V494 PolarHBondContact N-O 3.15Å; S490-V494 PolarHBondContact OG-O 3.12Å; S490-S497 WeakPolarHBondContact CB-OG 3.41Å
491	E	77.8	Confident	84.4	Confident	208 Å²	208	63.2 Å²	63.2	97%	0.972	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.8	175.6	-63.8	-175.8	166.3	0	0	112.6	G493	E491-G493 PolarHBondContact O-N 2.99Å
492	D	69.5	Low	84.4	Confident	131 Å²	131	63.6 Å²	63.6	70%	0.701	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-1.7	173.4	-43	-72.2	0	0	0	114	S490 V494	S490-D492 PolarHBondContact O-N 3.15Å; S490-D492 VanDerWaalsContact O-N 3.16Å; S490-D492 PolarHBondContact OG-OD2 3.35Å; D492-V494 VanDerWaalsContact C-N 3.3Å; D492-V494 HydrophobicContact CB-CG2 4.31Å; D492-V494 PolarHBondContact O-N 3.25Å
493	G	78.5	Confident	84.4	Confident	56 Å²	56	66 Å²	66	58%	0.577	40%	0.396	S	S	*	.	S	Bend	trans	76.8	10.8	-175.4	0	0	0	0	0	114.6	S490 E491	S490-G493 WeakPolarHBondContact O-CA 3.49Å; S490-G493 PolarHBondContact O-N 3.26Å; E491-G493 PolarHBondContact O-N 2.99Å
494	V	81.3	Confident	84.6	Confident	70 Å²	70	64.5 Å²	64.5	42%	0.424	39%	0.388	S	S	.	.			trans	-103.9	134.6	-175.7	-175.1	0	0	0	0	110.8	S490 D492 C496 S497	S490-V494 PolarHBondContact N-O 3.15Å; S490-V494 PolarHBondContact OG-O 3.12Å; D492-V494 VanDerWaalsContact C-N 3.3Å; D492-V494 HydrophobicContact CB-CG2 4.31Å; D492-V494 PolarHBondContact O-N 3.25Å; V494-C496 PolarHBondContact O-N 3.12Å; V494-S497 PolarHBondContact O-N 2.82Å
495	L	85.1	Confident	84.6	Confident	72 Å²	72	63 Å²	63	38%	0.377	38%	0.38	S	S	.	.	B	Isolated β-bridge	trans	-60.3	121.8	174.7	-163.2	85.4	0	0	0	110.3	T485 C488 S497 G498 C502	T485-L495 HydrophobicContact CG2-CD1 4.22Å; C488-L495 HydrophobicContact CB-CD1 3.64Å; C488-L495 HydrophobicContact CB-CG 4.25Å; L495-S497 PolarHBondContact O-N 3.36Å; L495-S497 VanDerWaalsContact O-N 3.1Å; L495-G498 PolarHBondContact O-N 3.09Å; L495-C502 HydrophobicContact CD1-CB 3.95Å; L495-C502 HydrophobicContact CD2-CB 3.8Å; L495-C502 HydrophobicContact CG-CB 4.02Å
496	C	87.7	Confident	84.8	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	50	35.7	178.6	-55.3	0	0	0	0	113.9	C488 V494 G498 R499 G500 C507 T518	C488-C496 PolarHBondContact O-N 3.2Å; V494-C496 PolarHBondContact O-N 3.12Å; C496-G498 PolarHBondContact O-N 3.13Å; C496-R499 PolarHBondContact O-N 3.15Å; C496-G500 WeakPolarHBondContact CB-O 3.49Å; C496-C507 WeakPolarHBondContact CA-SG 3.1Å; C496-C507 HydrophobicContact CB-CB 3.66Å; C496-C507 WeakPolarHBondContact CB-SG 3.05Å; C496-C507 WeakPolarHBondContact SG-CA 3.02Å; C496-C507 WeakPolarHBondContact SG-CB 3.32Å; C496-C507 CovalentContact SG-SG 2.03Å; C496-C507 PolarHBondContact SG-SG 2.95Å; C496-T518 CarbonylContact C-O 3.59Å; C496-T518 WeakPolarHBondContact CA-O 3.47Å
497	S	84.6	Confident	85.1	Confident	21 Å²	21	62.2 Å²	62.2	15%	0.147	37%	0.367	C	S	.	.	G	3₁₀ helix	trans	52.4	19.8	-176.1	-50.7	0	0	0	0	114.4	S490 V494 L495 R499 T518	S490-S497 WeakPolarHBondContact CB-OG 3.41Å; V494-S497 PolarHBondContact O-N 2.82Å; L495-S497 PolarHBondContact O-N 3.36Å; L495-S497 VanDerWaalsContact O-N 3.1Å; S497-R499 VanDerWaalsContact C-N 3.3Å; S497-R499 WeakPolarHBondContact O-CG 3.33Å; S497-R499 PolarHBondContact O-N 2.71Å; S497-T518 WeakPolarHBondContact CB-O 3.03Å; S497-T518 PolarHBondContact N-O 3.31Å; S497-T518 PolarHBondContact OG-O 3.05Å
498	G	84	Confident	85.6	Confident	59 Å²	59	62.6 Å²	62.6	61%	0.608	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	69.8	18.1	-172.5	0	0	0	0	0	115.1	L495 C496	L495-G498 PolarHBondContact O-N 3.09Å; C496-G498 PolarHBondContact O-N 3.13Å
499	R	84.9	Confident	85.7	Confident	81 Å²	81	64.6 Å²	64.6	31%	0.306	38%	0.379	S	S	.	.	S	Bend	trans	-122.9	9.9	-169	-62.9	167.8	-167.5	-127.4	5.3	113.7	C496 S497 T510 N511 A514 C519 C525	C496-R499 PolarHBondContact O-N 3.15Å; S497-R499 VanDerWaalsContact C-N 3.3Å; S497-R499 WeakPolarHBondContact O-CG 3.33Å; S497-R499 PolarHBondContact O-N 2.71Å; R499-T510 PolarHBondContact O-N 3.38Å; R499-T510 PolarHBondContact O-OG1 2.72Å; R499-N511 HydrophobicContact CB-CB 4.27Å; R499-N511 PolarHBondContact O-N 2.85Å; R499-A514 HydrophobicContact CB-CB 4.4Å; R499-C519 HydrophobicContact CB-CB 3.93Å; R499-C519 WeakPolarHBondContact CD-O 3.29Å; R499-C525 PolarHBondContact NH1-SG 3.15Å; R499-C525 VanDerWaalsContact NH1-SG 3.37Å
500	G	88.7	Confident	85.6	Confident	12 Å²	12	65.7 Å²	65.7	12%	0.124	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-175.1	174.7	-176.7	0	0	0	0	0	112.6	C496 V508	C496-G500 WeakPolarHBondContact CB-O 3.49Å; G500-V508 CarbonylContact C-O 3.57Å; G500-V508 WeakPolarHBondContact CA-O 3.39Å
501	D	91.3	Very high	85.5	Confident	100 Å²	100	68.4 Å²	68.4	54%	0.535	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	140.2	179.6	-63.5	-59.5	0	0	0	110.8	V503 V508	D501-V503 PolarHBondContact O-N 3.06Å; D501-V508 PolarHBondContact N-O 3.07Å; D501-V508 PolarHBondContact O-N 3.46Å
502	C	90.8	Very high	85.3	Confident	31 Å²	31	64.1 Å²	64.1	21%	0.209	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	112.1	174.5	-175.1	0	0	0	0	110.4	C488 L495	C488-C502 HydrophobicContact CB-CB 3.54Å; C488-C502 WeakPolarHBondContact CB-SG 3.4Å; C488-C502 WeakPolarHBondContact SG-CB 3.48Å; C488-C502 CovalentContact SG-SG 2.03Å; C488-C502 PolarHBondContact SG-SG 3.2Å; L495-C502 HydrophobicContact CD1-CB 3.95Å; L495-C502 HydrophobicContact CD2-CB 3.8Å; L495-C502 HydrophobicContact CG-CB 4.02Å
503	V	90.3	Very high	85.4	Confident	80 Å²	80	60 Å²	60	49%	0.485	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	118.4	178.1	-176.6	0	0	0	0	108.5	D501 G505 K506 V508	D501-V503 PolarHBondContact O-N 3.06Å; V503-G505 VanDerWaalsContact C-N 3.32Å; V503-G505 PolarHBondContact O-N 3.11Å; V503-K506 PolarHBondContact N-O 3.32Å; V503-K506 PolarHBondContact O-N 3.16Å; V503-K506 VanDerWaalsContact O-N 3.1Å; V503-K506 VanDerWaalsContact O-O 3.14Å; V503-V508 HydrophobicContact CB-CG2 4.09Å; V503-V508 HydrophobicContact CG2-CG2 4.04Å
504	C	88.8	Confident	85.5	Confident	55 Å²	55	58 Å²	58	37%	0.372	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.9	42.6	179.8	-52.3	0	0	0	0	114.1	C481 T482 K506	C481-C504 HydrophobicContact CB-CB 3.87Å; C481-C504 WeakPolarHBondContact CB-SG 3.35Å; C481-C504 WeakPolarHBondContact SG-CA 3.4Å; C481-C504 WeakPolarHBondContact SG-CB 3.4Å; C481-C504 CovalentContact SG-SG 2.04Å; C481-C504 PolarHBondContact SG-SG 2.99Å; T482-C504 WeakPolarHBondContact O-CA 3.43Å; C504-K506 VanDerWaalsContact C-N 3.31Å; C504-K506 PolarHBondContact O-N 3.25Å
505	G	86.3	Confident	85.5	Confident	9 Å²	9	57.3 Å²	57.3	9%	0.093	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	20.2	-178.8	0	0	0	0	0	114.6	S487 V503	S487-G505 PolarHBondContact OG-O 2.02Å; V503-G505 VanDerWaalsContact C-N 3.32Å; V503-G505 PolarHBondContact O-N 3.11Å
506	K	90.3	Very high	85.5	Confident	157 Å²	157	55.3 Å²	55.3	68%	0.683	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.7	141.8	173.4	-66.5	-170.9	175.8	-168.7	0	111.5	C488 V503 C504	C488-K506 VanDerWaalsContact SG-C 3.54Å; C488-K506 PolarHBondContact SG-N 3.1Å; C488-K506 VanDerWaalsContact SG-N 3.4Å; V503-K506 PolarHBondContact N-O 3.32Å; V503-K506 PolarHBondContact O-N 3.16Å; V503-K506 VanDerWaalsContact O-N 3.1Å; V503-K506 VanDerWaalsContact O-O 3.14Å; C504-K506 VanDerWaalsContact C-N 3.31Å; C504-K506 PolarHBondContact O-N 3.25Å
507	C	90.7	Very high	85.3	Confident	20 Å²	20	59.8 Å²	59.8	14%	0.135	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	127.9	175.5	-67.7	0	0	0	0	112	C496 P517	C496-C507 WeakPolarHBondContact CA-SG 3.1Å; C496-C507 HydrophobicContact CB-CB 3.66Å; C496-C507 WeakPolarHBondContact CB-SG 3.05Å; C496-C507 WeakPolarHBondContact SG-CA 3.02Å; C496-C507 WeakPolarHBondContact SG-CB 3.32Å; C496-C507 CovalentContact SG-SG 2.03Å; C496-C507 PolarHBondContact SG-SG 2.95Å; C507-P517 WeakPolarHBondContact CB-O 3.33Å
508	V	91.6	Very high	85.4	Confident	80 Å²	80	59.7 Å²	59.7	49%	0.485	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	103	169.5	-178.9	0	0	0	0	107.1	G500 D501 V503 T510	G500-V508 CarbonylContact C-O 3.57Å; G500-V508 WeakPolarHBondContact CA-O 3.39Å; D501-V508 PolarHBondContact N-O 3.07Å; D501-V508 PolarHBondContact O-N 3.46Å; V503-V508 HydrophobicContact CB-CG2 4.09Å; V503-V508 HydrophobicContact CG2-CG2 4.04Å; V508-T510 PolarHBondContact O-N 3.27Å
509	C	89	Confident	85.5	Confident	43 Å²	43	56.9 Å²	56.9	29%	0.291	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	119.2	-174.8	-48.1	0	0	0	0	111.1	A514 C519	C509-A514 HydrophobicContact CB-CB 4.11Å; C509-C519 WeakPolarHBondContact CA-SG 3.03Å; C509-C519 HydrophobicContact CB-CB 3.92Å; C509-C519 WeakPolarHBondContact CB-SG 3.49Å; C509-C519 WeakPolarHBondContact SG-CA 3.04Å; C509-C519 WeakPolarHBondContact SG-CB 2.99Å; C509-C519 CovalentContact SG-SG 2.04Å; C509-C519 PolarHBondContact SG-SG 2.94Å
510	T	84.9	Confident	85.3	Confident	84 Å²	84	56.3 Å²	56.3	52%	0.515	35%	0.352	S	S	.	.			trans	-91.2	-21.6	179.1	50.1	0	0	0	0	112.1	R499 V508	R499-T510 PolarHBondContact O-N 3.38Å; R499-T510 PolarHBondContact O-OG1 2.72Å; V508-T510 PolarHBondContact O-N 3.27Å
511	N	78.9	Confident	84.8	Confident	67 Å²	67	63.2 Å²	63.2	36%	0.358	37%	0.374	S	S	.	.	S	Bend	trans	-80.5	132	179.4	-75.4	-2.8	0	0	0	112.6	R499 G513 A514	R499-N511 HydrophobicContact CB-CB 4.27Å; R499-N511 PolarHBondContact O-N 2.85Å; N511-G513 PolarHBondContact O-N 2.83Å; N511-A514 HydrophobicContact CB-CB 4.08Å; N511-A514 WeakPolarHBondContact O-CB 3.31Å; N511-A514 PolarHBondContact O-N 3.4Å; N511-A514 VanDerWaalsContact O-N 3.1Å
512	P	74.4	Confident	83.8	Confident	118 Å²	118	59.2 Å²	59.2	77%	0.766	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	120.9	-178.6	-24.9	34.3	0	0	0	113.9	A514 T524	P512-A514 VanDerWaalsContact C-N 3.32Å; P512-T524 PolarHBondContact O-OG1 3.3Å; P512-T524 VanDerWaalsContact O-OG1 3.06Å
513	G	72.4	Confident	82.6	Confident	46 Å²	46	62.8 Å²	62.8	47%	0.474	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	3.4	-179.6	0	0	0	0	0	114.9	N511	N511-G513 PolarHBondContact O-N 2.83Å
514	A	80.4	Confident	81.2	Confident	14 Å²	14	64 Å²	64	12%	0.116	38%	0.384	C	S	.	.			trans	-76.5	139.2	166.1	0	0	0	0	0	110.9	R499 C509 N511 P512 C519 R521 C522	R499-A514 HydrophobicContact CB-CB 4.4Å; C509-A514 HydrophobicContact CB-CB 4.11Å; N511-A514 HydrophobicContact CB-CB 4.08Å; N511-A514 WeakPolarHBondContact O-CB 3.31Å; N511-A514 PolarHBondContact O-N 3.4Å; N511-A514 VanDerWaalsContact O-N 3.1Å; P512-A514 VanDerWaalsContact C-N 3.32Å; A514-C519 HydrophobicContact CB-CB 4.44Å; A514-R521 CarbonylContact C-O 3.58Å; A514-C522 HydrophobicContact CB-CB 4Å
515	S	81	Confident	79.9	Confident	55 Å²	55	64.3 Å²	64.3	39%	0.385	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-155.2	173.6	-173	64.6	0	0	0	0	110.5	C519 E520 R521	S515-C519 CarbonylContact O-C 3.57Å; S515-C519 VanDerWaalsContact O-C 3.31Å; S515-C519 WeakPolarHBondContact O-CA 3.48Å; S515-E520 PolarHBondContact O-N 2.78Å; S515-R521 PolarHBondContact N-O 2.79Å; S515-R521 WeakPolarHBondContact O-CA 3.45Å; S515-R521 WeakPolarHBondContact O-CB 2.99Å; S515-R521 PolarHBondContact O-N 2.97Å; S515-R521 WeakPolarHBondContact OG-CB 3.44Å; S515-R521 PolarHBondContact OG-O 3.11Å
516	G	83.7	Confident	78.4	Confident	30 Å²	30	66.4 Å²	66.4	31%	0.309	41%	0.408	S	S	.	.	S	Bend	trans	94.7	163	-174.6	0	0	0	0	0	113.2	T518 C519 E520	G516-T518 PolarHBondContact O-N 3.39Å; G516-C519 PolarHBondContact O-N 3.38Å; G516-C519 VanDerWaalsContact O-N 3.15Å; G516-E520 WeakPolarHBondContact CA-OE1 3.34Å; G516-E520 VanDerWaalsContact CA-OE2 3.31Å; G516-E520 WeakPolarHBondContact CA-OE2 3.4Å
517	P	83.8	Confident	77	Confident	93 Å²	93	62.1 Å²	62.1	60%	0.604	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-31.2	-174.2	21.7	-35.7	0	0	0	114.9	C507 E520	C507-P517 WeakPolarHBondContact CB-O 3.33Å; P517-E520 WeakPolarHBondContact CD-OE1 3.02Å; P517-E520 WeakPolarHBondContact CD-OE2 2.98Å
518	T	88.2	Confident	75.6	Confident	20 Å²	20	65.4 Å²	65.4	12%	0.123	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	25.5	177.8	57.6	0	0	0	0	112	C496 S497 G516 E520	C496-T518 CarbonylContact C-O 3.59Å; C496-T518 WeakPolarHBondContact CA-O 3.47Å; S497-T518 WeakPolarHBondContact CB-O 3.03Å; S497-T518 PolarHBondContact N-O 3.31Å; S497-T518 PolarHBondContact OG-O 3.05Å; G516-T518 PolarHBondContact O-N 3.39Å; T518-E520 PolarHBondContact N-OE2 3.03Å; T518-E520 PolarHBondContact O-N 2.85Å; T518-E520 PolarHBondContact OG1-OE2 3.4Å
519	C	85.4	Confident	74.6	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	40%	0.395	C	S	.	.	S	Bend	trans	58.1	26.3	-176.5	-54.3	0	0	0	0	114.2	R499 C509 A514 S515 G516	R499-C519 HydrophobicContact CB-CB 3.93Å; R499-C519 WeakPolarHBondContact CD-O 3.29Å; C509-C519 WeakPolarHBondContact CA-SG 3.03Å; C509-C519 HydrophobicContact CB-CB 3.92Å; C509-C519 WeakPolarHBondContact CB-SG 3.49Å; C509-C519 WeakPolarHBondContact SG-CA 3.04Å; C509-C519 WeakPolarHBondContact SG-CB 2.99Å; C509-C519 CovalentContact SG-SG 2.04Å; C509-C519 PolarHBondContact SG-SG 2.94Å; A514-C519 HydrophobicContact CB-CB 4.44Å; S515-C519 CarbonylContact O-C 3.57Å; S515-C519 VanDerWaalsContact O-C 3.31Å; S515-C519 WeakPolarHBondContact O-CA 3.48Å; G516-C519 PolarHBondContact O-N 3.38Å; G516-C519 VanDerWaalsContact O-N 3.15Å
520	E	80.8	Confident	73.7	Confident	69 Å²	69	64 Å²	64	32%	0.322	40%	0.402	S	S	.	.			trans	-74.2	-30.8	-173	77.4	-66.3	165.5	0	0	112.9	S515 G516 P517 T518 C522	S515-E520 PolarHBondContact O-N 2.78Å; G516-E520 WeakPolarHBondContact CA-OE1 3.34Å; G516-E520 VanDerWaalsContact CA-OE2 3.31Å; G516-E520 WeakPolarHBondContact CA-OE2 3.4Å; P517-E520 WeakPolarHBondContact CD-OE1 3.02Å; P517-E520 WeakPolarHBondContact CD-OE2 2.98Å; T518-E520 PolarHBondContact N-OE2 3.03Å; T518-E520 PolarHBondContact O-N 2.85Å; T518-E520 PolarHBondContact OG1-OE2 3.4Å; E520-C522 PolarHBondContact O-N 2.77Å
521	R	78.6	Confident	73	Confident	157 Å²	157	63.2 Å²	63.2	59%	0.592	40%	0.399	S	S	*	.	B	Isolated β-bridge	trans	-90.8	99.8	-178.1	-58	168.7	-154.7	-153	-5.3	110.2	A514 S515	A514-R521 CarbonylContact C-O 3.58Å; S515-R521 PolarHBondContact N-O 2.79Å; S515-R521 WeakPolarHBondContact O-CA 3.45Å; S515-R521 WeakPolarHBondContact O-CB 2.99Å; S515-R521 PolarHBondContact O-N 2.97Å; S515-R521 WeakPolarHBondContact OG-CB 3.44Å; S515-R521 PolarHBondContact OG-O 3.11Å
522	C	70.3	Confident	72.8	Confident	15 Å²	15	61 Å²	61	10%	0.101	39%	0.387	C	S	.	.			trans	-127.5	87.4	170.7	-172.8	0	0	0	0	111.6	A514 E520 T524 C525	A514-C522 HydrophobicContact CB-CB 4Å; E520-C522 PolarHBondContact O-N 2.77Å; C522-T524 PolarHBondContact O-N 2.93Å; C522-T524 PolarHBondContact SG-OG1 2.9Å; C522-T524 VanDerWaalsContact SG-OG1 3.38Å; C522-C525 HydrophobicContact CB-CB 3.53Å; C522-C525 WeakPolarHBondContact CB-SG 3.33Å; C522-C525 PolarHBondContact O-N 2.79Å; C522-C525 WeakPolarHBondContact SG-CB 3.27Å; C522-C525 PolarHBondContact SG-N 3.31Å; C522-C525 CovalentContact SG-SG 2.02Å; C522-C525 PolarHBondContact SG-SG 3.05Å
523	P	65.3	Low	72.8	Confident	106 Å²	106	58.7 Å²	58.7	69%	0.688	36%	0.363	S	S	*	.	G	3₁₀ helix	trans	-58.1	-28.7	178.4	-23.5	34.3	0	0	0	113.3
524	T	61.2	Low	73	Confident	105 Å²	105	59.7 Å²	59.7	64%	0.644	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-83.1	-11.3	178	46	0	0	0	0	114.1	P512 C522	P512-T524 PolarHBondContact O-OG1 3.3Å; P512-T524 VanDerWaalsContact O-OG1 3.06Å; C522-T524 PolarHBondContact O-N 2.93Å; C522-T524 PolarHBondContact SG-OG1 2.9Å; C522-T524 VanDerWaalsContact SG-OG1 3.38Å
525	C	61.1	Low	73	Confident	62 Å²	62	59 Å²	59	42%	0.419	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-89.4	2.9	-175.7	-65.3	0	0	0	0	114.2	R499 C522	R499-C525 PolarHBondContact NH1-SG 3.15Å; R499-C525 VanDerWaalsContact NH1-SG 3.37Å; C522-C525 HydrophobicContact CB-CB 3.53Å; C522-C525 WeakPolarHBondContact CB-SG 3.33Å; C522-C525 PolarHBondContact O-N 2.79Å; C522-C525 WeakPolarHBondContact SG-CB 3.27Å; C522-C525 PolarHBondContact SG-N 3.31Å; C522-C525 CovalentContact SG-SG 2.02Å; C522-C525 PolarHBondContact SG-SG 3.05Å
526	G	55.3	Low	72.8	Confident	54 Å²	54	56.5 Å²	56.5	56%	0.557	34%	0.339	S	S	*	.			trans	156.7	103.5	177.8	0	0	0	0	0	112.1	P528	G526-P528 WeakPolarHBondContact O-CD 3.39Å
527	D	60.3	Low	72.5	Confident	66 Å²	66	57.7 Å²	57.7	35%	0.353	34%	0.336	S	S	.	.			trans	-65.4	121.7	174.2	165.2	19.4	0	0	0	110.3	C529 N530 S531	D527-C529 PolarHBondContact O-N 2.9Å; D527-C529 WeakPolarHBondContact OD1-CB 3.25Å; D527-C529 PolarHBondContact OD1-N 2.78Å; D527-N530 HydrophobicContact CB-CB 4.24Å; D527-N530 PolarHBondContact O-N 3.2Å; D527-N530 VanDerWaalsContact O-N 3.15Å; D527-N530 PolarHBondContact OD2-ND2 3.16Å; D527-S531 PolarHBondContact O-N 3.46Å; D527-S531 VanDerWaalsContact O-N 3.15Å
528	P	62.2	Low	72.2	Confident	89 Å²	89	53.9 Å²	53.9	58%	0.578	31%	0.312	S	S	*	.	H	α-helix	trans	-53.2	-36.7	179.2	-26.8	34.8	0	0	0	113	G526 S531	G526-P528 WeakPolarHBondContact O-CD 3.39Å; P528-S531 PolarHBondContact O-N 2.9Å; P528-S531 PolarHBondContact O-OG 3.29Å
529	C	68.8	Low	71.7	Confident	16 Å²	16	55.9 Å²	55.9	11%	0.108	32%	0.32	C	S	.	.	H	α-helix	trans	-65.1	-47.6	179.8	-57	0	0	0	0	111.5	D527 S531 K532 C575 L577 F587	D527-C529 PolarHBondContact O-N 2.9Å; D527-C529 WeakPolarHBondContact OD1-CB 3.25Å; D527-C529 PolarHBondContact OD1-N 2.78Å; C529-S531 VanDerWaalsContact C-N 3.34Å; C529-S531 PolarHBondContact O-N 2.88Å; C529-K532 PolarHBondContact O-N 2.91Å; C529-C575 VanDerWaalsContact CA-SG 3.6Å; C529-C575 HydrophobicContact CB-CB 3.65Å; C529-C575 WeakPolarHBondContact CB-SG 3.24Å; C529-C575 WeakPolarHBondContact SG-CB 3.34Å; C529-C575 CovalentContact SG-SG 2.04Å; C529-C575 PolarHBondContact SG-SG 3.37Å; C529-L577 HydrophobicContact CB-CD2 4.41Å; C529-F587 HydrophobicContact CB-CZ 4.19Å
530	N	70.1	Confident	71.2	Confident	79 Å²	79	58.9 Å²	58.9	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-66.5	-32	179.3	-103.9	-54.1	0	0	0	113.2	D527 K532 R533 L577	D527-N530 HydrophobicContact CB-CB 4.24Å; D527-N530 PolarHBondContact O-N 3.2Å; D527-N530 VanDerWaalsContact O-N 3.15Å; D527-N530 PolarHBondContact OD2-ND2 3.16Å; N530-K532 PolarHBondContact O-N 2.82Å; N530-K532 VanDerWaalsContact O-N 3.1Å; N530-R533 WeakPolarHBondContact O-CB 3.31Å; N530-R533 PolarHBondContact O-N 3.26Å; N530-R533 VanDerWaalsContact O-N 3.09Å; N530-L577 HydrophobicContact CB-CD2 4.47Å
531	S	70.8	Confident	70.6	Confident	66 Å²	66	60 Å²	60	46%	0.462	35%	0.351	S	S	.	.	H	α-helix	trans	-58.7	-24.8	178.5	77.1	0	0	0	0	113.7	D527 P528 C529	D527-S531 PolarHBondContact O-N 3.46Å; D527-S531 VanDerWaalsContact O-N 3.15Å; P528-S531 PolarHBondContact O-N 2.9Å; P528-S531 PolarHBondContact O-OG 3.29Å; C529-S531 VanDerWaalsContact C-N 3.34Å; C529-S531 PolarHBondContact O-N 2.88Å
532	K	74.6	Confident	69.9	Low	22 Å²	22	53.2 Å²	53.2	10%	0.096	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	-1.2	-178.4	-47.3	-56.8	177.6	158.2	0	113.5	C529 N530 S534 C535 I536 A557 G558 A559 T597 I599	C529-K532 PolarHBondContact O-N 2.91Å; N530-K532 PolarHBondContact O-N 2.82Å; N530-K532 VanDerWaalsContact O-N 3.1Å; K532-S534 VanDerWaalsContact C-N 3.33Å; K532-S534 PolarHBondContact O-N 3.18Å; K532-C535 WeakPolarHBondContact O-CB 3.34Å; K532-C535 PolarHBondContact O-N 3.31Å; K532-I536 HydrophobicContact CB-CD1 4.23Å; K532-I536 PolarHBondContact O-N 3.49Å; K532-A557 HydrophobicContact CD-CB 4.39Å; K532-A557 VanDerWaalsContact CD-O 3.28Å; K532-A557 WeakPolarHBondContact CD-O 3.35Å; K532-A557 WeakPolarHBondContact CE-O 3.28Å; K532-A557 PolarHBondContact NZ-O 3.26Å; K532-G558 PolarHBondContact NZ-O 2.96Å; K532-G558 VanDerWaalsContact NZ-O 3.14Å; K532-A559 HydrophobicContact CD-CB 3.98Å; K532-T597 PolarHBondContact NZ-OG1 3.02Å; K532-I599 HydrophobicContact CB-CD1 4.04Å; K532-I599 HydrophobicContact CG-CD1 4.39Å
533	R	75.4	Confident	69.2	Low	69 Å²	69	57.3 Å²	57.3	26%	0.26	36%	0.363	S	S	.	.	H	α-helix	trans	-49.9	-47.7	-175.2	179.5	177	-176.5	124.5	15.2	113.3	N530 C535 I536 E537 L577 Q578	N530-R533 WeakPolarHBondContact O-CB 3.31Å; N530-R533 PolarHBondContact O-N 3.26Å; N530-R533 VanDerWaalsContact O-N 3.09Å; R533-C535 VanDerWaalsContact C-N 3.27Å; R533-C535 PolarHBondContact O-N 3.18Å; R533-I536 PolarHBondContact O-N 2.91Å; R533-I536 VanDerWaalsContact O-N 3.14Å; R533-E537 HydrophobicContact CG-CG 4.24Å; R533-E537 WeakPolarHBondContact CG-OE2 3.41Å; R533-E537 IonicContact CZ-OE1 3.23Å; R533-E537 IonicContact NE-OE1 3.7Å; R533-E537 PolarHBondContact NE-OE1 2.76Å; R533-E537 IonicContact NE-OE2 2.7Å; R533-E537 PolarHBondContact NE-OE2 3.02Å; R533-E537 IonicContact NH2-OE1 2.82Å; R533-E537 PolarHBondContact NH2-OE1 3.37Å; R533-E537 PolarHBondContact O-N 3.38Å; R533-L577 HydrophobicContact CB-CD1 4.01Å; R533-L577 HydrophobicContact CG-CD1 4.26Å; R533-Q578 PolarHBondContact NH1-O 3.01Å; R533-Q578 VanDerWaalsContact NH1-O 3.12Å; R533-Q578 PolarHBondContact NH2-O 3.29Å
534	S	75.6	Confident	68.8	Low	67 Å²	67	55.9 Å²	55.9	47%	0.469	37%	0.368	S	S	.	.	H	α-helix	trans	-64.8	-24.9	-177.8	57.1	0	0	0	0	114.6	K532 C538	K532-S534 VanDerWaalsContact C-N 3.33Å; K532-S534 PolarHBondContact O-N 3.18Å; S534-C538 WeakPolarHBondContact O-CB 3.46Å
535	C	80.4	Confident	68.4	Low	0 Å²	0	60.5 Å²	60.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-77.4	-44.4	172.7	168.5	0	0	0	0	110.9	K532 R533 C538 H539 C554 A557	K532-C535 WeakPolarHBondContact O-CB 3.34Å; K532-C535 PolarHBondContact O-N 3.31Å; R533-C535 VanDerWaalsContact C-N 3.27Å; R533-C535 PolarHBondContact O-N 3.18Å; C535-C538 WeakPolarHBondContact O-CB 3.37Å; C535-C538 PolarHBondContact O-N 3.47Å; C535-H539 PolarHBondContact O-N 3.48Å; C535-C554 HydrophobicContact CB-CB 3.94Å; C535-C554 WeakPolarHBondContact CB-SG 3.42Å; C535-C554 VanDerWaalsContact SG-CA 3.6Å; C535-C554 WeakPolarHBondContact SG-CB 3.48Å; C535-C554 CovalentContact SG-SG 2.04Å; C535-C554 PolarHBondContact SG-SG 3.1Å; C535-A557 HydrophobicContact CB-CB 4.22Å
536	I	77.9	Confident	68	Low	1 Å²	1	59.6 Å²	59.6	1%	0.005	38%	0.379	C	S	.	.	H	α-helix	trans	-69.9	-46.1	-175.8	-62.9	167.8	0	0	0	111.4	K532 R533 C538 H539 L540 I585 F587 I599 I602	K532-I536 HydrophobicContact CB-CD1 4.23Å; K532-I536 PolarHBondContact O-N 3.49Å; R533-I536 PolarHBondContact O-N 2.91Å; R533-I536 VanDerWaalsContact O-N 3.14Å; I536-C538 VanDerWaalsContact C-N 3.26Å; I536-C538 PolarHBondContact O-N 2.04Å; I536-H539 PolarHBondContact O-N 2.89Å; I536-L540 HydrophobicContact CG2-CD1 4.07Å; I536-L540 PolarHBondContact O-N 2.96Å; I536-I585 HydrophobicContact CG2-CG2 3.88Å; I536-F587 HydrophobicContact CD1-CD1 3.81Å; I536-F587 HydrophobicContact CD1-CD2 3.7Å; I536-F587 HydrophobicContact CD1-CE1 3.53Å; I536-F587 HydrophobicContact CD1-CE2 3.37Å; I536-F587 HydrophobicContact CD1-CG 3.89Å; I536-F587 HydrophobicContact CD1-CZ 3.29Å; I536-I599 HydrophobicContact CD1-CD1 4.27Å; I536-I599 HydrophobicContact CG1-CD1 4.14Å; I536-I602 HydrophobicContact CG2-CD1 4.45Å; I536-I602 HydrophobicContact CG2-CG2 3.84Å
537	E	75.9	Confident	68.2	Low	55 Å²	55	63.4 Å²	63.4	26%	0.257	38%	0.377	S	S	.	.	H	α-helix	trans	-63.5	-33	175.9	-70.5	175.2	152.5	0	0	111.6	R533 S541	R533-E537 HydrophobicContact CG-CG 4.24Å; R533-E537 WeakPolarHBondContact CG-OE2 3.41Å; R533-E537 IonicContact CZ-OE1 3.23Å; R533-E537 IonicContact NE-OE1 3.7Å; R533-E537 PolarHBondContact NE-OE1 2.76Å; R533-E537 IonicContact NE-OE2 2.7Å; R533-E537 PolarHBondContact NE-OE2 3.02Å; R533-E537 IonicContact NH2-OE1 2.82Å; R533-E537 PolarHBondContact NH2-OE1 3.37Å; R533-E537 PolarHBondContact O-N 3.38Å; E537-S541 WeakPolarHBondContact O-CB 3.45Å; E537-S541 PolarHBondContact O-N 3.14Å; E537-S541 VanDerWaalsContact O-N 3.09Å; E537-S541 PolarHBondContact O-OG 3.4Å
538	C	78.3	Confident	68.3	Low	14 Å²	14	68.5 Å²	68.5	10%	0.095	40%	0.398	C	S	.	.	H	α-helix	trans	-67	-45.6	172.9	-159.5	0	0	0	0	111.6	S534 C535 I536 S541 A542 C550 K553	S534-C538 WeakPolarHBondContact O-CB 3.46Å; C535-C538 WeakPolarHBondContact O-CB 3.37Å; C535-C538 PolarHBondContact O-N 3.47Å; I536-C538 VanDerWaalsContact C-N 3.26Å; I536-C538 PolarHBondContact O-N 2.04Å; C538-S541 PolarHBondContact O-N 3.3Å; C538-S541 PolarHBondContact O-OG 2.03Å; C538-A542 VanDerWaalsContact O-CB 3.23Å; C538-A542 WeakPolarHBondContact O-CB 3.06Å; C538-A542 PolarHBondContact O-N 2.94Å; C538-C550 HydrophobicContact CB-CB 3.83Å; C538-C550 WeakPolarHBondContact CB-SG 3.5Å; C538-C550 PolarHBondContact O-SG 2.86Å; C538-C550 WeakPolarHBondContact SG-CA 3.09Å; C538-C550 WeakPolarHBondContact SG-CB 3.31Å; C538-C550 CovalentContact SG-SG 2.04Å; C538-C550 PolarHBondContact SG-SG 3.21Å; C538-K553 HydrophobicContact CB-CD 4.45Å
539	H	78.1	Confident	68.3	Low	61 Å²	61	70.9 Å²	70.9	28%	0.282	40%	0.402	S	S	.	.	H	α-helix	trans	-64.4	-41.3	179.5	-172.7	-92.3	0	0	0	112.7	C535 I536 A542 R547 I561 E563	C535-H539 PolarHBondContact O-N 3.48Å; I536-H539 PolarHBondContact O-N 2.89Å; H539-A542 PolarHBondContact O-N 2.03Å; H539-R547 PolarHBondContact NE2-NH2 2.63Å; H539-I561 HydrophobicContact CB-CD1 3.55Å; H539-I561 VanDerWaalsContact CD2-CD1 3.43Å; H539-I561 WeakPolarHBondContact CD2-CD1 3.38Å; H539-E563 IonicContact CE1-OE1 2.73Å; H539-E563 IonicContact NE2-OE1 2.84Å; H539-E563 PolarHBondContact NE2-OE1 3.39Å
540	L	75.1	Confident	68.3	Low	64 Å²	64	70.5 Å²	70.5	34%	0.335	40%	0.399	S	S	.	.	H	α-helix	trans	-68.2	-36.1	176.8	-72.3	170.6	0	0	0	113.2	I536 I585 I602	I536-L540 HydrophobicContact CG2-CD1 4.07Å; I536-L540 PolarHBondContact O-N 2.96Å; L540-I585 HydrophobicContact CD1-CD1 3.84Å; L540-I585 HydrophobicContact CD1-CG1 4.05Å; L540-I585 HydrophobicContact CD1-CG2 3.85Å; L540-I602 HydrophobicContact CD1-CG2 4.04Å; L540-I602 HydrophobicContact CD2-CG2 3.94Å; L540-I602 HydrophobicContact CG-CG2 4.05Å
541	S	68	Low	68.3	Low	92 Å²	92	70.3 Å²	70.3	64%	0.643	40%	0.401	S	S	*	.	H	α-helix	trans	-80	-17.6	177.7	55.9	0	0	0	0	113.9	E537 C538 A543	E537-S541 WeakPolarHBondContact O-CB 3.45Å; E537-S541 PolarHBondContact O-N 3.14Å; E537-S541 VanDerWaalsContact O-N 3.09Å; E537-S541 PolarHBondContact O-OG 3.4Å; C538-S541 PolarHBondContact O-N 3.3Å; C538-S541 PolarHBondContact O-OG 2.03Å; S541-A543 PolarHBondContact O-N 2.04Å
542	A	63.4	Low	68.4	Low	14 Å²	14	71.5 Å²	71.5	12%	0.116	40%	0.402	C	S	.	.			trans	-77.8	55.4	-178.2	0	0	0	0	0	114	C538 H539 G544 A546	C538-A542 VanDerWaalsContact O-CB 3.23Å; C538-A542 WeakPolarHBondContact O-CB 3.06Å; C538-A542 PolarHBondContact O-N 2.94Å; H539-A542 PolarHBondContact O-N 2.03Å; A542-G544 VanDerWaalsContact C-N 3.28Å; A542-G544 PolarHBondContact O-N 3.24Å; A542-A546 HydrophobicContact CB-CB 4.23Å
543	A	55.7	Low	68.3	Low	101 Å²	101	75.1 Å²	75.1	84%	0.835	42%	0.418	S	S	*	.	S	Bend	trans	-68.7	79.7	171.7	0	0	0	0	0	112	S541	S541-A543 PolarHBondContact O-N 2.04Å
544	G	56.7	Low	68.2	Low	77 Å²	77	72.3 Å²	72.3	79%	0.794	41%	0.409	S	S	*	.	S	Bend	trans	105.4	-21.8	158.4	0	0	0	0	0	118	A542	A542-G544 VanDerWaalsContact C-N 3.28Å; A542-G544 PolarHBondContact O-N 3.24Å
545	Q	52.2	Low	68.1	Low	201 Å²	201	75.7 Å²	75.7	94%	0.939	42%	0.415	S	S	*	.	S	Bend	trans	-142.1	1.7	-171.6	-112.3	167.5	-13.6	0	0	117.8
546	A	52.9	Low	67.6	Low	43 Å²	43	83 Å²	83	36%	0.355	45%	0.453	S	S	.	.			trans	-117.5	22.7	-176.8	0	0	0	0	0	114.3	A542 E548	A542-A546 HydrophobicContact CB-CB 4.23Å; A546-E548 PolarHBondContact O-N 2.77Å
547	R	60.3	Low	67	Low	134 Å²	134	83.9 Å²	83.9	51%	0.506	46%	0.46	S	S	.	.	H	α-helix	trans	-71.6	-32	-166.9	-128.7	171.1	-167.5	-169.3	-2	114.4	H539 V551 E563	H539-R547 PolarHBondContact NE2-NH2 2.63Å; R547-V551 WeakPolarHBondContact O-CG2 2.99Å; R547-V551 PolarHBondContact O-N 3.37Å; R547-E563 IonicContact CZ-OE1 3.82Å; R547-E563 IonicContact NH1-OE1 3.79Å; R547-E563 IonicContact NH2-OE1 3.68Å; R547-E563 PolarHBondContact NH2-OE1 2.7Å
548	E	61.6	Low	66.8	Low	173 Å²	173	83.3 Å²	83.3	81%	0.808	47%	0.469	S	S	*	.	H	α-helix	trans	-70.6	-41	179.4	-67.9	-174.9	147.9	0	0	112.8	A546 C550 V551	A546-E548 PolarHBondContact O-N 2.77Å; E548-C550 VanDerWaalsContact C-N 3.27Å; E548-C550 PolarHBondContact O-N 3.1Å; E548-V551 WeakPolarHBondContact O-CB 3.38Å; E548-V551 PolarHBondContact O-N 2.97Å; E548-V551 VanDerWaalsContact O-N 3.08Å
549	E	63.3	Low	66.6	Low	140 Å²	140	83 Å²	83	65%	0.654	47%	0.467	S	S	*	.	H	α-helix	trans	-67.6	-27.8	-179.3	-162.8	176.2	-157.2	0	0	112.4
550	C	68.6	Low	66.6	Low	7 Å²	7	84.1 Å²	84.1	5%	0.047	48%	0.479	C	S	.	.	H	α-helix	trans	-73	-30	171.7	-63.3	0	0	0	0	113.4	C538 E548 D552 K553 C554	C538-C550 HydrophobicContact CB-CB 3.83Å; C538-C550 WeakPolarHBondContact CB-SG 3.5Å; C538-C550 PolarHBondContact O-SG 2.86Å; C538-C550 WeakPolarHBondContact SG-CA 3.09Å; C538-C550 WeakPolarHBondContact SG-CB 3.31Å; C538-C550 CovalentContact SG-SG 2.04Å; C538-C550 PolarHBondContact SG-SG 3.21Å; E548-C550 VanDerWaalsContact C-N 3.27Å; E548-C550 PolarHBondContact O-N 3.1Å; C550-D552 VanDerWaalsContact C-N 3.3Å; C550-D552 PolarHBondContact O-N 3.39Å; C550-K553 PolarHBondContact O-N 2.95Å; C550-C554 WeakPolarHBondContact O-CB 3.13Å; C550-C554 PolarHBondContact O-N 3.26Å; C550-C554 PolarHBondContact O-SG 3.06Å
551	V	70.7	Confident	66.8	Low	75 Å²	75	82.9 Å²	82.9	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-61.7	-40.8	178.9	168.3	0	0	0	0	110.8	R547 E548 C554 K555	R547-V551 WeakPolarHBondContact O-CG2 2.99Å; R547-V551 PolarHBondContact O-N 3.37Å; E548-V551 WeakPolarHBondContact O-CB 3.38Å; E548-V551 PolarHBondContact O-N 2.97Å; E548-V551 VanDerWaalsContact O-N 3.08Å; V551-C554 PolarHBondContact O-N 2.02Å; V551-K555 WeakPolarHBondContact O-CG 3.46Å; V551-K555 PolarHBondContact O-N 2.99Å
552	D	72.3	Confident	67.2	Low	91 Å²	91	79.9 Å²	79.9	49%	0.487	45%	0.451	S	S	.	.	H	α-helix	trans	-73.7	-32.2	178.3	-71.1	-21.6	0	0	0	112.8	C550 K555 L556	C550-D552 VanDerWaalsContact C-N 3.3Å; C550-D552 PolarHBondContact O-N 3.39Å; D552-K555 PolarHBondContact O-N 3.47Å; D552-K555 IonicContact OD1-NZ 2.85Å; D552-K555 PolarHBondContact OD1-NZ 2.7Å; D552-L556 WeakPolarHBondContact O-CB 3.35Å; D552-L556 PolarHBondContact O-N 3.24Å
553	K	72.8	Confident	67.2	Low	99 Å²	99	85.6 Å²	85.6	43%	0.43	48%	0.475	S	S	.	.	H	α-helix	trans	-63.8	-39	168.4	-73	179.7	-178.4	170.9	0	112.3	C538 C550 L556 A557	C538-K553 HydrophobicContact CB-CD 4.45Å; C550-K553 PolarHBondContact O-N 2.95Å; K553-L556 PolarHBondContact O-N 2.98Å; K553-A557 WeakPolarHBondContact O-CB 3.42Å; K553-A557 PolarHBondContact O-N 2.77Å
554	C	72.7	Confident	67.5	Low	10 Å²	10	88.2 Å²	88.2	7%	0.068	47%	0.47	C	S	.	.	H	α-helix	trans	-68.5	-39.5	175.6	-68.1	0	0	0	0	112.5	C535 C550 V551 A557 G558 A559	C535-C554 HydrophobicContact CB-CB 3.94Å; C535-C554 WeakPolarHBondContact CB-SG 3.42Å; C535-C554 VanDerWaalsContact SG-CA 3.6Å; C535-C554 WeakPolarHBondContact SG-CB 3.48Å; C535-C554 CovalentContact SG-SG 2.04Å; C535-C554 PolarHBondContact SG-SG 3.1Å; C550-C554 WeakPolarHBondContact O-CB 3.13Å; C550-C554 PolarHBondContact O-N 3.26Å; C550-C554 PolarHBondContact O-SG 3.06Å; V551-C554 PolarHBondContact O-N 2.02Å; C554-A557 CarbonylContact O-C 3.56Å; C554-A557 PolarHBondContact O-N 3.37Å; C554-G558 PolarHBondContact O-N 3.38Å; C554-A559 CarbonylContact C-O 3.53Å; C554-A559 WeakPolarHBondContact CB-O 3.43Å; C554-A559 PolarHBondContact O-N 3.29Å; C554-A559 VanDerWaalsContact O-O 3.11Å
555	K	74.4	Confident	67.6	Low	137 Å²	137	93.5 Å²	93.5	60%	0.596	47%	0.474	S	S	*	.	H	α-helix	trans	-60.5	-43.2	169.8	-70.9	173.4	-165.6	153.3	0	112.3	V551 D552 A557 G558	V551-K555 WeakPolarHBondContact O-CG 3.46Å; V551-K555 PolarHBondContact O-N 2.99Å; D552-K555 PolarHBondContact O-N 3.47Å; D552-K555 IonicContact OD1-NZ 2.85Å; D552-K555 PolarHBondContact OD1-NZ 2.7Å; K555-A557 VanDerWaalsContact C-N 3.31Å; K555-A557 PolarHBondContact O-N 3.14Å; K555-G558 WeakPolarHBondContact O-CA 3.34Å; K555-G558 PolarHBondContact O-N 2.98Å
556	L	69.3	Low	67.7	Low	155 Å²	155	92 Å²	92	81%	0.812	47%	0.473	S	S	*	.	H	α-helix	trans	-62.1	-36.6	174.6	-94.8	155.9	0	0	0	112.6	D552 K553 G558	D552-L556 WeakPolarHBondContact O-CB 3.35Å; D552-L556 PolarHBondContact O-N 3.24Å; K553-L556 PolarHBondContact O-N 2.98Å; L556-G558 PolarHBondContact O-N 2.97Å
557	A	65.2	Low	68.1	Low	18 Å²	18	92.1 Å²	92.1	15%	0.149	47%	0.466	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.5	-0.2	170.8	0	0	0	0	0	113.5	K532 C535 K553 C554 K555 A559	K532-A557 HydrophobicContact CD-CB 4.39Å; K532-A557 VanDerWaalsContact CD-O 3.28Å; K532-A557 WeakPolarHBondContact CD-O 3.35Å; K532-A557 WeakPolarHBondContact CE-O 3.28Å; K532-A557 PolarHBondContact NZ-O 3.26Å; C535-A557 HydrophobicContact CB-CB 4.22Å; K553-A557 WeakPolarHBondContact O-CB 3.42Å; K553-A557 PolarHBondContact O-N 2.77Å; C554-A557 CarbonylContact O-C 3.56Å; C554-A557 PolarHBondContact O-N 3.37Å; K555-A557 VanDerWaalsContact C-N 3.31Å; K555-A557 PolarHBondContact O-N 3.14Å; A557-A559 PolarHBondContact O-N 3.14Å
558	G	71.7	Confident	67.9	Low	43 Å²	43	89.7 Å²	89.7	44%	0.443	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.3	38.3	-179.3	0	0	0	0	0	114	K532 C554 K555 L556 T597	K532-G558 PolarHBondContact NZ-O 2.96Å; K532-G558 VanDerWaalsContact NZ-O 3.14Å; C554-G558 PolarHBondContact O-N 3.38Å; K555-G558 WeakPolarHBondContact O-CA 3.34Å; K555-G558 PolarHBondContact O-N 2.98Å; L556-G558 PolarHBondContact O-N 2.97Å; G558-T597 PolarHBondContact O-OG1 2.81Å
559	A	74.8	Confident	67.8	Low	7 Å²	7	88.8 Å²	88.8	6%	0.058	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	154.7	-179.5	0	0	0	0	0	114.2	K532 C554 A557 T597 I599	K532-A559 HydrophobicContact CD-CB 3.98Å; C554-A559 CarbonylContact C-O 3.53Å; C554-A559 WeakPolarHBondContact CB-O 3.43Å; C554-A559 PolarHBondContact O-N 3.29Å; C554-A559 VanDerWaalsContact O-O 3.11Å; A557-A559 PolarHBondContact O-N 3.14Å; A559-T597 VanDerWaalsContact CA-O 3.27Å; A559-T597 WeakPolarHBondContact CA-O 3.48Å; A559-T597 WeakPolarHBondContact CB-OG1 3.33Å; A559-I599 HydrophobicContact CB-CD1 3.78Å; A559-I599 HydrophobicContact CB-CG1 4.23Å
560	T	78.1	Confident	67.3	Low	85 Å²	85	90 Å²	90	52%	0.521	47%	0.473	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	140.4	174.8	-47.3	0	0	0	0	109.4	T597 I598 I599	T560-T597 PolarHBondContact N-O 2.04Å; T560-T597 VanDerWaalsContact N-O 3.13Å; T560-I598 CarbonylContact O-C 2.95Å; T560-I598 WeakPolarHBondContact O-CA 3.44Å; T560-I599 PolarHBondContact O-N 3.31Å
561	I	78.3	Confident	66.9	Low	38 Å²	38	92.7 Å²	92.7	20%	0.195	50%	0.503	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	135.3	176.7	-59.4	174.4	0	0	0	108.8	H539 I599 I602	H539-I561 HydrophobicContact CB-CD1 3.55Å; H539-I561 VanDerWaalsContact CD2-CD1 3.43Å; H539-I561 WeakPolarHBondContact CD2-CD1 3.38Å; I561-I599 HydrophobicContact CG1-CB 4.46Å; I561-I602 HydrophobicContact CD1-CD1 4.11Å; I561-I602 HydrophobicContact CG1-CD1 4.42Å; I561-I602 HydrophobicContact CG2-CD1 4.13Å
562	S	75.8	Confident	66.8	Low	29 Å²	29	90.5 Å²	90.5	20%	0.203	49%	0.491	C	S	.	.			trans	-122.1	138.9	175	61.7	0	0	0	0	111.1	I598 I599 H600	S562-I598 WeakPolarHBondContact OG-CG2 3.4Å; S562-I599 PolarHBondContact N-O 3.16Å; S562-I599 PolarHBondContact OG-O 3.27Å; S562-H600 PolarHBondContact OG-CE1 3.36Å; S562-H600 PolarHBondContact OG-ND1 2.81Å
563	E	64.5	Low	66.8	Low	134 Å²	134	90.6 Å²	90.6	63%	0.626	49%	0.494	S	S	*	.			trans	-101.9	10.1	178.8	-65.1	-176.2	169.3	0	0	112.3	H539 R547	H539-E563 IonicContact CE1-OE1 2.73Å; H539-E563 IonicContact NE2-OE1 2.84Å; H539-E563 PolarHBondContact NE2-OE1 3.39Å; R547-E563 IonicContact CZ-OE1 3.82Å; R547-E563 IonicContact NH1-OE1 3.79Å; R547-E563 IonicContact NH2-OE1 3.68Å; R547-E563 PolarHBondContact NH2-OE1 2.7Å
564	E	62.2	Low	67	Low	157 Å²	157	90.4 Å²	90.4	73%	0.734	51%	0.506	S	S	*	.			trans	-83.5	135.9	-178.8	-63.9	-178.5	168.3	0	0	111.6
565	E	57.3	Low	67.3	Low	188 Å²	188	90 Å²	90	88%	0.879	50%	0.503	S	S	*	.	S	Bend	trans	-87.4	-15.6	-176.2	-65.5	-169.5	142.4	0	0	114.1	F567	E565-F567 PolarHBondContact O-N 3.35Å
566	D	54.6	Low	67.3	Low	170 Å²	170	87.2 Å²	87.2	91%	0.909	50%	0.501	S	S	*	.			trans	-88.6	88.8	179.1	-94.6	-29.6	0	0	0	111.6
567	F	62.4	Low	67.5	Low	45 Å²	45	80.3 Å²	80.3	20%	0.197	46%	0.464	C	S	.	.			trans	-139.8	149.8	167.6	70	-85.3	0	0	0	112.8	E565 K569 L588 H600	E565-F567 PolarHBondContact O-N 3.35Å; F567-K569 HydrophobicContact CE2-CG 4.45Å; F567-K569 PolarHBondContact O-N 3.03Å; F567-L588 HydrophobicContact CE2-CD1 4.03Å; F567-L588 HydrophobicContact CZ-CD1 3.67Å; F567-H600 HydrophobicContact CD1-CB 4.28Å; F567-H600 AromaticContact CD1-ND1 3.58Å; F567-H600 HydrophobicContact CE1-CB 3.78Å; F567-H600 AromaticContact CE1-ND1 3.99Å; F567-H600 HydrophobicContact CE2-CB 4.36Å; F567-H600 AromaticContact CG-ND1 3.85Å; F567-H600 HydrophobicContact CZ-CB 3.83Å
568	S	56.7	Low	67.9	Low	82 Å²	82	85.2 Å²	85.2	57%	0.573	48%	0.484	S	S	*	.			trans	-70.6	125.1	177	179.1	0	0	0	0	111.1
569	K	58.7	Low	67.6	Low	154 Å²	154	83.6 Å²	83.6	67%	0.67	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-77.1	-26	178.5	-72	-177.5	178.6	174.4	0	113.3	F567 G571 S572	F567-K569 HydrophobicContact CE2-CG 4.45Å; F567-K569 PolarHBondContact O-N 3.03Å; K569-G571 PolarHBondContact O-N 3.36Å; K569-G571 VanDerWaalsContact O-N 3.09Å; K569-S572 PolarHBondContact O-N 2.95Å; K569-S572 VanDerWaalsContact O-N 3.09Å; K569-S572 PolarHBondContact O-OG 2.92Å
570	D	53.3	Low	67	Low	165 Å²	165	91.8 Å²	91.8	88%	0.882	51%	0.505	S	S	*	.	G	3₁₀ helix	trans	-69.3	-11.1	-169.9	-61.2	-29.3	0	0	0	114
571	G	58.5	Low	66.3	Low	65 Å²	65	93.5 Å²	93.5	67%	0.67	51%	0.51	S	S	*	.	G	3₁₀ helix	trans	-117.8	13.9	174.1	0	0	0	0	0	115	K569	K569-G571 PolarHBondContact O-N 3.36Å; K569-G571 VanDerWaalsContact O-N 3.09Å
572	S	69.1	Low	65.5	Low	29 Å²	29	98.1 Å²	98.1	20%	0.203	53%	0.531	C	S	.	.	P	Polyproline II helix	trans	-100.7	137.6	-172.8	67.2	0	0	0	0	113.5	K569	K569-S572 PolarHBondContact O-N 2.95Å; K569-S572 VanDerWaalsContact O-N 3.09Å; K569-S572 PolarHBondContact O-OG 2.92Å
573	V	73.8	Confident	65.3	Low	92 Å²	92	96.9 Å²	96.9	56%	0.558	52%	0.522	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.5	119.3	176.8	-178.9	0	0	0	0	109.6	L588 I589	V573-L588 CarbonylContact O-C 3.1Å; V573-L588 WeakPolarHBondContact O-CA 3.02Å; V573-I589 PolarHBondContact N-O 3.19Å; V573-I589 PolarHBondContact O-N 2.93Å
574	S	76.6	Confident	65.9	Low	96 Å²	96	93.9 Å²	93.9	67%	0.671	51%	0.51	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.2	121.4	176.8	-172.7	0	0	0	0	111.3
575	C	77.6	Confident	66.7	Low	2 Å²	2	86.7 Å²	86.7	1%	0.014	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	143.6	179.2	-76.3	0	0	0	0	111.3	C529 T586 F587 I589	C529-C575 VanDerWaalsContact CA-SG 3.6Å; C529-C575 HydrophobicContact CB-CB 3.65Å; C529-C575 WeakPolarHBondContact CB-SG 3.24Å; C529-C575 WeakPolarHBondContact SG-CB 3.34Å; C529-C575 CovalentContact SG-SG 2.04Å; C529-C575 PolarHBondContact SG-SG 3.37Å; C575-T586 WeakPolarHBondContact O-CA 3.46Å; C575-F587 HydrophobicContact CB-CD1 3.99Å; C575-F587 HydrophobicContact CB-CD2 3.86Å; C575-F587 HydrophobicContact CB-CE1 3.55Å; C575-F587 HydrophobicContact CB-CE2 3.44Å; C575-F587 VanDerWaalsContact CB-CE2 3.44Å; C575-F587 HydrophobicContact CB-CG 4.14Å; C575-F587 HydrophobicContact CB-CZ 3.27Å; C575-F587 PolarHBondContact N-O 3.3Å; C575-F587 PolarHBondContact O-N 2.81Å; C575-I589 VanDerWaalsContact SG-CD1 3.53Å
576	S	74.6	Confident	67.7	Low	78 Å²	78	79.8 Å²	79.8	55%	0.545	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	126.4	171.4	60.9	0	0	0	0	110.8	I585	S576-I585 CarbonylContact C-O 3.52Å; S576-I585 VanDerWaalsContact CA-O 3.31Å; S576-I585 WeakPolarHBondContact CA-O 3.03Å
577	L	75.1	Confident	69.1	Low	10 Å²	10	71.8 Å²	71.8	5%	0.052	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	145.5	177.3	-68.3	173.9	0	0	0	110.1	C529 N530 R533 I585 F587	C529-L577 HydrophobicContact CB-CD2 4.41Å; N530-L577 HydrophobicContact CB-CD2 4.47Å; R533-L577 HydrophobicContact CB-CD1 4.01Å; R533-L577 HydrophobicContact CG-CD1 4.26Å; L577-I585 PolarHBondContact N-O 3.32Å; L577-I585 PolarHBondContact O-N 3.44Å; L577-F587 HydrophobicContact CB-CE1 4.49Å; L577-F587 HydrophobicContact CD1-CE1 3.64Å; L577-F587 HydrophobicContact CD1-CZ 3.87Å; L577-F587 HydrophobicContact CG-CE1 3.8Å; L577-F587 HydrophobicContact CG-CZ 4.24Å
578	Q	71.8	Confident	70	Confident	120 Å²	120	71.3 Å²	71.3	56%	0.561	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	115.9	170.3	-165.3	172.9	14.5	0	0	109.3	R533	R533-Q578 PolarHBondContact NH1-O 3.01Å; R533-Q578 VanDerWaalsContact NH1-O 3.12Å; R533-Q578 PolarHBondContact NH2-O 3.29Å
579	G	65.6	Low	71.1	Confident	9 Å²	9	68.1 Å²	68.1	9%	0.093	38%	0.38	C	S	.	.			trans	-73.6	169.4	178.1	0	0	0	0	0	112.7	N581 E582 C583	G579-N581 PolarHBondContact O-N 3.17Å; G579-N581 VanDerWaalsContact O-N 3.13Å; G579-E582 PolarHBondContact O-N 3.16Å; G579-E582 VanDerWaalsContact O-N 3.15Å; G579-C583 PolarHBondContact N-O 2.85Å
580	E	63.7	Low	71.9	Confident	180 Å²	180	62 Å²	62	84%	0.841	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.1	179.3	-65.4	-169.6	138.9	0	0	113.6	E582	E580-E582 VanDerWaalsContact C-N 3.27Å; E580-E582 PolarHBondContact O-N 3.1Å
581	N	62	Low	72.9	Confident	120 Å²	120	59 Å²	59	64%	0.642	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	15.1	179.3	-63.8	-29.8	0	0	0	114.1	G579 C583	G579-N581 PolarHBondContact O-N 3.17Å; G579-N581 VanDerWaalsContact O-N 3.13Å; N581-C583 PolarHBondContact O-N 3.4Å
582	E	62.6	Low	73.3	Confident	135 Å²	135	58.4 Å²	58.4	63%	0.631	33%	0.325	S	S	*	.	S	Bend	trans	59.3	-3.1	-166.2	-61.5	-169	155.7	0	0	115.8	G579 E580 P608	G579-E582 PolarHBondContact O-N 3.16Å; G579-E582 VanDerWaalsContact O-N 3.15Å; E580-E582 VanDerWaalsContact C-N 3.27Å; E580-E582 PolarHBondContact O-N 3.1Å; E582-P608 HydrophobicContact CB-CG 4.4Å
583	C	71.7	Confident	72.9	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.02	36%	0.361	C	S	.	.			trans	-66	146.6	176.6	-48.8	0	0	0	0	112.3	G579 N581 E604 C607	G579-C583 PolarHBondContact N-O 2.85Å; N581-C583 PolarHBondContact O-N 3.4Å; C583-E604 HydrophobicContact CB-CG 3.83Å; C583-E604 WeakPolarHBondContact CB-OE1 3.24Å; C583-C607 HydrophobicContact CB-CB 4.18Å; C583-C607 WeakPolarHBondContact CB-SG 3.48Å; C583-C607 WeakPolarHBondContact SG-CA 3.03Å; C583-C607 WeakPolarHBondContact SG-CB 3.33Å; C583-C607 CovalentContact SG-SG 2.04Å; C583-C607 PolarHBondContact SG-SG 3.03Å
584	L	76.9	Confident	72.1	Confident	71 Å²	71	68.3 Å²	68.3	37%	0.372	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.8	177.9	-168.4	74.1	0	0	0	110.3	T586 K605	L584-T586 HydrophobicContact CD2-CG2 4.2Å; L584-T586 HydrophobicContact CG-CG2 4.29Å; L584-K605 PolarHBondContact N-O 2.82Å; L584-K605 PolarHBondContact O-N 3.4Å
585	I	78.8	Confident	71.2	Confident	7 Å²	7	66.7 Å²	66.7	4%	0.036	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	126.6	175	-56.9	166.2	0	0	0	108	I536 L540 S576 L577 F587 I602 N603 E604	I536-I585 HydrophobicContact CG2-CG2 3.88Å; L540-I585 HydrophobicContact CD1-CD1 3.84Å; L540-I585 HydrophobicContact CD1-CG1 4.05Å; L540-I585 HydrophobicContact CD1-CG2 3.85Å; S576-I585 CarbonylContact C-O 3.52Å; S576-I585 VanDerWaalsContact CA-O 3.31Å; S576-I585 WeakPolarHBondContact CA-O 3.03Å; L577-I585 PolarHBondContact N-O 3.32Å; L577-I585 PolarHBondContact O-N 3.44Å; I585-F587 HydrophobicContact CG2-CD1 4.46Å; I585-I602 HydrophobicContact CG2-CG2 4.22Å; I585-N603 CarbonylContact C-O 3.57Å; I585-N603 WeakPolarHBondContact CA-O 3.49Å; I585-E604 HydrophobicContact CG1-CG 4.49Å
586	T	78.7	Confident	70.8	Confident	42 Å²	42	71.5 Å²	71.5	26%	0.258	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	138.3	-180	51.6	0	0	0	0	110.3	C575 L584 I602 N603	C575-T586 WeakPolarHBondContact O-CA 3.46Å; L584-T586 HydrophobicContact CD2-CG2 4.2Å; L584-T586 HydrophobicContact CG-CG2 4.29Å; T586-I602 WeakPolarHBondContact O-CA 3.03Å; T586-N603 PolarHBondContact N-O 3.1Å; T586-N603 PolarHBondContact O-N 2.83Å; T586-N603 PolarHBondContact OG1-O 3.44Å
587	F	82.4	Confident	70.7	Confident	3 Å²	3	69 Å²	69	1%	0.013	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.6	163.5	-177.3	60.9	-80	0	0	0	111	C529 I536 C575 L577 I585 I589 I599 I602	C529-F587 HydrophobicContact CB-CZ 4.19Å; I536-F587 HydrophobicContact CD1-CD1 3.81Å; I536-F587 HydrophobicContact CD1-CD2 3.7Å; I536-F587 HydrophobicContact CD1-CE1 3.53Å; I536-F587 HydrophobicContact CD1-CE2 3.37Å; I536-F587 HydrophobicContact CD1-CG 3.89Å; I536-F587 HydrophobicContact CD1-CZ 3.29Å; C575-F587 HydrophobicContact CB-CD1 3.99Å; C575-F587 HydrophobicContact CB-CD2 3.86Å; C575-F587 HydrophobicContact CB-CE1 3.55Å; C575-F587 HydrophobicContact CB-CE2 3.44Å; C575-F587 VanDerWaalsContact CB-CE2 3.44Å; C575-F587 HydrophobicContact CB-CG 4.14Å; C575-F587 HydrophobicContact CB-CZ 3.27Å; C575-F587 PolarHBondContact N-O 3.3Å; C575-F587 PolarHBondContact O-N 2.81Å; L577-F587 HydrophobicContact CB-CE1 4.49Å; L577-F587 HydrophobicContact CD1-CE1 3.64Å; L577-F587 HydrophobicContact CD1-CZ 3.87Å; L577-F587 HydrophobicContact CG-CE1 3.8Å; L577-F587 HydrophobicContact CG-CZ 4.24Å; I585-F587 HydrophobicContact CG2-CD1 4.46Å; F587-I589 HydrophobicContact CD2-CG1 3.98Å; F587-I589 HydrophobicContact CE2-CD1 3.87Å; F587-I589 HydrophobicContact CE2-CG1 3.78Å; F587-I599 HydrophobicContact CB-CG2 4.27Å; F587-I599 HydrophobicContact CD2-CG2 3.95Å; F587-I599 HydrophobicContact CG-CG2 4.46Å; F587-I602 HydrophobicContact CB-CG1 4.11Å
588	L	81.1	Confident	70.9	Confident	34 Å²	34	70.6 Å²	70.6	18%	0.178	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	139.7	179.5	-71.7	157	0	0	0	109.9	F567 V573 I599 H600	F567-L588 HydrophobicContact CE2-CD1 4.03Å; F567-L588 HydrophobicContact CZ-CD1 3.67Å; V573-L588 CarbonylContact O-C 3.1Å; V573-L588 WeakPolarHBondContact O-CA 3.02Å; L588-I599 WeakPolarHBondContact O-CA 3.41Å; L588-H600 HydrophobicContact CB-CB 4.27Å; L588-H600 PolarHBondContact N-O 2.98Å; L588-H600 PolarHBondContact O-N 3.42Å
589	I	79.8	Confident	71.3	Confident	15 Å²	15	64.9 Å²	64.9	8%	0.077	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.5	174	-48.8	-179.7	0	0	0	109.5	V573 C575 F587 T597 I598	V573-I589 PolarHBondContact N-O 3.19Å; V573-I589 PolarHBondContact O-N 2.93Å; C575-I589 VanDerWaalsContact SG-CD1 3.53Å; F587-I589 HydrophobicContact CD2-CG1 3.98Å; F587-I589 HydrophobicContact CE2-CD1 3.87Å; F587-I589 HydrophobicContact CE2-CG1 3.78Å; I589-T597 HydrophobicContact CG2-CG2 4.12Å; I589-I598 WeakPolarHBondContact CA-O 3.23Å
590	T	76.9	Confident	71.9	Confident	26 Å²	26	65.3 Å²	65.3	16%	0.16	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	163.2	167.3	59	0	0	0	0	109.3	T597 I598 H600	T590-T597 CarbonylContact O-C 3.55Å; T590-T597 VanDerWaalsContact O-CA 3.32Å; T590-T597 WeakPolarHBondContact O-CA 3.15Å; T590-I598 PolarHBondContact N-O 3.1Å; T590-I598 PolarHBondContact O-N 3.49Å; T590-H600 PolarHBondContact OG1-CD2 3.15Å; T590-H600 PolarHBondContact OG1-NE2 2.99Å
591	T	74.5	Confident	72.4	Confident	102 Å²	102	59.4 Å²	59.4	63%	0.626	33%	0.328	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	134	172.6	40	0	0	0	0	110.2	K596 T597	T591-K596 WeakPolarHBondContact CA-O 3.05Å; T591-T597 HydrophobicContact CG2-CG2 3.97Å
592	D	67	Low	73.1	Confident	52 Å²	52	55.1 Å²	55.1	28%	0.278	31%	0.305	S	S	.	.			trans	-77.6	173.5	173.9	78.6	5.6	0	0	0	112.6	E594 G595 K596 I598	D592-E594 PolarHBondContact O-N 2.86Å; D592-E594 VanDerWaalsContact O-N 3.14Å; D592-E594 VanDerWaalsContact OD1-C 3.27Å; D592-E594 VanDerWaalsContact OD1-CA 3.3Å; D592-E594 WeakPolarHBondContact OD1-CA 3.05Å; D592-E594 WeakPolarHBondContact OD1-CB 3.45Å; D592-E594 PolarHBondContact OD1-N 2.84Å; D592-G595 PolarHBondContact O-N 2.9Å; D592-G595 PolarHBondContact OD1-N 3.1Å; D592-K596 PolarHBondContact N-O 3.46Å; D592-K596 PolarHBondContact OD1-N 3.41Å; D592-I598 HydrophobicContact CB-CD1 4.22Å
593	N	60.2	Low	73.5	Confident	180 Å²	180	52.4 Å²	52.4	96%	0.963	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.8	-7.2	179.4	-62.6	-30.6	0	0	0	113.9
594	E	56	Low	73.6	Confident	150 Å²	150	56.5 Å²	56.5	70%	0.701	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.4	2.9	173.8	-59.4	-173.3	169.3	0	0	112.3	D592 K596	D592-E594 PolarHBondContact O-N 2.86Å; D592-E594 VanDerWaalsContact O-N 3.14Å; D592-E594 VanDerWaalsContact OD1-C 3.27Å; D592-E594 VanDerWaalsContact OD1-CA 3.3Å; D592-E594 WeakPolarHBondContact OD1-CA 3.05Å; D592-E594 WeakPolarHBondContact OD1-CB 3.45Å; D592-E594 PolarHBondContact OD1-N 2.84Å; E594-K596 IonicContact OE2-NZ 2.72Å; E594-K596 PolarHBondContact OE2-NZ 3.15Å
595	G	58.2	Low	72.8	Confident	61 Å²	61	59.1 Å²	59.1	63%	0.629	32%	0.322	S	S	*	.	S	Bend	trans	83	10.7	-180	0	0	0	0	0	115.4	D592	D592-G595 PolarHBondContact O-N 2.9Å; D592-G595 PolarHBondContact OD1-N 3.1Å
596	K	68.5	Low	71.8	Confident	103 Å²	103	65.4 Å²	65.4	45%	0.448	36%	0.356	S	S	.	.			trans	-84.7	138.9	176.6	-63.4	167.5	-174.5	144.7	0	110.8	T591 D592 E594	T591-K596 WeakPolarHBondContact CA-O 3.05Å; D592-K596 PolarHBondContact N-O 3.46Å; D592-K596 PolarHBondContact OD1-N 3.41Å; E594-K596 IonicContact OE2-NZ 2.72Å; E594-K596 PolarHBondContact OE2-NZ 3.15Å
597	T	73.5	Confident	71	Confident	25 Å²	25	66.4 Å²	66.4	15%	0.153	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83	128	177.2	56.7	0	0	0	0	111.8	K532 G558 A559 T560 I589 T590 T591	K532-T597 PolarHBondContact NZ-OG1 3.02Å; G558-T597 PolarHBondContact O-OG1 2.81Å; A559-T597 VanDerWaalsContact CA-O 3.27Å; A559-T597 WeakPolarHBondContact CA-O 3.48Å; A559-T597 WeakPolarHBondContact CB-OG1 3.33Å; T560-T597 PolarHBondContact N-O 2.04Å; T560-T597 VanDerWaalsContact N-O 3.13Å; I589-T597 HydrophobicContact CG2-CG2 4.12Å; T590-T597 CarbonylContact O-C 3.55Å; T590-T597 VanDerWaalsContact O-CA 3.32Å; T590-T597 WeakPolarHBondContact O-CA 3.15Å; T591-T597 HydrophobicContact CG2-CG2 3.97Å
598	I	78.5	Confident	69.8	Low	45 Å²	45	70.2 Å²	70.2	23%	0.231	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	136.7	172.8	-53.4	175.3	0	0	0	108.5	T560 S562 I589 T590 D592 H600	T560-I598 CarbonylContact O-C 2.95Å; T560-I598 WeakPolarHBondContact O-CA 3.44Å; S562-I598 WeakPolarHBondContact OG-CG2 3.4Å; I589-I598 WeakPolarHBondContact CA-O 3.23Å; T590-I598 PolarHBondContact N-O 3.1Å; T590-I598 PolarHBondContact O-N 3.49Å; D592-I598 HydrophobicContact CB-CD1 4.22Å; I598-H600 WeakPolarHBondContact CG2-NE2 3.02Å
599	I	80.1	Confident	68.8	Low	0 Å²	0	77.8 Å²	77.8	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	127.8	-179.8	-59	172.2	0	0	0	109.1	K532 I536 A559 T560 I561 S562 F587 L588 I602	K532-I599 HydrophobicContact CB-CD1 4.04Å; K532-I599 HydrophobicContact CG-CD1 4.39Å; I536-I599 HydrophobicContact CD1-CD1 4.27Å; I536-I599 HydrophobicContact CG1-CD1 4.14Å; A559-I599 HydrophobicContact CB-CD1 3.78Å; A559-I599 HydrophobicContact CB-CG1 4.23Å; T560-I599 PolarHBondContact O-N 3.31Å; I561-I599 HydrophobicContact CG1-CB 4.46Å; S562-I599 PolarHBondContact N-O 3.16Å; S562-I599 PolarHBondContact OG-O 3.27Å; F587-I599 HydrophobicContact CB-CG2 4.27Å; F587-I599 HydrophobicContact CD2-CG2 3.95Å; F587-I599 HydrophobicContact CG-CG2 4.46Å; L588-I599 WeakPolarHBondContact O-CA 3.41Å; I599-I602 HydrophobicContact CG2-CD1 3.93Å; I599-I602 HydrophobicContact CG2-CG1 3.79Å
600	H	79.1	Confident	67.7	Low	18 Å²	18	82.7 Å²	82.7	8%	0.083	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	154.8	-178.9	-60.1	-96.9	0	0	0	111.5	S562 F567 L588 T590 I598 I602	S562-H600 PolarHBondContact OG-CE1 3.36Å; S562-H600 PolarHBondContact OG-ND1 2.81Å; F567-H600 HydrophobicContact CD1-CB 4.28Å; F567-H600 AromaticContact CD1-ND1 3.58Å; F567-H600 HydrophobicContact CE1-CB 3.78Å; F567-H600 AromaticContact CE1-ND1 3.99Å; F567-H600 HydrophobicContact CE2-CB 4.36Å; F567-H600 AromaticContact CG-ND1 3.85Å; F567-H600 HydrophobicContact CZ-CB 3.83Å; L588-H600 HydrophobicContact CB-CB 4.27Å; L588-H600 PolarHBondContact N-O 2.98Å; L588-H600 PolarHBondContact O-N 3.42Å; T590-H600 PolarHBondContact OG1-CD2 3.15Å; T590-H600 PolarHBondContact OG1-NE2 2.99Å; I598-H600 WeakPolarHBondContact CG2-NE2 3.02Å; H600-I602 PolarHBondContact O-N 3.27Å
601	S	73.6	Confident	66.9	Low	56 Å²	56	85.9 Å²	85.9	39%	0.392	47%	0.474	S	S	.	.	E	Extended strand (participates in β ladder)	trans	52.2	46.3	164.3	-50.8	0	0	0	0	115.8	N603	S601-N603 PolarHBondContact O-N 3Å; S601-N603 PolarHBondContact O-ND2 2.92Å
602	I	77.1	Confident	66.4	Low	30 Å²	30	86.5 Å²	86.5	15%	0.154	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	120.7	176	-52	172.8	0	0	0	109.8	I536 L540 I561 I585 T586 F587 I599 H600	I536-I602 HydrophobicContact CG2-CD1 4.45Å; I536-I602 HydrophobicContact CG2-CG2 3.84Å; L540-I602 HydrophobicContact CD1-CG2 4.04Å; L540-I602 HydrophobicContact CD2-CG2 3.94Å; L540-I602 HydrophobicContact CG-CG2 4.05Å; I561-I602 HydrophobicContact CD1-CD1 4.11Å; I561-I602 HydrophobicContact CG1-CD1 4.42Å; I561-I602 HydrophobicContact CG2-CD1 4.13Å; I585-I602 HydrophobicContact CG2-CG2 4.22Å; T586-I602 WeakPolarHBondContact O-CA 3.03Å; F587-I602 HydrophobicContact CB-CG1 4.11Å; I599-I602 HydrophobicContact CG2-CD1 3.93Å; I599-I602 HydrophobicContact CG2-CG1 3.79Å; H600-I602 PolarHBondContact O-N 3.27Å
603	N	71.8	Confident	66.4	Low	78 Å²	78	89.6 Å²	89.6	42%	0.417	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.5	-178.5	-77.8	-85.1	0	0	0	111.4	I585 T586 S601	I585-N603 CarbonylContact C-O 3.57Å; I585-N603 WeakPolarHBondContact CA-O 3.49Å; T586-N603 PolarHBondContact N-O 3.1Å; T586-N603 PolarHBondContact O-N 2.83Å; T586-N603 PolarHBondContact OG1-O 3.44Å; S601-N603 PolarHBondContact O-N 3Å; S601-N603 PolarHBondContact O-ND2 2.92Å
604	E	72.8	Confident	66.8	Low	89 Å²	89	85.4 Å²	85.4	42%	0.416	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	124.7	171.1	-172.1	175.5	-155.5	0	0	110	C583 I585	C583-E604 HydrophobicContact CB-CG 3.83Å; C583-E604 WeakPolarHBondContact CB-OE1 3.24Å; I585-E604 HydrophobicContact CG1-CG 4.49Å
605	K	60.6	Low	67.6	Low	126 Å²	126	85.1 Å²	85.1	55%	0.548	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	161.1	-179.9	-75.9	-176.2	177.4	173.5	0	111.9	L584 C607	L584-K605 PolarHBondContact N-O 2.82Å; L584-K605 PolarHBondContact O-N 3.4Å; K605-C607 PolarHBondContact O-N 2.84Å
606	D	57.5	Low	68.4	Low	139 Å²	139	86.8 Å²	86.8	74%	0.743	47%	0.465	S	S	*	.			trans	56.7	41	172.2	-59	-37.6	0	0	0	116.6
607	C	62.1	Low	68.7	Low	63 Å²	63	87.7 Å²	87.7	43%	0.426	47%	0.473	S	S	.	.			trans	-63.7	127.7	164.9	-63.8	0	0	0	0	111.7	C583 K605 K609	C583-C607 HydrophobicContact CB-CB 4.18Å; C583-C607 WeakPolarHBondContact CB-SG 3.48Å; C583-C607 WeakPolarHBondContact SG-CA 3.03Å; C583-C607 WeakPolarHBondContact SG-CB 3.33Å; C583-C607 CovalentContact SG-SG 2.04Å; C583-C607 PolarHBondContact SG-SG 3.03Å; K605-C607 PolarHBondContact O-N 2.84Å; C607-K609 PolarHBondContact O-N 2.91Å; C607-K609 VanDerWaalsContact O-N 3.13Å
608	P	57.5	Low	69	Low	82 Å²	82	92.3 Å²	92.3	53%	0.532	50%	0.496	S	S	.	.			trans	-68.1	111.4	180	25.7	-32.8	0	0	0	111.6	E582	E582-P608 HydrophobicContact CB-CG 4.4Å
609	K	59.4	Low	69.1	Low	193 Å²	193	92.1 Å²	92.1	84%	0.839	51%	0.505	S	S	*	.	P	Polyproline II helix	trans	-72.5	132.9	172.3	-67.8	173.9	-177.4	170.2	0	109.4	C607	C607-K609 PolarHBondContact O-N 2.91Å; C607-K609 VanDerWaalsContact O-N 3.13Å
610	P	56.5	Low	69.3	Low	118 Å²	118	96 Å²	96	77%	0.766	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-60.3	133.7	-179.9	24	-33.4	0	0	0	110.5
611	P	60.7	Low	69.5	Low	94 Å²	94	98.6 Å²	98.6	61%	0.61	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-66.6	142	-175.4	25.9	-34	0	0	0	111.3	I613 I616	P611-I613 VanDerWaalsContact C-N 3.26Å; P611-I613 PolarHBondContact O-N 3.13Å; P611-I616 HydrophobicContact CB-CD1 4.12Å
612	N	63.1	Low	70	Confident	114 Å²	114	100.9 Å²	100.9	61%	0.61	56%	0.556	S	S	*	*			trans	-72	79.6	174.5	-96	-46.2	0	0	0	111	P614 M615 I616	N612-P614 VanDerWaalsContact C-CD 3.4Å; N612-P614 VanDerWaalsContact C-N 3.32Å; N612-M615 HydrophobicContact CB-CB 4.12Å; N612-M615 WeakPolarHBondContact O-CB 3.01Å; N612-M615 PolarHBondContact O-N 3.19Å; N612-I616 PolarHBondContact O-N 3.32Å
613	I	67.2	Low	70.4	Confident	118 Å²	118	101.8 Å²	101.8	61%	0.605	57%	0.568	S	S	*	*	H	α-helix	trans	-40.9	-47.9	176.2	-63.7	168.4	0	0	0	113.5	P611 M615 I616 M617	P611-I613 VanDerWaalsContact C-N 3.26Å; P611-I613 PolarHBondContact O-N 3.13Å; I613-M615 VanDerWaalsContact C-N 3.31Å; I613-M615 PolarHBondContact O-N 3.05Å; I613-I616 PolarHBondContact O-N 3.33Å; I613-M617 HydrophobicContact CG2-CG 4.41Å; I613-M617 WeakPolarHBondContact O-CG 3.34Å; I613-M617 PolarHBondContact O-N 2.04Å; I613-M617 VanDerWaalsContact O-N 3.09Å
614	P	69.3	Low	71.2	Confident	92 Å²	92	103.6 Å²	103.6	60%	0.597	58%	0.576	S	S	*	*	H	α-helix	trans	-63.4	-32.1	179.2	23.4	-34.5	0	0	0	114	N612 L618	N612-P614 VanDerWaalsContact C-CD 3.4Å; N612-P614 VanDerWaalsContact C-N 3.32Å; P614-L618 WeakPolarHBondContact O-CB 3.01Å; P614-L618 PolarHBondContact O-N 2.04Å; P614-L618 VanDerWaalsContact O-N 3.11Å
615	M	72.9	Confident	72	Confident	144 Å²	144	105 Å²	105	71%	0.709	59%	0.586	S	S	*	*	H	α-helix	trans	-70.7	-40.1	178.7	-174.9	-177.5	-102.8	0	0	111.3	N612 I613 L618 G619	N612-M615 HydrophobicContact CB-CB 4.12Å; N612-M615 WeakPolarHBondContact O-CB 3.01Å; N612-M615 PolarHBondContact O-N 3.19Å; I613-M615 VanDerWaalsContact C-N 3.31Å; I613-M615 PolarHBondContact O-N 3.05Å; M615-L618 PolarHBondContact O-N 2.89Å; M615-G619 PolarHBondContact O-N 2.84Å
616	I	75.1	Confident	73.3	Confident	95 Å²	95	103.9 Å²	103.9	49%	0.487	59%	0.585	S	S	.	*	H	α-helix	trans	-65	-47.1	177.3	-61.6	172.2	0	0	0	110.2	P611 N612 I613 L618 G619 V620	P611-I616 HydrophobicContact CB-CD1 4.12Å; N612-I616 PolarHBondContact O-N 3.32Å; I613-I616 PolarHBondContact O-N 3.33Å; I616-L618 VanDerWaalsContact C-N 3.3Å; I616-L618 PolarHBondContact O-N 3.31Å; I616-G619 PolarHBondContact O-N 2.04Å; I616-V620 HydrophobicContact CG2-CG2 4.42Å; I616-V620 WeakPolarHBondContact O-CG2 3.27Å; I616-V620 PolarHBondContact O-N 3.42Å
617	M	75.1	Confident	74.8	Confident	123 Å²	123	102.3 Å²	102.3	61%	0.606	58%	0.576	S	S	*	*	H	α-helix	trans	-59.8	-40.2	177.8	-69.7	-62.9	-71.2	0	0	112.4	I613 S621	I613-M617 HydrophobicContact CG2-CG 4.41Å; I613-M617 WeakPolarHBondContact O-CG 3.34Å; I613-M617 PolarHBondContact O-N 2.04Å; I613-M617 VanDerWaalsContact O-N 3.09Å; M617-S621 VanDerWaalsContact O-CB 3.32Å; M617-S621 WeakPolarHBondContact O-CB 3.31Å; M617-S621 PolarHBondContact O-N 3.26Å; M617-S621 VanDerWaalsContact O-N 3.12Å; M617-S621 PolarHBondContact O-OG 3.46Å
618	L	78.9	Confident	76.1	Confident	121 Å²	121	100.9 Å²	100.9	63%	0.634	57%	0.572	S	S	*	*	H	α-helix	trans	-69.3	-42.1	178.6	-161.7	148.6	0	0	0	111.6	P614 M615 I616 S621 L622	P614-L618 WeakPolarHBondContact O-CB 3.01Å; P614-L618 PolarHBondContact O-N 2.04Å; P614-L618 VanDerWaalsContact O-N 3.11Å; M615-L618 PolarHBondContact O-N 2.89Å; I616-L618 VanDerWaalsContact C-N 3.3Å; I616-L618 PolarHBondContact O-N 3.31Å; L618-S621 PolarHBondContact O-N 3.31Å; L618-L622 WeakPolarHBondContact O-CB 3.32Å; L618-L622 PolarHBondContact O-N 3.26Å
619	G	80.3	Confident	77.6	Confident	41 Å²	41	100.5 Å²	100.5	42%	0.423	57%	0.568	S	S	.	*	H	α-helix	trans	-62.4	-48.1	176.4	0	0	0	0	0	113.5	M615 I616 S621 L622 A623	M615-G619 PolarHBondContact O-N 2.84Å; I616-G619 PolarHBondContact O-N 2.04Å; G619-S621 PolarHBondContact O-N 3.41Å; G619-L622 PolarHBondContact O-N 2.92Å; G619-A623 WeakPolarHBondContact O-CB 3.42Å; G619-A623 PolarHBondContact O-N 3.09Å
620	V	85.6	Confident	79	Confident	82 Å²	82	95 Å²	95	50%	0.497	55%	0.55	S	S	.	*	H	α-helix	trans	-63.3	-42.7	178.3	174.6	0	0	0	0	111.1	I616 L622 A623 I624	I616-V620 HydrophobicContact CG2-CG2 4.42Å; I616-V620 WeakPolarHBondContact O-CG2 3.27Å; I616-V620 PolarHBondContact O-N 3.42Å; V620-L622 PolarHBondContact O-N 3.2Å; V620-A623 PolarHBondContact O-N 3.33Å; V620-I624 HydrophobicContact CG1-CD1 3.92Å; V620-I624 WeakPolarHBondContact O-CG1 3.36Å; V620-I624 PolarHBondContact O-N 2.03Å; V620-I624 VanDerWaalsContact O-N 3.12Å
621	S	82.7	Confident	80.5	Confident	73 Å²	73	94.5 Å²	94.5	51%	0.51	54%	0.541	S	S	.	.	H	α-helix	trans	-62.3	-42.1	178	-58.7	0	0	0	0	112.1	M617 L618 G619 L625	M617-S621 VanDerWaalsContact O-CB 3.32Å; M617-S621 WeakPolarHBondContact O-CB 3.31Å; M617-S621 PolarHBondContact O-N 3.26Å; M617-S621 VanDerWaalsContact O-N 3.12Å; M617-S621 PolarHBondContact O-OG 3.46Å; L618-S621 PolarHBondContact O-N 3.31Å; G619-S621 PolarHBondContact O-N 3.41Å; S621-L625 PolarHBondContact O-N 3.13Å
622	L	83.2	Confident	81.9	Confident	104 Å²	104	95.3 Å²	95.3	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-67.2	-39.9	178.5	-152.8	84.2	0	0	0	111.9	L618 G619 V620 L625 L626	L618-L622 WeakPolarHBondContact O-CB 3.32Å; L618-L622 PolarHBondContact O-N 3.26Å; G619-L622 PolarHBondContact O-N 2.92Å; V620-L622 PolarHBondContact O-N 3.2Å; L622-L625 PolarHBondContact O-N 2.86Å; L622-L626 HydrophobicContact CD2-CD1 4.47Å; L622-L626 WeakPolarHBondContact O-CB 3.31Å; L622-L626 PolarHBondContact O-N 3.04Å
623	A	85.6	Confident	83	Confident	48 Å²	48	93.2 Å²	93.2	40%	0.397	53%	0.533	S	S	.	.	H	α-helix	trans	-64	-45.6	179.2	0	0	0	0	0	112.4	G619 V620 L625 L626 I627	G619-A623 WeakPolarHBondContact O-CB 3.42Å; G619-A623 PolarHBondContact O-N 3.09Å; V620-A623 PolarHBondContact O-N 3.33Å; A623-L625 VanDerWaalsContact C-N 3.31Å; A623-L625 PolarHBondContact O-N 3.42Å; A623-L626 PolarHBondContact O-N 2.88Å; A623-I627 VanDerWaalsContact O-CG1 3.31Å; A623-I627 WeakPolarHBondContact O-CG1 3.13Å; A623-I627 PolarHBondContact O-N 3.44Å
624	I	90	Very high	83.9	Confident	117 Å²	117	91.7 Å²	91.7	60%	0.6	53%	0.525	S	S	*	.	H	α-helix	trans	-60.4	-43.2	176.6	-66.9	167.6	0	0	0	110.6	V620 I627 G628	V620-I624 HydrophobicContact CG1-CD1 3.92Å; V620-I624 WeakPolarHBondContact O-CG1 3.36Å; V620-I624 PolarHBondContact O-N 2.03Å; V620-I624 VanDerWaalsContact O-N 3.12Å; I624-I627 PolarHBondContact O-N 2.97Å; I624-G628 PolarHBondContact O-N 3.06Å
625	L	88.5	Confident	84.9	Confident	119 Å²	119	95.3 Å²	95.3	62%	0.623	53%	0.527	S	S	*	.	H	α-helix	trans	-66.8	-41.2	-179.8	-165.1	145.9	0	0	0	112	S621 L622 A623 G628 V629	S621-L625 PolarHBondContact O-N 3.13Å; L622-L625 PolarHBondContact O-N 2.86Å; A623-L625 VanDerWaalsContact C-N 3.31Å; A623-L625 PolarHBondContact O-N 3.42Å; L625-G628 PolarHBondContact O-N 2.8Å; L625-V629 HydrophobicContact CD2-CG2 4.33Å; L625-V629 WeakPolarHBondContact O-CG2 3.47Å; L625-V629 PolarHBondContact O-N 3.03Å
626	L	87.9	Confident	85.7	Confident	101 Å²	101	95.7 Å²	95.7	53%	0.529	53%	0.525	S	S	.	.	H	α-helix	trans	-61.5	-45.2	173.8	-90.4	161.7	0	0	0	112.5	L622 A623 G628 V629 V630	L622-L626 HydrophobicContact CD2-CD1 4.47Å; L622-L626 WeakPolarHBondContact O-CB 3.31Å; L622-L626 PolarHBondContact O-N 3.04Å; A623-L626 PolarHBondContact O-N 2.88Å; L626-G628 VanDerWaalsContact C-N 3.32Å; L626-G628 PolarHBondContact O-N 3.08Å; L626-V629 PolarHBondContact O-N 2.78Å; L626-V630 WeakPolarHBondContact O-CG2 3.44Å; L626-V630 PolarHBondContact O-N 3.07Å
627	I	89.8	Confident	86.2	Confident	106 Å²	106	97.2 Å²	97.2	54%	0.544	53%	0.533	S	S	.	.	H	α-helix	trans	-60.2	-43.5	177.2	-68.7	164.6	0	0	0	110.5	A623 I624 V629 V630 L631	A623-I627 VanDerWaalsContact O-CG1 3.31Å; A623-I627 WeakPolarHBondContact O-CG1 3.13Å; A623-I627 PolarHBondContact O-N 3.44Å; I624-I627 PolarHBondContact O-N 2.97Å; I627-V629 PolarHBondContact O-N 2.85Å; I627-V630 PolarHBondContact O-N 3.23Å; I627-L631 HydrophobicContact CG2-CD1 4.01Å; I627-L631 HydrophobicContact CG2-CG 4.49Å; I627-L631 WeakPolarHBondContact O-CG 3.44Å; I627-L631 PolarHBondContact O-N 2.71Å
628	G	88.8	Confident	86.7	Confident	34 Å²	34	97 Å²	97	35%	0.351	53%	0.534	S	S	.	.	H	α-helix	trans	-59	-44.8	175.2	0	0	0	0	0	113.2	I624 L625 L626 L631 L632	I624-G628 PolarHBondContact O-N 3.06Å; L625-G628 PolarHBondContact O-N 2.8Å; L626-G628 VanDerWaalsContact C-N 3.32Å; L626-G628 PolarHBondContact O-N 3.08Å; G628-L631 PolarHBondContact O-N 3.35Å; G628-L632 WeakPolarHBondContact O-CG 3.02Å; G628-L632 PolarHBondContact O-N 2.02Å; G628-L632 VanDerWaalsContact O-N 3.08Å
629	V	89	Confident	87.1	Confident	73 Å²	73	93.9 Å²	93.9	44%	0.442	52%	0.519	S	S	.	.	H	α-helix	trans	-65	-43.6	176.8	173	0	0	0	0	111.6	L625 L626 I627 L631 L632 C633	L625-V629 HydrophobicContact CD2-CG2 4.33Å; L625-V629 WeakPolarHBondContact O-CG2 3.47Å; L625-V629 PolarHBondContact O-N 3.03Å; L626-V629 PolarHBondContact O-N 2.78Å; I627-V629 PolarHBondContact O-N 2.85Å; V629-L631 PolarHBondContact O-N 2.58Å; V629-L632 PolarHBondContact O-N 3.44Å; V629-C633 PolarHBondContact O-N 2.95Å; V629-C633 PolarHBondContact O-SG 3.41Å
630	V	88.5	Confident	87.3	Confident	78 Å²	78	94.6 Å²	94.6	47%	0.473	52%	0.518	S	S	.	.	H	α-helix	trans	-61.2	-44.2	177.9	169.7	0	0	0	0	111.2	L626 I627 L632 C633 I634	L626-V630 WeakPolarHBondContact O-CG2 3.44Å; L626-V630 PolarHBondContact O-N 3.07Å; I627-V630 PolarHBondContact O-N 3.23Å; V630-L632 PolarHBondContact O-N 3.32Å; V630-C633 PolarHBondContact O-N 3.04Å; V630-I634 HydrophobicContact CG1-CD1 3.8Å; V630-I634 HydrophobicContact CG1-CG1 4.44Å; V630-I634 WeakPolarHBondContact O-CG1 3.44Å; V630-I634 PolarHBondContact O-N 3.25Å
631	L	88.8	Confident	87.3	Confident	108 Å²	108	98 Å²	98	57%	0.565	53%	0.526	S	S	*	.	H	α-helix	trans	-62.9	-40.1	176.3	-71.5	171.7	0	0	0	112.3	I627 G628 V629 I634 W635	I627-L631 HydrophobicContact CG2-CD1 4.01Å; I627-L631 HydrophobicContact CG2-CG 4.49Å; I627-L631 WeakPolarHBondContact O-CG 3.44Å; I627-L631 PolarHBondContact O-N 2.71Å; G628-L631 PolarHBondContact O-N 3.35Å; V629-L631 PolarHBondContact O-N 2.58Å; L631-I634 PolarHBondContact O-N 3.13Å; L631-W635 WeakPolarHBondContact O-CB 3.34Å; L631-W635 PolarHBondContact O-N 3.37Å
632	L	89.3	Confident	87.4	Confident	111 Å²	111	99.7 Å²	99.7	58%	0.581	53%	0.526	S	S	*	.	H	α-helix	trans	-66	-37.9	174.1	-72.7	172.5	0	0	0	112.5	G628 V629 V630 W635 K636	G628-L632 WeakPolarHBondContact O-CG 3.02Å; G628-L632 PolarHBondContact O-N 2.02Å; G628-L632 VanDerWaalsContact O-N 3.08Å; V629-L632 PolarHBondContact O-N 3.44Å; V630-L632 PolarHBondContact O-N 3.32Å; L632-W635 HydrophobicContact CD2-CE3 4.45Å; L632-K636 VanDerWaalsContact O-CB 3.28Å; L632-K636 WeakPolarHBondContact O-CB 3.2Å; L632-K636 PolarHBondContact O-N 2.91Å
633	C	85.9	Confident	87.4	Confident	70 Å²	70	99 Å²	99	47%	0.473	52%	0.523	S	S	.	.	H	α-helix	trans	-64.9	-45	173.7	-76.4	0	0	0	0	112	V629 V630 K636 L637	V629-C633 PolarHBondContact O-N 2.95Å; V629-C633 PolarHBondContact O-SG 3.41Å; V630-C633 PolarHBondContact O-N 3.04Å; C633-K636 PolarHBondContact O-N 3.12Å; C633-L637 WeakPolarHBondContact O-CB 3.43Å; C633-L637 WeakPolarHBondContact O-CG 3.48Å; C633-L637 PolarHBondContact O-N 2.98Å
634	I	87.4	Confident	87.3	Confident	85 Å²	85	105.8 Å²	105.8	44%	0.436	54%	0.538	S	S	.	.	H	α-helix	trans	-61.5	-47.7	175.6	-68.9	167.2	0	0	0	110.2	V630 L631 K636 L637 L638	V630-I634 HydrophobicContact CG1-CD1 3.8Å; V630-I634 HydrophobicContact CG1-CG1 4.44Å; V630-I634 WeakPolarHBondContact O-CG1 3.44Å; V630-I634 PolarHBondContact O-N 3.25Å; L631-I634 PolarHBondContact O-N 3.13Å; I634-K636 PolarHBondContact O-N 2.9Å; I634-L637 PolarHBondContact O-N 2.9Å; I634-L638 HydrophobicContact CG2-CD1 3.94Å; I634-L638 HydrophobicContact CG2-CG 4.37Å; I634-L638 WeakPolarHBondContact O-CG 3.21Å; I634-L638 PolarHBondContact O-N 2.94Å
635	W	89.1	Confident	87	Confident	168 Å²	168	106.7 Å²	106.7	64%	0.636	54%	0.538	S	S	*	.	H	α-helix	trans	-59	-46.7	177.1	177.6	67.3	0	0	0	112	L631 L632 L637 L638 V639	L631-W635 WeakPolarHBondContact O-CB 3.34Å; L631-W635 PolarHBondContact O-N 3.37Å; L632-W635 HydrophobicContact CD2-CE3 4.45Å; W635-L637 VanDerWaalsContact C-N 3.34Å; W635-L637 PolarHBondContact O-N 3.12Å; W635-L638 PolarHBondContact O-N 2.04Å; W635-V639 HydrophobicContact CD2-CG2 4.41Å; W635-V639 HydrophobicContact CZ2-CG2 4.31Å; W635-V639 WeakPolarHBondContact O-CG2 3.33Å; W635-V639 PolarHBondContact O-N 3.07Å
636	K	89.8	Confident	86.8	Confident	153 Å²	153	104.4 Å²	104.4	67%	0.665	52%	0.524	S	S	*	.	H	α-helix	trans	-63.9	-36	177.5	-171.4	174.8	-177.6	177.6	0	112.7	L632 C633 I634 S640	L632-K636 VanDerWaalsContact O-CB 3.28Å; L632-K636 WeakPolarHBondContact O-CB 3.2Å; L632-K636 PolarHBondContact O-N 2.91Å; C633-K636 PolarHBondContact O-N 3.12Å; I634-K636 PolarHBondContact O-N 2.9Å; K636-S640 WeakPolarHBondContact O-CB 3.01Å; K636-S640 PolarHBondContact O-N 2.87Å
637	L	85.9	Confident	86.5	Confident	126 Å²	126	103.5 Å²	103.5	66%	0.66	52%	0.522	S	S	*	.	H	α-helix	trans	-67.4	-44.3	173.8	-77.3	170.5	0	0	0	111.9	C633 I634 W635 S640 F641	C633-L637 WeakPolarHBondContact O-CB 3.43Å; C633-L637 WeakPolarHBondContact O-CG 3.48Å; C633-L637 PolarHBondContact O-N 2.98Å; I634-L637 PolarHBondContact O-N 2.9Å; W635-L637 VanDerWaalsContact C-N 3.34Å; W635-L637 PolarHBondContact O-N 3.12Å; L637-S640 PolarHBondContact O-N 3.34Å; L637-F641 WeakPolarHBondContact O-CB 3.48Å; L637-F641 PolarHBondContact O-N 2.91Å
638	L	86.3	Confident	86.1	Confident	119 Å²	119	101.1 Å²	101.1	62%	0.623	52%	0.519	S	S	*	.	H	α-helix	trans	-62.6	-45.8	177	-71.7	173.2	0	0	0	111.7	I634 W635 F641 H642	I634-L638 HydrophobicContact CG2-CD1 3.94Å; I634-L638 HydrophobicContact CG2-CG 4.37Å; I634-L638 WeakPolarHBondContact O-CG 3.21Å; I634-L638 PolarHBondContact O-N 2.94Å; W635-L638 PolarHBondContact O-N 2.04Å; L638-F641 PolarHBondContact O-N 3.47Å; L638-H642 WeakPolarHBondContact O-CB 3.38Å; L638-H642 PolarHBondContact O-N 3.41Å
639	V	87.6	Confident	85.8	Confident	55 Å²	55	104 Å²	104	33%	0.333	52%	0.521	S	S	.	.	H	α-helix	trans	-62.2	-48.6	174.5	173.1	0	0	0	0	110.5	W635 F641 H642 D643	W635-V639 HydrophobicContact CD2-CG2 4.41Å; W635-V639 HydrophobicContact CZ2-CG2 4.31Å; W635-V639 WeakPolarHBondContact O-CG2 3.33Å; W635-V639 PolarHBondContact O-N 3.07Å; V639-F641 VanDerWaalsContact C-N 3.29Å; V639-F641 PolarHBondContact O-N 3.1Å; V639-H642 PolarHBondContact O-N 2.75Å; V639-H642 VanDerWaalsContact O-N 3.11Å; V639-D643 WeakPolarHBondContact O-CB 3.36Å; V639-D643 PolarHBondContact O-N 3.39Å
640	S	84.5	Confident	85.2	Confident	57 Å²	57	106.8 Å²	106.8	40%	0.399	53%	0.528	S	S	.	.	H	α-helix	trans	-64.2	-32.1	-179.7	-170.9	0	0	0	0	113.3	K636 L637 R644	K636-S640 WeakPolarHBondContact O-CB 3.01Å; K636-S640 PolarHBondContact O-N 2.87Å; L637-S640 PolarHBondContact O-N 3.34Å; S640-R644 WeakPolarHBondContact O-CB 3.19Å; S640-R644 VanDerWaalsContact O-CG 3.32Å; S640-R644 WeakPolarHBondContact O-CG 3.02Å; S640-R644 PolarHBondContact O-N 3.32Å
641	F	85.8	Confident	84.7	Confident	153 Å²	153	108.7 Å²	108.7	67%	0.671	53%	0.532	S	S	*	.	H	α-helix	trans	-71.7	-40.4	172.8	-171	-95	0	0	0	111.9	L637 L638 V639 R644 K645	L637-F641 WeakPolarHBondContact O-CB 3.48Å; L637-F641 PolarHBondContact O-N 2.91Å; L638-F641 PolarHBondContact O-N 3.47Å; V639-F641 VanDerWaalsContact C-N 3.29Å; V639-F641 PolarHBondContact O-N 3.1Å; F641-R644 PolarHBondContact O-N 3.1Å; F641-K645 WeakPolarHBondContact O-CB 3.44Å; F641-K645 PolarHBondContact O-N 3.03Å
642	H	84.3	Confident	84.1	Confident	108 Å²	108	105.5 Å²	105.5	50%	0.5	52%	0.521	S	S	.	.	H	α-helix	trans	-64.1	-47.9	174.7	-168.9	76.4	0	0	0	111.5	L638 V639 R644 K645 E646	L638-H642 WeakPolarHBondContact O-CB 3.38Å; L638-H642 PolarHBondContact O-N 3.41Å; V639-H642 PolarHBondContact O-N 2.75Å; V639-H642 VanDerWaalsContact O-N 3.11Å; H642-R644 PolarHBondContact O-N 2.78Å; H642-K645 CarbonylContact O-C 3.53Å; H642-K645 WeakPolarHBondContact O-CA 3.48Å; H642-K645 WeakPolarHBondContact O-CB 3.04Å; H642-K645 PolarHBondContact O-N 3.01Å; H642-E646 PolarHBondContact O-N 3.36Å
643	D	82.9	Confident	83.4	Confident	90 Å²	90	105.4 Å²	105.4	48%	0.481	52%	0.517	S	S	.	.	H	α-helix	trans	-59.7	-44.2	175.4	-73.5	-14.6	0	0	0	111.5	V639 K645 E646 V647	V639-D643 WeakPolarHBondContact O-CB 3.36Å; V639-D643 PolarHBondContact O-N 3.39Å; D643-K645 VanDerWaalsContact C-N 3.28Å; D643-K645 PolarHBondContact O-N 2.98Å; D643-E646 PolarHBondContact O-N 2.06Å; D643-V647 VanDerWaalsContact O-CB 3.3Å; D643-V647 WeakPolarHBondContact O-CB 3.49Å; D643-V647 VanDerWaalsContact O-CG2 3.23Å; D643-V647 WeakPolarHBondContact O-CG2 3.47Å; D643-V647 PolarHBondContact O-N 3.03Å
644	R	83.1	Confident	82.6	Confident	190 Å²	190	110.6 Å²	110.6	72%	0.717	53%	0.527	S	S	*	.	H	α-helix	trans	-60.6	-37.5	173.8	-82.3	-177.8	174.5	-164.8	-0.3	112.4	S640 F641 H642 A648	S640-R644 WeakPolarHBondContact O-CB 3.19Å; S640-R644 VanDerWaalsContact O-CG 3.32Å; S640-R644 WeakPolarHBondContact O-CG 3.02Å; S640-R644 PolarHBondContact O-N 3.32Å; F641-R644 PolarHBondContact O-N 3.1Å; H642-R644 PolarHBondContact O-N 2.78Å; R644-A648 VanDerWaalsContact O-CB 3.26Å; R644-A648 WeakPolarHBondContact O-CB 3.15Å; R644-A648 PolarHBondContact O-N 2.04Å
645	K	84.6	Confident	81.6	Confident	136 Å²	136	110.9 Å²	110.9	59%	0.591	54%	0.537	S	S	*	.	H	α-helix	trans	-70.2	-43.6	178.3	-170.9	179.6	179.9	-177.6	0	111.8	F641 H642 D643 A648 K649	F641-K645 WeakPolarHBondContact O-CB 3.44Å; F641-K645 PolarHBondContact O-N 3.03Å; H642-K645 CarbonylContact O-C 3.53Å; H642-K645 WeakPolarHBondContact O-CA 3.48Å; H642-K645 WeakPolarHBondContact O-CB 3.04Å; H642-K645 PolarHBondContact O-N 3.01Å; D643-K645 VanDerWaalsContact C-N 3.28Å; D643-K645 PolarHBondContact O-N 2.98Å; K645-A648 PolarHBondContact O-N 2.98Å; K645-K649 VanDerWaalsContact O-CB 3.28Å; K645-K649 WeakPolarHBondContact O-CB 3.19Å; K645-K649 PolarHBondContact O-N 3.11Å
646	E	83.2	Confident	80.4	Confident	72 Å²	72	111 Å²	111	34%	0.336	54%	0.542	S	S	.	.	H	α-helix	trans	-72.3	-33.8	176.7	-70.7	-58.5	132.6	0	0	112.2	H642 D643 K649 F650	H642-E646 PolarHBondContact O-N 3.36Å; D643-E646 PolarHBondContact O-N 2.06Å; E646-K649 PolarHBondContact O-N 2.04Å; E646-K649 IonicContact OE1-NZ 2.7Å; E646-K649 PolarHBondContact OE1-NZ 3.39Å; E646-K649 IonicContact OE2-NZ 3.67Å; E646-K649 PolarHBondContact OE2-NZ 3.22Å; E646-F650 VanDerWaalsContact O-CB 3.23Å; E646-F650 WeakPolarHBondContact O-CB 3.47Å; E646-F650 PolarHBondContact O-N 3.19Å
647	V	83.1	Confident	78.9	Confident	81 Å²	81	106.2 Å²	106.2	49%	0.491	53%	0.531	S	S	.	.	H	α-helix	trans	-64.9	-46.4	170.3	169.5	0	0	0	0	111	D643 K649 F650 E651	D643-V647 VanDerWaalsContact O-CB 3.3Å; D643-V647 WeakPolarHBondContact O-CB 3.49Å; D643-V647 VanDerWaalsContact O-CG2 3.23Å; D643-V647 WeakPolarHBondContact O-CG2 3.47Å; D643-V647 PolarHBondContact O-N 3.03Å; V647-K649 VanDerWaalsContact C-N 3.29Å; V647-K649 PolarHBondContact O-N 3.03Å; V647-F650 PolarHBondContact O-N 2.89Å; V647-E651 WeakPolarHBondContact O-CG 3.07Å; V647-E651 PolarHBondContact O-N 2.03Å
648	A	80.9	Confident	77.1	Confident	57 Å²	57	109.5 Å²	109.5	47%	0.471	54%	0.54	S	S	.	.	H	α-helix	trans	-62	-37.3	176.1	0	0	0	0	0	112.2	R644 K645 A652	R644-A648 VanDerWaalsContact O-CB 3.26Å; R644-A648 WeakPolarHBondContact O-CB 3.15Å; R644-A648 PolarHBondContact O-N 2.04Å; K645-A648 PolarHBondContact O-N 2.98Å; A648-A652 VanDerWaalsContact O-CB 3.31Å; A648-A652 WeakPolarHBondContact O-CB 3.02Å; A648-A652 PolarHBondContact O-N 3.13Å
649	K	81.6	Confident	75.4	Confident	93 Å²	93	115.2 Å²	115.2	40%	0.404	55%	0.553	S	S	.	*	H	α-helix	trans	-67.1	-42.6	172.9	179.9	178.8	151.9	-143.6	0	111.8	K645 E646 V647 A652 E653	K645-K649 VanDerWaalsContact O-CB 3.28Å; K645-K649 WeakPolarHBondContact O-CB 3.19Å; K645-K649 PolarHBondContact O-N 3.11Å; E646-K649 PolarHBondContact O-N 2.04Å; E646-K649 IonicContact OE1-NZ 2.7Å; E646-K649 PolarHBondContact OE1-NZ 3.39Å; E646-K649 IonicContact OE2-NZ 3.67Å; E646-K649 PolarHBondContact OE2-NZ 3.22Å; V647-K649 VanDerWaalsContact C-N 3.29Å; V647-K649 PolarHBondContact O-N 3.03Å; K649-A652 CarbonylContact O-C 3.6Å; K649-A652 WeakPolarHBondContact O-CB 3.45Å; K649-A652 PolarHBondContact O-N 2.93Å; K649-E653 WeakPolarHBondContact CE-OE1 2.98Å; K649-E653 WeakPolarHBondContact O-CG 3.02Å; K649-E653 PolarHBondContact O-N 2.83Å
650	F	77.7	Confident	73.4	Confident	132 Å²	132	121.3 Å²	121.3	58%	0.579	58%	0.578	S	S	*	*	H	α-helix	trans	-64.9	-38.6	176.1	-177.4	-100.3	0	0	0	112.2	E646 V647 E653 R654	E646-F650 VanDerWaalsContact O-CB 3.23Å; E646-F650 WeakPolarHBondContact O-CB 3.47Å; E646-F650 PolarHBondContact O-N 3.19Å; V647-F650 PolarHBondContact O-N 2.89Å; F650-E653 PolarHBondContact O-N 3.14Å; F650-R654 WeakPolarHBondContact O-CB 3.36Å; F650-R654 PolarHBondContact O-N 3.38Å
651	E	76.4	Confident	71.6	Confident	118 Å²	118	125.3 Å²	125.3	55%	0.551	60%	0.6	S	S	*	*	H	α-helix	trans	-68.1	-36.9	172.1	-71	-171.7	155.5	0	0	112.1	V647 S655	V647-E651 WeakPolarHBondContact O-CG 3.07Å; V647-E651 PolarHBondContact O-N 2.03Å; E651-S655 WeakPolarHBondContact O-CB 2.99Å; E651-S655 PolarHBondContact O-N 3.26Å; E651-S655 PolarHBondContact O-OG 3.4Å
652	A	76.1	Confident	69.6	Low	41 Å²	41	121.7 Å²	121.7	34%	0.339	61%	0.606	S	S	.	*	H	α-helix	trans	-67.1	-33.5	172.7	0	0	0	0	0	113.1	A648 K649 S655 K656	A648-A652 VanDerWaalsContact O-CB 3.31Å; A648-A652 WeakPolarHBondContact O-CB 3.02Å; A648-A652 PolarHBondContact O-N 3.13Å; K649-A652 CarbonylContact O-C 3.6Å; K649-A652 WeakPolarHBondContact O-CB 3.45Å; K649-A652 PolarHBondContact O-N 2.93Å; A652-S655 WeakPolarHBondContact CA-OG 3.17Å; A652-S655 PolarHBondContact O-OG 3.2Å; A652-S655 VanDerWaalsContact O-OG 3.06Å; A652-K656 WeakPolarHBondContact O-CD 3.32Å; A652-K656 VanDerWaalsContact O-CG 3.32Å; A652-K656 WeakPolarHBondContact O-CG 3.3Å
653	E	75.4	Confident	67.7	Low	109 Å²	109	123 Å²	123	51%	0.509	62%	0.622	S	S	.	*	H	α-helix	trans	-76	-43.2	173.3	-73.9	174.8	-164.8	0	0	111.2	K649 F650 S655 K656 A657	K649-E653 WeakPolarHBondContact CE-OE1 2.98Å; K649-E653 WeakPolarHBondContact O-CG 3.02Å; K649-E653 PolarHBondContact O-N 2.83Å; F650-E653 PolarHBondContact O-N 3.14Å; E653-S655 VanDerWaalsContact C-N 3.34Å; E653-S655 PolarHBondContact O-N 2.77Å; E653-K656 CarbonylContact O-C 3.56Å; E653-K656 WeakPolarHBondContact O-CB 3.47Å; E653-K656 PolarHBondContact O-N 3.39Å; E653-A657 PolarHBondContact O-N 3.17Å
654	R	69.2	Low	65.9	Low	179 Å²	179	124.4 Å²	124.4	68%	0.675	63%	0.629	S	S	*	*	H	α-helix	trans	-60.9	-38.2	175.4	178	179.9	163.5	-173.2	-6	112.6	F650 K656 A657	F650-R654 WeakPolarHBondContact O-CB 3.36Å; F650-R654 PolarHBondContact O-N 3.38Å; R654-K656 VanDerWaalsContact C-N 3.28Å; R654-K656 PolarHBondContact O-N 3.44Å; R654-A657 PolarHBondContact O-N 3.32Å
655	S	66.2	Low	64.5	Low	91 Å²	91	121.5 Å²	121.5	64%	0.636	64%	0.635	S	S	*	*	H	α-helix	trans	-70.9	-21.6	175.4	57.4	0	0	0	0	113.5	E651 A652 E653	E651-S655 WeakPolarHBondContact O-CB 2.99Å; E651-S655 PolarHBondContact O-N 3.26Å; E651-S655 PolarHBondContact O-OG 3.4Å; A652-S655 WeakPolarHBondContact CA-OG 3.17Å; A652-S655 PolarHBondContact O-OG 3.2Å; A652-S655 VanDerWaalsContact O-OG 3.06Å; E653-S655 VanDerWaalsContact C-N 3.34Å; E653-S655 PolarHBondContact O-N 2.77Å
656	K	64.3	Low	62.7	Low	172 Å²	172	122.6 Å²	122.6	75%	0.748	65%	0.646	S	S	*	*	H	α-helix	trans	-85.7	-24.1	171.8	-68.9	170.8	-174.8	174.6	0	112.7	A652 E653 R654 K658	A652-K656 WeakPolarHBondContact O-CD 3.32Å; A652-K656 VanDerWaalsContact O-CG 3.32Å; A652-K656 WeakPolarHBondContact O-CG 3.3Å; E653-K656 CarbonylContact O-C 3.56Å; E653-K656 WeakPolarHBondContact O-CB 3.47Å; E653-K656 PolarHBondContact O-N 3.39Å; R654-K656 VanDerWaalsContact C-N 3.28Å; R654-K656 PolarHBondContact O-N 3.44Å; K656-K658 VanDerWaalsContact C-N 3.31Å; K656-K658 PolarHBondContact O-N 3.06Å
657	A	57.5	Low	61.4	Low	52 Å²	52	129.1 Å²	129.1	43%	0.43	67%	0.669	S	S	.	*			trans	-77.1	69.6	176.7	0	0	0	0	0	113.3	E653 R654 W659	E653-A657 PolarHBondContact O-N 3.17Å; R654-A657 PolarHBondContact O-N 3.32Å; A657-W659 PolarHBondContact O-N 3.48Å
658	K	49.4	Very low	59.6	Low	195 Å²	195	137.1 Å²	137.1	85%	0.848	69%	0.691	S	S	*	*			trans	-68.2	95.5	164.8	-82.3	-175.7	176.1	176.7	0	110.5	K656 Q660	K656-K658 VanDerWaalsContact C-N 3.31Å; K656-K658 PolarHBondContact O-N 3.06Å; K658-Q660 PolarHBondContact O-N 3.46Å
659	W	50.2	Low	58.1	Low	239 Å²	239	137.5 Å²	137.5	91%	0.905	70%	0.7	S	S	*	*			trans	-71.7	111.7	165.2	-74.9	88.2	0	0	0	110.1	A657	A657-W659 PolarHBondContact O-N 3.48Å
660	Q	45.7	Very low	55.9	Low	182 Å²	182	138.4 Å²	138.4	85%	0.85	72%	0.718	S	S	*	*			trans	-76.4	119.9	167.5	-70.9	-170.7	-8.4	0	0	109.5	K658 G662	K658-Q660 PolarHBondContact O-N 3.46Å; Q660-G662 VanDerWaalsContact C-N 3.3Å; Q660-G662 PolarHBondContact O-N 2.72Å
661	T	46	Very low	54.2	Low	142 Å²	142	138.8 Å²	138.8	87%	0.871	73%	0.732	S	S	*	*			trans	-70.5	85.8	164.9	23.5	0	0	0	0	109.7	T663	T661-T663 PolarHBondContact O-N 2.98Å
662	G	43.5	Very low	52.6	Low	77 Å²	77	137.7 Å²	137.7	79%	0.794	74%	0.737	S	S	*	*			trans	-71.2	92.9	174.8	0	0	0	0	0	112	Q660	Q660-G662 VanDerWaalsContact C-N 3.3Å; Q660-G662 PolarHBondContact O-N 2.72Å
663	T	44	Very low	51	Low	135 Å²	135	142.7 Å²	142.7	83%	0.828	76%	0.763	S	S	*	*			trans	-75.2	143	165.7	22.9	0	0	0	0	111.5	T661	T661-T663 PolarHBondContact O-N 2.98Å
664	N	45.2	Very low	49.3	Very low	119 Å²	119	146.6 Å²	146.6	64%	0.636	78%	0.779	S	S	*	*			trans	-55.6	129	-168.4	-175.4	-14.4	0	0	0	114	L666	N664-L666 PolarHBondContact O-N 3.18Å
665	P	54	Low	47.8	Very low	129 Å²	129	147.8 Å²	147.8	84%	0.838	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	29.1	-171.6	31.8	-38.9	0	0	0	116.7
666	L	48.3	Very low	46.2	Very low	159 Å²	159	150.8 Å²	150.8	83%	0.832	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.3	10.9	-177.1	-80	170.6	0	0	0	115.4	N664	N664-L666 PolarHBondContact O-N 3.18Å
667	Y	54.1	Low	44.9	Very low	209 Å²	209	148.8 Å²	148.8	82%	0.82	80%	0.8	S	S	*	*			trans	-116.6	122.6	-176.9	-165.6	-103.9	0	0	0	113.3
668	R	46.2	Very low	43.7	Very low	250 Å²	250	151.8 Å²	151.8	94%	0.943	81%	0.813	S	S	*	*			trans	-123.9	115.2	170.6	-96.3	-175.6	172.8	179.4	-1	109.9
669	G	48.2	Very low	43	Very low	64 Å²	64	152.8 Å²	152.8	66%	0.66	81%	0.813	S	S	*	*			trans	-107.7	154.7	170	0	0	0	0	0	111.4
670	S	36.5	Very low	42.2	Very low	113 Å²	113	149.3 Å²	149.3	79%	0.79	80%	0.804	S	S	*	*			trans	-99.1	155.5	-160	47.3	0	0	0	0	116.3
671	T	42	Very low	41.8	Very low	140 Å²	140	147.3 Å²	147.3	86%	0.859	80%	0.795	S	S	*	*			trans	83.5	153.1	163.1	-10.5	0	0	0	0	117.6
672	S	43.2	Very low	41.2	Very low	94 Å²	94	150.6 Å²	150.6	66%	0.657	79%	0.791	S	S	*	*			trans	-132.7	154.6	-155.2	51.8	0	0	0	0	113.1
673	T	41.4	Very low	40.8	Very low	146 Å²	146	153.3 Å²	153.3	90%	0.896	78%	0.783	S	S	*	*			trans	-139.6	127.2	171	-30.4	0	0	0	0	111.4
674	F	39.5	Very low	40.4	Very low	191 Å²	191	154.5 Å²	154.5	84%	0.838	78%	0.777	S	S	*	*			trans	-89.7	157.6	-178.7	-88.7	-107.5	0	0	0	112.7
675	K	37.8	Very low	40	Very low	205 Å²	205	157 Å²	157	89%	0.891	78%	0.784	S	S	*	*			trans	-94.2	133.1	158.5	-89.8	-176.2	172.7	179.7	0	109.9
676	N	32.9	Very low	39	Very low	154 Å²	154	158.7 Å²	158.7	82%	0.824	78%	0.779	S	S	*	*			trans	-108.3	156.8	173.5	-165.8	0.5	0	0	0	110.3
677	V	37.5	Very low	38.5	Very low	129 Å²	129	157.2 Å²	157.2	78%	0.782	78%	0.776	S	S	*	*			trans	-126.9	103.9	-168.5	-160.5	0	0	0	0	110.6
678	T	32.1	Very low	37.6	Very low	115 Å²	115	152.4 Å²	152.4	71%	0.706	77%	0.765	S	S	*	*			trans	-169	152.7	163.3	-2.3	0	0	0	0	112.8
679	Y	35.5	Very low	37.2	Very low	217 Å²	217	147.4 Å²	147.4	85%	0.851	76%	0.756	S	S	*	*			trans	65.7	115.3	-179.8	-69.1	-85.5	0	0	0	116.3
680	K	33	Very low	36.6	Very low	166 Å²	166	148.4 Å²	148.4	72%	0.722	75%	0.752	S	S	*	*			cis	101.5	129.1	11.5	-153.4	-165.9	-174.1	-156.4	0	115.6
681	H	36.4	Very low	36.6	Very low	140 Å²	140	148.7 Å²	148.7	65%	0.648	75%	0.749	S	S	*	*			trans	77.6	147.2	172.9	-65.8	-61.3	0	0	0	116.9
682	R	34	Very low	36.6	Very low	210 Å²	210	148.5 Å²	148.5	79%	0.792	74%	0.743	S	S	*	*			cis	-154.4	164.5	3.5	-138.7	167.2	176	166.7	-3.2	112.9
683	E	35.8	Very low	36.5	Very low	135 Å²	135	154.1 Å²	154.1	63%	0.631	78%	0.78	S	S	*	*			trans	-27	158.2	154.9	-60.6	167.7	-170.3	0	0	116
684	K	35.2	Very low	36.2	Very low	159 Å²	159	154.6 Å²	154.6	69%	0.691	78%	0.775	S	S	*	*			cis	-159.4	-173.8	25.6	-129	145.5	-168.6	156.8	0	108.3
685	Q	35.9	Very low	36	Very low	172 Å²	172	152.6 Å²	152.6	80%	0.804	77%	0.771	S	S	*	*			cis	-147.1	-137.2	11.7	-160.8	139	-87.7	0	0	112.1
686	K	33.7	Very low	36	Very low	164 Å²	164	149.7 Å²	149.7	71%	0.713	77%	0.765	S	S	*	*			trans	-132.9	164.1	178.4	-91.5	-175.6	157.2	-151.6	0	110.1	D688	K686-D688 IonicContact NZ-OD2 2.68Å
687	V	37.2	Very low	36.1	Very low	128 Å²	128	149.5 Å²	149.5	78%	0.776	76%	0.761	S	S	*	*				168	111.1	123	154.9	0	0	0	0	105
688	D	35.7	Very low	36	Very low	109 Å²	109	150.8 Å²	150.8	58%	0.583	76%	0.76	S	S	*	*				55.2	137.4	84.3	-64	-31.7	0	0	0	111.9	K686	K686-D688 IonicContact NZ-OD2 2.68Å
689	L	36.8	Very low	36.3	Very low	145 Å²	145	153.1 Å²	153.1	76%	0.759	76%	0.764	S	S	*	*			cis	-150.9	165.6	4.6	-152	82	0	0	0	110.4
690	S	35.6	Very low	36.4	Very low	84 Å²	84	148.6 Å²	148.6	59%	0.587	76%	0.757	S	S	*	*			trans	-65.6	158.8	162.6	49.3	0	0	0	0	113.7
691	T	38.1	Very low	36.6	Very low	119 Å²	119	147.2 Å²	147.2	73%	0.73	76%	0.76	S	S	*	*				164.4	149.8	127.4	46.3	0	0	0	0	109.2
692	D	40.6	Very low	36.6	Very low	136 Å²	136	147.8 Å²	147.8	73%	0.727	77%	0.769	S	S	*	*			cis	-168.3	137.2	-24.7	-98.2	-18.8	0	0	0	106.1
693	C	40.9	Very low	36.9	Very low	213 Å²	213	142.2 Å²	142.2	100%	1.439	77%	0.767	S	S	*	*			trans	169.6	0	153.7	-101.8	0	0	0	0	109.8

Retrieved 693 of 693 residues in 221.8 ms (Link to these results)

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