A0A090KKD3_HUMAN Loading...

HLA class I antigen

Involved in the presentation of foreign antigens to the immune system.

AlphaFold DB , UniProt , Accession A0A090KKD3, Species HUMAN (Homo sapiens, Human), Gene HLA-C, Length 366 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	35	Very low	41.7	Very low	241 Å²	241	144.3 Å²	144.3	100%	1.187	73%	0.725	S	S	*	*				0	133.8	0	-69.5	151.1	167.2	0	0	108.2
2	R	33.8	Very low	41.7	Very low	248 Å²	248	142.8 Å²	142.8	94%	0.936	72%	0.72	S	S	*	*			trans	-90.4	118.4	166.3	-83.5	-178.4	171	162.9	-3.1	107.7	M4	R2-M4 PolarHBondContact O-N 3.12Å; R2-M4 VanDerWaalsContact O-N 3.13Å
3	V	36.6	Very low	41.4	Very low	143 Å²	143	140 Å²	140	87%	0.867	71%	0.707	S	S	*	*			trans	-73.9	102.5	172.1	179.3	0	0	0	0	107.4	A5	V3-A5 PolarHBondContact O-N 3.14Å
4	M	39.1	Very low	41.4	Very low	176 Å²	176	134.3 Å²	134.3	87%	0.867	69%	0.687	S	S	*	*			trans	-81.7	92.5	177.6	-172	167.3	68.2	0	0	108.6	R2	R2-M4 PolarHBondContact O-N 3.12Å; R2-M4 VanDerWaalsContact O-N 3.13Å
5	A	43.3	Very low	41.4	Very low	59 Å²	59	127.7 Å²	127.7	49%	0.488	67%	0.665	S	S	.	*			trans	-55.5	135	175.8	0	0	0	0	0	110.3	V3 R7	V3-A5 PolarHBondContact O-N 3.14Å; A5-R7 PolarHBondContact O-N 2.9Å
6	P	40.8	Very low	41.3	Very low	78 Å²	78	122.9 Å²	122.9	51%	0.506	65%	0.65	S	S	.	*			trans	-66.8	124.8	-175.6	25.3	-32.1	0	0	0	110.4	T8 L9	P6-T8 PolarHBondContact O-N 3.41Å; P6-L9 HydrophobicContact CG-CB 4.34Å; P6-L9 WeakPolarHBondContact O-CB 3.37Å; P6-L9 PolarHBondContact O-N 3.09Å
7	R	48.1	Very low	41	Very low	214 Å²	214	122.2 Å²	122.2	81%	0.808	65%	0.646	S	S	*	*	H	α-helix	trans	-55.5	-26.5	-177	-80.5	177.2	161.9	151.1	-7.5	113.8	A5 L9 I10 L11	A5-R7 PolarHBondContact O-N 2.9Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.15Å; R7-I10 PolarHBondContact O-N 2.81Å; R7-L11 PolarHBondContact O-N 2.88Å
8	T	46.6	Very low	40.8	Very low	97 Å²	97	118.6 Å²	118.6	60%	0.595	64%	0.637	S	S	*	*	H	α-helix	trans	-62	-34.1	174.1	41.7	0	0	0	0	113.5	P6 L11 L12	P6-T8 PolarHBondContact O-N 3.41Å; T8-L11 PolarHBondContact O-N 2.66Å; T8-L12 WeakPolarHBondContact O-CG 3.37Å; T8-L12 PolarHBondContact O-N 3.22Å
9	L	41.7	Very low	40.7	Very low	103 Å²	103	117.5 Å²	117.5	54%	0.539	63%	0.63	S	S	.	*	H	α-helix	trans	-70.1	-34.9	179.9	-144.1	82.3	0	0	0	112	P6 R7 L13	P6-L9 HydrophobicContact CG-CB 4.34Å; P6-L9 WeakPolarHBondContact O-CB 3.37Å; P6-L9 PolarHBondContact O-N 3.09Å; R7-L9 VanDerWaalsContact C-N 3.33Å; R7-L9 PolarHBondContact O-N 3.15Å; L9-L13 WeakPolarHBondContact O-CG 3.17Å; L9-L13 PolarHBondContact O-N 3.38Å; L9-L13 VanDerWaalsContact O-N 3.17Å
10	I	46.2	Very low	40.4	Very low	104 Å²	104	116.3 Å²	116.3	53%	0.533	63%	0.627	S	S	.	*	H	α-helix	trans	-69.9	-39.4	179.3	-62.5	172	0	0	0	110.3	R7 L13 S14	R7-I10 PolarHBondContact O-N 2.81Å; I10-L13 PolarHBondContact O-N 3.03Å; I10-S14 PolarHBondContact O-N 3.45Å; I10-S14 PolarHBondContact O-OG 2.85Å; I10-S14 VanDerWaalsContact O-OG 3.08Å
11	L	47.3	Very low	40.3	Very low	124 Å²	124	118.4 Å²	118.4	65%	0.649	63%	0.633	S	S	*	*	H	α-helix	trans	-65.7	-41.3	176.5	-74	166.6	0	0	0	112.7	R7 T8 S14 G15	R7-L11 PolarHBondContact O-N 2.88Å; T8-L11 PolarHBondContact O-N 2.66Å; L11-S14 WeakPolarHBondContact CA-OG 3.45Å; L11-S14 PolarHBondContact O-N 2.67Å; L11-S14 PolarHBondContact O-OG 2.89Å; L11-G15 PolarHBondContact O-N 2.99Å
12	L	42.4	Very low	40.6	Very low	126 Å²	126	112 Å²	112	66%	0.66	61%	0.607	S	S	*	*	H	α-helix	trans	-62.3	-41.7	174.7	-73.3	167.3	0	0	0	111.9	T8 G15 A16	T8-L12 WeakPolarHBondContact O-CG 3.37Å; T8-L12 PolarHBondContact O-N 3.22Å; L12-G15 PolarHBondContact O-N 3.03Å; L12-A16 WeakPolarHBondContact O-CB 3.41Å; L12-A16 PolarHBondContact O-N 3.29Å
13	L	38.1	Very low	41.4	Very low	107 Å²	107	104 Å²	104	56%	0.56	58%	0.578	S	S	*	*	H	α-helix	trans	-66.7	-38.9	176.8	-77.6	164.8	0	0	0	112.9	L9 I10 L17	L9-L13 WeakPolarHBondContact O-CG 3.17Å; L9-L13 PolarHBondContact O-N 3.38Å; L9-L13 VanDerWaalsContact O-N 3.17Å; I10-L13 PolarHBondContact O-N 3.03Å; L13-L17 WeakPolarHBondContact O-CB 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.44Å; L13-L17 PolarHBondContact O-N 2.7Å
14	S	41.5	Very low	42.3	Very low	60 Å²	60	99.6 Å²	99.6	42%	0.42	56%	0.556	S	S	.	*	H	α-helix	trans	-72.8	-33.3	177	52.6	0	0	0	0	113.1	I10 L11 A18	I10-S14 PolarHBondContact O-N 3.45Å; I10-S14 PolarHBondContact O-OG 2.85Å; I10-S14 VanDerWaalsContact O-OG 3.08Å; L11-S14 WeakPolarHBondContact CA-OG 3.45Å; L11-S14 PolarHBondContact O-N 2.67Å; L11-S14 PolarHBondContact O-OG 2.89Å; S14-A18 WeakPolarHBondContact O-CB 3.37Å; S14-A18 PolarHBondContact O-N 2.95Å; S14-A18 VanDerWaalsContact O-N 3.09Å
15	G	41.5	Very low	43.9	Very low	35 Å²	35	94.3 Å²	94.3	36%	0.361	54%	0.535	S	S	.	.	H	α-helix	trans	-65.2	-44.4	171.1	0	0	0	0	0	112	L11 L12 A18 L19	L11-G15 PolarHBondContact O-N 2.99Å; L12-G15 PolarHBondContact O-N 3.03Å; G15-A18 PolarHBondContact O-N 2.81Å; G15-L19 WeakPolarHBondContact O-CB 3.32Å; G15-L19 PolarHBondContact O-N 2.9Å
16	A	39.4	Very low	46.1	Very low	51 Å²	51	95 Å²	95	42%	0.421	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-43.5	175.4	0	0	0	0	0	112.5	L12 L19 T20	L12-A16 WeakPolarHBondContact O-CB 3.41Å; L12-A16 PolarHBondContact O-N 3.29Å; A16-L19 PolarHBondContact O-N 2.93Å; A16-T20 PolarHBondContact O-N 3.21Å; A16-T20 PolarHBondContact O-OG1 2.92Å
17	L	35.9	Very low	48.7	Very low	111 Å²	111	92.9 Å²	92.9	58%	0.581	52%	0.52	S	S	*	.	H	α-helix	trans	-62.6	-44.8	177.8	-78.1	164.9	0	0	0	112.3	L13 L19 T20 E21	L13-L17 WeakPolarHBondContact O-CB 3.22Å; L13-L17 WeakPolarHBondContact O-CG 3.44Å; L13-L17 PolarHBondContact O-N 2.7Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 2.75Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 2.96Å; L17-T20 VanDerWaalsContact O-N 3.08Å; L17-T20 PolarHBondContact O-OG1 2.93Å; L17-E21 PolarHBondContact O-N 2.97Å; L17-E21 VanDerWaalsContact O-N 3.14Å
18	A	36.9	Very low	51.1	Low	58 Å²	58	83.8 Å²	83.8	48%	0.479	49%	0.489	S	S	.	.	H	α-helix	trans	-62.9	-33.8	175.7	0	0	0	0	0	112.8	S14 G15	S14-A18 WeakPolarHBondContact O-CB 3.37Å; S14-A18 PolarHBondContact O-N 2.95Å; S14-A18 VanDerWaalsContact O-N 3.09Å; G15-A18 PolarHBondContact O-N 2.81Å
19	L	38.4	Very low	53.6	Low	98 Å²	98	79.1 Å²	79.1	51%	0.513	46%	0.461	S	S	.	.	H	α-helix	trans	-72.9	-24.4	173	-83.4	162.1	0	0	0	113.5	G15 A16 L17 T22	G15-L19 WeakPolarHBondContact O-CB 3.32Å; G15-L19 PolarHBondContact O-N 2.9Å; A16-L19 PolarHBondContact O-N 2.93Å; L17-L19 VanDerWaalsContact C-N 3.29Å; L17-L19 PolarHBondContact O-N 2.75Å; L19-T22 PolarHBondContact O-OG1 3.24Å
20	T	36.4	Very low	56.3	Low	92 Å²	92	76.5 Å²	76.5	56%	0.564	44%	0.443	S	S	*	.	H	α-helix	trans	-84.4	-26.7	176.2	50.8	0	0	0	0	114.3	A16 L17	A16-T20 PolarHBondContact O-N 3.21Å; A16-T20 PolarHBondContact O-OG1 2.92Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 2.96Å; L17-T20 VanDerWaalsContact O-N 3.08Å; L17-T20 PolarHBondContact O-OG1 2.93Å
21	E	36.7	Very low	58.8	Low	161 Å²	161	71.9 Å²	71.9	75%	0.752	42%	0.419	S	S	*	.	H	α-helix	trans	-71.9	-27.1	178.7	-79.3	-170.2	133.9	0	0	113.3	L17 W23	L17-E21 PolarHBondContact O-N 2.97Å; L17-E21 VanDerWaalsContact O-N 3.14Å; E21-W23 VanDerWaalsContact C-N 3.25Å; E21-W23 PolarHBondContact O-N 3.38Å
22	T	42	Very low	61.2	Low	107 Å²	107	70 Å²	70	66%	0.656	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-2.1	-177.4	49.9	0	0	0	0	115.1	L19	L19-T22 PolarHBondContact O-OG1 3.24Å
23	W	51.5	Low	63.9	Low	81 Å²	81	64.5 Å²	64.5	31%	0.307	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.3	12.1	-176.4	-65	69.3	0	0	0	113.1	E21 C25 H287 E288 L290	E21-W23 VanDerWaalsContact C-N 3.25Å; E21-W23 PolarHBondContact O-N 3.38Å; W23-C25 PolarHBondContact O-N 3.44Å; W23-H287 WeakPolarHBondContact CH2-O 3.41Å; W23-H287 WeakPolarHBondContact CZ3-O 3.47Å; W23-E288 VanDerWaalsContact CZ3-CA 3.43Å; W23-E288 VanDerWaalsContact CZ3-O 3.29Å; W23-E288 WeakPolarHBondContact CZ3-O 3.31Å; W23-L290 HydrophobicContact CH2-CB 4.42Å; W23-L290 WeakPolarHBondContact CH2-O 3.48Å; W23-L290 WeakPolarHBondContact CZ3-O 3.27Å
24	A	53.9	Low	66.8	Low	50 Å²	50	61.3 Å²	61.3	41%	0.413	36%	0.362	S	S	.	.	S	Bend	trans	-82	97.6	175.9	0	0	0	0	0	108.8	S26 P129	A24-S26 PolarHBondContact O-N 2.85Å; A24-P129 HydrophobicContact CB-CB 4.49Å; A24-P129 HydrophobicContact CB-CG 3.48Å; A24-P129 VanDerWaalsContact CB-CG 3.48Å
25	C	72.9	Confident	69.5	Low	64 Å²	64	58.6 Å²	58.6	43%	0.432	34%	0.343	S	S	.	.			trans	-42.2	110.7	-171.6	-54.6	0	0	0	0	112.7	W23 E288	W23-C25 PolarHBondContact O-N 3.44Å; C25-E288 PolarHBondContact SG-OE1 2.83Å
26	S	90.7	Very high	72.3	Confident	74 Å²	74	59.3 Å²	59.3	52%	0.517	34%	0.34	S	S	.	.			trans	-112.9	141	176.2	72.6	0	0	0	0	109.1	A24 L127	A24-S26 PolarHBondContact O-N 2.85Å; S26-L127 VanDerWaalsContact CA-O 3.31Å; S26-L127 WeakPolarHBondContact CA-O 3.48Å; S26-L127 WeakPolarHBondContact CB-O 3.2Å
27	H	95.3	Very high	75	Confident	34 Å²	34	57.7 Å²	57.7	16%	0.157	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.7	-174.7	-69.3	-72.4	0	0	0	111.5	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.17Å; H27-D53 IonicContact CE1-OD2 3.09Å; H27-D53 IonicContact CG-OD2 3.29Å; H27-D53 IonicContact ND1-OD1 2.7Å; H27-D53 IonicContact ND1-OD2 3.85Å; H27-D53 PolarHBondContact ND1-OD2 3.06Å; H27-D126 CarbonylContact O-C 3.51Å; H27-D126 WeakPolarHBondContact O-CA 3.43Å; H27-L127 PolarHBondContact N-O 3.32Å; H27-L127 PolarHBondContact O-N 2.99Å; H27-L192 HydrophobicContact CB-CD1 4.48Å; H27-L196 HydrophobicContact CB-CD1 3.67Å; H27-L196 HydrophobicContact CB-CD2 3.97Å; H27-L196 HydrophobicContact CB-CG 4.41Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.37Å
28	S	97.4	Very high	77.9	Confident	22 Å²	22	56 Å²	56	15%	0.154	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	150.5	-178.6	67.8	0	0	0	0	112.4	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.31Å; S28-V52 WeakPolarHBondContact O-CA 3.46Å; S28-D53 PolarHBondContact N-OD1 2.98Å; S28-D53 PolarHBondContact O-N 3.24Å; S28-C125 WeakPolarHBondContact CA-O 3.32Å; S28-D126 WeakPolarHBondContact CB-OD1 3.21Å
29	M	98.6	Very high	80.6	Confident	0 Å²	0	55.9 Å²	55.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	115.6	166.6	-179.5	173.1	60.6	0	0	108.3	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.21Å; M29-Y31 HydrophobicContact CG-CD2 4.47Å; M29-Y31 HydrophobicContact CG-CE2 3.99Å; M29-Y31 HydrophobicContact SD-CE2 3.9Å; M29-Y51 WeakPolarHBondContact CA-O 3.15Å; M29-V52 HydrophobicContact CB-CG2 4.48Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; M29-F57 HydrophobicContact CG-CE1 4.43Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; M29-G124 CarbonylContact O-C 3.57Å; M29-G124 WeakPolarHBondContact O-CA 3.49Å; M29-C125 PolarHBondContact N-O 3.39Å; M29-C125 PolarHBondContact O-N 3.08Å; M29-C188 HydrophobicContact CE-CB 4.15Å; M29-C188 WeakPolarHBondContact CE-O 3.44Å; M29-C188 WeakPolarHBondContact CE-SG 3.32Å; M29-W191 HydrophobicContact CE-CB 4.18Å; M29-W191 HydrophobicContact SD-CB 4.49Å; M29-L192 HydrophobicContact CB-CB 4Å; M29-L192 HydrophobicContact CB-CD1 4.05Å; M29-L192 HydrophobicContact CB-CD2 3.9Å; M29-L192 HydrophobicContact CB-CG 4.2Å; M29-L192 HydrophobicContact CE-CB 4.26Å; M29-L192 HydrophobicContact SD-CB 4.45Å; M29-Y195 HydrophobicContact SD-CD2 3.77Å; M29-Y195 HydrophobicContact SD-CE2 3.5Å; M29-Y195 WeakPolarHBondContact SD-CE2 3.43Å
30	R	98.6	Very high	83.1	Confident	48 Å²	48	55.5 Å²	55.5	18%	0.181	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	130.6	-173.8	-53.9	-62	-171.1	73.2	1.1	110.2	F32 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.49Å; R30-F32 HydrophobicContact CB-CE2 3.66Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; R30-Y51 PolarHBondContact N-O 2.81Å; R30-Y51 PolarHBondContact O-N 3.33Å; R30-D126 IonicContact CZ-OD1 2.67Å; R30-D126 VanDerWaalsContact CZ-OD1 3.23Å; R30-D126 IonicContact CZ-OD2 3.37Å; R30-D126 IonicContact NE-OD1 3.13Å; R30-D126 PolarHBondContact NE-OD1 3.25Å; R30-D126 IonicContact NH2-OD1 2.84Å; R30-D126 PolarHBondContact NH2-OD1 2.81Å; R30-D126 IonicContact NH2-OD2 2.66Å; R30-D126 PolarHBondContact NH2-OD2 3.32Å; R30-Y137 VanDerWaalsContact NH2-CE2 3.33Å; R30-Y137 PolarHBondContact NH2-OH 2.85Å
31	Y	98.8	Very high	85.8	Confident	6 Å²	6	61 Å²	61	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	130.7	172.8	-72.1	-90.3	0	0	0	109.5	M29 Y33 V49 F57 V58 M122 Y123	M29-Y31 HydrophobicContact CE-CE2 4.21Å; M29-Y31 HydrophobicContact CG-CD2 4.47Å; M29-Y31 HydrophobicContact CG-CE2 3.99Å; M29-Y31 HydrophobicContact SD-CE2 3.9Å; Y31-Y33 HydrophobicContact CD1-CE1 4.32Å; Y31-V49 WeakPolarHBondContact CA-O 3.48Å; Y31-F57 HydrophobicContact CE1-CZ 4.22Å; Y31-F57 AromaticContact CZ-CZ 3.91Å; Y31-V58 HydrophobicContact CE1-CG2 4.1Å; Y31-M122 WeakPolarHBondContact O-CA 3.32Å; Y31-Y123 VanDerWaalsContact CB-CZ 3.5Å; Y31-Y123 HydrophobicContact CD2-CD2 4.46Å; Y31-Y123 AromaticContact CD2-CE2 3.63Å; Y31-Y123 HydrophobicContact CD2-CE2 3.63Å; Y31-Y123 AromaticContact CD2-CZ 3.71Å; Y31-Y123 HydrophobicContact CE2-CE2 4.38Å; Y31-Y123 HydrophobicContact CG-CE1 4.2Å; Y31-Y123 HydrophobicContact CG-CE2 4.07Å; Y31-Y123 AromaticContact CG-CZ 3.66Å; Y31-Y123 PolarHBondContact N-O 2.76Å; Y31-Y123 PolarHBondContact O-N 2.85Å; Y31-Y123 VanDerWaalsContact O-N 3.09Å
32	F	98.9	Very high	88.4	Confident	86 Å²	86	56.1 Å²	56.1	38%	0.377	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	117.4	178.3	-55.7	-96.2	0	0	0	109	R30 A48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.49Å; R30-F32 HydrophobicContact CB-CE2 3.66Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; F32-A48 WeakPolarHBondContact O-CA 3.24Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.38Å; F32-V49 PolarHBondContact N-O 3.05Å; F32-V49 PolarHBondContact O-N 3.39Å; F32-Y51 HydrophobicContact CD2-CD2 4.06Å; F32-Y51 HydrophobicContact CE2-CD2 4.09Å; F32-R121 WeakPolarHBondContact CA-O 3.43Å; F32-M122 HydrophobicContact CD1-CB 4.03Å; F32-M122 HydrophobicContact CD1-CG 3.64Å; F32-M122 HydrophobicContact CE1-CB 4.21Å; F32-M122 HydrophobicContact CE1-CG 3.42Å; F32-M122 VanDerWaalsContact CE1-CG 3.42Å; F32-M122 HydrophobicContact CG-CG 4.44Å; F32-M122 HydrophobicContact CZ-CG 4.07Å
33	Y	98.8	Very high	90.9	Very high	9 Å²	9	55.8 Å²	55.8	4%	0.035	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	139.6	177.1	-59.6	-14.7	0	0	0	109.7	Y31 F46 I47 A48 Y91 Q94 Q120 R121 Y123	Y31-Y33 HydrophobicContact CD1-CE1 4.32Å; Y33-F46 HydrophobicContact CD1-CZ 4.17Å; Y33-F46 HydrophobicContact CD2-CE2 4.14Å; Y33-F46 AromaticContact CD2-CZ 3.97Å; Y33-F46 HydrophobicContact CD2-CZ 3.97Å; Y33-F46 HydrophobicContact CE2-CZ 4.35Å; Y33-F46 HydrophobicContact CG-CE2 4.07Å; Y33-F46 AromaticContact CG-CZ 3.85Å; Y33-F46 HydrophobicContact CG-CZ 3.85Å; Y33-I47 WeakPolarHBondContact CA-O 3.42Å; Y33-A48 HydrophobicContact CD1-CB 3.3Å; Y33-A48 HydrophobicContact CE1-CB 3.43Å; Y33-A48 VanDerWaalsContact CE1-CB 3.43Å; Y33-A48 HydrophobicContact CG-CB 4.27Å; Y33-Y91 HydrophobicContact CE1-CD1 4.12Å; Y33-Y91 AromaticContact CE1-CE1 3.81Å; Y33-Y91 HydrophobicContact CE1-CE1 3.81Å; Y33-Y91 AromaticContact CZ-CE1 3.99Å; Y33-Y91 WeakPolarHBondContact OH-CE1 3.3Å; Y33-Q94 HydrophobicContact CD2-CG 3.63Å; Y33-Q94 HydrophobicContact CE2-CB 4.35Å; Y33-Q94 HydrophobicContact CE2-CG 3.65Å; Y33-Q120 CarbonylContact O-C 3.58Å; Y33-Q120 VanDerWaalsContact O-CA 3.32Å; Y33-Q120 WeakPolarHBondContact O-CA 3.35Å; Y33-R121 PolarHBondContact N-O 2.61Å; Y33-R121 PolarHBondContact O-N 2.96Å; Y33-Y123 HydrophobicContact CD2-CE1 4.2Å; Y33-Y123 HydrophobicContact CE1-CE1 4.2Å; Y33-Y123 AromaticContact CE2-CE1 3.6Å; Y33-Y123 HydrophobicContact CE2-CE1 3.6Å; Y33-Y123 AromaticContact CZ-CE1 3.63Å; Y33-Y123 PolarHBondContact OH-OH 3.14Å
34	T	98.9	Very high	93.1	Very high	41 Å²	41	53.2 Å²	53.2	25%	0.252	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137	119.7	177.4	-58.6	0	0	0	0	109.3	V36 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 3.94Å; T34-I47 PolarHBondContact N-O 3.03Å; T34-I47 PolarHBondContact O-N 3.36Å; T34-T118 HydrophobicContact CG2-CG2 4.08Å; T34-L119 WeakPolarHBondContact CA-O 3.41Å; T34-Q120 HydrophobicContact CG2-CG 4.03Å
35	A	98.8	Very high	95.2	Very high	2 Å²	2	55.4 Å²	55.4	2%	0.017	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	117.6	175	0	0	0	0	0	110.1	R45 F46 D98 L102 T118 L119	A35-R45 CarbonylContact C-O 3.49Å; A35-R45 WeakPolarHBondContact CA-O 3.46Å; A35-F46 HydrophobicContact CB-CD2 4.32Å; A35-D98 HydrophobicContact CB-CB 3.7Å; A35-L102 HydrophobicContact CB-CD1 3.84Å; A35-T118 WeakPolarHBondContact O-CA 3.46Å; A35-L119 HydrophobicContact CB-CB 4.48Å; A35-L119 PolarHBondContact N-O 3.09Å; A35-L119 PolarHBondContact O-N 3.49Å
36	V	98.6	Very high	96.4	Very high	50 Å²	50	52.4 Å²	52.4	30%	0.303	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	112.7	-178.4	-172.1	0	0	0	0	109.9	T34 P44 R45 T118	T34-V36 HydrophobicContact CG2-CG2 3.94Å; V36-P44 CarbonylContact O-C 3.55Å; V36-P44 WeakPolarHBondContact O-CA 3.26Å; V36-R45 PolarHBondContact N-O 3.21Å; V36-R45 PolarHBondContact O-N 3.4Å; V36-T118 HydrophobicContact CG2-CG2 4.31Å
37	S	97.9	Very high	96.8	Very high	18 Å²	18	51.3 Å²	51.3	13%	0.126	28%	0.28	C	S	.	.			trans	-72.9	138.8	174.2	56	0	0	0	0	111.5	S116 H117	S37-S116 PolarHBondContact O-OG 3.31Å; S37-S116 VanDerWaalsContact O-OG 3.06Å; S37-H117 PolarHBondContact N-O 2.91Å; S37-H117 WeakPolarHBondContact OG-CA 3.41Å; S37-H117 WeakPolarHBondContact OG-CB 3.32Å; S37-H117 PolarHBondContact OG-N 3.48Å; S37-H117 PolarHBondContact OG-O 3.13Å
38	R	96.1	Very high	97	Very high	74 Å²	74	49.7 Å²	49.7	28%	0.279	27%	0.272	S	S	.	.			trans	-134.5	76.6	-173.8	51.7	171.8	172	-154.3	-17.5	112	G40 R41 E43 D63	R38-G40 PolarHBondContact O-N 3.13Å; R38-R41 HydrophobicContact CB-CB 4.14Å; R38-R41 WeakPolarHBondContact CD-O 3.17Å; R38-R41 HydrophobicContact CG-CB 4.19Å; R38-R41 PolarHBondContact NE-O 3.16Å; R38-R41 PolarHBondContact O-N 2.84Å; R38-E43 VanDerWaalsContact CZ-O 3.26Å; R38-E43 PolarHBondContact NE-O 2.98Å; R38-E43 PolarHBondContact NH2-O 2.88Å; R38-D63 IonicContact CZ-OD1 3.56Å; R38-D63 IonicContact CZ-OD2 3.52Å; R38-D63 IonicContact NH1-OD1 3.56Å; R38-D63 IonicContact NH1-OD2 2.75Å; R38-D63 PolarHBondContact NH1-OD2 3.48Å; R38-D63 IonicContact NH2-OD1 3.5Å; R38-D63 PolarHBondContact NH2-OD1 2.92Å; R38-D63 IonicContact NH2-OD2 2.69Å; R38-D63 PolarHBondContact NH2-OD2 2.79Å
39	P	92.6	Very high	97.1	Very high	56 Å²	56	50 Å²	50	36%	0.364	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	134.1	-177.4	-28.6	35.7	0	0	0	113.3	R41 E113 G115	P39-R41 PolarHBondContact O-N 2.72Å; P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.15Å; P39-G115 WeakPolarHBondContact CG-O 3.33Å
40	G	91.3	Very high	97.1	Very high	91 Å²	91	50 Å²	50	94%	0.938	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	1.7	-177	0	0	0	0	0	115.9	R38	R38-G40 PolarHBondContact O-N 3.13Å
41	R	93	Very high	97.1	Very high	206 Å²	206	51 Å²	51	78%	0.777	28%	0.277	S	S	*	.	S	Bend	trans	-123.4	26.1	-178.8	-58.4	-174.8	-179.8	-171.2	0.1	113.6	R38 P39	R38-R41 HydrophobicContact CB-CB 4.14Å; R38-R41 WeakPolarHBondContact CD-O 3.17Å; R38-R41 HydrophobicContact CG-CB 4.19Å; R38-R41 PolarHBondContact NE-O 3.16Å; R38-R41 PolarHBondContact O-N 2.84Å; P39-R41 PolarHBondContact O-N 2.72Å
42	G	91.9	Very high	97	Very high	60 Å²	60	50.7 Å²	50.7	62%	0.619	28%	0.276	S	S	*	.	S	Bend	trans	89.5	-163.4	-179.4	0	0	0	0	0	113.7
43	E	94.7	Very high	96.9	Very high	100 Å²	100	47.9 Å²	47.9	47%	0.467	27%	0.265	S	S	.	.	S	Bend	trans	-70.7	155.3	-175.6	-63.3	-58.8	167.6	0	0	112.9	R38 R45 R99	R38-E43 VanDerWaalsContact CZ-O 3.26Å; R38-E43 PolarHBondContact NE-O 2.98Å; R38-E43 PolarHBondContact NH2-O 2.88Å; E43-R45 PolarHBondContact O-N 2.78Å; E43-R99 VanDerWaalsContact CD-NE 3.31Å; E43-R99 IonicContact OE1-CZ 3.45Å; E43-R99 IonicContact OE1-NE 2.66Å; E43-R99 IonicContact OE1-NH2 3.45Å; E43-R99 PolarHBondContact OE1-NH2 3.49Å; E43-R99 IonicContact OE2-CZ 3.48Å; E43-R99 IonicContact OE2-NE 2.97Å; E43-R99 PolarHBondContact OE2-NE 3.06Å; E43-R99 IonicContact OE2-NH2 3.77Å; E43-R99 PolarHBondContact OE2-NH2 3.43Å
44	P	97.3	Very high	96.7	Very high	26 Å²	26	50.4 Å²	50.4	17%	0.169	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-51.4	133.3	175.6	-25.9	34.8	0	0	0	112.3	V36 F46 R99 L102	V36-P44 CarbonylContact O-C 3.55Å; V36-P44 WeakPolarHBondContact O-CA 3.26Å; P44-F46 PolarHBondContact O-N 2.84Å; P44-R99 HydrophobicContact CG-CB 4.3Å; P44-R99 HydrophobicContact CG-CG 4.18Å; P44-L102 HydrophobicContact CB-CD1 3.75Å; P44-L102 HydrophobicContact CG-CD1 3.94Å
45	R	98.4	Very high	96.6	Very high	96 Å²	96	49.4 Å²	49.4	36%	0.362	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	125.8	173.1	-177.7	-179.3	-174.5	-174.1	0.4	108.6	A35 V36 E43 I47 D61 S62 D63	A35-R45 CarbonylContact C-O 3.49Å; A35-R45 WeakPolarHBondContact CA-O 3.46Å; V36-R45 PolarHBondContact N-O 3.21Å; V36-R45 PolarHBondContact O-N 3.4Å; E43-R45 PolarHBondContact O-N 2.78Å; R45-I47 HydrophobicContact CG-CG1 4.22Å; R45-D61 IonicContact CZ-OD1 3.65Å; R45-D61 IonicContact CZ-OD2 3.44Å; R45-D61 IonicContact NE-OD1 3.82Å; R45-D61 PolarHBondContact NE-OD1 2.83Å; R45-D61 IonicContact NE-OD2 2.78Å; R45-D61 PolarHBondContact NE-OD2 2.9Å; R45-D61 IonicContact NH2-OD1 3.89Å; R45-D61 IonicContact NH2-OD2 3.51Å; R45-D61 PolarHBondContact NH2-OD2 2.88Å; R45-S62 WeakPolarHBondContact CA-OG 3.41Å; R45-D63 VanDerWaalsContact CD-OD2 3.28Å; R45-D63 WeakPolarHBondContact CD-OD2 3.46Å; R45-D63 HydrophobicContact CG-CB 4.37Å; R45-D63 IonicContact NE-OD2 3.27Å
46	F	98.8	Very high	96.5	Very high	2 Å²	2	51.7 Å²	51.7	1%	0.009	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	121.5	175.6	173.8	-88.7	0	0	0	109.5	Y33 A35 P44 A48 F60 S62 Y91 Q94 A95 D98	Y33-F46 HydrophobicContact CD1-CZ 4.17Å; Y33-F46 HydrophobicContact CD2-CE2 4.14Å; Y33-F46 AromaticContact CD2-CZ 3.97Å; Y33-F46 HydrophobicContact CD2-CZ 3.97Å; Y33-F46 HydrophobicContact CE2-CZ 4.35Å; Y33-F46 HydrophobicContact CG-CE2 4.07Å; Y33-F46 AromaticContact CG-CZ 3.85Å; Y33-F46 HydrophobicContact CG-CZ 3.85Å; A35-F46 HydrophobicContact CB-CD2 4.32Å; P44-F46 PolarHBondContact O-N 2.84Å; F46-A48 HydrophobicContact CE1-CB 3.69Å; F46-A48 HydrophobicContact CZ-CB 3.89Å; F46-F60 AromaticContact CD1-CD1 3.74Å; F46-F60 HydrophobicContact CD1-CD1 3.74Å; F46-F60 AromaticContact CD1-CE1 3.82Å; F46-F60 HydrophobicContact CD1-CE1 3.82Å; F46-F60 AromaticContact CE1-CD1 3.93Å; F46-F60 HydrophobicContact CE1-CD1 3.93Å; F46-F60 HydrophobicContact CE1-CE1 4.29Å; F46-S62 PolarHBondContact N-OG 2.82Å; F46-S62 PolarHBondContact O-N 2.87Å; F46-Y91 HydrophobicContact CE1-CD1 4.4Å; F46-Q94 HydrophobicContact CE2-CB 4.18Å; F46-Q94 HydrophobicContact CE2-CG 3.7Å; F46-Q94 HydrophobicContact CZ-CB 4Å; F46-Q94 HydrophobicContact CZ-CG 3.87Å; F46-A95 HydrophobicContact CB-CB 3.67Å; F46-A95 HydrophobicContact CD1-CB 3.91Å; F46-A95 HydrophobicContact CD2-CB 4.16Å; F46-A95 HydrophobicContact CG-CB 3.65Å; F46-D98 HydrophobicContact CD2-CB 4.48Å; F46-D98 VanDerWaalsContact CE2-OD2 3.28Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.48Å
47	I	98.8	Very high	96.5	Very high	51 Å²	51	49.3 Å²	49.3	26%	0.262	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	135.1	173.3	-56.8	174.6	0	0	0	107.8	Y33 T34 R45 F60	Y33-I47 WeakPolarHBondContact CA-O 3.42Å; T34-I47 PolarHBondContact N-O 3.03Å; T34-I47 PolarHBondContact O-N 3.36Å; R45-I47 HydrophobicContact CG-CG1 4.22Å; I47-F60 WeakPolarHBondContact CA-O 3.32Å
48	A	98.8	Very high	96.5	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127	139.2	170.3	0	0	0	0	0	110.5	F32 Y33 F46 Q59 F60 Y91	F32-A48 WeakPolarHBondContact O-CA 3.24Å; Y33-A48 HydrophobicContact CD1-CB 3.3Å; Y33-A48 HydrophobicContact CE1-CB 3.43Å; Y33-A48 VanDerWaalsContact CE1-CB 3.43Å; Y33-A48 HydrophobicContact CG-CB 4.27Å; F46-A48 HydrophobicContact CE1-CB 3.69Å; F46-A48 HydrophobicContact CZ-CB 3.89Å; A48-Q59 CarbonylContact O-C 3.6Å; A48-Q59 WeakPolarHBondContact O-CA 3Å; A48-F60 HydrophobicContact CB-CB 4.27Å; A48-F60 PolarHBondContact N-O 2.82Å; A48-F60 PolarHBondContact O-N 2.79Å; A48-Y91 HydrophobicContact CB-CD1 3.71Å; A48-Y91 HydrophobicContact CB-CE1 3.76Å
49	V	98.8	Very high	96.6	Very high	27 Å²	27	47.6 Å²	47.6	16%	0.164	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	147.5	170.6	-63.9	0	0	0	0	110	Y31 F32 Y51 Q56 V58 Q59	Y31-V49 WeakPolarHBondContact CA-O 3.48Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.38Å; F32-V49 PolarHBondContact N-O 3.05Å; F32-V49 PolarHBondContact O-N 3.39Å; V49-Y51 HydrophobicContact CB-CE2 4.1Å; V49-Y51 HydrophobicContact CG2-CD2 4.35Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.32Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; V49-Q59 HydrophobicContact CG1-CG 4.13Å
50	G	98.6	Very high	96.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	136.9	176.9	0	0	0	0	0	110.8	Q56 F57 V58	G50-Q56 WeakPolarHBondContact O-CG 2.94Å; G50-F57 WeakPolarHBondContact O-CD1 3.45Å; G50-F57 PolarHBondContact O-N 3.09Å; G50-V58 PolarHBondContact N-O 3.19Å; G50-V58 VanDerWaalsContact N-O 3.08Å; G50-V58 PolarHBondContact O-N 3.4Å
51	Y	98.6	Very high	97.3	Very high	70 Å²	70	42.3 Å²	42.3	28%	0.275	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	142.6	-178.2	-76.4	-104.4	0	0	0	110.5	M29 R30 F32 V49 T55 Q56	M29-Y51 WeakPolarHBondContact CA-O 3.15Å; R30-Y51 PolarHBondContact N-O 2.81Å; R30-Y51 PolarHBondContact O-N 3.33Å; F32-Y51 HydrophobicContact CD2-CD2 4.06Å; F32-Y51 HydrophobicContact CE2-CD2 4.09Å; V49-Y51 HydrophobicContact CB-CE2 4.1Å; V49-Y51 HydrophobicContact CG2-CD2 4.35Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; Y51-T55 WeakPolarHBondContact CA-O 3.34Å; Y51-Q56 HydrophobicContact CD1-CB 4.04Å; Y51-Q56 HydrophobicContact CD2-CB 4.48Å; Y51-Q56 HydrophobicContact CD2-CG 4.27Å; Y51-Q56 HydrophobicContact CE1-CB 3.62Å; Y51-Q56 HydrophobicContact CE1-CG 4.31Å; Y51-Q56 HydrophobicContact CE2-CB 4.09Å; Y51-Q56 HydrophobicContact CE2-CG 3.83Å; Y51-Q56 HydrophobicContact CG-CB 4.44Å
52	V	98.1	Very high	97.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	118.7	156.8	175.8	0	0	0	0	106	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.57Å; S28-V52 VanDerWaalsContact O-CA 3.31Å; S28-V52 WeakPolarHBondContact O-CA 3.46Å; M29-V52 HydrophobicContact CB-CG2 4.48Å; M29-V52 HydrophobicContact CG-CG2 4.33Å; V52-D54 PolarHBondContact O-N 2.89Å; V52-T55 PolarHBondContact N-O 2.8Å; V52-T55 WeakPolarHBondContact O-CA 3.42Å; V52-T55 WeakPolarHBondContact O-CB 3.41Å; V52-T55 PolarHBondContact O-N 2.02Å; V52-F57 HydrophobicContact CG2-CD1 3.94Å; V52-F57 HydrophobicContact CG2-CE1 3.89Å; V52-W75 HydrophobicContact CB-CH2 4.23Å; V52-W75 HydrophobicContact CB-CZ2 4.3Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; V52-L192 HydrophobicContact CG1-CD1 3.56Å; V52-L192 HydrophobicContact CG2-CD1 4.21Å; V52-Y195 HydrophobicContact CG2-CD2 3.79Å; V52-Y195 HydrophobicContact CG2-CG 4.35Å; V52-L196 HydrophobicContact CG1-CD2 4.13Å; V52-L203 HydrophobicContact CB-CD1 4.3Å; V52-L203 HydrophobicContact CB-CD2 4.22Å; V52-L203 HydrophobicContact CG1-CD1 3.84Å; V52-L203 HydrophobicContact CG1-CD2 4.1Å
53	D	95.6	Very high	97.8	Very high	27 Å²	27	34.6 Å²	34.6	14%	0.144	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.8	-132.9	-165.2	-49.9	-42.1	0	0	0	110.2	H27 S28 T55	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.17Å; H27-D53 IonicContact CE1-OD2 3.09Å; H27-D53 IonicContact CG-OD2 3.29Å; H27-D53 IonicContact ND1-OD1 2.7Å; H27-D53 IonicContact ND1-OD2 3.85Å; H27-D53 PolarHBondContact ND1-OD2 3.06Å; S28-D53 PolarHBondContact N-OD1 2.98Å; S28-D53 PolarHBondContact O-N 3.24Å; D53-T55 VanDerWaalsContact C-N 3.26Å; D53-T55 PolarHBondContact O-N 2.83Å
54	D	95.4	Very high	97.9	Very high	61 Å²	61	31.9 Å²	31.9	33%	0.326	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.5	-1.7	176.3	-61.5	-62.1	0	0	0	114.1	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 2.89Å; D54-Y233 HydrophobicContact CB-CE2 4.05Å; D54-P234 VanDerWaalsContact OD2-CB 3.27Å; D54-P234 WeakPolarHBondContact OD2-CB 3.29Å; D54-A235 HydrophobicContact CB-CB 4.39Å; D54-A235 VanDerWaalsContact CG-CB 3.46Å; D54-A235 WeakPolarHBondContact OD1-CB 3.07Å; D54-A235 WeakPolarHBondContact OD2-CB 3.37Å; D54-A235 PolarHBondContact OD2-N 3.04Å; D54-F265 HydrophobicContact CB-CE2 3.69Å; D54-F265 HydrophobicContact CB-CZ 3.71Å
55	T	96.4	Very high	97.8	Very high	20 Å²	20	36.2 Å²	36.2	12%	0.123	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	111	-176.3	-63.3	0	0	0	0	111.7	Y51 V52 D53 F57 A73 W75 L203 Y233	Y51-T55 WeakPolarHBondContact CA-O 3.34Å; V52-T55 PolarHBondContact N-O 2.8Å; V52-T55 WeakPolarHBondContact O-CA 3.42Å; V52-T55 WeakPolarHBondContact O-CB 3.41Å; V52-T55 PolarHBondContact O-N 2.02Å; D53-T55 VanDerWaalsContact C-N 3.26Å; D53-T55 PolarHBondContact O-N 2.83Å; T55-F57 PolarHBondContact O-N 2.94Å; T55-A73 HydrophobicContact CG2-CB 4.25Å; T55-W75 HydrophobicContact CG2-CZ2 4.37Å; T55-L203 HydrophobicContact CG2-CD2 4Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.46Å; T55-Y233 PolarHBondContact OG1-OH 2.9Å
56	Q	97.4	Very high	97.7	Very high	51 Å²	51	35.8 Å²	35.8	24%	0.238	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	129.4	170	-165.3	-173.7	-6.7	0	0	110.5	V49 G50 Y51 V58 R72	V49-Q56 VanDerWaalsContact CG1-NE2 3.32Å; G50-Q56 WeakPolarHBondContact O-CG 2.94Å; Y51-Q56 HydrophobicContact CD1-CB 4.04Å; Y51-Q56 HydrophobicContact CD2-CB 4.48Å; Y51-Q56 HydrophobicContact CD2-CG 4.27Å; Y51-Q56 HydrophobicContact CE1-CB 3.62Å; Y51-Q56 HydrophobicContact CE1-CG 4.31Å; Y51-Q56 HydrophobicContact CE2-CB 4.09Å; Y51-Q56 HydrophobicContact CE2-CG 3.83Å; Y51-Q56 HydrophobicContact CG-CB 4.44Å; Q56-V58 PolarHBondContact NE2-O 2.89Å; Q56-R72 HydrophobicContact CG-CB 4.22Å; Q56-R72 CarbonylContact O-C 3.59Å
57	F	98.1	Very high	97.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	-23.5	180	75.5	-82.7	0	0	0	114.6	M29 Y31 G50 V52 T55 R72 A73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.43Å; M29-F57 HydrophobicContact SD-CZ 4.28Å; Y31-F57 HydrophobicContact CE1-CZ 4.22Å; Y31-F57 AromaticContact CZ-CZ 3.91Å; G50-F57 WeakPolarHBondContact O-CD1 3.45Å; G50-F57 PolarHBondContact O-N 3.09Å; V52-F57 HydrophobicContact CG2-CD1 3.94Å; V52-F57 HydrophobicContact CG2-CE1 3.89Å; T55-F57 PolarHBondContact O-N 2.94Å; F57-R72 PolarHBondContact O-N 3.24Å; F57-A73 HydrophobicContact CB-CB 4.1Å; F57-W75 HydrophobicContact CB-CH2 3.18Å; F57-W75 HydrophobicContact CB-CZ2 3.43Å; F57-W75 VanDerWaalsContact CB-CZ2 3.43Å; F57-W75 HydrophobicContact CB-CZ3 3.91Å; F57-W75 AromaticContact CD1-CH2 3.96Å; F57-W75 HydrophobicContact CD1-CH2 3.96Å; F57-W75 AromaticContact CD2-CH2 3.79Å; F57-W75 HydrophobicContact CD2-CH2 3.79Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.4Å; F57-W75 HydrophobicContact CG-CH2 3.4Å; F57-W75 HydrophobicContact CG-CZ2 4.11Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; F57-V76 HydrophobicContact CB-CG1 4.49Å; F57-V76 HydrophobicContact CD2-CB 4.39Å; F57-V76 HydrophobicContact CD2-CG1 4.43Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 WeakPolarHBondContact O-CG1 3.47Å; F57-Y195 HydrophobicContact CD2-CE2 4.33Å; F57-Y195 HydrophobicContact CE1-CE2 4.45Å; F57-Y195 HydrophobicContact CE2-CD2 4.15Å; F57-Y195 HydrophobicContact CE2-CE1 4.34Å; F57-Y195 AromaticContact CE2-CE2 3.46Å; F57-Y195 HydrophobicContact CE2-CE2 3.46Å; F57-Y195 VanDerWaalsContact CE2-CE2 3.46Å; F57-Y195 AromaticContact CE2-CZ 3.57Å; F57-Y195 HydrophobicContact CZ-CD2 4.14Å; F57-Y195 AromaticContact CZ-CE2 3.53Å; F57-Y195 HydrophobicContact CZ-CE2 3.53Å
58	V	98.2	Very high	97.5	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.006	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.3	176.5	-73.6	0	0	0	0	113.6	Y31 V49 G50 Q56 E70 W84	Y31-V58 HydrophobicContact CE1-CG2 4.1Å; V49-V58 WeakPolarHBondContact CA-O 3.35Å; G50-V58 PolarHBondContact N-O 3.19Å; G50-V58 VanDerWaalsContact N-O 3.08Å; G50-V58 PolarHBondContact O-N 3.4Å; Q56-V58 PolarHBondContact NE2-O 2.89Å; V58-E70 WeakPolarHBondContact CA-O 3.41Å; V58-W84 HydrophobicContact CG1-CH2 3.85Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å
59	Q	98.3	Very high	97.5	Very high	54 Å²	54	42 Å²	42	25%	0.252	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.9	168.2	-171.6	169.4	25.7	0	0	111.4	A48 V49 G69 E70 R72	A48-Q59 CarbonylContact O-C 3.6Å; A48-Q59 WeakPolarHBondContact O-CA 3Å; V49-Q59 HydrophobicContact CG1-CG 4.13Å; Q59-G69 WeakPolarHBondContact O-CA 3.49Å; Q59-E70 PolarHBondContact N-O 2.85Å; Q59-E70 PolarHBondContact O-N 2.73Å; Q59-R72 HydrophobicContact CB-CG 4.02Å; Q59-R72 VanDerWaalsContact OE1-CZ 3.28Å
60	F	98.8	Very high	97.4	Very high	5 Å²	5	43.4 Å²	43.4	2%	0.022	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	144.6	163	175.3	-78	0	0	0	108.8	F46 I47 A48 P67 R68 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.74Å; F46-F60 HydrophobicContact CD1-CD1 3.74Å; F46-F60 AromaticContact CD1-CE1 3.82Å; F46-F60 HydrophobicContact CD1-CE1 3.82Å; F46-F60 AromaticContact CE1-CD1 3.93Å; F46-F60 HydrophobicContact CE1-CD1 3.93Å; F46-F60 HydrophobicContact CE1-CE1 4.29Å; I47-F60 WeakPolarHBondContact CA-O 3.32Å; A48-F60 HydrophobicContact CB-CB 4.27Å; A48-F60 PolarHBondContact N-O 2.82Å; A48-F60 PolarHBondContact O-N 2.79Å; F60-P67 HydrophobicContact CE1-CB 4.44Å; F60-P67 HydrophobicContact CE2-CB 3.91Å; F60-P67 HydrophobicContact CZ-CB 3.64Å; F60-R68 VanDerWaalsContact CD2-C 3.41Å; F60-R68 WeakPolarHBondContact CD2-O 3.2Å; F60-Y91 HydrophobicContact CB-CD1 4.4Å; F60-Y91 HydrophobicContact CB-CD2 3.56Å; F60-Y91 HydrophobicContact CB-CE2 4.03Å; F60-Y91 HydrophobicContact CB-CG 3.79Å; F60-Y91 HydrophobicContact CD1-CG 4.44Å; F60-Y91 AromaticContact CD2-CD2 3.65Å; F60-Y91 HydrophobicContact CD2-CD2 3.65Å; F60-Y91 AromaticContact CD2-CG 3.92Å; F60-Y91 HydrophobicContact CD2-CG 3.92Å; F60-Y91 AromaticContact CG-CD2 3.81Å; F60-Y91 HydrophobicContact CG-CD2 3.81Å; F60-Y91 AromaticContact CG-CG 3.81Å; F60-Y91 HydrophobicContact CG-CG 3.81Å; F60-K92 HydrophobicContact CE2-CG 4.07Å; F60-K92 HydrophobicContact CZ-CG 3.9Å
61	D	98.6	Very high	97.4	Very high	31 Å²	31	45.5 Å²	45.5	17%	0.166	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	128.8	173.5	-171.8	-8.4	0	0	0	109.6	R45 D63 A64	R45-D61 IonicContact CZ-OD1 3.65Å; R45-D61 IonicContact CZ-OD2 3.44Å; R45-D61 IonicContact NE-OD1 3.82Å; R45-D61 PolarHBondContact NE-OD1 2.83Å; R45-D61 IonicContact NE-OD2 2.78Å; R45-D61 PolarHBondContact NE-OD2 2.9Å; R45-D61 IonicContact NH2-OD1 3.89Å; R45-D61 IonicContact NH2-OD2 3.51Å; R45-D61 PolarHBondContact NH2-OD2 2.88Å; D61-D63 PolarHBondContact O-N 3.16Å; D61-D63 PolarHBondContact OD1-N 3.22Å; D61-A64 PolarHBondContact O-N 3.26Å
62	S	98.2	Very high	97.3	Very high	34 Å²	34	47.1 Å²	47.1	24%	0.238	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-23.6	177.9	64.2	0	0	0	0	113.6	R45 F46 P67	R45-S62 WeakPolarHBondContact CA-OG 3.41Å; F46-S62 PolarHBondContact N-OG 2.82Å; F46-S62 PolarHBondContact O-N 2.87Å; S62-P67 WeakPolarHBondContact O-CG 3.46Å
63	D	97.4	Very high	97.2	Very high	70 Å²	70	47.4 Å²	47.4	37%	0.374	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-2.1	-176.2	-72.9	15.1	0	0	0	113	R38 R45 D61	R38-D63 IonicContact CZ-OD1 3.56Å; R38-D63 IonicContact CZ-OD2 3.52Å; R38-D63 IonicContact NH1-OD1 3.56Å; R38-D63 IonicContact NH1-OD2 2.75Å; R38-D63 PolarHBondContact NH1-OD2 3.48Å; R38-D63 IonicContact NH2-OD1 3.5Å; R38-D63 PolarHBondContact NH2-OD1 2.92Å; R38-D63 IonicContact NH2-OD2 2.69Å; R38-D63 PolarHBondContact NH2-OD2 2.79Å; R45-D63 VanDerWaalsContact CD-OD2 3.28Å; R45-D63 WeakPolarHBondContact CD-OD2 3.46Å; R45-D63 HydrophobicContact CG-CB 4.37Å; R45-D63 IonicContact NE-OD2 3.27Å; D61-D63 PolarHBondContact O-N 3.16Å; D61-D63 PolarHBondContact OD1-N 3.22Å
64	A	96.9	Very high	97.2	Very high	44 Å²	44	51 Å²	51	36%	0.364	29%	0.293	S	S	.	.	S	Bend	trans	-64	146.5	172.3	0	0	0	0	0	111.1	D61 S66 P67	D61-A64 PolarHBondContact O-N 3.26Å; A64-S66 PolarHBondContact O-N 2.82Å; A64-P67 WeakPolarHBondContact O-CD 3.12Å; A64-P67 VanDerWaalsContact O-CG 3.31Å; A64-P67 WeakPolarHBondContact O-CG 3.15Å
65	A	96.2	Very high	97.2	Very high	117 Å²	117	48.8 Å²	48.8	97%	0.967	28%	0.28	S	S	*	.	S	Bend	trans	-60.8	-21.1	-178.5	0	0	0	0	0	114.2
66	S	95.6	Very high	97.3	Very high	87 Å²	87	47.8 Å²	47.8	61%	0.608	27%	0.274	S	S	*	.	S	Bend	trans	-141.6	92.1	166.9	-173.6	0	0	0	0	108.8	A64 R68	A64-S66 PolarHBondContact O-N 2.82Å; S66-R68 PolarHBondContact O-N 3.45Å; S66-R68 VanDerWaalsContact O-N 3.17Å
67	P	96.8	Very high	97.2	Very high	35 Å²	35	51.1 Å²	51.1	23%	0.227	29%	0.29	C	S	.	.			trans	-64.3	117.6	-173.8	-25.4	36.4	0	0	0	111.7	F60 S62 A64 K92	F60-P67 HydrophobicContact CE1-CB 4.44Å; F60-P67 HydrophobicContact CE2-CB 3.91Å; F60-P67 HydrophobicContact CZ-CB 3.64Å; S62-P67 WeakPolarHBondContact O-CG 3.46Å; A64-P67 WeakPolarHBondContact O-CD 3.12Å; A64-P67 VanDerWaalsContact O-CG 3.31Å; A64-P67 WeakPolarHBondContact O-CG 3.15Å; P67-K92 WeakPolarHBondContact O-CE 3.38Å; P67-K92 PolarHBondContact O-NZ 3.35Å
68	R	97.6	Very high	97	Very high	142 Å²	142	57.1 Å²	57.1	54%	0.536	32%	0.318	S	S	.	.			trans	-149.6	160.5	179.7	64.6	-177.1	179.6	174.8	1.7	109.7	F60 S66 E70 T88	F60-R68 VanDerWaalsContact CD2-C 3.41Å; F60-R68 WeakPolarHBondContact CD2-O 3.2Å; S66-R68 PolarHBondContact O-N 3.45Å; S66-R68 VanDerWaalsContact O-N 3.17Å; R68-E70 HydrophobicContact CG-CG 4Å; R68-E70 IonicContact CZ-OE1 2.71Å; R68-E70 IonicContact NE-OE1 3.28Å; R68-E70 PolarHBondContact NE-OE1 3.37Å; R68-E70 IonicContact NH2-OE1 3.81Å; R68-E70 PolarHBondContact NH2-OE1 2.82Å; R68-T88 HydrophobicContact CB-CG2 4.33Å
69	G	97.3	Very high	97	Very high	5 Å²	5	57.5 Å²	57.5	5%	0.052	32%	0.32	C	S	.	.			trans	-67.3	133	164.9	0	0	0	0	0	109.3	Q59 T88	Q59-G69 WeakPolarHBondContact O-CA 3.49Å; G69-T88 PolarHBondContact N-OG1 3Å
70	E	97.5	Very high	96.8	Very high	57 Å²	57	56.8 Å²	56.8	27%	0.266	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.9	177.7	-58.8	-157.4	138.2	0	0	111.2	V58 Q59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.41Å; Q59-E70 PolarHBondContact N-O 2.85Å; Q59-E70 PolarHBondContact O-N 2.73Å; R68-E70 HydrophobicContact CG-CG 4Å; R68-E70 IonicContact CZ-OE1 2.71Å; R68-E70 IonicContact NE-OE1 3.28Å; R68-E70 PolarHBondContact NE-OE1 3.37Å; R68-E70 IonicContact NH2-OE1 3.81Å; R68-E70 PolarHBondContact NH2-OE1 2.82Å; E70-R72 IonicContact OE2-CZ 2.67Å; E70-R72 IonicContact OE2-NH1 2.77Å; E70-R72 PolarHBondContact OE2-NH1 3.17Å; E70-R72 VanDerWaalsContact OE2-NH1 3.09Å; E70-R72 IonicContact OE2-NH2 3.64Å; E70-R72 PolarHBondContact OE2-NH2 2.87Å
71	P	97.9	Very high	96.7	Very high	45 Å²	45	61.3 Å²	61.3	29%	0.292	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	149.2	171.9	29.3	-34.8	0	0	0	111.4	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.87Å; P71-E77 HydrophobicContact CB-CG 3.68Å; P71-E77 HydrophobicContact CG-CG 3.93Å; P71-W84 HydrophobicContact CB-CH2 3.73Å; P71-W84 HydrophobicContact CB-CZ2 3.98Å; P71-W84 HydrophobicContact CG-CH2 4.32Å; P71-W84 HydrophobicContact CG-CZ2 4.42Å
72	R	97.3	Very high	96.7	Very high	104 Å²	104	67.4 Å²	67.4	39%	0.392	38%	0.384	S	S	.	.	S	Bend	trans	-131.6	-2.1	171	-63.2	-64.6	178.6	-106.3	4.1	113.4	Q56 F57 Q59 E70	Q56-R72 HydrophobicContact CG-CB 4.22Å; Q56-R72 CarbonylContact O-C 3.59Å; F57-R72 PolarHBondContact O-N 3.24Å; Q59-R72 HydrophobicContact CB-CG 4.02Å; Q59-R72 VanDerWaalsContact OE1-CZ 3.28Å; E70-R72 IonicContact OE2-CZ 2.67Å; E70-R72 IonicContact OE2-NH1 2.77Å; E70-R72 PolarHBondContact OE2-NH1 3.17Å; E70-R72 VanDerWaalsContact OE2-NH1 3.09Å; E70-R72 IonicContact OE2-NH2 3.64Å; E70-R72 PolarHBondContact OE2-NH2 2.87Å
73	A	95.9	Very high	96.6	Very high	5 Å²	5	66.1 Å²	66.1	4%	0.041	37%	0.374	C	S	.	.	S	Bend	trans	-136.6	139.4	171.2	0	0	0	0	0	111	T55 F57 W75 V76	T55-A73 HydrophobicContact CG2-CB 4.25Å; F57-A73 HydrophobicContact CB-CB 4.1Å; A73-W75 HydrophobicContact CB-CD2 4.27Å; A73-W75 HydrophobicContact CB-CG 4.42Å; A73-W75 HydrophobicContact CB-CZ2 4.18Å; A73-W75 PolarHBondContact O-N 2.91Å; A73-W75 VanDerWaalsContact O-N 3.11Å; A73-V76 WeakPolarHBondContact O-CG1 3.23Å; A73-V76 PolarHBondContact O-N 2.98Å
74	P	96.1	Very high	96.7	Very high	103 Å²	103	64.6 Å²	64.6	67%	0.669	36%	0.363	S	S	*	.	H	α-helix	trans	-58.5	-30.1	-174.9	-28	35.7	0	0	0	114.9	V76 E77	P74-V76 PolarHBondContact O-N 2.82Å; P74-E77 WeakPolarHBondContact O-CB 3.34Å; P74-E77 PolarHBondContact O-N 3.19Å; P74-E77 VanDerWaalsContact O-N 3.15Å
75	W	95.8	Very high	96.7	Very high	14 Å²	14	67.4 Å²	67.4	5%	0.053	37%	0.372	C	S	.	.	H	α-helix	trans	-72.2	-9.7	-177.1	55.7	-109.4	0	0	0	114.8	V52 T55 F57 A73 Q78 Y195 N198 G199 L203	V52-W75 HydrophobicContact CB-CH2 4.23Å; V52-W75 HydrophobicContact CB-CZ2 4.3Å; V52-W75 HydrophobicContact CG2-CH2 3.83Å; V52-W75 HydrophobicContact CG2-CZ2 4.4Å; T55-W75 HydrophobicContact CG2-CZ2 4.37Å; F57-W75 HydrophobicContact CB-CH2 3.18Å; F57-W75 HydrophobicContact CB-CZ2 3.43Å; F57-W75 VanDerWaalsContact CB-CZ2 3.43Å; F57-W75 HydrophobicContact CB-CZ3 3.91Å; F57-W75 AromaticContact CD1-CH2 3.96Å; F57-W75 HydrophobicContact CD1-CH2 3.96Å; F57-W75 AromaticContact CD2-CH2 3.79Å; F57-W75 HydrophobicContact CD2-CH2 3.79Å; F57-W75 AromaticContact CD2-CZ3 3.98Å; F57-W75 HydrophobicContact CD2-CZ3 3.98Å; F57-W75 AromaticContact CG-CH2 3.4Å; F57-W75 HydrophobicContact CG-CH2 3.4Å; F57-W75 HydrophobicContact CG-CZ2 4.11Å; F57-W75 HydrophobicContact CG-CZ3 4.06Å; A73-W75 HydrophobicContact CB-CD2 4.27Å; A73-W75 HydrophobicContact CB-CG 4.42Å; A73-W75 HydrophobicContact CB-CZ2 4.18Å; A73-W75 PolarHBondContact O-N 2.91Å; A73-W75 VanDerWaalsContact O-N 3.11Å; W75-Q78 WeakPolarHBondContact O-CG 3.44Å; W75-Y195 HydrophobicContact CE3-CD1 4.28Å; W75-Y195 HydrophobicContact CE3-CG 4.48Å; W75-Y195 HydrophobicContact CH2-CD1 4.47Å; W75-Y195 HydrophobicContact CH2-CD2 4.44Å; W75-Y195 HydrophobicContact CH2-CG 4.04Å; W75-Y195 AromaticContact CZ3-CD1 3.56Å; W75-Y195 HydrophobicContact CZ3-CD1 3.56Å; W75-Y195 HydrophobicContact CZ3-CD2 4.27Å; W75-Y195 HydrophobicContact CZ3-CE1 4.31Å; W75-Y195 AromaticContact CZ3-CG 3.54Å; W75-Y195 HydrophobicContact CZ3-CG 3.54Å; W75-N198 HydrophobicContact CB-CB 4.44Å; W75-G199 VanDerWaalsContact CB-CA 3.47Å; W75-G199 VanDerWaalsContact CG-CA 3.42Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.34Å; W75-L203 HydrophobicContact CZ2-CD1 3.78Å; W75-L203 HydrophobicContact CZ2-CD2 3.99Å; W75-L203 HydrophobicContact CZ2-CG 4.3Å
76	V	97.2	Very high	96.8	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-100	-13.3	170.4	80.4	0	0	0	0	112.6	F57 P71 A73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.49Å; F57-V76 HydrophobicContact CD2-CB 4.39Å; F57-V76 HydrophobicContact CD2-CG1 4.43Å; F57-V76 HydrophobicContact CD2-CG2 4.16Å; F57-V76 WeakPolarHBondContact O-CG1 3.47Å; P71-V76 HydrophobicContact CB-CG1 3.87Å; A73-V76 WeakPolarHBondContact O-CG1 3.23Å; A73-V76 PolarHBondContact O-N 2.98Å; P74-V76 PolarHBondContact O-N 2.82Å; V76-Q78 PolarHBondContact O-N 2.96Å; V76-E79 HydrophobicContact CG2-CB 4.39Å; V76-E79 HydrophobicContact CG2-CG 3.69Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.37Å; V76-E79 WeakPolarHBondContact O-CG 3.39Å; V76-E79 PolarHBondContact O-N 2.96Å; V76-Y83 HydrophobicContact CG2-CE1 4.13Å; V76-W84 HydrophobicContact CG1-CH2 3.83Å; V76-W84 HydrophobicContact CG1-CZ2 4Å; V76-W84 HydrophobicContact CG2-CH2 4.24Å; V76-W84 HydrophobicContact CG2-CZ2 4.13Å; V76-W84 WeakPolarHBondContact O-CZ2 3.45Å; V76-Y195 HydrophobicContact CG2-CE1 4.16Å
77	E	95.8	Very high	96.8	Very high	120 Å²	120	62.7 Å²	62.7	56%	0.561	32%	0.316	S	S	*	.	H	α-helix	trans	-63.5	-23.6	178.6	-64.3	178.2	-169.6	0	0	112.8	P71 P74 E79	P71-E77 HydrophobicContact CB-CG 3.68Å; P71-E77 HydrophobicContact CG-CG 3.93Å; P74-E77 WeakPolarHBondContact O-CB 3.34Å; P74-E77 PolarHBondContact O-N 3.19Å; P74-E77 VanDerWaalsContact O-N 3.15Å; E77-E79 VanDerWaalsContact C-N 3.25Å; E77-E79 PolarHBondContact O-N 3Å
78	Q	94.6	Very high	96.9	Very high	126 Å²	126	61.4 Å²	61.4	59%	0.589	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-6.7	173	66.3	176.4	25.5	0	0	114.6	W75 V76 N198	W75-Q78 WeakPolarHBondContact O-CG 3.44Å; V76-Q78 PolarHBondContact O-N 2.96Å; Q78-N198 PolarHBondContact NE2-ND2 3.39Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.18Å; Q78-N198 PolarHBondContact NE2-OD1 2.89Å
79	E	96.6	Very high	97	Very high	10 Å²	10	59.4 Å²	59.4	5%	0.047	31%	0.305	C	S	.	.	S	Bend	trans	-72	131.1	174.1	-66.6	-62.5	160.1	0	0	110.8	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CB 4.39Å; V76-E79 HydrophobicContact CG2-CG 3.69Å; V76-E79 VanDerWaalsContact O-CB 3.31Å; V76-E79 WeakPolarHBondContact O-CB 3.37Å; V76-E79 WeakPolarHBondContact O-CG 3.39Å; V76-E79 PolarHBondContact O-N 2.96Å; E77-E79 VanDerWaalsContact C-N 3.25Å; E77-E79 PolarHBondContact O-N 3Å; E79-Y83 HydrophobicContact CB-CD1 3.66Å; E79-Y83 HydrophobicContact CB-CD2 4.33Å; E79-Y83 HydrophobicContact CB-CE1 4.23Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.28Å; E79-Y83 HydrophobicContact CG-CD2 4.34Å; E79-Y83 HydrophobicContact CG-CE1 4.46Å; E79-Y83 HydrophobicContact CG-CG 4.24Å; E79-W84 VanDerWaalsContact O-CD1 3.25Å; E79-W84 PolarHBondContact O-NE1 3.31Å; E79-R194 VanDerWaalsContact CD-NH2 3.32Å; E79-R194 IonicContact OE1-CZ 3.82Å; E79-R194 IonicContact OE1-NE 3.1Å; E79-R194 PolarHBondContact OE1-NE 2.98Å; E79-R194 IonicContact OE1-NH2 3.23Å; E79-R194 PolarHBondContact OE1-NH2 3.11Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 2.75Å; E79-R194 IonicContact OE2-NE 2.75Å; E79-R194 PolarHBondContact OE2-NE 3.43Å; E79-R194 IonicContact OE2-NH2 2.67Å; E79-R194 PolarHBondContact OE2-NH2 3.31Å; E79-N198 PolarHBondContact OE1-ND2 2.78Å; E79-N198 VanDerWaalsContact OE1-ND2 3.13Å
80	G	95.8	Very high	97	Very high	39 Å²	39	62.4 Å²	62.4	40%	0.402	32%	0.316	S	S	.	.			trans	-68.2	168.6	-172.8	0	0	0	0	0	114.7	E82 Y83 W84	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.44Å; G80-E82 VanDerWaalsContact O-N 3.16Å; G80-Y83 VanDerWaalsContact O-CB 3.32Å; G80-Y83 WeakPolarHBondContact O-CB 3.44Å; G80-Y83 PolarHBondContact O-N 3.43Å; G80-W84 PolarHBondContact O-N 2.93Å
81	P	96.7	Very high	97	Very high	99 Å²	99	59.7 Å²	59.7	64%	0.643	30%	0.304	S	S	*	.	H	α-helix	trans	-56.4	-36.6	-175.9	22.1	-33.4	0	0	0	113.3	Y83 W84 D85	P81-Y83 PolarHBondContact O-N 3.03Å; P81-W84 PolarHBondContact O-N 2.97Å; P81-D85 PolarHBondContact O-N 2.88Å
82	E	97.3	Very high	97	Very high	159 Å²	159	61.3 Å²	61.3	74%	0.743	31%	0.306	S	S	*	.	H	α-helix	trans	-58.2	-31.7	176.3	-61.4	-177.7	-176.8	0	0	113.8	G80 R86	G80-E82 VanDerWaalsContact C-N 3.25Å; G80-E82 PolarHBondContact O-N 3.44Å; G80-E82 VanDerWaalsContact O-N 3.16Å; E82-R86 WeakPolarHBondContact O-CB 3.48Å; E82-R86 PolarHBondContact O-N 3.05Å; E82-R86 VanDerWaalsContact O-N 3.13Å
83	Y	97.3	Very high	97.1	Very high	7 Å²	7	63.9 Å²	63.9	3%	0.027	32%	0.316	C	S	.	.	H	α-helix	trans	-67	-54.1	172.4	169.3	-87.6	0	0	0	109.7	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.13Å; E79-Y83 HydrophobicContact CB-CD1 3.66Å; E79-Y83 HydrophobicContact CB-CD2 4.33Å; E79-Y83 HydrophobicContact CB-CE1 4.23Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.28Å; E79-Y83 HydrophobicContact CG-CD2 4.34Å; E79-Y83 HydrophobicContact CG-CE1 4.46Å; E79-Y83 HydrophobicContact CG-CG 4.24Å; G80-Y83 VanDerWaalsContact O-CB 3.32Å; G80-Y83 WeakPolarHBondContact O-CB 3.44Å; G80-Y83 PolarHBondContact O-N 3.43Å; P81-Y83 PolarHBondContact O-N 3.03Å; Y83-D85 PolarHBondContact O-N 2.84Å; Y83-R86 VanDerWaalsContact CD2-NH2 3.32Å; Y83-R86 PolarHBondContact O-N 2.96Å; Y83-E87 HydrophobicContact CD1-CG 4.33Å; Y83-E87 HydrophobicContact CD2-CG 4.17Å; Y83-E87 HydrophobicContact CE1-CG 4.02Å; Y83-E87 HydrophobicContact CE2-CG 3.86Å; Y83-E87 HydrophobicContact CG-CG 4.38Å; Y83-E87 WeakPolarHBondContact O-CG 3.25Å; Y83-E87 PolarHBondContact O-N 3.33Å; Y83-W191 HydrophobicContact CD2-CE3 4.45Å; Y83-W191 AromaticContact CD2-CH2 3.58Å; Y83-W191 HydrophobicContact CD2-CH2 3.58Å; Y83-W191 HydrophobicContact CD2-CZ2 4.36Å; Y83-W191 AromaticContact CD2-CZ3 3.61Å; Y83-W191 HydrophobicContact CD2-CZ3 3.61Å; Y83-W191 HydrophobicContact CE2-CE3 4.06Å; Y83-W191 HydrophobicContact CE2-CH2 4.01Å; Y83-W191 AromaticContact CE2-CZ3 3.62Å; Y83-W191 HydrophobicContact CE2-CZ3 3.62Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.27Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.3Å; Y83-Y195 PolarHBondContact OH-OH 2.82Å
84	W	97.9	Very high	97.2	Very high	39 Å²	39	65 Å²	65	15%	0.148	32%	0.32	C	S	.	.	H	α-helix	trans	-63	-38.8	-176.2	-66.3	106.8	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.85Å; V58-W84 HydrophobicContact CG1-CZ3 3.84Å; P71-W84 HydrophobicContact CB-CH2 3.73Å; P71-W84 HydrophobicContact CB-CZ2 3.98Å; P71-W84 HydrophobicContact CG-CH2 4.32Å; P71-W84 HydrophobicContact CG-CZ2 4.42Å; V76-W84 HydrophobicContact CG1-CH2 3.83Å; V76-W84 HydrophobicContact CG1-CZ2 4Å; V76-W84 HydrophobicContact CG2-CH2 4.24Å; V76-W84 HydrophobicContact CG2-CZ2 4.13Å; V76-W84 WeakPolarHBondContact O-CZ2 3.45Å; E79-W84 VanDerWaalsContact O-CD1 3.25Å; E79-W84 PolarHBondContact O-NE1 3.31Å; G80-W84 PolarHBondContact O-N 2.93Å; P81-W84 PolarHBondContact O-N 2.97Å; W84-T88 WeakPolarHBondContact O-CB 3.37Å; W84-T88 PolarHBondContact O-N 3.4Å; W84-T88 PolarHBondContact O-OG1 3.32Å
85	D	97.9	Very high	97.3	Very high	102 Å²	102	61 Å²	61	55%	0.545	30%	0.296	S	S	.	.	H	α-helix	trans	-64.9	-48.1	172.9	-78.1	-35.2	0	0	0	111.3	P81 Y83 E87 T88 Q89	P81-D85 PolarHBondContact O-N 2.88Å; Y83-D85 PolarHBondContact O-N 2.84Å; D85-E87 PolarHBondContact O-N 3.36Å; D85-T88 WeakPolarHBondContact O-CB 3.31Å; D85-T88 PolarHBondContact O-N 3.41Å; D85-Q89 WeakPolarHBondContact O-CB 3.46Å; D85-Q89 VanDerWaalsContact O-CG 3.27Å; D85-Q89 WeakPolarHBondContact O-CG 3.38Å; D85-Q89 PolarHBondContact O-N 2.96Å
86	R	97.3	Very high	97.4	Very high	95 Å²	95	64.9 Å²	64.9	36%	0.358	31%	0.314	S	S	.	.	H	α-helix	trans	-62.6	-44.2	-179.9	-178.1	-175.4	64.4	-133	-4.2	112.5	E82 Y83 Q89 K90 W191	E82-R86 WeakPolarHBondContact O-CB 3.48Å; E82-R86 PolarHBondContact O-N 3.05Å; E82-R86 VanDerWaalsContact O-N 3.13Å; Y83-R86 VanDerWaalsContact CD2-NH2 3.32Å; Y83-R86 PolarHBondContact O-N 2.96Å; R86-Q89 PolarHBondContact O-N 3.47Å; R86-K90 WeakPolarHBondContact O-CG 3.47Å; R86-K90 PolarHBondContact O-N 3.41Å; R86-W191 VanDerWaalsContact NH2-CZ2 3.31Å
87	E	97.3	Very high	97.5	Very high	10 Å²	10	68.2 Å²	68.2	5%	0.047	34%	0.335	C	S	.	.	H	α-helix	trans	-69	-40.1	176.8	-56.5	-39.3	115.9	0	0	110.9	Y83 D85 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.33Å; Y83-E87 HydrophobicContact CD2-CG 4.17Å; Y83-E87 HydrophobicContact CE1-CG 4.02Å; Y83-E87 HydrophobicContact CE2-CG 3.86Å; Y83-E87 HydrophobicContact CG-CG 4.38Å; Y83-E87 WeakPolarHBondContact O-CG 3.25Å; Y83-E87 PolarHBondContact O-N 3.33Å; D85-E87 PolarHBondContact O-N 3.36Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 2.94Å; E87-K90 WeakPolarHBondContact O-CB 3.49Å; E87-K90 PolarHBondContact O-N 3.31Å; E87-K90 IonicContact OE1-NZ 3.11Å; E87-K90 PolarHBondContact OE1-NZ 3.45Å; E87-K90 WeakPolarHBondContact OE2-CD 3.34Å; E87-K90 WeakPolarHBondContact OE2-CE 3.35Å; E87-K90 IonicContact OE2-NZ 3.47Å; E87-K90 PolarHBondContact OE2-NZ 3Å; E87-Y91 HydrophobicContact CB-CE2 4.04Å; E87-Y91 WeakPolarHBondContact O-CD2 3.4Å; E87-Y91 PolarHBondContact O-N 2.95Å
88	T	98.4	Very high	97.6	Very high	9 Å²	9	62.6 Å²	62.6	6%	0.055	31%	0.309	C	S	.	.	H	α-helix	trans	-55.4	-43.8	170.7	-65.9	0	0	0	0	112.3	R68 G69 W84 D85 Y91 K92	R68-T88 HydrophobicContact CB-CG2 4.33Å; G69-T88 PolarHBondContact N-OG1 3Å; W84-T88 WeakPolarHBondContact O-CB 3.37Å; W84-T88 PolarHBondContact O-N 3.4Å; W84-T88 PolarHBondContact O-OG1 3.32Å; D85-T88 WeakPolarHBondContact O-CB 3.31Å; D85-T88 PolarHBondContact O-N 3.41Å; T88-Y91 PolarHBondContact O-N 3.36Å; T88-K92 HydrophobicContact CG2-CD 3.93Å; T88-K92 WeakPolarHBondContact O-CB 3.45Å; T88-K92 WeakPolarHBondContact O-CG 3.33Å; T88-K92 PolarHBondContact O-N 3.05Å
89	Q	98.3	Very high	97.7	Very high	100 Å²	100	60.4 Å²	60.4	47%	0.467	30%	0.295	S	S	.	.	H	α-helix	trans	-75.8	-19.5	178	-63.7	-62.8	-7.8	0	0	113.4	D85 R86 E87 R93	D85-Q89 WeakPolarHBondContact O-CB 3.46Å; D85-Q89 VanDerWaalsContact O-CG 3.27Å; D85-Q89 WeakPolarHBondContact O-CG 3.38Å; D85-Q89 PolarHBondContact O-N 2.96Å; R86-Q89 PolarHBondContact O-N 3.47Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 2.94Å; Q89-R93 WeakPolarHBondContact O-CB 3.46Å; Q89-R93 WeakPolarHBondContact O-CG 3.41Å; Q89-R93 PolarHBondContact O-N 3.49Å; Q89-R93 PolarHBondContact O-NE 3.08Å
90	K	97.4	Very high	97.8	Very high	68 Å²	68	65.6 Å²	65.6	30%	0.296	32%	0.319	S	S	.	.	H	α-helix	trans	-71.5	-51.9	166.1	-76.8	159.1	162.5	178	0	110.4	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.47Å; R86-K90 PolarHBondContact O-N 3.41Å; E87-K90 WeakPolarHBondContact O-CB 3.49Å; E87-K90 PolarHBondContact O-N 3.31Å; E87-K90 IonicContact OE1-NZ 3.11Å; E87-K90 PolarHBondContact OE1-NZ 3.45Å; E87-K90 WeakPolarHBondContact OE2-CD 3.34Å; E87-K90 WeakPolarHBondContact OE2-CE 3.35Å; E87-K90 IonicContact OE2-NZ 3.47Å; E87-K90 PolarHBondContact OE2-NZ 3Å; K90-K92 PolarHBondContact O-N 2.96Å; K90-R93 PolarHBondContact O-N 2.96Å; K90-Q94 PolarHBondContact O-N 3.01Å
91	Y	98.5	Very high	97.9	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.1	-44.8	179.1	-60.3	-48.5	0	0	0	112.3	Y33 F46 A48 F60 E87 T88 R93 Q94 A95	Y33-Y91 HydrophobicContact CE1-CD1 4.12Å; Y33-Y91 AromaticContact CE1-CE1 3.81Å; Y33-Y91 HydrophobicContact CE1-CE1 3.81Å; Y33-Y91 AromaticContact CZ-CE1 3.99Å; Y33-Y91 WeakPolarHBondContact OH-CE1 3.3Å; F46-Y91 HydrophobicContact CE1-CD1 4.4Å; A48-Y91 HydrophobicContact CB-CD1 3.71Å; A48-Y91 HydrophobicContact CB-CE1 3.76Å; F60-Y91 HydrophobicContact CB-CD1 4.4Å; F60-Y91 HydrophobicContact CB-CD2 3.56Å; F60-Y91 HydrophobicContact CB-CE2 4.03Å; F60-Y91 HydrophobicContact CB-CG 3.79Å; F60-Y91 HydrophobicContact CD1-CG 4.44Å; F60-Y91 AromaticContact CD2-CD2 3.65Å; F60-Y91 HydrophobicContact CD2-CD2 3.65Å; F60-Y91 AromaticContact CD2-CG 3.92Å; F60-Y91 HydrophobicContact CD2-CG 3.92Å; F60-Y91 AromaticContact CG-CD2 3.81Å; F60-Y91 HydrophobicContact CG-CD2 3.81Å; F60-Y91 AromaticContact CG-CG 3.81Å; F60-Y91 HydrophobicContact CG-CG 3.81Å; E87-Y91 HydrophobicContact CB-CE2 4.04Å; E87-Y91 WeakPolarHBondContact O-CD2 3.4Å; E87-Y91 PolarHBondContact O-N 2.95Å; T88-Y91 PolarHBondContact O-N 3.36Å; Y91-R93 VanDerWaalsContact C-N 3.34Å; Y91-R93 PolarHBondContact O-N 3.29Å; Y91-Q94 PolarHBondContact O-N 3.01Å; Y91-A95 WeakPolarHBondContact O-CB 3.48Å; Y91-A95 PolarHBondContact O-N 3.34Å
92	K	98.4	Very high	98	Very high	79 Å²	79	61 Å²	61	34%	0.343	28%	0.283	S	S	.	.	H	α-helix	trans	-62.2	-35.7	176.9	-75.6	175.1	179.4	168.2	0	113.7	F60 P67 T88 K90	F60-K92 HydrophobicContact CE2-CG 4.07Å; F60-K92 HydrophobicContact CZ-CG 3.9Å; P67-K92 WeakPolarHBondContact O-CE 3.38Å; P67-K92 PolarHBondContact O-NZ 3.35Å; T88-K92 HydrophobicContact CG2-CD 3.93Å; T88-K92 WeakPolarHBondContact O-CB 3.45Å; T88-K92 WeakPolarHBondContact O-CG 3.33Å; T88-K92 PolarHBondContact O-N 3.05Å; K90-K92 PolarHBondContact O-N 2.96Å
93	R	98.3	Very high	98	Very high	157 Å²	157	61.3 Å²	61.3	59%	0.592	28%	0.277	S	S	*	.	H	α-helix	trans	-71.6	-45.9	173.7	-77.2	-179.1	-69.2	172.7	-0.5	111.6	Q89 K90 Y91 A95 Q96 T97	Q89-R93 WeakPolarHBondContact O-CB 3.46Å; Q89-R93 WeakPolarHBondContact O-CG 3.41Å; Q89-R93 PolarHBondContact O-N 3.49Å; Q89-R93 PolarHBondContact O-NE 3.08Å; K90-R93 PolarHBondContact O-N 2.96Å; Y91-R93 VanDerWaalsContact C-N 3.34Å; Y91-R93 PolarHBondContact O-N 3.29Å; R93-A95 VanDerWaalsContact C-N 3.29Å; R93-A95 PolarHBondContact O-N 2.95Å; R93-Q96 PolarHBondContact O-N 3.06Å; R93-Q96 VanDerWaalsContact O-N 3.08Å; R93-T97 PolarHBondContact O-N 3.17Å; R93-T97 PolarHBondContact O-OG1 3.21Å
94	Q	98.4	Very high	98	Very high	30 Å²	30	64.6 Å²	64.6	14%	0.14	30%	0.295	C	S	.	.	H	α-helix	trans	-58.8	-40.6	177.2	-170.9	73.7	53.9	0	0	111.8	Y33 F46 K90 Y91 Q96 T97 D98	Y33-Q94 HydrophobicContact CD2-CG 3.63Å; Y33-Q94 HydrophobicContact CE2-CB 4.35Å; Y33-Q94 HydrophobicContact CE2-CG 3.65Å; F46-Q94 HydrophobicContact CE2-CB 4.18Å; F46-Q94 HydrophobicContact CE2-CG 3.7Å; F46-Q94 HydrophobicContact CZ-CB 4Å; F46-Q94 HydrophobicContact CZ-CG 3.87Å; K90-Q94 PolarHBondContact O-N 3.01Å; Y91-Q94 PolarHBondContact O-N 3.01Å; Q94-Q96 PolarHBondContact O-N 3.38Å; Q94-T97 CarbonylContact O-C 3.59Å; Q94-T97 WeakPolarHBondContact O-CB 3.34Å; Q94-T97 PolarHBondContact O-N 3.48Å; Q94-T97 VanDerWaalsContact O-N 3.08Å; Q94-D98 PolarHBondContact NE2-OD1 3.49Å; Q94-D98 WeakPolarHBondContact O-CB 3.4Å; Q94-D98 PolarHBondContact O-N 2.94Å
95	A	98.4	Very high	98.1	Very high	19 Å²	19	63 Å²	63	16%	0.157	29%	0.29	C	S	.	.	H	α-helix	trans	-57.7	-35	176	0	0	0	0	0	113.2	F46 Y91 R93 R99	F46-A95 HydrophobicContact CB-CB 3.67Å; F46-A95 HydrophobicContact CD1-CB 3.91Å; F46-A95 HydrophobicContact CD2-CB 4.16Å; F46-A95 HydrophobicContact CG-CB 3.65Å; Y91-A95 WeakPolarHBondContact O-CB 3.48Å; Y91-A95 PolarHBondContact O-N 3.34Å; R93-A95 VanDerWaalsContact C-N 3.29Å; R93-A95 PolarHBondContact O-N 2.95Å; A95-R99 VanDerWaalsContact O-CB 3.27Å; A95-R99 WeakPolarHBondContact O-CB 3.48Å; A95-R99 PolarHBondContact O-N 3.39Å; A95-R99 VanDerWaalsContact O-N 3.1Å
96	Q	98.1	Very high	98	Very high	94 Å²	94	60.9 Å²	60.9	44%	0.439	27%	0.274	S	S	.	.	H	α-helix	trans	-75.1	-41.2	173.2	-60.4	-57.3	-39.5	0	0	111.8	R93 Q94 D98 R99 E100	R93-Q96 PolarHBondContact O-N 3.06Å; R93-Q96 VanDerWaalsContact O-N 3.08Å; Q94-Q96 PolarHBondContact O-N 3.38Å; Q96-D98 VanDerWaalsContact C-N 3.29Å; Q96-D98 PolarHBondContact O-N 3.4Å; Q96-R99 WeakPolarHBondContact O-CB 3.4Å; Q96-R99 PolarHBondContact O-N 2.99Å; Q96-E100 PolarHBondContact O-N 3.16Å
97	T	98.1	Very high	98	Very high	70 Å²	70	58.4 Å²	58.4	43%	0.429	28%	0.278	S	S	.	.	H	α-helix	trans	-59.5	-39	173.9	-54	0	0	0	0	112.3	R93 Q94 E100 S101	R93-T97 PolarHBondContact O-N 3.17Å; R93-T97 PolarHBondContact O-OG1 3.21Å; Q94-T97 CarbonylContact O-C 3.59Å; Q94-T97 WeakPolarHBondContact O-CB 3.34Å; Q94-T97 PolarHBondContact O-N 3.48Å; Q94-T97 VanDerWaalsContact O-N 3.08Å; T97-E100 PolarHBondContact O-N 3.46Å; T97-S101 WeakPolarHBondContact O-CB 3.5Å; T97-S101 PolarHBondContact O-N 3.21Å; T97-S101 PolarHBondContact O-OG 3.34Å
98	D	98.3	Very high	98.1	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.011	29%	0.285	C	S	.	.	H	α-helix	trans	-77	-33.8	-179.5	-68.8	-0.7	0	0	0	111.4	A35 F46 Q94 Q96 S101 L102 L119	A35-D98 HydrophobicContact CB-CB 3.7Å; F46-D98 HydrophobicContact CD2-CB 4.48Å; F46-D98 VanDerWaalsContact CE2-OD2 3.28Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.48Å; Q94-D98 PolarHBondContact NE2-OD1 3.49Å; Q94-D98 WeakPolarHBondContact O-CB 3.4Å; Q94-D98 PolarHBondContact O-N 2.94Å; Q96-D98 VanDerWaalsContact C-N 3.29Å; Q96-D98 PolarHBondContact O-N 3.4Å; D98-S101 PolarHBondContact O-N 3.01Å; D98-L102 WeakPolarHBondContact O-CB 3.36Å; D98-L102 VanDerWaalsContact O-CG 3.24Å; D98-L102 WeakPolarHBondContact O-CG 2.97Å; D98-L102 PolarHBondContact O-N 2.78Å; D98-L119 HydrophobicContact CB-CD2 4.12Å
99	R	98.1	Very high	98.1	Very high	81 Å²	81	63.2 Å²	63.2	31%	0.306	30%	0.296	S	S	.	.	H	α-helix	trans	-59.6	-44.4	168.5	173.3	-168.5	-175	-145.2	2.1	112.2	E43 P44 A95 Q96 R103	E43-R99 VanDerWaalsContact CD-NE 3.31Å; E43-R99 IonicContact OE1-CZ 3.45Å; E43-R99 IonicContact OE1-NE 2.66Å; E43-R99 IonicContact OE1-NH2 3.45Å; E43-R99 PolarHBondContact OE1-NH2 3.49Å; E43-R99 IonicContact OE2-CZ 3.48Å; E43-R99 IonicContact OE2-NE 2.97Å; E43-R99 PolarHBondContact OE2-NE 3.06Å; E43-R99 IonicContact OE2-NH2 3.77Å; E43-R99 PolarHBondContact OE2-NH2 3.43Å; P44-R99 HydrophobicContact CG-CB 4.3Å; P44-R99 HydrophobicContact CG-CG 4.18Å; A95-R99 VanDerWaalsContact O-CB 3.27Å; A95-R99 WeakPolarHBondContact O-CB 3.48Å; A95-R99 PolarHBondContact O-N 3.39Å; A95-R99 VanDerWaalsContact O-N 3.1Å; Q96-R99 WeakPolarHBondContact O-CB 3.4Å; Q96-R99 PolarHBondContact O-N 2.99Å; R99-R103 PolarHBondContact O-N 3.27Å
100	E	97.8	Very high	98	Very high	119 Å²	119	65.7 Å²	65.7	56%	0.556	31%	0.312	S	S	*	.	H	α-helix	trans	-68.2	-41.6	174.2	-72.1	-178.6	-176.3	0	0	111.7	Q96 T97 L102 R103 N104	Q96-E100 PolarHBondContact O-N 3.16Å; T97-E100 PolarHBondContact O-N 3.46Å; E100-L102 PolarHBondContact O-N 3.29Å; E100-R103 PolarHBondContact O-N 3.26Å; E100-N104 PolarHBondContact O-N 2.78Å; E100-N104 PolarHBondContact O-ND2 3.19Å; E100-N104 VanDerWaalsContact O-ND2 3.1Å
101	S	98.3	Very high	98	Very high	35 Å²	35	65.2 Å²	65.2	25%	0.245	31%	0.311	C	S	.	.	H	α-helix	trans	-58.8	-46.2	175.3	-60.6	0	0	0	0	111.8	T97 D98 R103 N104 L105 L119	T97-S101 WeakPolarHBondContact O-CB 3.5Å; T97-S101 PolarHBondContact O-N 3.21Å; T97-S101 PolarHBondContact O-OG 3.34Å; D98-S101 PolarHBondContact O-N 3.01Å; S101-R103 VanDerWaalsContact C-N 3.33Å; S101-R103 PolarHBondContact O-N 3.06Å; S101-N104 PolarHBondContact O-N 2.93Å; S101-N104 VanDerWaalsContact O-N 3.12Å; S101-L105 WeakPolarHBondContact O-CB 3.1Å; S101-L105 WeakPolarHBondContact O-CD1 3.36Å; S101-L105 WeakPolarHBondContact O-CG 3.03Å; S101-L105 PolarHBondContact O-N 3.15Å; S101-L119 VanDerWaalsContact CB-CD2 3.45Å
102	L	98.5	Very high	97.8	Very high	7 Å²	7	69.1 Å²	69.1	4%	0.037	34%	0.338	C	S	.	.	H	α-helix	trans	-56.9	-42.4	175	-78	164.4	0	0	0	112.4	A35 P44 D98 E100 R106 H117 L119 Y142	A35-L102 HydrophobicContact CB-CD1 3.84Å; P44-L102 HydrophobicContact CB-CD1 3.75Å; P44-L102 HydrophobicContact CG-CD1 3.94Å; D98-L102 WeakPolarHBondContact O-CB 3.36Å; D98-L102 VanDerWaalsContact O-CG 3.24Å; D98-L102 WeakPolarHBondContact O-CG 2.97Å; D98-L102 PolarHBondContact O-N 2.78Å; E100-L102 PolarHBondContact O-N 3.29Å; L102-R106 VanDerWaalsContact O-CB 3.3Å; L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.11Å; L102-R106 VanDerWaalsContact O-N 3.13Å; L102-H117 HydrophobicContact CD2-CB 4.33Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 3.98Å; L102-L119 HydrophobicContact CG-CD2 4.47Å; L102-Y142 HydrophobicContact CD2-CE2 4.01Å
103	R	97.1	Very high	97.6	Very high	164 Å²	164	71.8 Å²	71.8	62%	0.619	35%	0.352	S	S	*	.	H	α-helix	trans	-64.4	-42.9	174.5	179.3	-177.9	-74.1	166.1	-3.4	111.9	R99 E100 S101 G107	R99-R103 PolarHBondContact O-N 3.27Å; E100-R103 PolarHBondContact O-N 3.26Å; S101-R103 VanDerWaalsContact C-N 3.33Å; S101-R103 PolarHBondContact O-N 3.06Å; R103-G107 PolarHBondContact O-N 2.93Å
104	N	97.9	Very high	97.3	Very high	76 Å²	76	68.2 Å²	68.2	41%	0.406	36%	0.356	S	S	.	.	H	α-helix	trans	-66.6	-46.2	179.6	-71.4	-39.9	0	0	0	112	E100 S101 G107 Y108	E100-N104 PolarHBondContact O-N 2.78Å; E100-N104 PolarHBondContact O-ND2 3.19Å; E100-N104 VanDerWaalsContact O-ND2 3.1Å; S101-N104 PolarHBondContact O-N 2.93Å; S101-N104 VanDerWaalsContact O-N 3.12Å; N104-G107 WeakPolarHBondContact O-CA 3.38Å; N104-G107 PolarHBondContact O-N 2.8Å; N104-G107 VanDerWaalsContact O-N 3.15Å; N104-Y108 HydrophobicContact CB-CE2 4.45Å; N104-Y108 WeakPolarHBondContact O-CD1 3.46Å; N104-Y108 VanDerWaalsContact O-CG 3.3Å; N104-Y108 PolarHBondContact O-N 3.15Å
105	L	98.3	Very high	97.1	Very high	6 Å²	6	67.9 Å²	67.9	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-59.2	-52.8	178.9	-71.4	161.5	0	0	0	111	S101 G107 Y108 Y109 L119 Y142 Y147	S101-L105 WeakPolarHBondContact O-CB 3.1Å; S101-L105 WeakPolarHBondContact O-CD1 3.36Å; S101-L105 WeakPolarHBondContact O-CG 3.03Å; S101-L105 PolarHBondContact O-N 3.15Å; L105-G107 PolarHBondContact O-N 2.83Å; L105-G107 VanDerWaalsContact O-N 3.14Å; L105-Y108 PolarHBondContact O-N 3.4Å; L105-Y109 HydrophobicContact CD2-CE2 4.24Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.49Å; L105-Y109 PolarHBondContact O-N 2.88Å; L105-L119 HydrophobicContact CD1-CD1 3.86Å; L105-L119 HydrophobicContact CD1-CD2 4.11Å; L105-L119 HydrophobicContact CD1-CG 4.41Å; L105-Y142 HydrophobicContact CB-CD1 4.26Å; L105-Y142 HydrophobicContact CB-CD2 4.24Å; L105-Y142 HydrophobicContact CB-CE1 3.86Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.67Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.1Å; L105-Y142 HydrophobicContact CD2-CD1 4.46Å; L105-Y142 HydrophobicContact CD2-CG 4.39Å; L105-Y142 HydrophobicContact CG-CD2 4.42Å; L105-Y142 HydrophobicContact CG-CE2 4.47Å; L105-Y147 HydrophobicContact CD2-CD1 4.17Å; L105-Y147 HydrophobicContact CD2-CD2 4.01Å; L105-Y147 HydrophobicContact CD2-CE1 3.66Å; L105-Y147 HydrophobicContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.46Å; L105-Y147 HydrophobicContact CD2-CG 4.34Å
106	R	97.4	Very high	97.1	Very high	57 Å²	57	70.9 Å²	70.9	22%	0.215	38%	0.38	C	S	.	.	H	α-helix	trans	-52.5	-37.4	175	-171.1	-165.2	66.3	170.3	9.4	112.1	L102 N110 Q111 E113 Y142	L102-R106 VanDerWaalsContact O-CB 3.3Å; L102-R106 WeakPolarHBondContact O-CB 3.44Å; L102-R106 PolarHBondContact O-N 3.11Å; L102-R106 VanDerWaalsContact O-N 3.13Å; R106-N110 PolarHBondContact O-N 2.89Å; R106-Q111 HydrophobicContact CG-CB 3.76Å; R106-Q111 PolarHBondContact O-N 3.03Å; R106-E113 IonicContact CZ-OE1 3.55Å; R106-E113 IonicContact NH1-OE1 2.95Å; R106-E113 PolarHBondContact NH1-OE1 3.38Å; R106-E113 IonicContact NH2-OE1 3.49Å; R106-E113 PolarHBondContact NH2-OE1 2.84Å; R106-Y142 PolarHBondContact N-OH 2.83Å
107	G	97.4	Very high	97.1	Very high	43 Å²	43	67.2 Å²	67.2	44%	0.443	36%	0.363	S	S	.	.	H	α-helix	trans	-67.3	-49.3	172.9	0	0	0	0	0	113.6	R103 N104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 2.93Å; N104-G107 WeakPolarHBondContact O-CA 3.38Å; N104-G107 PolarHBondContact O-N 2.8Å; N104-G107 VanDerWaalsContact O-N 3.15Å; L105-G107 PolarHBondContact O-N 2.83Å; L105-G107 VanDerWaalsContact O-N 3.14Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 2.94Å; G107-N110 PolarHBondContact O-N 3.43Å; G107-N110 VanDerWaalsContact O-N 3.11Å
108	Y	98.1	Very high	97.1	Very high	52 Å²	52	65.6 Å²	65.6	20%	0.204	35%	0.353	C	S	.	.	H	α-helix	trans	-60.5	-35.2	178.8	-58	-24.8	0	0	0	112.9	N104 L105 A163 I166 K170	N104-Y108 HydrophobicContact CB-CE2 4.45Å; N104-Y108 WeakPolarHBondContact O-CD1 3.46Å; N104-Y108 VanDerWaalsContact O-CG 3.3Å; N104-Y108 PolarHBondContact O-N 3.15Å; L105-Y108 PolarHBondContact O-N 3.4Å; Y108-A163 HydrophobicContact CD2-CB 4.48Å; Y108-I166 HydrophobicContact CD1-CD1 3.92Å; Y108-I166 HydrophobicContact CE1-CD1 4.31Å; Y108-I166 HydrophobicContact CE1-CG2 3.87Å; Y108-I166 HydrophobicContact CE2-CB 4.32Å; Y108-I166 HydrophobicContact CE2-CG2 4.29Å; Y108-I166 HydrophobicContact CG-CD1 4.03Å; Y108-K170 PolarHBondContact OH-NZ 2.62Å
109	Y	98.1	Very high	97.2	Very high	69 Å²	69	65.7 Å²	65.7	27%	0.271	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	0.4	177.9	-69.6	-70.5	0	0	0	114.1	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.24Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.49Å; L105-Y109 PolarHBondContact O-N 2.88Å; G107-Y109 VanDerWaalsContact C-N 3.26Å; G107-Y109 PolarHBondContact O-N 2.94Å; Y109-Q111 VanDerWaalsContact C-N 3.25Å; Y109-Q111 PolarHBondContact O-N 3.35Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.48Å; Y109-Y142 HydrophobicContact CD2-CE1 3.48Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.48Å; Y109-Y142 AromaticContact CE2-CD1 3.48Å; Y109-Y142 HydrophobicContact CE2-CD1 3.48Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.48Å; Y109-Y142 AromaticContact CE2-CE1 3.77Å; Y109-Y142 HydrophobicContact CE2-CE1 3.77Å; Y109-Y142 HydrophobicContact CG-CE1 4.44Å; Y109-Y147 HydrophobicContact CE2-CD2 4.39Å; Y109-Y147 HydrophobicContact CE2-CE2 4.11Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.47Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.39Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.35Å; Y109-D161 VanDerWaalsContact OH-CG 3.29Å; Y109-D161 PolarHBondContact OH-OD1 2.94Å; Y109-D161 PolarHBondContact OH-OD2 2.75Å; Y109-A163 HydrophobicContact CD1-CB 4.23Å; Y109-A163 HydrophobicContact CD2-CB 4.45Å; Y109-A163 HydrophobicContact CE1-CB 3.72Å; Y109-A163 HydrophobicContact CE2-CB 3.96Å
110	N	97.1	Very high	97.2	Very high	151 Å²	151	65.4 Å²	65.4	81%	0.807	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.9	36.4	-177.8	-53.6	-85.6	0	0	0	113.6	R106 G107	R106-N110 PolarHBondContact O-N 2.89Å; G107-N110 PolarHBondContact O-N 3.43Å; G107-N110 VanDerWaalsContact O-N 3.11Å
111	Q	97.4	Very high	97.2	Very high	59 Å²	59	60.5 Å²	60.5	28%	0.276	33%	0.332	S	S	.	.			trans	-83.6	152.9	-177.1	-71.1	163	-48	0	0	112.3	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.76Å; R106-Q111 PolarHBondContact O-N 3.03Å; Y109-Q111 VanDerWaalsContact C-N 3.25Å; Y109-Q111 PolarHBondContact O-N 3.35Å; Q111-H117 PolarHBondContact NE2-CE1 2.92Å; Q111-H117 PolarHBondContact NE2-ND1 3.4Å; Q111-Y142 PolarHBondContact OE1-OH 3.41Å; Q111-D143 PolarHBondContact NE2-OD2 3.48Å; Q111-D143 VanDerWaalsContact NE2-OD2 3.16Å
112	S	95.4	Very high	97.3	Very high	82 Å²	82	60 Å²	60	57%	0.573	33%	0.326	S	S	*	.			trans	-67.7	145.2	-178.6	179.5	0	0	0	0	112.9	A114 G115	S112-A114 PolarHBondContact O-N 2.94Å; S112-A114 PolarHBondContact OG-N 2.94Å; S112-G115 PolarHBondContact O-N 3.3Å; S112-G115 VanDerWaalsContact O-N 3.08Å
113	E	92.6	Very high	97.3	Very high	135 Å²	135	60.8 Å²	60.8	63%	0.631	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-20.8	174.3	-61.6	-139.2	100.8	0	0	114	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.26Å; P39-E113 WeakPolarHBondContact CG-O 3.15Å; R106-E113 IonicContact CZ-OE1 3.55Å; R106-E113 IonicContact NH1-OE1 2.95Å; R106-E113 PolarHBondContact NH1-OE1 3.38Å; R106-E113 IonicContact NH2-OE1 3.49Å; R106-E113 PolarHBondContact NH2-OE1 2.84Å; E113-G115 VanDerWaalsContact C-N 3.29Å
114	A	93.2	Very high	97.3	Very high	82 Å²	82	53 Å²	53	68%	0.678	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.5	-7.3	176.1	0	0	0	0	0	113.6	S112	S112-A114 PolarHBondContact O-N 2.94Å; S112-A114 PolarHBondContact OG-N 2.94Å
115	G	94.1	Very high	97.4	Very high	23 Å²	23	49.4 Å²	49.4	24%	0.237	28%	0.28	C	S	.	.			trans	-73.6	132.6	179.6	0	0	0	0	0	113	P39 S112 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.33Å; S112-G115 PolarHBondContact O-N 3.3Å; S112-G115 VanDerWaalsContact O-N 3.08Å; E113-G115 VanDerWaalsContact C-N 3.29Å; G115-H117 PolarHBondContact O-CD2 3.17Å
116	S	97.5	Very high	97.4	Very high	82 Å²	82	50.3 Å²	50.3	57%	0.573	29%	0.285	S	S	*	.			trans	-83.1	116.1	165.1	180	0	0	0	0	108.4	S37	S37-S116 PolarHBondContact O-OG 3.31Å; S37-S116 VanDerWaalsContact O-OG 3.06Å
117	H	98.4	Very high	97.3	Very high	16 Å²	16	47.8 Å²	47.8	7%	0.074	28%	0.276	C	S	.	.			trans	-120.5	147.9	-177.8	-62.1	-77.1	0	0	0	112.2	S37 L102 Q111 G115 Y142 D143	S37-H117 PolarHBondContact N-O 2.91Å; S37-H117 WeakPolarHBondContact OG-CA 3.41Å; S37-H117 WeakPolarHBondContact OG-CB 3.32Å; S37-H117 PolarHBondContact OG-N 3.48Å; S37-H117 PolarHBondContact OG-O 3.13Å; L102-H117 HydrophobicContact CD2-CB 4.33Å; Q111-H117 PolarHBondContact NE2-CE1 2.92Å; Q111-H117 PolarHBondContact NE2-ND1 3.4Å; G115-H117 PolarHBondContact O-CD2 3.17Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.19Å; H117-Y142 VanDerWaalsContact CG-OH 3.31Å; H117-Y142 PolarHBondContact ND1-OH 3.38Å; H117-D143 VanDerWaalsContact CA-OD1 3.23Å; H117-D143 WeakPolarHBondContact CA-OD1 3.4Å; H117-D143 WeakPolarHBondContact CB-OD1 3.2Å; H117-D143 IonicContact CE1-OD2 2.7Å; H117-D143 IonicContact CG-OD1 3.47Å; H117-D143 IonicContact CG-OD2 3.09Å; H117-D143 IonicContact ND1-OD1 3.34Å; H117-D143 IonicContact ND1-OD2 2.83Å; H117-D143 PolarHBondContact ND1-OD2 2.92Å
118	T	98.8	Very high	97.1	Very high	36 Å²	36	46 Å²	46	22%	0.221	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	124.6	-174.3	-64.7	0	0	0	0	110.8	T34 A35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 4.08Å; A35-T118 WeakPolarHBondContact O-CA 3.46Å; V36-T118 HydrophobicContact CG2-CG2 4.31Å; T118-Q120 HydrophobicContact CG2-CG 3.97Å; T118-Y142 WeakPolarHBondContact O-CA 3.45Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.29Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 3.2Å
119	L	98.9	Very high	96.7	Very high	4 Å²	4	47.9 Å²	47.9	2%	0.021	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	127.1	170.2	173.8	60.2	0	0	0	108.7	T34 A35 D98 S101 L102 L105 F140	T34-L119 WeakPolarHBondContact CA-O 3.41Å; A35-L119 HydrophobicContact CB-CB 4.48Å; A35-L119 PolarHBondContact N-O 3.09Å; A35-L119 PolarHBondContact O-N 3.49Å; D98-L119 HydrophobicContact CB-CD2 4.12Å; S101-L119 VanDerWaalsContact CB-CD2 3.45Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 3.98Å; L102-L119 HydrophobicContact CG-CD2 4.47Å; L105-L119 HydrophobicContact CD1-CD1 3.86Å; L105-L119 HydrophobicContact CD1-CD2 4.11Å; L105-L119 HydrophobicContact CD1-CG 4.41Å; L119-F140 HydrophobicContact CD1-CD1 4.21Å
120	Q	98.9	Very high	96.2	Very high	76 Å²	76	48.8 Å²	48.8	36%	0.355	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	148.6	176.6	-71.7	168.9	-84.9	0	0	110.1	Y33 T34 T118 F140 A141	Y33-Q120 CarbonylContact O-C 3.58Å; Y33-Q120 VanDerWaalsContact O-CA 3.32Å; Y33-Q120 WeakPolarHBondContact O-CA 3.35Å; T34-Q120 HydrophobicContact CG2-CG 4.03Å; T118-Q120 HydrophobicContact CG2-CG 3.97Å; Q120-F140 CarbonylContact O-C 3.56Å; Q120-F140 VanDerWaalsContact O-CA 3.25Å; Q120-F140 WeakPolarHBondContact O-CA 3.48Å; Q120-A141 HydrophobicContact CB-CB 4.35Å; Q120-A141 PolarHBondContact N-O 3.44Å; Q120-A141 PolarHBondContact O-N 2.89Å
121	R	98.7	Very high	95.9	Very high	16 Å²	16	42.5 Å²	42.5	6%	0.06	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	133.5	173.3	-176.8	-167.8	-177.1	-178.4	-1.8	110	F32 Y33 Y123 N138 Q139 F140	F32-R121 WeakPolarHBondContact CA-O 3.43Å; Y33-R121 PolarHBondContact N-O 2.61Å; Y33-R121 PolarHBondContact O-N 2.96Å; R121-Y123 HydrophobicContact CG-CD1 4.36Å; R121-N138 PolarHBondContact NE-OD1 3.25Å; R121-N138 VanDerWaalsContact NE-OD1 3.11Å; R121-N138 PolarHBondContact NH2-OD1 2.78Å; R121-Q139 WeakPolarHBondContact CA-O 3.28Å; R121-F140 HydrophobicContact CB-CD1 3.77Å; R121-F140 HydrophobicContact CB-CE1 3.83Å; R121-F140 HydrophobicContact CB-CG 4.37Å; R121-F140 HydrophobicContact CB-CZ 4.43Å; R121-F140 VanDerWaalsContact CD-CE1 3.49Å; R121-F140 VanDerWaalsContact CD-CZ 3.43Å; R121-F140 HydrophobicContact CG-CD1 3.84Å; R121-F140 HydrophobicContact CG-CD2 4.28Å; R121-F140 HydrophobicContact CG-CE1 3.58Å; R121-F140 HydrophobicContact CG-CE2 4.02Å; R121-F140 HydrophobicContact CG-CG 4.2Å; R121-F140 HydrophobicContact CG-CZ 3.68Å
122	M	98.8	Very high	95.7	Very high	25 Å²	25	47.7 Å²	47.7	12%	0.123	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	131.7	163.4	-171.6	-79.7	-76.8	0	0	108.8	Y31 F32 Y137 N138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.32Å; F32-M122 HydrophobicContact CD1-CB 4.03Å; F32-M122 HydrophobicContact CD1-CG 3.64Å; F32-M122 HydrophobicContact CE1-CB 4.21Å; F32-M122 HydrophobicContact CE1-CG 3.42Å; F32-M122 VanDerWaalsContact CE1-CG 3.42Å; F32-M122 HydrophobicContact CG-CG 4.44Å; F32-M122 HydrophobicContact CZ-CG 4.07Å; M122-Y137 HydrophobicContact CE-CD1 3.81Å; M122-Y137 HydrophobicContact CE-CG 3.99Å; M122-Y137 HydrophobicContact SD-CG 4.46Å; M122-N138 WeakPolarHBondContact O-CA 3.23Å; M122-Q139 HydrophobicContact CB-CG 4.19Å; M122-Q139 HydrophobicContact CE-CG 4.32Å; M122-Q139 VanDerWaalsContact CE-OE1 3.31Å; M122-Q139 PolarHBondContact N-O 2.91Å; M122-Q139 PolarHBondContact O-N 2.88Å
123	Y	98.8	Very high	95.7	Very high	23 Å²	23	46.1 Å²	46.1	9%	0.09	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.8	155.1	168.9	75.4	-88.9	0	0	0	110.6	Y31 Y33 R121 Y137 Y183	Y31-Y123 VanDerWaalsContact CB-CZ 3.5Å; Y31-Y123 HydrophobicContact CD2-CD2 4.46Å; Y31-Y123 AromaticContact CD2-CE2 3.63Å; Y31-Y123 HydrophobicContact CD2-CE2 3.63Å; Y31-Y123 AromaticContact CD2-CZ 3.71Å; Y31-Y123 HydrophobicContact CE2-CE2 4.38Å; Y31-Y123 HydrophobicContact CG-CE1 4.2Å; Y31-Y123 HydrophobicContact CG-CE2 4.07Å; Y31-Y123 AromaticContact CG-CZ 3.66Å; Y31-Y123 PolarHBondContact N-O 2.76Å; Y31-Y123 PolarHBondContact O-N 2.85Å; Y31-Y123 VanDerWaalsContact O-N 3.09Å; Y33-Y123 HydrophobicContact CD2-CE1 4.2Å; Y33-Y123 HydrophobicContact CE1-CE1 4.2Å; Y33-Y123 AromaticContact CE2-CE1 3.6Å; Y33-Y123 HydrophobicContact CE2-CE1 3.6Å; Y33-Y123 AromaticContact CZ-CE1 3.63Å; Y33-Y123 PolarHBondContact OH-OH 3.14Å; R121-Y123 HydrophobicContact CG-CD1 4.36Å; Y123-Y137 WeakPolarHBondContact CA-O 3.09Å; Y123-Y137 VanDerWaalsContact CB-O 3.27Å; Y123-Y137 WeakPolarHBondContact CB-O 3.3Å; Y123-Y183 AromaticContact CD2-CE1 3.84Å; Y123-Y183 HydrophobicContact CD2-CE1 3.84Å; Y123-Y183 AromaticContact CE2-CE1 3.61Å; Y123-Y183 HydrophobicContact CE2-CE1 3.61Å; Y123-Y183 AromaticContact CE2-CZ 3.93Å
124	G	98.6	Very high	95.9	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	166.6	179.4	-173.9	0	0	0	0	0	113.8	M29 Y137 L184	M29-G124 CarbonylContact O-C 3.57Å; M29-G124 WeakPolarHBondContact O-CA 3.49Å; G124-Y137 PolarHBondContact N-O 3.45Å; G124-Y137 PolarHBondContact O-N 3.44Å; G124-L184 WeakPolarHBondContact O-CD2 3.43Å
125	C	98.5	Very high	96.1	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	148.2	-180	51.9	0	0	0	0	110.7	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.32Å; M29-C125 PolarHBondContact N-O 3.39Å; M29-C125 PolarHBondContact O-N 3.08Å; C125-L133 HydrophobicContact CB-CD1 3.53Å; C125-R135 WeakPolarHBondContact CA-O 3.41Å; C125-C188 HydrophobicContact CB-CB 3.84Å; C125-C188 WeakPolarHBondContact CB-SG 3.48Å; C125-C188 PolarHBondContact N-SG 3Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.34Å; C125-C188 CovalentContact SG-SG 2.03Å; C125-C188 PolarHBondContact SG-SG 3.08Å
126	D	97.9	Very high	96.3	Very high	25 Å²	25	45.1 Å²	45.1	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	135.2	175	-59.5	-1.4	0	0	0	109	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.51Å; H27-D126 WeakPolarHBondContact O-CA 3.43Å; S28-D126 WeakPolarHBondContact CB-OD1 3.21Å; R30-D126 IonicContact CZ-OD1 2.67Å; R30-D126 VanDerWaalsContact CZ-OD1 3.23Å; R30-D126 IonicContact CZ-OD2 3.37Å; R30-D126 IonicContact NE-OD1 3.13Å; R30-D126 PolarHBondContact NE-OD1 3.25Å; R30-D126 IonicContact NH2-OD1 2.84Å; R30-D126 PolarHBondContact NH2-OD1 2.81Å; R30-D126 IonicContact NH2-OD2 2.66Å; R30-D126 PolarHBondContact NH2-OD2 3.32Å; D126-L134 PolarHBondContact O-N 3.36Å; D126-R135 PolarHBondContact N-O 3.2Å; D126-R135 PolarHBondContact O-N 3.08Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.43Å; D126-Y137 PolarHBondContact OD2-OH 2.85Å
127	L	96.8	Very high	96.3	Very high	4 Å²	4	43.2 Å²	43.2	2%	0.021	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	140.9	178	-54.1	-177.3	0	0	0	110.9	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.31Å; S26-L127 WeakPolarHBondContact CA-O 3.48Å; S26-L127 WeakPolarHBondContact CB-O 3.2Å; H27-L127 PolarHBondContact N-O 3.32Å; H27-L127 PolarHBondContact O-N 2.99Å; L127-R132 CarbonylContact C-O 3.55Å; L127-R132 WeakPolarHBondContact CA-O 3.33Å; L127-V189 HydrophobicContact CD1-CG1 4.38Å; L127-V189 HydrophobicContact CD2-CB 4.18Å; L127-V189 HydrophobicContact CD2-CG1 3.79Å; L127-V189 HydrophobicContact CD2-CG2 3.89Å; L127-L192 HydrophobicContact CD1-CB 4.26Å; L127-L192 HydrophobicContact CD1-CD2 3.7Å; L127-L192 HydrophobicContact CD1-CG 3.75Å; L127-L192 HydrophobicContact CG-CD2 3.6Å; L127-L192 HydrophobicContact CG-CG 4.24Å; L127-R193 HydrophobicContact CD1-CG 3.92Å
128	G	93.3	Very high	96.3	Very high	5 Å²	5	42.7 Å²	42.7	5%	0.052	21%	0.213	C	C	.	.			trans	-79.7	179.2	170.9	0	0	0	0	0	112.8	D130 G131 R132 L134	G128-D130 PolarHBondContact O-N 3.11Å; G128-G131 WeakPolarHBondContact O-CA 3.36Å; G128-G131 PolarHBondContact O-N 3.18Å; G128-R132 PolarHBondContact N-O 2.9Å; G128-L134 VanDerWaalsContact CA-CD1 3.48Å
129	P	88.7	Confident	96.3	Very high	92 Å²	92	44 Å²	44	60%	0.597	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-24.7	178	-19.7	29.1	0	0	0	113.9	A24 G131	A24-P129 HydrophobicContact CB-CB 4.49Å; A24-P129 HydrophobicContact CB-CG 3.48Å; A24-P129 VanDerWaalsContact CB-CG 3.48Å; P129-G131 PolarHBondContact O-N 2.97Å
130	D	88.9	Confident	96.3	Very high	88 Å²	88	44.6 Å²	44.6	47%	0.471	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	4.3	173.2	76.5	-15.5	0	0	0	113.2	G128 R132	G128-D130 PolarHBondContact O-N 3.11Å; D130-R132 PolarHBondContact O-N 3.12Å; D130-R132 VanDerWaalsContact OD1-CB 3.29Å; D130-R132 WeakPolarHBondContact OD1-CB 3.44Å; D130-R132 WeakPolarHBondContact OD1-CG 3.14Å; D130-R132 PolarHBondContact OD1-N 2.86Å; D130-R132 WeakPolarHBondContact OD2-CD 3.35Å; D130-R132 VanDerWaalsContact OD2-CG 3.32Å; D130-R132 WeakPolarHBondContact OD2-CG 3.45Å; D130-R132 IonicContact OD2-CZ 3.28Å; D130-R132 VanDerWaalsContact OD2-CZ 3.28Å; D130-R132 IonicContact OD2-NE 3.37Å; D130-R132 PolarHBondContact OD2-NE 3.32Å; D130-R132 IonicContact OD2-NH1 2.71Å; D130-R132 PolarHBondContact OD2-NH1 3.29Å
131	G	89	Confident	96.3	Very high	20 Å²	20	41.8 Å²	41.8	21%	0.206	21%	0.209	C	C	.	.	S	Bend	trans	69.7	10.1	-178.5	0	0	0	0	0	114.7	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.36Å; G128-G131 PolarHBondContact O-N 3.18Å; P129-G131 PolarHBondContact O-N 2.97Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.79Å; G131-R193 PolarHBondContact O-NH2 3.43Å
132	R	93.8	Very high	96.3	Very high	168 Å²	168	41.6 Å²	41.6	63%	0.634	21%	0.208	S	C	*	.			trans	-89.7	156	177.4	-60.1	-174.2	-173	131.6	-8.8	111.6	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.55Å; L127-R132 WeakPolarHBondContact CA-O 3.33Å; G128-R132 PolarHBondContact N-O 2.9Å; D130-R132 PolarHBondContact O-N 3.12Å; D130-R132 VanDerWaalsContact OD1-CB 3.29Å; D130-R132 WeakPolarHBondContact OD1-CB 3.44Å; D130-R132 WeakPolarHBondContact OD1-CG 3.14Å; D130-R132 PolarHBondContact OD1-N 2.86Å; D130-R132 WeakPolarHBondContact OD2-CD 3.35Å; D130-R132 VanDerWaalsContact OD2-CG 3.32Å; D130-R132 WeakPolarHBondContact OD2-CG 3.45Å; D130-R132 IonicContact OD2-CZ 3.28Å; D130-R132 VanDerWaalsContact OD2-CZ 3.28Å; D130-R132 IonicContact OD2-NE 3.37Å; D130-R132 PolarHBondContact OD2-NE 3.32Å; D130-R132 IonicContact OD2-NH1 2.71Å; D130-R132 PolarHBondContact OD2-NH1 3.29Å; R132-L134 PolarHBondContact O-N 3.21Å
133	L	96.6	Very high	96.3	Very high	49 Å²	49	43.3 Å²	43.3	26%	0.257	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-59.8	117.7	174.8	-174.8	74.5	0	0	0	110.4	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.53Å; L133-R135 VanDerWaalsContact CD1-O 3.29Å; L133-R135 WeakPolarHBondContact CD1-O 3.25Å; L133-L154 HydrophobicContact CD2-CD1 4.17Å; L133-E185 HydrophobicContact CD2-CG 3.83Å; L133-V189 HydrophobicContact CB-CG2 4.11Å; L133-V189 HydrophobicContact CD1-CG2 4.23Å
134	L	96.1	Very high	96.2	Very high	120 Å²	120	45 Å²	45	63%	0.628	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-84.6	-45.6	165.3	-70.5	175.3	0	0	0	110.5	D126 G128 R132	D126-L134 PolarHBondContact O-N 3.36Å; G128-L134 VanDerWaalsContact CA-CD1 3.48Å; R132-L134 PolarHBondContact O-N 3.21Å
135	R	96.5	Very high	96.2	Very high	93 Å²	93	52.7 Å²	52.7	35%	0.351	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	141.8	-171.9	-168.5	163.7	171.9	128.6	8.2	112.1	C125 D126 L133 Y137 E152	C125-R135 WeakPolarHBondContact CA-O 3.41Å; D126-R135 PolarHBondContact N-O 3.2Å; D126-R135 PolarHBondContact O-N 3.08Å; L133-R135 VanDerWaalsContact CD1-O 3.29Å; L133-R135 WeakPolarHBondContact CD1-O 3.25Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-OH 3.25Å; R135-Y137 WeakPolarHBondContact CD-OH 3.23Å; R135-Y137 HydrophobicContact CG-CD2 4.33Å; R135-Y137 HydrophobicContact CG-CE1 4.42Å; R135-Y137 HydrophobicContact CG-CE2 3.68Å; R135-Y137 PolarHBondContact NE-OH 2.86Å; R135-E152 IonicContact CZ-OE1 3.23Å; R135-E152 IonicContact CZ-OE2 3.58Å; R135-E152 IonicContact NH1-OE1 2.67Å; R135-E152 PolarHBondContact NH1-OE1 2.95Å; R135-E152 IonicContact NH1-OE2 3.04Å; R135-E152 PolarHBondContact NH1-OE2 2.88Å; R135-E152 VanDerWaalsContact NH2-CD 3.3Å; R135-E152 IonicContact NH2-OE1 2.99Å; R135-E152 PolarHBondContact NH2-OE1 3.4Å
136	G	98.1	Very high	96.2	Very high	6 Å²	6	58 Å²	58	6%	0.062	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	148.2	171.1	0	0	0	0	0	111.2
137	Y	98.3	Very high	96.3	Very high	42 Å²	42	57.3 Å²	57.3	17%	0.165	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	140.6	-177.3	-60.1	-99.6	0	0	0	110.6	R30 M122 Y123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CE2 3.33Å; R30-Y137 PolarHBondContact NH2-OH 2.85Å; M122-Y137 HydrophobicContact CE-CD1 3.81Å; M122-Y137 HydrophobicContact CE-CG 3.99Å; M122-Y137 HydrophobicContact SD-CG 4.46Å; Y123-Y137 WeakPolarHBondContact CA-O 3.09Å; Y123-Y137 VanDerWaalsContact CB-O 3.27Å; Y123-Y137 WeakPolarHBondContact CB-O 3.3Å; G124-Y137 PolarHBondContact N-O 3.45Å; G124-Y137 PolarHBondContact O-N 3.44Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.43Å; D126-Y137 PolarHBondContact OD2-OH 2.85Å; R135-Y137 HydrophobicContact CB-CE2 4.05Å; R135-Y137 VanDerWaalsContact CD-OH 3.25Å; R135-Y137 WeakPolarHBondContact CD-OH 3.23Å; R135-Y137 HydrophobicContact CG-CD2 4.33Å; R135-Y137 HydrophobicContact CG-CE1 4.42Å; R135-Y137 HydrophobicContact CG-CE2 3.68Å; R135-Y137 PolarHBondContact NE-OH 2.86Å
138	N	98.6	Very high	96.4	Very high	4 Å²	4	57.3 Å²	57.3	2%	0.021	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159	94	165.1	177	77.9	0	0	0	109.1	R121 M122 L150 W157	R121-N138 PolarHBondContact NE-OD1 3.25Å; R121-N138 VanDerWaalsContact NE-OD1 3.11Å; R121-N138 PolarHBondContact NH2-OD1 2.78Å; M122-N138 WeakPolarHBondContact O-CA 3.23Å; N138-L150 HydrophobicContact CB-CB 4.07Å; N138-L150 HydrophobicContact CB-CD2 4.14Å; N138-L150 WeakPolarHBondContact O-CB 3.32Å; N138-L150 PolarHBondContact O-N 2.66Å; N138-W157 WeakPolarHBondContact ND2-CH2 3.42Å; N138-W157 WeakPolarHBondContact ND2-CZ3 3.43Å
139	Q	98.7	Very high	96.6	Very high	63 Å²	63	58.4 Å²	58.4	29%	0.294	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	151.2	-174.7	67.3	-166.6	86.1	0	0	112	R121 M122 I148 A149	R121-Q139 WeakPolarHBondContact CA-O 3.28Å; M122-Q139 HydrophobicContact CB-CG 4.19Å; M122-Q139 HydrophobicContact CE-CG 4.32Å; M122-Q139 VanDerWaalsContact CE-OE1 3.31Å; M122-Q139 PolarHBondContact N-O 2.91Å; M122-Q139 PolarHBondContact O-N 2.88Å; Q139-I148 WeakPolarHBondContact CA-O 3.27Å; Q139-A149 HydrophobicContact CB-CB 3.83Å
140	F	98.8	Very high	97.1	Very high	18 Å²	18	54.7 Å²	54.7	8%	0.079	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	143.2	-177.5	-65.3	-106.3	0	0	0	110.4	L119 Q120 R121 Y147 I148 W171	L119-F140 HydrophobicContact CD1-CD1 4.21Å; Q120-F140 CarbonylContact O-C 3.56Å; Q120-F140 VanDerWaalsContact O-CA 3.25Å; Q120-F140 WeakPolarHBondContact O-CA 3.48Å; R121-F140 HydrophobicContact CB-CD1 3.77Å; R121-F140 HydrophobicContact CB-CE1 3.83Å; R121-F140 HydrophobicContact CB-CG 4.37Å; R121-F140 HydrophobicContact CB-CZ 4.43Å; R121-F140 VanDerWaalsContact CD-CE1 3.49Å; R121-F140 VanDerWaalsContact CD-CZ 3.43Å; R121-F140 HydrophobicContact CG-CD1 3.84Å; R121-F140 HydrophobicContact CG-CD2 4.28Å; R121-F140 HydrophobicContact CG-CE1 3.58Å; R121-F140 HydrophobicContact CG-CE2 4.02Å; R121-F140 HydrophobicContact CG-CG 4.2Å; R121-F140 HydrophobicContact CG-CZ 3.68Å; F140-Y147 WeakPolarHBondContact O-CB 3.47Å; F140-Y147 PolarHBondContact O-N 2.67Å; F140-I148 HydrophobicContact CB-CG2 4.23Å; F140-I148 HydrophobicContact CD2-CG2 4.15Å; F140-I148 HydrophobicContact CG-CG2 4.49Å; F140-I148 PolarHBondContact N-O 2.97Å; F140-I148 PolarHBondContact O-N 3.45Å; F140-W171 AromaticContact CD2-CH2 3.76Å; F140-W171 HydrophobicContact CD2-CH2 3.76Å; F140-W171 HydrophobicContact CD2-CZ3 4.16Å; F140-W171 HydrophobicContact CE1-CH2 4.44Å; F140-W171 AromaticContact CE2-CH2 3.41Å; F140-W171 HydrophobicContact CE2-CH2 3.41Å; F140-W171 VanDerWaalsContact CE2-CH2 3.41Å; F140-W171 HydrophobicContact CE2-CZ2 4.45Å; F140-W171 AromaticContact CE2-CZ3 3.92Å; F140-W171 HydrophobicContact CE2-CZ3 3.92Å; F140-W171 HydrophobicContact CG-CH2 4.43Å; F140-W171 AromaticContact CZ-CH2 3.77Å; F140-W171 HydrophobicContact CZ-CH2 3.77Å; F140-W171 HydrophobicContact CZ-CZ2 4.43Å
141	A	98.9	Very high	97.6	Very high	17 Å²	17	52.5 Å²	52.5	14%	0.14	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	146.7	173.3	0	0	0	0	0	110.3	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.35Å; Q120-A141 PolarHBondContact N-O 3.44Å; Q120-A141 PolarHBondContact O-N 2.89Å; A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.19Å; A141-K145 VanDerWaalsContact CB-O 3.23Å; A141-K145 WeakPolarHBondContact CB-O 3.42Å
142	Y	98.8	Very high	98	Very high	12 Å²	12	58.1 Å²	58.1	5%	0.047	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	131.6	178.6	-174.1	-123.3	0	0	0	110.3	L102 L105 R106 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 4.01Å; L105-Y142 HydrophobicContact CB-CD1 4.26Å; L105-Y142 HydrophobicContact CB-CD2 4.24Å; L105-Y142 HydrophobicContact CB-CE1 3.86Å; L105-Y142 HydrophobicContact CB-CE2 3.86Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.67Å; L105-Y142 HydrophobicContact CD1-CE2 3.93Å; L105-Y142 HydrophobicContact CD1-CG 4.1Å; L105-Y142 HydrophobicContact CD2-CD1 4.46Å; L105-Y142 HydrophobicContact CD2-CG 4.39Å; L105-Y142 HydrophobicContact CG-CD2 4.42Å; L105-Y142 HydrophobicContact CG-CE2 4.47Å; R106-Y142 PolarHBondContact N-OH 2.83Å; Y109-Y142 AromaticContact CD2-CD1 3.73Å; Y109-Y142 HydrophobicContact CD2-CD1 3.73Å; Y109-Y142 AromaticContact CD2-CE1 3.48Å; Y109-Y142 HydrophobicContact CD2-CE1 3.48Å; Y109-Y142 VanDerWaalsContact CD2-CE1 3.48Å; Y109-Y142 AromaticContact CE2-CD1 3.48Å; Y109-Y142 HydrophobicContact CE2-CD1 3.48Å; Y109-Y142 VanDerWaalsContact CE2-CD1 3.48Å; Y109-Y142 AromaticContact CE2-CE1 3.77Å; Y109-Y142 HydrophobicContact CE2-CE1 3.77Å; Y109-Y142 HydrophobicContact CG-CE1 4.44Å; Q111-Y142 PolarHBondContact OE1-OH 3.41Å; H117-Y142 HydrophobicContact CB-CE2 3.84Å; H117-Y142 WeakPolarHBondContact CB-OH 3.19Å; H117-Y142 VanDerWaalsContact CG-OH 3.31Å; H117-Y142 PolarHBondContact ND1-OH 3.38Å; T118-Y142 WeakPolarHBondContact O-CA 3.45Å; T118-Y142 VanDerWaalsContact O-CD2 3.28Å; T118-Y142 WeakPolarHBondContact O-CD2 3.29Å; Y142-G144 PolarHBondContact O-N 2.88Å; Y142-G144 VanDerWaalsContact O-N 3.12Å; Y142-K145 PolarHBondContact N-O 2.86Å; Y142-K145 PolarHBondContact O-N 2.87Å
143	D	98.4	Very high	98.2	Very high	61 Å²	61	53.6 Å²	53.6	33%	0.326	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	46	40.5	-174	-64.7	-20.3	0	0	0	113.1	Q111 H117 T118	Q111-D143 PolarHBondContact NE2-OD2 3.48Å; Q111-D143 VanDerWaalsContact NE2-OD2 3.16Å; H117-D143 VanDerWaalsContact CA-OD1 3.23Å; H117-D143 WeakPolarHBondContact CA-OD1 3.4Å; H117-D143 WeakPolarHBondContact CB-OD1 3.2Å; H117-D143 IonicContact CE1-OD2 2.7Å; H117-D143 IonicContact CG-OD1 3.47Å; H117-D143 IonicContact CG-OD2 3.09Å; H117-D143 IonicContact ND1-OD1 3.34Å; H117-D143 IonicContact ND1-OD2 2.83Å; H117-D143 PolarHBondContact ND1-OD2 2.92Å; T118-D143 PolarHBondContact N-OD1 2.94Å; T118-D143 PolarHBondContact O-N 3.2Å
144	G	97.8	Very high	98.2	Very high	59 Å²	59	51.6 Å²	51.6	61%	0.608	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.9	11	178	0	0	0	0	0	116	Y142	Y142-G144 PolarHBondContact O-N 2.88Å; Y142-G144 VanDerWaalsContact O-N 3.12Å
145	K	98.6	Very high	98.3	Very high	160 Å²	160	53.6 Å²	53.6	70%	0.696	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-123.2	146.3	179.3	-60.7	177.4	-176	176.2	0	111.2	A141 Y142 Y147	A141-K145 CarbonylContact C-O 3.57Å; A141-K145 WeakPolarHBondContact CA-O 3.19Å; A141-K145 VanDerWaalsContact CB-O 3.23Å; A141-K145 WeakPolarHBondContact CB-O 3.42Å; Y142-K145 PolarHBondContact N-O 2.86Å; Y142-K145 PolarHBondContact O-N 2.87Å; K145-Y147 PolarHBondContact O-N 3.27Å
146	D	98.8	Very high	98.4	Very high	113 Å²	113	51.1 Å²	51.1	60%	0.604	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.7	136.7	174.4	-69.3	-55.2	0	0	0	111.5	A160	D146-A160 WeakPolarHBondContact O-CB 3.42Å
147	Y	98.8	Very high	98.4	Very high	9 Å²	9	51.3 Å²	51.3	4%	0.035	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	-62.5	-179.6	179.3	-111.7	0	0	0	110.5	L105 Y109 F140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.17Å; L105-Y147 HydrophobicContact CD2-CD2 4.01Å; L105-Y147 HydrophobicContact CD2-CE1 3.66Å; L105-Y147 HydrophobicContact CD2-CE2 3.46Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.46Å; L105-Y147 HydrophobicContact CD2-CG 4.34Å; Y109-Y147 HydrophobicContact CE2-CD2 4.39Å; Y109-Y147 HydrophobicContact CE2-CE2 4.11Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.47Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.39Å; F140-Y147 WeakPolarHBondContact O-CB 3.47Å; F140-Y147 PolarHBondContact O-N 2.67Å; K145-Y147 PolarHBondContact O-N 3.27Å; Y147-A160 WeakPolarHBondContact O-CB 3.41Å; Y147-A160 PolarHBondContact O-N 3.28Å; Y147-A163 HydrophobicContact CE2-CB 4.43Å; Y147-A163 PolarHBondContact OH-O 3.36Å; Y147-A164 HydrophobicContact CD2-CB 3.85Å; Y147-A164 VanDerWaalsContact CE2-CA 3.42Å; Y147-A164 HydrophobicContact CE2-CB 3.69Å; Y147-A164 HydrophobicContact CG-CB 4.37Å; Y147-A164 WeakPolarHBondContact O-CB 3.37Å; Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 WeakPolarHBondContact OH-CB 3.44Å; Y147-T167 PolarHBondContact OH-OG1 3.48Å
148	I	98.8	Very high	98.4	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.1	138.7	177.8	-163.9	172.9	0	0	0	111	Q139 F140 W157 T158 A159 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.27Å; F140-I148 HydrophobicContact CB-CG2 4.23Å; F140-I148 HydrophobicContact CD2-CG2 4.15Å; F140-I148 HydrophobicContact CG-CG2 4.49Å; F140-I148 PolarHBondContact N-O 2.97Å; F140-I148 PolarHBondContact O-N 3.45Å; I148-W157 HydrophobicContact CD1-CB 4.12Å; I148-W157 HydrophobicContact CD1-CD2 4.43Å; I148-W157 HydrophobicContact CD1-CE3 4.28Å; I148-W157 HydrophobicContact CD1-CG 4.39Å; I148-W157 HydrophobicContact CG1-CB 4.23Å; I148-W157 HydrophobicContact CG1-CE3 4.15Å; I148-T158 WeakPolarHBondContact CA-O 3.35Å; I148-T158 WeakPolarHBondContact CG1-O 3.45Å; I148-A159 HydrophobicContact CG1-CB 4.48Å; I148-T167 HydrophobicContact CD1-CG2 4.3Å; I148-Q168 HydrophobicContact CD1-CB 3.86Å; I148-W171 HydrophobicContact CD1-CE3 4.02Å; I148-W171 HydrophobicContact CD1-CZ3 4.2Å; I148-W171 HydrophobicContact CG2-CE3 4.38Å; I148-W171 HydrophobicContact CG2-CH2 3.88Å; I148-W171 HydrophobicContact CG2-CZ3 3.52Å
149	A	98.8	Very high	98.4	Very high	29 Å²	29	54 Å²	54	24%	0.24	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	140.4	178.2	0	0	0	0	0	111.5	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.83Å; A149-W157 CarbonylContact O-C 3.57Å; A149-W157 WeakPolarHBondContact O-CA 3.39Å; A149-T158 PolarHBondContact N-O 3.42Å; A149-T158 PolarHBondContact O-N 3.02Å
150	L	98.8	Very high	98.4	Very high	14 Å²	14	53.9 Å²	53.9	7%	0.073	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	130.4	165	-174.8	68.8	0	0	0	108.5	N138 L154 W157 A177 R180 L184	N138-L150 HydrophobicContact CB-CB 4.07Å; N138-L150 HydrophobicContact CB-CD2 4.14Å; N138-L150 WeakPolarHBondContact O-CB 3.32Å; N138-L150 PolarHBondContact O-N 2.66Å; L150-L154 HydrophobicContact CD2-CB 4.5Å; L150-L154 HydrophobicContact CD2-CD2 3.79Å; L150-L154 HydrophobicContact CG-CD2 4.34Å; L150-W157 HydrophobicContact CB-CE3 3.97Å; L150-W157 HydrophobicContact CB-CH2 4.22Å; L150-W157 HydrophobicContact CB-CZ3 3.7Å; L150-W157 HydrophobicContact CD1-CD2 4.14Å; L150-W157 HydrophobicContact CD1-CE3 4.22Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.94Å; L150-W157 HydrophobicContact CD1-CZ3 4.16Å; L150-A177 HydrophobicContact CD1-CB 3.94Å; L150-R180 HydrophobicContact CD2-CB 3.96Å; L150-L184 HydrophobicContact CD2-CD1 3.94Å
151	N	98.5	Very high	98.4	Very high	42 Å²	42	55.7 Å²	55.7	23%	0.225	31%	0.309	C	S	.	.			trans	-76.5	166.2	-179.1	-66.2	-22.6	0	0	0	111.8	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.26Å; N151-D153 VanDerWaalsContact O-N 3.13Å; N151-L154 WeakPolarHBondContact O-CA 3.47Å; N151-L154 PolarHBondContact O-N 2.64Å; N151-S156 WeakPolarHBondContact CB-O 3.18Å; N151-S156 PolarHBondContact N-O 3.4Å; N151-S156 PolarHBondContact ND2-OG 2.93Å; N151-T158 PolarHBondContact ND2-OG1 2.66Å; N151-T158 WeakPolarHBondContact OD1-CB 3.48Å; N151-T158 PolarHBondContact OD1-N 3.33Å; N151-T158 PolarHBondContact OD1-OG1 3.44Å
152	E	97.4	Very high	98.4	Very high	138 Å²	138	63.4 Å²	63.4	65%	0.645	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.3	-177.5	-59.3	-178.8	-163.7	0	0	113.6	R135 L154	R135-E152 IonicContact CZ-OE1 3.23Å; R135-E152 IonicContact CZ-OE2 3.58Å; R135-E152 IonicContact NH1-OE1 2.67Å; R135-E152 PolarHBondContact NH1-OE1 2.95Å; R135-E152 IonicContact NH1-OE2 3.04Å; R135-E152 PolarHBondContact NH1-OE2 2.88Å; R135-E152 VanDerWaalsContact NH2-CD 3.3Å; R135-E152 IonicContact NH2-OE1 2.99Å; R135-E152 PolarHBondContact NH2-OE1 3.4Å; E152-L154 PolarHBondContact O-N 2.92Å
153	D	97.3	Very high	98.3	Very high	72 Å²	72	63.2 Å²	63.2	39%	0.385	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	-9	172.3	70.6	-2.7	0	0	0	113.9	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.26Å; N151-D153 VanDerWaalsContact O-N 3.13Å; D153-R155 HydrophobicContact CB-CB 4.47Å; D153-R155 WeakPolarHBondContact O-CD 3.28Å; D153-R155 VanDerWaalsContact O-CG 3.27Å; D153-R155 WeakPolarHBondContact O-CG 3.32Å; D153-R155 PolarHBondContact O-N 3.44Å; D153-R155 PolarHBondContact OD1-N 3.36Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.91Å; D153-S156 PolarHBondContact OD1-OG 3.36Å; D153-S156 WeakPolarHBondContact OD2-CB 3.45Å; D153-S156 PolarHBondContact OD2-N 3.35Å; D153-S156 PolarHBondContact OD2-OG 2.92Å
154	L	97.9	Very high	98.3	Very high	8 Å²	8	60.3 Å²	60.3	4%	0.042	33%	0.325	C	S	.	.	S	Bend	trans	52.2	28.5	-172.4	-54.1	-178.5	0	0	0	113.7	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.17Å; L150-L154 HydrophobicContact CD2-CB 4.5Å; L150-L154 HydrophobicContact CD2-CD2 3.79Å; L150-L154 HydrophobicContact CG-CD2 4.34Å; N151-L154 WeakPolarHBondContact O-CA 3.47Å; N151-L154 PolarHBondContact O-N 2.64Å; E152-L154 PolarHBondContact O-N 2.92Å; L154-R181 HydrophobicContact CB-CB 4Å; L154-R181 HydrophobicContact CB-CG 3.75Å; L154-R181 HydrophobicContact CD1-CG 4.19Å; L154-R181 WeakPolarHBondContact O-CB 3.38Å; L154-R181 WeakPolarHBondContact O-CD 3.38Å; L154-L184 HydrophobicContact CD1-CB 4.46Å; L154-L184 HydrophobicContact CD2-CD1 3.99Å; L154-E185 HydrophobicContact CD1-CG 4.19Å
155	R	97.7	Very high	98.4	Very high	162 Å²	162	61 Å²	61	61%	0.611	31%	0.313	S	S	*	.	S	Bend	trans	-135.2	-36.1	-172.5	-69.9	160	-176.6	-89.5	6.3	113.2	D153 A177	D153-R155 HydrophobicContact CB-CB 4.47Å; D153-R155 WeakPolarHBondContact O-CD 3.28Å; D153-R155 VanDerWaalsContact O-CG 3.27Å; D153-R155 WeakPolarHBondContact O-CG 3.32Å; D153-R155 PolarHBondContact O-N 3.44Å; D153-R155 PolarHBondContact OD1-N 3.36Å; R155-A177 WeakPolarHBondContact O-CB 3.31Å
156	S	98	Very high	98.4	Very high	41 Å²	41	56.1 Å²	56.1	29%	0.287	29%	0.294	S	S	.	.			trans	-110.4	165	-179	62.2	0	0	0	0	112	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.18Å; N151-S156 PolarHBondContact N-O 3.4Å; N151-S156 PolarHBondContact ND2-OG 2.93Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 2.91Å; D153-S156 PolarHBondContact OD1-OG 3.36Å; D153-S156 WeakPolarHBondContact OD2-CB 3.45Å; D153-S156 PolarHBondContact OD2-N 3.35Å; D153-S156 PolarHBondContact OD2-OG 2.92Å
157	W	98.7	Very high	98.4	Very high	10 Å²	10	51.5 Å²	51.5	4%	0.038	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	143.4	-178.6	-58.4	92	0	0	0	111	N138 I148 A149 L150 Q168 W171 E176 A177 R180	N138-W157 WeakPolarHBondContact ND2-CH2 3.42Å; N138-W157 WeakPolarHBondContact ND2-CZ3 3.43Å; I148-W157 HydrophobicContact CD1-CB 4.12Å; I148-W157 HydrophobicContact CD1-CD2 4.43Å; I148-W157 HydrophobicContact CD1-CE3 4.28Å; I148-W157 HydrophobicContact CD1-CG 4.39Å; I148-W157 HydrophobicContact CG1-CB 4.23Å; I148-W157 HydrophobicContact CG1-CE3 4.15Å; A149-W157 CarbonylContact O-C 3.57Å; A149-W157 WeakPolarHBondContact O-CA 3.39Å; L150-W157 HydrophobicContact CB-CE3 3.97Å; L150-W157 HydrophobicContact CB-CH2 4.22Å; L150-W157 HydrophobicContact CB-CZ3 3.7Å; L150-W157 HydrophobicContact CD1-CD2 4.14Å; L150-W157 HydrophobicContact CD1-CE3 4.22Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.94Å; L150-W157 HydrophobicContact CD1-CZ3 4.16Å; W157-Q168 HydrophobicContact CB-CG 4.26Å; W157-Q168 PolarHBondContact O-NE2 2.85Å; W157-W171 HydrophobicContact CD2-CE3 4.03Å; W157-W171 AromaticContact CE2-CE3 3.93Å; W157-W171 AromaticContact CE3-CE3 3.83Å; W157-W171 HydrophobicContact CE3-CE3 3.83Å; W157-W171 AromaticContact CE3-CZ3 3.96Å; W157-W171 HydrophobicContact CE3-CZ3 3.96Å; W157-W171 HydrophobicContact CH2-CD2 4.49Å; W157-W171 AromaticContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CE3 3.47Å; W157-W171 VanDerWaalsContact CH2-CE3 3.47Å; W157-W171 AromaticContact CH2-CZ3 3.66Å; W157-W171 HydrophobicContact CH2-CZ3 3.66Å; W157-W171 HydrophobicContact CZ2-CB 4.5Å; W157-W171 HydrophobicContact CZ2-CD2 4.44Å; W157-W171 AromaticContact CZ2-CE3 3.68Å; W157-W171 HydrophobicContact CZ2-CE3 3.68Å; W157-W171 HydrophobicContact CZ2-CZ3 4.34Å; W157-W171 AromaticContact CZ3-CE3 3.56Å; W157-W171 HydrophobicContact CZ3-CE3 3.56Å; W157-W171 AromaticContact CZ3-CZ3 3.45Å; W157-W171 HydrophobicContact CZ3-CZ3 3.45Å; W157-W171 VanDerWaalsContact CZ3-CZ3 3.45Å; W157-E176 HydrophobicContact CZ2-CB 4Å; W157-A177 HydrophobicContact CZ2-CB 4.23Å; W157-R180 HydrophobicContact CH2-CG 4.2Å
158	T	98.7	Very high	98.4	Very high	80 Å²	80	53 Å²	53	49%	0.491	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	119.3	165.4	-65.1	0	0	0	0	109	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.35Å; I148-T158 WeakPolarHBondContact CG1-O 3.45Å; A149-T158 PolarHBondContact N-O 3.42Å; A149-T158 PolarHBondContact O-N 3.02Å; N151-T158 PolarHBondContact ND2-OG1 2.66Å; N151-T158 WeakPolarHBondContact OD1-CB 3.48Å; N151-T158 PolarHBondContact OD1-N 3.33Å; N151-T158 PolarHBondContact OD1-OG1 3.44Å
159	A	98.7	Very high	98.4	Very high	21 Å²	21	59.8 Å²	59.8	17%	0.174	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	127.5	177.2	0	0	0	0	0	110.4	I148 D161 A164 Q165 Q168	I148-A159 HydrophobicContact CG1-CB 4.48Å; A159-D161 PolarHBondContact O-N 3.11Å; A159-A164 HydrophobicContact CB-CB 3.64Å; A159-Q165 HydrophobicContact CB-CG 4.08Å; A159-Q168 HydrophobicContact CB-CB 4.33Å; A159-Q168 VanDerWaalsContact CB-OE1 3.26Å
160	A	98.5	Very high	98.3	Very high	61 Å²	61	63.7 Å²	63.7	50%	0.504	31%	0.314	S	S	.	.	S	Bend	trans	-70.8	-30.5	-174.3	0	0	0	0	0	113.8	D146 Y147	D146-A160 WeakPolarHBondContact O-CB 3.42Å; Y147-A160 WeakPolarHBondContact O-CB 3.41Å; Y147-A160 PolarHBondContact O-N 3.28Å
161	D	98.4	Very high	98.3	Very high	57 Å²	57	65.6 Å²	65.6	31%	0.305	32%	0.32	S	S	.	.	S	Bend	trans	-150.3	-173	-177.4	71.5	29.7	0	0	0	114.3	Y109 A159 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.35Å; Y109-D161 VanDerWaalsContact OH-CG 3.29Å; Y109-D161 PolarHBondContact OH-OD1 2.94Å; Y109-D161 PolarHBondContact OH-OD2 2.75Å; A159-D161 PolarHBondContact O-N 3.11Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 3.01Å; D161-A163 WeakPolarHBondContact OD1-CA 3.37Å; D161-A163 WeakPolarHBondContact OD1-CB 3.4Å; D161-A163 PolarHBondContact OD1-N 3.28Å; D161-A164 PolarHBondContact O-N 3.46Å; D161-A164 PolarHBondContact OD1-N 2.71Å; D161-Q165 WeakPolarHBondContact O-CG 3.46Å; D161-Q165 PolarHBondContact O-N 2.94Å
162	K	98.3	Very high	98.3	Very high	178 Å²	178	67.8 Å²	67.8	77%	0.774	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-26.7	-179.6	-66.5	-179.2	179.7	176.8	0	114.3
163	A	98.1	Very high	98.4	Very high	9 Å²	9	65.4 Å²	65.4	7%	0.074	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-37.4	174.6	0	0	0	0	0	110.8	Y108 Y109 Y147 D161 Q165 I166	Y108-A163 HydrophobicContact CD2-CB 4.48Å; Y109-A163 HydrophobicContact CD1-CB 4.23Å; Y109-A163 HydrophobicContact CD2-CB 4.45Å; Y109-A163 HydrophobicContact CE1-CB 3.72Å; Y109-A163 HydrophobicContact CE2-CB 3.96Å; Y147-A163 HydrophobicContact CE2-CB 4.43Å; Y147-A163 PolarHBondContact OH-O 3.36Å; D161-A163 VanDerWaalsContact C-N 3.33Å; D161-A163 PolarHBondContact O-N 3.01Å; D161-A163 WeakPolarHBondContact OD1-CA 3.37Å; D161-A163 WeakPolarHBondContact OD1-CB 3.4Å; D161-A163 PolarHBondContact OD1-N 3.28Å; A163-Q165 VanDerWaalsContact C-N 3.3Å; A163-Q165 PolarHBondContact O-N 2.98Å; A163-I166 WeakPolarHBondContact O-CB 3.01Å; A163-I166 PolarHBondContact O-N 2.9Å; A163-I166 VanDerWaalsContact O-N 3.11Å
164	A	98.6	Very high	98.4	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.8	-38.2	170.9	0	0	0	0	0	112.5	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.85Å; Y147-A164 VanDerWaalsContact CE2-CA 3.42Å; Y147-A164 HydrophobicContact CE2-CB 3.69Å; Y147-A164 HydrophobicContact CG-CB 4.37Å; Y147-A164 WeakPolarHBondContact O-CB 3.37Å; A159-A164 HydrophobicContact CB-CB 3.64Å; D161-A164 PolarHBondContact O-N 3.46Å; D161-A164 PolarHBondContact OD1-N 2.71Å; A164-I166 PolarHBondContact O-N 3.15Å; A164-I166 VanDerWaalsContact O-N 3.16Å; A164-T167 PolarHBondContact O-N 2.73Å; A164-Q168 PolarHBondContact O-N 2.91Å
165	Q	98.7	Very high	98.4	Very high	73 Å²	73	71.7 Å²	71.7	34%	0.341	36%	0.362	S	S	.	.	H	α-helix	trans	-59.6	-23.2	173.2	-73.9	175.6	16	0	0	114.1	A159 D161 A163 R169	A159-Q165 HydrophobicContact CB-CG 4.08Å; D161-Q165 WeakPolarHBondContact O-CG 3.46Å; D161-Q165 PolarHBondContact O-N 2.94Å; A163-Q165 VanDerWaalsContact C-N 3.3Å; A163-Q165 PolarHBondContact O-N 2.98Å; Q165-R169 VanDerWaalsContact O-CG 3.3Å; Q165-R169 WeakPolarHBondContact O-CG 3.45Å; Q165-R169 PolarHBondContact O-N 3.14Å; Q165-R169 VanDerWaalsContact OE1-NH2 3.14Å
166	I	98.5	Very high	98.4	Very high	58 Å²	58	65.6 Å²	65.6	30%	0.297	34%	0.341	S	S	.	.	H	α-helix	trans	-71.3	-42	173.9	-54.8	172.9	0	0	0	110	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 3.92Å; Y108-I166 HydrophobicContact CE1-CD1 4.31Å; Y108-I166 HydrophobicContact CE1-CG2 3.87Å; Y108-I166 HydrophobicContact CE2-CB 4.32Å; Y108-I166 HydrophobicContact CE2-CG2 4.29Å; Y108-I166 HydrophobicContact CG-CD1 4.03Å; A163-I166 WeakPolarHBondContact O-CB 3.01Å; A163-I166 PolarHBondContact O-N 2.9Å; A163-I166 VanDerWaalsContact O-N 3.11Å; A164-I166 PolarHBondContact O-N 3.15Å; A164-I166 VanDerWaalsContact O-N 3.16Å; I166-K170 WeakPolarHBondContact O-CG 3.25Å; I166-K170 PolarHBondContact O-N 3.23Å
167	T	98.4	Very high	98.4	Very high	15 Å²	15	64.1 Å²	64.1	9%	0.092	33%	0.331	C	S	.	.	H	α-helix	trans	-69.7	-43	175.9	-66.3	0	0	0	0	111.4	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 WeakPolarHBondContact OH-CB 3.44Å; Y147-T167 PolarHBondContact OH-OG1 3.48Å; I148-T167 HydrophobicContact CD1-CG2 4.3Å; A164-T167 PolarHBondContact O-N 2.73Å; T167-R169 PolarHBondContact O-N 3.37Å; T167-K170 WeakPolarHBondContact O-CB 3.45Å; T167-K170 PolarHBondContact O-N 2.82Å; T167-K170 VanDerWaalsContact O-N 3.14Å; T167-W171 HydrophobicContact CG2-CD2 3.65Å; T167-W171 VanDerWaalsContact CG2-CE2 3.44Å; T167-W171 HydrophobicContact CG2-CE3 4.04Å; T167-W171 HydrophobicContact CG2-CG 4.15Å; T167-W171 HydrophobicContact CG2-CH2 4.02Å; T167-W171 HydrophobicContact CG2-CZ2 3.65Å; T167-W171 HydrophobicContact CG2-CZ3 4.21Å; T167-W171 WeakPolarHBondContact O-CB 3.19Å; T167-W171 PolarHBondContact O-N 2.85Å
168	Q	98.7	Very high	98.4	Very high	40 Å²	40	69 Å²	69	19%	0.187	35%	0.354	C	S	.	.	H	α-helix	trans	-50.5	-56	174.5	176.2	171.3	8.5	0	0	111.8	I148 W157 A159 A164 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.86Å; W157-Q168 HydrophobicContact CB-CG 4.26Å; W157-Q168 PolarHBondContact O-NE2 2.85Å; A159-Q168 HydrophobicContact CB-CB 4.33Å; A159-Q168 VanDerWaalsContact CB-OE1 3.26Å; A164-Q168 PolarHBondContact O-N 2.91Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.04Å; Q168-W171 PolarHBondContact O-N 3.13Å; Q168-E172 VanDerWaalsContact CG-CD 3.43Å; Q168-E172 HydrophobicContact CG-CG 4.25Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.39Å; Q168-E172 PolarHBondContact NE2-OE1 3.25Å; Q168-E172 WeakPolarHBondContact O-CB 3.33Å; Q168-E172 WeakPolarHBondContact O-CG 3.41Å; Q168-E172 PolarHBondContact O-N 3.22Å
169	R	98.7	Very high	98.3	Very high	148 Å²	148	70.7 Å²	70.7	56%	0.558	36%	0.357	S	S	*	.	H	α-helix	trans	-60.4	-35.1	-179	-67.3	168.8	-163.6	145.3	11.9	112.8	Q165 T167 A173	Q165-R169 VanDerWaalsContact O-CG 3.3Å; Q165-R169 WeakPolarHBondContact O-CG 3.45Å; Q165-R169 PolarHBondContact O-N 3.14Å; Q165-R169 VanDerWaalsContact OE1-NH2 3.14Å; T167-R169 PolarHBondContact O-N 3.37Å; R169-A173 VanDerWaalsContact O-CB 3.29Å; R169-A173 WeakPolarHBondContact O-CB 3.42Å; R169-A173 PolarHBondContact O-N 2.75Å; R169-A173 VanDerWaalsContact O-N 3.1Å
170	K	98.3	Very high	98.3	Very high	111 Å²	111	73 Å²	73	48%	0.483	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-43.3	174.8	-73.3	175.5	175.5	-176	0	111.5	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 2.62Å; I166-K170 WeakPolarHBondContact O-CG 3.25Å; I166-K170 PolarHBondContact O-N 3.23Å; T167-K170 WeakPolarHBondContact O-CB 3.45Å; T167-K170 PolarHBondContact O-N 2.82Å; T167-K170 VanDerWaalsContact O-N 3.14Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.04Å; K170-A174 VanDerWaalsContact O-CB 3.24Å; K170-A174 WeakPolarHBondContact O-CB 3.25Å; K170-A174 PolarHBondContact O-N 2.67Å
171	W	98.4	Very high	98.2	Very high	53 Å²	53	73.7 Å²	73.7	20%	0.201	35%	0.35	C	S	.	.	H	α-helix	trans	-73.7	-32.9	-179.2	-74.6	3.1	0	0	0	113.3	F140 I148 W157 T167 Q168 A174 R175 E176	F140-W171 AromaticContact CD2-CH2 3.76Å; F140-W171 HydrophobicContact CD2-CH2 3.76Å; F140-W171 HydrophobicContact CD2-CZ3 4.16Å; F140-W171 HydrophobicContact CE1-CH2 4.44Å; F140-W171 AromaticContact CE2-CH2 3.41Å; F140-W171 HydrophobicContact CE2-CH2 3.41Å; F140-W171 VanDerWaalsContact CE2-CH2 3.41Å; F140-W171 HydrophobicContact CE2-CZ2 4.45Å; F140-W171 AromaticContact CE2-CZ3 3.92Å; F140-W171 HydrophobicContact CE2-CZ3 3.92Å; F140-W171 HydrophobicContact CG-CH2 4.43Å; F140-W171 AromaticContact CZ-CH2 3.77Å; F140-W171 HydrophobicContact CZ-CH2 3.77Å; F140-W171 HydrophobicContact CZ-CZ2 4.43Å; I148-W171 HydrophobicContact CD1-CE3 4.02Å; I148-W171 HydrophobicContact CD1-CZ3 4.2Å; I148-W171 HydrophobicContact CG2-CE3 4.38Å; I148-W171 HydrophobicContact CG2-CH2 3.88Å; I148-W171 HydrophobicContact CG2-CZ3 3.52Å; W157-W171 HydrophobicContact CD2-CE3 4.03Å; W157-W171 AromaticContact CE2-CE3 3.93Å; W157-W171 AromaticContact CE3-CE3 3.83Å; W157-W171 HydrophobicContact CE3-CE3 3.83Å; W157-W171 AromaticContact CE3-CZ3 3.96Å; W157-W171 HydrophobicContact CE3-CZ3 3.96Å; W157-W171 HydrophobicContact CH2-CD2 4.49Å; W157-W171 AromaticContact CH2-CE3 3.47Å; W157-W171 HydrophobicContact CH2-CE3 3.47Å; W157-W171 VanDerWaalsContact CH2-CE3 3.47Å; W157-W171 AromaticContact CH2-CZ3 3.66Å; W157-W171 HydrophobicContact CH2-CZ3 3.66Å; W157-W171 HydrophobicContact CZ2-CB 4.5Å; W157-W171 HydrophobicContact CZ2-CD2 4.44Å; W157-W171 AromaticContact CZ2-CE3 3.68Å; W157-W171 HydrophobicContact CZ2-CE3 3.68Å; W157-W171 HydrophobicContact CZ2-CZ3 4.34Å; W157-W171 AromaticContact CZ3-CE3 3.56Å; W157-W171 HydrophobicContact CZ3-CE3 3.56Å; W157-W171 AromaticContact CZ3-CZ3 3.45Å; W157-W171 HydrophobicContact CZ3-CZ3 3.45Å; W157-W171 VanDerWaalsContact CZ3-CZ3 3.45Å; T167-W171 HydrophobicContact CG2-CD2 3.65Å; T167-W171 VanDerWaalsContact CG2-CE2 3.44Å; T167-W171 HydrophobicContact CG2-CE3 4.04Å; T167-W171 HydrophobicContact CG2-CG 4.15Å; T167-W171 HydrophobicContact CG2-CH2 4.02Å; T167-W171 HydrophobicContact CG2-CZ2 3.65Å; T167-W171 HydrophobicContact CG2-CZ3 4.21Å; T167-W171 WeakPolarHBondContact O-CB 3.19Å; T167-W171 PolarHBondContact O-N 2.85Å; Q168-W171 PolarHBondContact O-N 3.13Å; W171-A174 CarbonylContact O-C 3.54Å; W171-R175 PolarHBondContact O-N 2.96Å; W171-E176 HydrophobicContact CB-CB 3.89Å; W171-E176 HydrophobicContact CB-CG 4.03Å; W171-E176 HydrophobicContact CD2-CG 4.45Å; W171-E176 HydrophobicContact CG-CB 4.09Å; W171-E176 HydrophobicContact CG-CG 3.84Å; W171-E176 PolarHBondContact O-N 3.12Å
172	E	98.5	Very high	98.2	Very high	89 Å²	89	74.1 Å²	74.1	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-66.2	-48.3	170.3	-71.7	166.6	166.9	0	0	110.9	Q168 A174 R175	Q168-E172 VanDerWaalsContact CG-CD 3.43Å; Q168-E172 HydrophobicContact CG-CG 4.25Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.39Å; Q168-E172 PolarHBondContact NE2-OE1 3.25Å; Q168-E172 WeakPolarHBondContact O-CB 3.33Å; Q168-E172 WeakPolarHBondContact O-CG 3.41Å; Q168-E172 PolarHBondContact O-N 3.22Å; E172-A174 VanDerWaalsContact C-N 3.3Å; E172-A174 PolarHBondContact O-N 3.28Å; E172-R175 PolarHBondContact O-N 3.38Å; E172-R175 VanDerWaalsContact O-N 3.1Å
173	A	98.4	Very high	98.2	Very high	88 Å²	88	68.3 Å²	68.3	73%	0.727	34%	0.335	S	S	*	.	H	α-helix	trans	-62.3	-35.2	175.6	0	0	0	0	0	113	R169 R175	R169-A173 VanDerWaalsContact O-CB 3.29Å; R169-A173 WeakPolarHBondContact O-CB 3.42Å; R169-A173 PolarHBondContact O-N 2.75Å; R169-A173 VanDerWaalsContact O-N 3.1Å; A173-R175 VanDerWaalsContact C-N 3.35Å
174	A	98.1	Very high	98.3	Very high	56 Å²	56	68 Å²	68	46%	0.463	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	-2.1	175.8	0	0	0	0	0	114.4	K170 W171 E172 E176	K170-A174 VanDerWaalsContact O-CB 3.24Å; K170-A174 WeakPolarHBondContact O-CB 3.25Å; K170-A174 PolarHBondContact O-N 2.67Å; W171-A174 CarbonylContact O-C 3.54Å; E172-A174 VanDerWaalsContact C-N 3.3Å; E172-A174 PolarHBondContact O-N 3.28Å; A174-E176 HydrophobicContact CB-CG 4.38Å; A174-E176 PolarHBondContact O-N 3.48Å
175	R	97.8	Very high	98.2	Very high	155 Å²	155	72 Å²	72	59%	0.585	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	54	33.8	-176.4	-61.6	164.3	164.2	-107.6	-2.5	114.2	W171 E172 A173 A177 E178	W171-R175 PolarHBondContact O-N 2.96Å; E172-R175 PolarHBondContact O-N 3.38Å; E172-R175 VanDerWaalsContact O-N 3.1Å; A173-R175 VanDerWaalsContact C-N 3.35Å; R175-A177 PolarHBondContact O-N 3.13Å; R175-A177 VanDerWaalsContact O-N 3.11Å; R175-E178 HydrophobicContact CB-CB 4.49Å; R175-E178 HydrophobicContact CB-CG 4.17Å; R175-E178 WeakPolarHBondContact CD-OE2 3.38Å; R175-E178 IonicContact CZ-OE1 2.85Å; R175-E178 VanDerWaalsContact NH1-CD 3.31Å; R175-E178 IonicContact NH1-OE1 2.76Å; R175-E178 PolarHBondContact NH1-OE1 2.93Å; R175-E178 IonicContact NH1-OE2 2.79Å; R175-E178 PolarHBondContact NH1-OE2 2.88Å; R175-E178 VanDerWaalsContact NH1-OE2 3.08Å; R175-E178 WeakPolarHBondContact O-CB 3.33Å; R175-E178 PolarHBondContact O-N 2.81Å
176	E	97.7	Very high	98.2	Very high	35 Å²	35	69.7 Å²	69.7	16%	0.164	35%	0.347	C	S	.	.	H	α-helix	trans	-52.3	-37.8	-179.1	-86	-77	152.6	0	0	112.7	W157 W171 A174 E178 Q179 R180	W157-E176 HydrophobicContact CZ2-CB 4Å; W171-E176 HydrophobicContact CB-CB 3.89Å; W171-E176 HydrophobicContact CB-CG 4.03Å; W171-E176 HydrophobicContact CD2-CG 4.45Å; W171-E176 HydrophobicContact CG-CB 4.09Å; W171-E176 HydrophobicContact CG-CG 3.84Å; W171-E176 PolarHBondContact O-N 3.12Å; A174-E176 HydrophobicContact CB-CG 4.38Å; A174-E176 PolarHBondContact O-N 3.48Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 2.87Å; E176-Q179 WeakPolarHBondContact O-CB 3.44Å; E176-Q179 PolarHBondContact O-N 2.87Å; E176-Q179 VanDerWaalsContact O-N 3.07Å; E176-R180 WeakPolarHBondContact O-CG 3.31Å; E176-R180 PolarHBondContact O-N 2.85Å; E176-R180 IonicContact OE1-NH2 2.74Å; E176-R180 IonicContact OE2-CZ 2.73Å; E176-R180 VanDerWaalsContact OE2-CZ 3.23Å; E176-R180 IonicContact OE2-NE 3.72Å; E176-R180 PolarHBondContact OE2-NE 2.77Å; E176-R180 IonicContact OE2-NH2 3.48Å; E176-R180 PolarHBondContact OE2-NH2 2.79Å
177	A	98.3	Very high	98.2	Very high	9 Å²	9	69.3 Å²	69.3	7%	0.074	35%	0.347	C	S	.	.	H	α-helix	trans	-58	-36.6	177.6	0	0	0	0	0	112.9	L150 R155 W157 R175 Q179 R180 R181	L150-A177 HydrophobicContact CD1-CB 3.94Å; R155-A177 WeakPolarHBondContact O-CB 3.31Å; W157-A177 HydrophobicContact CZ2-CB 4.23Å; R175-A177 PolarHBondContact O-N 3.13Å; R175-A177 VanDerWaalsContact O-N 3.11Å; A177-Q179 VanDerWaalsContact C-N 3.31Å; A177-Q179 PolarHBondContact O-N 3.2Å; A177-R180 PolarHBondContact O-N 2.76Å; A177-R181 WeakPolarHBondContact O-CB 3.32Å; A177-R181 PolarHBondContact O-N 2.81Å
178	E	98.1	Very high	98.2	Very high	113 Å²	113	68.6 Å²	68.6	53%	0.528	34%	0.343	S	S	.	.	H	α-helix	trans	-62	-40.6	176.3	-62	-179.9	172.7	0	0	110.9	R175 E176 A182	R175-E178 HydrophobicContact CB-CB 4.49Å; R175-E178 HydrophobicContact CB-CG 4.17Å; R175-E178 WeakPolarHBondContact CD-OE2 3.38Å; R175-E178 IonicContact CZ-OE1 2.85Å; R175-E178 VanDerWaalsContact NH1-CD 3.31Å; R175-E178 IonicContact NH1-OE1 2.76Å; R175-E178 PolarHBondContact NH1-OE1 2.93Å; R175-E178 IonicContact NH1-OE2 2.79Å; R175-E178 PolarHBondContact NH1-OE2 2.88Å; R175-E178 VanDerWaalsContact NH1-OE2 3.08Å; R175-E178 WeakPolarHBondContact O-CB 3.33Å; R175-E178 PolarHBondContact O-N 2.81Å; E176-E178 VanDerWaalsContact C-N 3.28Å; E176-E178 PolarHBondContact O-N 2.87Å; E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 2.96Å
179	Q	97	Very high	98.1	Very high	116 Å²	116	67.1 Å²	67.1	54%	0.542	34%	0.336	S	S	.	.	H	α-helix	trans	-71.6	-42	177	-57.8	-174.5	33.1	0	0	112.5	E176 A177 A182 Y183	E176-Q179 WeakPolarHBondContact O-CB 3.44Å; E176-Q179 PolarHBondContact O-N 2.87Å; E176-Q179 VanDerWaalsContact O-N 3.07Å; A177-Q179 VanDerWaalsContact C-N 3.31Å; A177-Q179 PolarHBondContact O-N 3.2Å; Q179-A182 PolarHBondContact O-N 2.9Å; Q179-Y183 PolarHBondContact O-N 2.87Å; Q179-Y183 VanDerWaalsContact O-N 3.12Å
180	R	98	Very high	98.1	Very high	70 Å²	70	65.8 Å²	65.8	26%	0.264	34%	0.336	S	S	.	.	H	α-helix	trans	-64.5	-43.6	177	-57.5	-56	155.8	-164.3	-3.8	110.7	L150 W157 E176 A177 Y183 L184	L150-R180 HydrophobicContact CD2-CB 3.96Å; W157-R180 HydrophobicContact CH2-CG 4.2Å; E176-R180 WeakPolarHBondContact O-CG 3.31Å; E176-R180 PolarHBondContact O-N 2.85Å; E176-R180 IonicContact OE1-NH2 2.74Å; E176-R180 IonicContact OE2-CZ 2.73Å; E176-R180 VanDerWaalsContact OE2-CZ 3.23Å; E176-R180 IonicContact OE2-NE 3.72Å; E176-R180 PolarHBondContact OE2-NE 2.77Å; E176-R180 IonicContact OE2-NH2 3.48Å; E176-R180 PolarHBondContact OE2-NH2 2.79Å; A177-R180 PolarHBondContact O-N 2.76Å; R180-Y183 PolarHBondContact O-N 3.41Å; R180-L184 WeakPolarHBondContact O-CB 3.21Å; R180-L184 WeakPolarHBondContact O-CG 3.39Å; R180-L184 PolarHBondContact O-N 2.93Å
181	R	98.3	Very high	98.1	Very high	75 Å²	75	62.9 Å²	62.9	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-60.2	-46.8	175.4	-173.7	169.4	177	-103.4	-17.6	112.2	L154 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4Å; L154-R181 HydrophobicContact CB-CG 3.75Å; L154-R181 HydrophobicContact CD1-CG 4.19Å; L154-R181 WeakPolarHBondContact O-CB 3.38Å; L154-R181 WeakPolarHBondContact O-CD 3.38Å; A177-R181 WeakPolarHBondContact O-CB 3.32Å; A177-R181 PolarHBondContact O-N 2.81Å; R181-Y183 VanDerWaalsContact C-N 3.32Å; R181-Y183 PolarHBondContact O-N 2.73Å; R181-L184 PolarHBondContact O-N 2.91Å; R181-L184 VanDerWaalsContact O-N 3.14Å; R181-E185 VanDerWaalsContact CG-CD 3.48Å; R181-E185 HydrophobicContact CG-CG 4.04Å; R181-E185 WeakPolarHBondContact CG-OE2 3.49Å; R181-E185 IonicContact CZ-OE1 2.64Å; R181-E185 IonicContact CZ-OE2 2.71Å; R181-E185 VanDerWaalsContact NE-CD 3.3Å; R181-E185 IonicContact NE-OE1 3.98Å; R181-E185 PolarHBondContact NE-OE1 3.37Å; R181-E185 IonicContact NE-OE2 3.08Å; R181-E185 PolarHBondContact NE-OE2 2.89Å; R181-E185 IonicContact NH1-OE2 3.7Å; R181-E185 IonicContact NH2-OE1 3.67Å; R181-E185 PolarHBondContact NH2-OE1 3.5Å; R181-E185 IonicContact NH2-OE2 3.15Å; R181-E185 PolarHBondContact NH2-OE2 2.9Å; R181-E185 WeakPolarHBondContact O-CB 3.24Å; R181-E185 WeakPolarHBondContact O-CG 3.37Å; R181-E185 PolarHBondContact O-N 2.93Å
182	A	98.4	Very high	98.1	Very high	65 Å²	65	60.3 Å²	60.3	54%	0.537	31%	0.313	S	S	.	.	H	α-helix	trans	-59.9	-39.2	177	0	0	0	0	0	113	E178 Q179 G186	E178-A182 WeakPolarHBondContact O-CB 3.49Å; E178-A182 PolarHBondContact O-N 2.96Å; Q179-A182 PolarHBondContact O-N 2.9Å; A182-G186 PolarHBondContact O-N 2.94Å
183	Y	98.3	Very high	98	Very high	56 Å²	56	62 Å²	62	22%	0.22	32%	0.315	C	S	.	.	I	π-helix	trans	-66.9	-43.3	172.7	172.7	-96.3	0	0	0	112.4	Y123 Q179 R180 R181 T187 C188	Y123-Y183 AromaticContact CD2-CE1 3.84Å; Y123-Y183 HydrophobicContact CD2-CE1 3.84Å; Y123-Y183 AromaticContact CE2-CE1 3.61Å; Y123-Y183 HydrophobicContact CE2-CE1 3.61Å; Y123-Y183 AromaticContact CE2-CZ 3.93Å; Q179-Y183 PolarHBondContact O-N 2.87Å; Q179-Y183 VanDerWaalsContact O-N 3.12Å; R180-Y183 PolarHBondContact O-N 3.41Å; R181-Y183 VanDerWaalsContact C-N 3.32Å; R181-Y183 PolarHBondContact O-N 2.73Å; Y183-T187 HydrophobicContact CD2-CG2 3.94Å; Y183-T187 HydrophobicContact CE2-CG2 3.72Å; Y183-T187 PolarHBondContact O-N 2.84Å; Y183-C188 HydrophobicContact CD1-CB 4.35Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.43Å; Y183-C188 PolarHBondContact O-N 3.35Å
184	L	98.5	Very high	97.9	Very high	2 Å²	2	63.5 Å²	63.5	1%	0.01	30%	0.302	C	S	.	.	I	π-helix	trans	-73.1	-38.1	-175.1	-71.4	171.7	0	0	0	113.3	G124 L150 L154 R180 R181 C188 V189	G124-L184 WeakPolarHBondContact O-CD2 3.43Å; L150-L184 HydrophobicContact CD2-CD1 3.94Å; L154-L184 HydrophobicContact CD1-CB 4.46Å; L154-L184 HydrophobicContact CD2-CD1 3.99Å; R180-L184 WeakPolarHBondContact O-CB 3.21Å; R180-L184 WeakPolarHBondContact O-CG 3.39Å; R180-L184 PolarHBondContact O-N 2.93Å; R181-L184 PolarHBondContact O-N 2.91Å; R181-L184 VanDerWaalsContact O-N 3.14Å; L184-C188 HydrophobicContact CD2-CB 4.47Å; L184-V189 WeakPolarHBondContact O-CG2 3.33Å
185	E	98.1	Very high	97.9	Very high	86 Å²	86	60.9 Å²	60.9	40%	0.402	28%	0.28	S	S	.	.	I	π-helix	trans	-80.9	-28	178.6	-66.7	-178.7	159.3	0	0	113.2	L133 L154 R181 V189	L133-E185 HydrophobicContact CD2-CG 3.83Å; L154-E185 HydrophobicContact CD1-CG 4.19Å; R181-E185 VanDerWaalsContact CG-CD 3.48Å; R181-E185 HydrophobicContact CG-CG 4.04Å; R181-E185 WeakPolarHBondContact CG-OE2 3.49Å; R181-E185 IonicContact CZ-OE1 2.64Å; R181-E185 IonicContact CZ-OE2 2.71Å; R181-E185 VanDerWaalsContact NE-CD 3.3Å; R181-E185 IonicContact NE-OE1 3.98Å; R181-E185 PolarHBondContact NE-OE1 3.37Å; R181-E185 IonicContact NE-OE2 3.08Å; R181-E185 PolarHBondContact NE-OE2 2.89Å; R181-E185 IonicContact NH1-OE2 3.7Å; R181-E185 IonicContact NH2-OE1 3.67Å; R181-E185 PolarHBondContact NH2-OE1 3.5Å; R181-E185 IonicContact NH2-OE2 3.15Å; R181-E185 PolarHBondContact NH2-OE2 2.9Å; R181-E185 WeakPolarHBondContact O-CB 3.24Å; R181-E185 WeakPolarHBondContact O-CG 3.37Å; R181-E185 PolarHBondContact O-N 2.93Å; E185-V189 WeakPolarHBondContact O-CG2 3.44Å
186	G	97.9	Very high	97.8	Very high	24 Å²	24	54.1 Å²	54.1	25%	0.247	26%	0.256	C	S	.	.	I	π-helix	trans	-104.4	-92.2	178.4	0	0	0	0	0	112.6	A182 C188 V189 E190	A182-G186 PolarHBondContact O-N 2.94Å; G186-C188 VanDerWaalsContact C-N 3.27Å; G186-C188 PolarHBondContact O-N 2.88Å; G186-C188 VanDerWaalsContact O-N 3.1Å; G186-V189 WeakPolarHBondContact O-CB 3.15Å; G186-V189 PolarHBondContact O-N 3.43Å; G186-E190 WeakPolarHBondContact O-CG 3.37Å; G186-E190 PolarHBondContact O-N 2.96Å
187	T	97.9	Very high	97.7	Very high	50 Å²	50	57.8 Å²	57.8	31%	0.307	27%	0.273	S	S	.	.	I	π-helix	trans	-52.8	-38.1	-168.6	-54.1	0	0	0	0	114.2	Y183 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.94Å; Y183-T187 HydrophobicContact CE2-CG2 3.72Å; Y183-T187 PolarHBondContact O-N 2.84Å; T187-E190 WeakPolarHBondContact CA-OE2 3.31Å; T187-E190 PolarHBondContact O-N 2.95Å; T187-W191 VanDerWaalsContact O-CD1 3.26Å; T187-W191 PolarHBondContact O-N 3.39Å
188	C	98.4	Very high	97.7	Very high	0 Å²	0	59.7 Å²	59.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.5	-47	178.6	-166.6	0	0	0	0	111.4	M29 C125 Y183 L184 G186 E190 L192	M29-C188 HydrophobicContact CE-CB 4.15Å; M29-C188 WeakPolarHBondContact CE-O 3.44Å; M29-C188 WeakPolarHBondContact CE-SG 3.32Å; C125-C188 HydrophobicContact CB-CB 3.84Å; C125-C188 WeakPolarHBondContact CB-SG 3.48Å; C125-C188 PolarHBondContact N-SG 3Å; C125-C188 VanDerWaalsContact N-SG 3.36Å; C125-C188 WeakPolarHBondContact SG-CB 3.34Å; C125-C188 CovalentContact SG-SG 2.03Å; C125-C188 PolarHBondContact SG-SG 3.08Å; Y183-C188 HydrophobicContact CD1-CB 4.35Å; Y183-C188 HydrophobicContact CE1-CB 3.91Å; Y183-C188 WeakPolarHBondContact O-CB 3.43Å; Y183-C188 PolarHBondContact O-N 3.35Å; L184-C188 HydrophobicContact CD2-CB 4.47Å; G186-C188 VanDerWaalsContact C-N 3.27Å; G186-C188 PolarHBondContact O-N 2.88Å; G186-C188 VanDerWaalsContact O-N 3.1Å; C188-E190 PolarHBondContact O-N 2.93Å; C188-L192 WeakPolarHBondContact O-CB 3.4Å; C188-L192 PolarHBondContact O-N 2.92Å
189	V	98.3	Very high	97.5	Very high	9 Å²	9	54.4 Å²	54.4	6%	0.055	26%	0.258	C	S	.	.	H	α-helix	trans	-61	-44.2	175.9	-179.2	0	0	0	0	111.3	L127 L133 L184 E185 G186 R193	L127-V189 HydrophobicContact CD1-CG1 4.38Å; L127-V189 HydrophobicContact CD2-CB 4.18Å; L127-V189 HydrophobicContact CD2-CG1 3.79Å; L127-V189 HydrophobicContact CD2-CG2 3.89Å; L133-V189 HydrophobicContact CB-CG2 4.11Å; L133-V189 HydrophobicContact CD1-CG2 4.23Å; L184-V189 WeakPolarHBondContact O-CG2 3.33Å; E185-V189 WeakPolarHBondContact O-CG2 3.44Å; G186-V189 WeakPolarHBondContact O-CB 3.15Å; G186-V189 PolarHBondContact O-N 3.43Å; V189-R193 VanDerWaalsContact CG1-CZ 3.43Å; V189-R193 WeakPolarHBondContact O-CB 3.49Å; V189-R193 VanDerWaalsContact O-CG 3.27Å; V189-R193 WeakPolarHBondContact O-CG 3.47Å; V189-R193 PolarHBondContact O-N 3.05Å
190	E	98	Very high	97.4	Very high	119 Å²	119	53 Å²	53	56%	0.556	25%	0.25	S	C	*	.	H	α-helix	trans	-62	-48.4	-179.9	-68.2	171.1	157	0	0	112.5	G186 T187 C188 R194	G186-E190 WeakPolarHBondContact O-CG 3.37Å; G186-E190 PolarHBondContact O-N 2.96Å; T187-E190 WeakPolarHBondContact CA-OE2 3.31Å; T187-E190 PolarHBondContact O-N 2.95Å; C188-E190 PolarHBondContact O-N 2.93Å; E190-R194 PolarHBondContact O-N 2.83Å; E190-R194 VanDerWaalsContact O-N 3.1Å
191	W	98.1	Very high	97	Very high	50 Å²	50	59 Å²	59	19%	0.189	28%	0.278	C	S	.	.	H	α-helix	trans	-71.8	-38.4	-179.2	-80.6	92.2	0	0	0	112.6	M29 Y83 R86 T187 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.18Å; M29-W191 HydrophobicContact SD-CB 4.49Å; Y83-W191 HydrophobicContact CD2-CE3 4.45Å; Y83-W191 AromaticContact CD2-CH2 3.58Å; Y83-W191 HydrophobicContact CD2-CH2 3.58Å; Y83-W191 HydrophobicContact CD2-CZ2 4.36Å; Y83-W191 AromaticContact CD2-CZ3 3.61Å; Y83-W191 HydrophobicContact CD2-CZ3 3.61Å; Y83-W191 HydrophobicContact CE2-CE3 4.06Å; Y83-W191 HydrophobicContact CE2-CH2 4.01Å; Y83-W191 AromaticContact CE2-CZ3 3.62Å; Y83-W191 HydrophobicContact CE2-CZ3 3.62Å; R86-W191 VanDerWaalsContact NH2-CZ2 3.31Å; T187-W191 VanDerWaalsContact O-CD1 3.26Å; T187-W191 PolarHBondContact O-N 3.39Å; W191-R194 WeakPolarHBondContact O-CB 3.49Å; W191-R194 PolarHBondContact O-N 3.04Å; W191-Y195 HydrophobicContact CB-CE2 4.1Å; W191-Y195 HydrophobicContact CE3-CD1 4.43Å; W191-Y195 AromaticContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE2 4.44Å; W191-Y195 AromaticContact CE3-CZ 3.55Å; W191-Y195 HydrophobicContact CZ3-CE1 4.02Å; W191-Y195 WeakPolarHBondContact O-CD2 3.39Å; W191-Y195 PolarHBondContact O-N 2.88Å
192	L	98.2	Very high	96.6	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-46	174.4	174.1	50.9	0	0	0	111.5	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.48Å; M29-L192 HydrophobicContact CB-CB 4Å; M29-L192 HydrophobicContact CB-CD1 4.05Å; M29-L192 HydrophobicContact CB-CD2 3.9Å; M29-L192 HydrophobicContact CB-CG 4.2Å; M29-L192 HydrophobicContact CE-CB 4.26Å; M29-L192 HydrophobicContact SD-CB 4.45Å; V52-L192 HydrophobicContact CG1-CD1 3.56Å; V52-L192 HydrophobicContact CG2-CD1 4.21Å; L127-L192 HydrophobicContact CD1-CB 4.26Å; L127-L192 HydrophobicContact CD1-CD2 3.7Å; L127-L192 HydrophobicContact CD1-CG 3.75Å; L127-L192 HydrophobicContact CG-CD2 3.6Å; L127-L192 HydrophobicContact CG-CG 4.24Å; C188-L192 WeakPolarHBondContact O-CB 3.4Å; C188-L192 PolarHBondContact O-N 2.92Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.09Å; L192-Y195 PolarHBondContact O-N 2.74Å; L192-L196 HydrophobicContact CD1-CD1 3.74Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.96Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.16Å; L192-L196 VanDerWaalsContact O-CG 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.33Å; L192-L196 PolarHBondContact O-N 3.36Å
193	R	96.8	Very high	96.3	Very high	123 Å²	123	55 Å²	55	46%	0.464	26%	0.255	S	S	.	.	H	α-helix	trans	-58.1	-41.7	173.6	-72.3	172.4	-177.8	169.2	0.5	112.6	L127 G131 V189 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.92Å; G131-R193 VanDerWaalsContact O-CZ 3.28Å; G131-R193 PolarHBondContact O-NE 2.79Å; G131-R193 PolarHBondContact O-NH2 3.43Å; V189-R193 VanDerWaalsContact CG1-CZ 3.43Å; V189-R193 WeakPolarHBondContact O-CB 3.49Å; V189-R193 VanDerWaalsContact O-CG 3.27Å; V189-R193 WeakPolarHBondContact O-CG 3.47Å; V189-R193 PolarHBondContact O-N 3.05Å; R193-L196 PolarHBondContact O-N 3.06Å; R193-E197 PolarHBondContact O-N 2.81Å; R193-E197 VanDerWaalsContact O-N 3.17Å
194	R	97.1	Very high	95.9	Very high	120 Å²	120	56.7 Å²	56.7	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-62.3	-46.2	175.5	179.4	-179.7	174.7	107.2	-6.6	111.6	E79 E190 W191 L192 E197 N198	E79-R194 VanDerWaalsContact CD-NH2 3.32Å; E79-R194 IonicContact OE1-CZ 3.82Å; E79-R194 IonicContact OE1-NE 3.1Å; E79-R194 PolarHBondContact OE1-NE 2.98Å; E79-R194 IonicContact OE1-NH2 3.23Å; E79-R194 PolarHBondContact OE1-NH2 3.11Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 2.75Å; E79-R194 IonicContact OE2-NE 2.75Å; E79-R194 PolarHBondContact OE2-NE 3.43Å; E79-R194 IonicContact OE2-NH2 2.67Å; E79-R194 PolarHBondContact OE2-NH2 3.31Å; E190-R194 PolarHBondContact O-N 2.83Å; E190-R194 VanDerWaalsContact O-N 3.1Å; W191-R194 WeakPolarHBondContact O-CB 3.49Å; W191-R194 PolarHBondContact O-N 3.04Å; L192-R194 VanDerWaalsContact C-N 3.32Å; L192-R194 PolarHBondContact O-N 3.09Å; R194-E197 PolarHBondContact O-N 3.49Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 3.25Å; R194-N198 PolarHBondContact O-OD1 3.49Å
195	Y	97.4	Very high	95.5	Very high	1 Å²	1	59.9 Å²	59.9	0%	0.004	28%	0.276	C	S	.	.	H	α-helix	trans	-65.5	-38.3	177.9	-61.9	-31.2	0	0	0	112.5	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.77Å; M29-Y195 HydrophobicContact SD-CE2 3.5Å; M29-Y195 WeakPolarHBondContact SD-CE2 3.43Å; V52-Y195 HydrophobicContact CG2-CD2 3.79Å; V52-Y195 HydrophobicContact CG2-CG 4.35Å; F57-Y195 HydrophobicContact CD2-CE2 4.33Å; F57-Y195 HydrophobicContact CE1-CE2 4.45Å; F57-Y195 HydrophobicContact CE2-CD2 4.15Å; F57-Y195 HydrophobicContact CE2-CE1 4.34Å; F57-Y195 AromaticContact CE2-CE2 3.46Å; F57-Y195 HydrophobicContact CE2-CE2 3.46Å; F57-Y195 VanDerWaalsContact CE2-CE2 3.46Å; F57-Y195 AromaticContact CE2-CZ 3.57Å; F57-Y195 HydrophobicContact CZ-CD2 4.14Å; F57-Y195 AromaticContact CZ-CE2 3.53Å; F57-Y195 HydrophobicContact CZ-CE2 3.53Å; W75-Y195 HydrophobicContact CE3-CD1 4.28Å; W75-Y195 HydrophobicContact CE3-CG 4.48Å; W75-Y195 HydrophobicContact CH2-CD1 4.47Å; W75-Y195 HydrophobicContact CH2-CD2 4.44Å; W75-Y195 HydrophobicContact CH2-CG 4.04Å; W75-Y195 AromaticContact CZ3-CD1 3.56Å; W75-Y195 HydrophobicContact CZ3-CD1 3.56Å; W75-Y195 HydrophobicContact CZ3-CD2 4.27Å; W75-Y195 HydrophobicContact CZ3-CE1 4.31Å; W75-Y195 AromaticContact CZ3-CG 3.54Å; W75-Y195 HydrophobicContact CZ3-CG 3.54Å; V76-Y195 HydrophobicContact CG2-CE1 4.16Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.27Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.3Å; Y83-Y195 PolarHBondContact OH-OH 2.82Å; W191-Y195 HydrophobicContact CB-CE2 4.1Å; W191-Y195 HydrophobicContact CE3-CD1 4.43Å; W191-Y195 AromaticContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE1 3.55Å; W191-Y195 HydrophobicContact CE3-CE2 4.44Å; W191-Y195 AromaticContact CE3-CZ 3.55Å; W191-Y195 HydrophobicContact CZ3-CE1 4.02Å; W191-Y195 WeakPolarHBondContact O-CD2 3.39Å; W191-Y195 PolarHBondContact O-N 2.88Å; L192-Y195 PolarHBondContact O-N 2.74Å; Y195-E197 VanDerWaalsContact C-N 3.35Å; Y195-E197 PolarHBondContact O-N 3.38Å; Y195-N198 PolarHBondContact O-N 3.41Å; Y195-G199 WeakPolarHBondContact O-CA 3.46Å; Y195-G199 PolarHBondContact O-N 3.06Å; Y195-L203 WeakPolarHBondContact O-CD1 3.41Å
196	L	96	Very high	95.2	Very high	13 Å²	13	57.8 Å²	57.8	7%	0.068	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-36.2	176.1	-73.1	168.2	0	0	0	112.9	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.67Å; H27-L196 HydrophobicContact CB-CD2 3.97Å; H27-L196 HydrophobicContact CB-CG 4.41Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.37Å; V52-L196 HydrophobicContact CG1-CD2 4.13Å; L192-L196 HydrophobicContact CD1-CD1 3.74Å; L192-L196 HydrophobicContact CD1-CD2 4.38Å; L192-L196 HydrophobicContact CD1-CG 3.8Å; L192-L196 HydrophobicContact CG-CD1 3.96Å; L192-L196 HydrophobicContact CG-CG 4.48Å; L192-L196 WeakPolarHBondContact O-CB 3.16Å; L192-L196 VanDerWaalsContact O-CG 3.29Å; L192-L196 WeakPolarHBondContact O-CG 3.33Å; L192-L196 PolarHBondContact O-N 3.36Å; R193-L196 PolarHBondContact O-N 3.06Å; L196-K200 WeakPolarHBondContact O-CA 3.4Å; L196-K200 WeakPolarHBondContact O-CB 3.38Å; L196-K200 PolarHBondContact O-N 3.33Å; L196-K200 VanDerWaalsContact O-N 3.1Å; L196-L203 HydrophobicContact CD2-CB 4.12Å; L196-L203 HydrophobicContact CD2-CD1 4.25Å; L196-Q204 PolarHBondContact O-NE2 2.89Å; L196-Q204 VanDerWaalsContact O-NE2 3.09Å
197	E	95.8	Very high	95	Very high	112 Å²	112	59.6 Å²	59.6	52%	0.523	28%	0.276	S	S	.	.	H	α-helix	trans	-77.9	-42.6	174	-165.4	62	-153.1	0	0	111.9	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 2.81Å; R193-E197 VanDerWaalsContact O-N 3.17Å; R194-E197 PolarHBondContact O-N 3.49Å; Y195-E197 VanDerWaalsContact C-N 3.35Å; Y195-E197 PolarHBondContact O-N 3.38Å; E197-G199 VanDerWaalsContact C-N 3.34Å; E197-G199 PolarHBondContact O-N 3.38Å; E197-K200 WeakPolarHBondContact O-CB 3.47Å; E197-K200 PolarHBondContact O-N 2.87Å; E197-K200 IonicContact OE1-NZ 3.37Å; E197-K200 PolarHBondContact OE1-NZ 3.17Å; E197-K200 IonicContact OE2-NZ 2.76Å; E197-K200 PolarHBondContact OE2-NZ 3.32Å
198	N	96.6	Very high	94.9	Very high	49 Å²	49	62.3 Å²	62.3	26%	0.262	29%	0.285	S	S	.	.	H	α-helix	trans	-57.1	-46.6	174.6	-71.8	2.6	0	0	0	111.7	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.44Å; Q78-N198 PolarHBondContact NE2-ND2 3.39Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.18Å; Q78-N198 PolarHBondContact NE2-OD1 2.89Å; E79-N198 PolarHBondContact OE1-ND2 2.78Å; E79-N198 VanDerWaalsContact OE1-ND2 3.13Å; R194-N198 WeakPolarHBondContact O-CB 3.41Å; R194-N198 PolarHBondContact O-N 3.25Å; R194-N198 PolarHBondContact O-OD1 3.49Å; Y195-N198 PolarHBondContact O-N 3.41Å
199	G	95.4	Very high	94.8	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.021	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	13.1	-174.6	0	0	0	0	0	114.5	W75 Y195 E197 K201 T202 L203	W75-G199 VanDerWaalsContact CB-CA 3.47Å; W75-G199 VanDerWaalsContact CG-CA 3.42Å; Y195-G199 WeakPolarHBondContact O-CA 3.46Å; Y195-G199 PolarHBondContact O-N 3.06Å; E197-G199 VanDerWaalsContact C-N 3.34Å; E197-G199 PolarHBondContact O-N 3.38Å; G199-K201 VanDerWaalsContact C-N 3.29Å; G199-K201 PolarHBondContact O-N 3.13Å; G199-T202 WeakPolarHBondContact O-CA 3.47Å; G199-T202 PolarHBondContact O-N 3.02Å; G199-L203 PolarHBondContact O-N 3.16Å
200	K	93.3	Very high	94.8	Very high	87 Å²	87	68.9 Å²	68.9	38%	0.378	31%	0.314	S	S	.	.	H	α-helix	trans	-44.6	-45.9	-170.1	-166.1	168.4	-157.4	145.6	0	115	L196 E197 T202 Q204	L196-K200 WeakPolarHBondContact O-CA 3.4Å; L196-K200 WeakPolarHBondContact O-CB 3.38Å; L196-K200 PolarHBondContact O-N 3.33Å; L196-K200 VanDerWaalsContact O-N 3.1Å; E197-K200 WeakPolarHBondContact O-CB 3.47Å; E197-K200 PolarHBondContact O-N 2.87Å; E197-K200 IonicContact OE1-NZ 3.37Å; E197-K200 PolarHBondContact OE1-NZ 3.17Å; E197-K200 IonicContact OE2-NZ 2.76Å; E197-K200 PolarHBondContact OE2-NZ 3.32Å; K200-T202 PolarHBondContact O-N 2.64Å; K200-Q204 HydrophobicContact CG-CB 4.49Å; K200-Q204 WeakPolarHBondContact O-CA 3.49Å; K200-Q204 WeakPolarHBondContact O-CB 3.47Å; K200-Q204 PolarHBondContact O-N 2.88Å
201	K	91.1	Very high	94.8	Very high	197 Å²	197	64.8 Å²	64.8	86%	0.857	30%	0.297	S	S	*	.	H	α-helix	trans	-67.2	-13.4	179.7	-63	-178.4	-179.8	177.6	0	114.8	G199	G199-K201 VanDerWaalsContact C-N 3.29Å; G199-K201 PolarHBondContact O-N 3.13Å
202	T	90.1	Very high	94.7	Very high	51 Å²	51	66.1 Å²	66.1	31%	0.313	31%	0.305	S	S	.	.	H	α-helix	trans	-119	-32.5	-174.3	-52.2	0	0	0	0	112.2	G199 K200 R205	G199-T202 WeakPolarHBondContact O-CA 3.47Å; G199-T202 PolarHBondContact O-N 3.02Å; K200-T202 PolarHBondContact O-N 2.64Å; T202-R205 WeakPolarHBondContact O-CD 3.44Å; T202-R205 WeakPolarHBondContact O-CG 3.39Å; T202-R205 PolarHBondContact O-NE 3.37Å
203	L	91.6	Very high	94.7	Very high	5 Å²	5	67.2 Å²	67.2	3%	0.026	31%	0.312	C	S	.	.	H	α-helix	trans	-93.8	-39.7	-178.7	-59.8	173.7	0	0	0	112.3	V52 T55 W75 Y195 L196 G199 R205	V52-L203 HydrophobicContact CB-CD1 4.3Å; V52-L203 HydrophobicContact CB-CD2 4.22Å; V52-L203 HydrophobicContact CG1-CD1 3.84Å; V52-L203 HydrophobicContact CG1-CD2 4.1Å; T55-L203 HydrophobicContact CG2-CD2 4Å; W75-L203 HydrophobicContact CD2-CD1 4.43Å; W75-L203 HydrophobicContact CH2-CD1 4.34Å; W75-L203 HydrophobicContact CZ2-CD1 3.78Å; W75-L203 HydrophobicContact CZ2-CD2 3.99Å; W75-L203 HydrophobicContact CZ2-CG 4.3Å; Y195-L203 WeakPolarHBondContact O-CD1 3.41Å; L196-L203 HydrophobicContact CD2-CB 4.12Å; L196-L203 HydrophobicContact CD2-CD1 4.25Å; G199-L203 PolarHBondContact O-N 3.16Å; L203-R205 VanDerWaalsContact C-N 3.27Å; L203-R205 PolarHBondContact O-N 3.14Å
204	Q	89.4	Confident	94.7	Very high	90 Å²	90	63.3 Å²	63.3	42%	0.421	30%	0.301	S	S	.	.	S	Bend	trans	-95.7	37.5	176.3	-58.4	171.3	25.5	0	0	111	L196 K200	L196-Q204 PolarHBondContact O-NE2 2.89Å; L196-Q204 VanDerWaalsContact O-NE2 3.09Å; K200-Q204 HydrophobicContact CG-CB 4.49Å; K200-Q204 WeakPolarHBondContact O-CA 3.49Å; K200-Q204 WeakPolarHBondContact O-CB 3.47Å; K200-Q204 PolarHBondContact O-N 2.88Å
205	R	90.4	Very high	94.6	Very high	69 Å²	69	60.1 Å²	60.1	26%	0.26	29%	0.292	S	S	.	.			trans	-108.2	145.7	168.6	75.3	-173.6	164	152.5	3.3	108.2	T202 L203 E207 Y233	T202-R205 WeakPolarHBondContact O-CD 3.44Å; T202-R205 WeakPolarHBondContact O-CG 3.39Å; T202-R205 PolarHBondContact O-NE 3.37Å; L203-R205 VanDerWaalsContact C-N 3.27Å; L203-R205 PolarHBondContact O-N 3.14Å; R205-E207 WeakPolarHBondContact CD-OE1 3.48Å; R205-E207 IonicContact CZ-OE1 2.69Å; R205-E207 IonicContact NE-OE1 3.18Å; R205-E207 IonicContact NH1-OE1 3.65Å; R205-E207 PolarHBondContact NH1-OE1 2.91Å; R205-Y233 HydrophobicContact CG-CD1 4.02Å; R205-Y233 HydrophobicContact CG-CE1 4.43Å; R205-Y233 WeakPolarHBondContact O-CD1 3.45Å
206	A	91.9	Very high	94.5	Very high	42 Å²	42	63.9 Å²	63.9	35%	0.347	31%	0.309	S	S	.	.			trans	-117.5	127.9	160.9	0	0	0	0	0	108.3	Y233	A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 VanDerWaalsContact CA-O 3.31Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å
207	E	93.9	Very high	94.3	Very high	62 Å²	62	68 Å²	68	29%	0.29	34%	0.337	S	S	.	.	B	Isolated β-bridge	trans	-106.9	118.7	175.6	-68.9	-170.3	-148.9	0	0	108.8	R205 F232 Y233 H287	R205-E207 WeakPolarHBondContact CD-OE1 3.48Å; R205-E207 IonicContact CZ-OE1 2.69Å; R205-E207 IonicContact NE-OE1 3.18Å; R205-E207 IonicContact NH1-OE1 3.65Å; R205-E207 PolarHBondContact NH1-OE1 2.91Å; E207-F232 WeakPolarHBondContact O-CA 3.45Å; E207-F232 VanDerWaalsContact O-CB 3.26Å; E207-F232 WeakPolarHBondContact O-CB 3.27Å; E207-Y233 PolarHBondContact N-O 2.85Å; E207-Y233 PolarHBondContact O-N 3.36Å; E207-Y233 VanDerWaalsContact O-N 3.15Å; E207-H287 PolarHBondContact O-CE1 3.1Å
208	H	95.1	Very high	94.1	Very high	108 Å²	108	67 Å²	67	50%	0.5	34%	0.338	S	S	.	.			trans	-66.5	142.1	-175.7	-43.7	-93.5	0	0	0	112	K210 G289 L290	H208-K210 PolarHBondContact O-N 2.94Å; H208-G289 PolarHBondContact CE1-O 2.87Å; H208-G289 PolarHBondContact ND1-O 3.05Å; H208-L290 HydrophobicContact CB-CD2 4.09Å
209	P	97.4	Very high	93.9	Very high	8 Å²	8	67.2 Å²	67.2	5%	0.052	34%	0.343	C	S	.	.			trans	-65	128	174.8	27.4	-35.5	0	0	0	111.9	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.9Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 2.93Å; P209-T211 VanDerWaalsContact O-N 3.16Å; P209-A229 HydrophobicContact CB-CB 3.78Å; P209-F232 HydrophobicContact CB-CB 3.98Å; P209-F232 HydrophobicContact CB-CD1 3.89Å; P209-F232 HydrophobicContact CB-CG 4.2Å; P209-I237 HydrophobicContact CB-CD1 4.08Å; P209-I237 HydrophobicContact CG-CD1 4.18Å; P209-V285 HydrophobicContact CG-CG1 3.94Å; P209-H287 HydrophobicContact CG-CB 4.04Å; P209-L290 HydrophobicContact CG-CD1 3.9Å; P209-L290 HydrophobicContact CG-CD2 4.3Å; P209-L290 HydrophobicContact CG-CG 4.19Å
210	K	97.6	Very high	93.6	Very high	139 Å²	139	74.5 Å²	74.5	60%	0.604	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	98	167.3	-65.1	155	-172.4	147.1	0	107.7	H208 L230	H208-K210 PolarHBondContact O-N 2.94Å; K210-L230 WeakPolarHBondContact CB-O 3.25Å; K210-L230 PolarHBondContact N-O 3.06Å; K210-L230 PolarHBondContact O-N 3.33Å
211	T	97.5	Very high	93.6	Very high	33 Å²	33	77.3 Å²	77.3	20%	0.202	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	144.7	-171.3	57	0	0	0	0	114	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.9Å; P209-T211 HydrophobicContact CG-CG2 4.11Å; P209-T211 PolarHBondContact O-N 2.93Å; P209-T211 VanDerWaalsContact O-N 3.16Å; T211-W228 WeakPolarHBondContact CA-O 3.39Å; T211-A229 HydrophobicContact CG2-CB 4.34Å; T211-V285 HydrophobicContact CG2-CB 4.41Å; T211-V285 HydrophobicContact CG2-CG1 4.13Å; T211-V285 HydrophobicContact CG2-CG2 4.07Å; T211-L294 HydrophobicContact CG2-CD1 4.25Å; T211-L296 HydrophobicContact CG2-CD1 4.14Å
212	H	96.5	Very high	93.8	Very high	78 Å²	78	72.3 Å²	72.3	36%	0.361	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.8	160.2	170.8	64.3	-70	0	0	0	111.2	W228	H212-W228 VanDerWaalsContact CE1-CB 3.49Å; H212-W228 WeakPolarHBondContact CE1-CB 3.43Å; H212-W228 AromaticContact CE1-CD1 3.95Å; H212-W228 AromaticContact CE1-CG 3.71Å; H212-W228 PolarHBondContact N-O 3.09Å; H212-W228 AromaticContact NE2-CD1 3.7Å; H212-W228 AromaticContact NE2-CG 3.91Å; H212-W228 PolarHBondContact O-N 2.77Å
213	V	97.9	Very high	94	Very high	23 Å²	23	70 Å²	70	14%	0.139	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	125.1	175.2	-178.7	0	0	0	0	109.5	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.37Å; V213-L225 HydrophobicContact CG1-CD2 4.47Å; V213-R226 WeakPolarHBondContact CA-O 2.98Å; V213-C227 HydrophobicContact CG2-CB 4.34Å; V213-W241 HydrophobicContact CG1-CH2 3.83Å; V213-W241 HydrophobicContact CG1-CZ2 4.25Å; V213-W241 HydrophobicContact CG2-CH2 4.25Å; V213-L296 HydrophobicContact CG2-CB 3.97Å; V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.85Å
214	T	96.5	Very high	94.3	Very high	40 Å²	40	70.8 Å²	70.8	25%	0.245	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	151.3	171.4	49.4	0	0	0	0	111.3	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.04Å; T214-L225 CarbonylContact O-C 3.55Å; T214-L225 WeakPolarHBondContact O-CA 3.13Å; T214-R226 PolarHBondContact N-O 3.48Å; T214-R226 PolarHBondContact O-N 3.33Å; T214-R226 PolarHBondContact OG1-O 3.11Å; T214-W228 PolarHBondContact OG1-NE1 2.88Å
215	H	95.5	Very high	94.7	Very high	54 Å²	54	66.5 Å²	66.5	25%	0.25	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	128.8	-175.4	163.3	-81.4	0	0	0	109.4	A223 T224 L225 W298	H215-A223 VanDerWaalsContact NE2-CB 3.32Å; H215-A223 WeakPolarHBondContact NE2-CB 3.29Å; H215-T224 WeakPolarHBondContact CA-O 3.4Å; H215-L225 HydrophobicContact CB-CD2 3.91Å; H215-W298 HydrophobicContact CB-CD2 4.15Å; H215-W298 HydrophobicContact CB-CG 4.12Å; H215-W298 HydrophobicContact CB-CZ2 4.03Å; H215-W298 AromaticContact CD2-CE2 3.85Å; H215-W298 AromaticContact CD2-CH2 3.95Å; H215-W298 AromaticContact CD2-CZ2 3.72Å; H215-W298 AromaticContact CG-CE2 3.66Å; H215-W298 AromaticContact CG-CZ2 3.65Å; H215-W298 AromaticContact CG-NE1 3.85Å; H215-W298 AromaticContact ND1-CZ2 3.88Å; H215-W298 AromaticContact NE2-CH2 3.96Å
216	H	94.3	Very high	95.1	Very high	80 Å²	80	65.3 Å²	65.3	37%	0.37	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	110.6	-178	-50.4	78.5	0	0	0	108.4	T214 V218 A223 T224	T214-H216 PolarHBondContact OG1-CE1 3.04Å; H216-V218 PolarHBondContact O-N 2.81Å; H216-A223 CarbonylContact O-C 3.39Å; H216-A223 WeakPolarHBondContact O-CA 3.19Å; H216-T224 PolarHBondContact N-O 2.87Å; H216-T224 PolarHBondContact O-N 2.71Å
217	P	93.4	Very high	95.4	Very high	100 Å²	100	63.3 Å²	63.3	65%	0.649	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-57.7	135.5	171.6	-21.1	31.8	0	0	0	110.7
218	V	91.3	Very high	95.6	Very high	90 Å²	90	63 Å²	63	55%	0.545	32%	0.322	S	S	.	.			trans	-109.3	-38.4	175.3	-178.1	0	0	0	0	110	H216 E222 T224	H216-V218 PolarHBondContact O-N 2.81Å; V218-E222 PolarHBondContact N-O 2.89Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.33Å
219	S	92.2	Very high	95.7	Very high	54 Å²	54	57.9 Å²	57.9	38%	0.378	30%	0.298	S	S	.	.	S	Bend	trans	-149.3	-178.4	174.1	70.1	0	0	0	0	110.6	H221 E222	S219-H221 PolarHBondContact O-N 3.2Å; S219-H221 VanDerWaalsContact O-N 3.12Å; S219-H221 PolarHBondContact OG-N 2.93Å; S219-H221 VanDerWaalsContact OG-N 3.14Å; S219-E222 PolarHBondContact N-O 3.47Å; S219-E222 PolarHBondContact OG-N 2.84Å; S219-E222 VanDerWaalsContact OG-N 3.09Å
220	D	89.6	Confident	95.8	Very high	155 Å²	155	60.1 Å²	60.1	83%	0.829	31%	0.309	S	S	*	.	S	Bend	trans	-67.8	-0.3	170.4	-61.7	-35.6	0	0	0	113.4
221	H	92.7	Very high	95.7	Very high	145 Å²	145	54.1 Å²	54.1	67%	0.671	29%	0.286	S	S	*	.	S	Bend	trans	-127.8	-15.9	-175.8	-56.6	-21.3	0	0	0	113.5	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.2Å; S219-H221 VanDerWaalsContact O-N 3.12Å; S219-H221 PolarHBondContact OG-N 2.93Å; S219-H221 VanDerWaalsContact OG-N 3.14Å; H221-P274 CarbonylContact O-C 3.55Å; H221-P274 WeakPolarHBondContact O-CA 3.32Å; H221-S275 PolarHBondContact O-N 3.3Å
222	E	95	Very high	95.7	Very high	93 Å²	93	52.5 Å²	52.5	44%	0.435	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	142.9	-171.9	-65.3	-180	159	0	0	112.4	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 2.89Å; S219-E222 PolarHBondContact N-O 3.47Å; S219-E222 PolarHBondContact OG-N 2.84Å; S219-E222 VanDerWaalsContact OG-N 3.09Å; E222-V272 HydrophobicContact CB-CG1 4.07Å; E222-V272 HydrophobicContact CG-CG1 4.33Å; E222-V273 WeakPolarHBondContact CA-O 3.27Å; E222-S275 PolarHBondContact N-OG 3.1Å
223	A	95.3	Very high	95.7	Very high	1 Å²	1	49 Å²	49	1%	0.008	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	152.5	171.2	0	0	0	0	0	111.3	H215 H216 V273	H215-A223 VanDerWaalsContact NE2-CB 3.32Å; H215-A223 WeakPolarHBondContact NE2-CB 3.29Å; H216-A223 CarbonylContact O-C 3.39Å; H216-A223 WeakPolarHBondContact O-CA 3.19Å; A223-V273 PolarHBondContact N-O 2.67Å; A223-V273 PolarHBondContact O-N 2.99Å
224	T	97.1	Very high	95.5	Very high	22 Å²	22	48.6 Å²	48.6	14%	0.135	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	115.2	170	-50.8	0	0	0	0	110.2	H215 H216 V218 A270 V271	H215-T224 WeakPolarHBondContact CA-O 3.4Å; H216-T224 PolarHBondContact N-O 2.87Å; H216-T224 PolarHBondContact O-N 2.71Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.33Å; T224-A270 HydrophobicContact CG2-CB 3.84Å; T224-V271 WeakPolarHBondContact CA-O 3.29Å
225	L	97.7	Very high	95.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	126.3	163.5	-62.4	-174.8	0	0	0	108.8	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.37Å; V213-L225 HydrophobicContact CG1-CD2 4.47Å; T214-L225 CarbonylContact O-C 3.55Å; T214-L225 WeakPolarHBondContact O-CA 3.13Å; H215-L225 HydrophobicContact CB-CD2 3.91Å; L225-W241 HydrophobicContact CB-CH2 3.69Å; L225-W241 HydrophobicContact CB-CZ2 3.73Å; L225-W241 HydrophobicContact CD1-CH2 3.94Å; L225-W241 HydrophobicContact CD1-CZ3 4.14Å; L225-W241 HydrophobicContact CG-CH2 4.47Å; L225-A270 CarbonylContact O-C 3.48Å; L225-A270 WeakPolarHBondContact O-CA 3.22Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 3.11Å; L225-V271 PolarHBondContact O-N 2.95Å; L225-V273 HydrophobicContact CD1-CG1 3.99Å; L225-V273 HydrophobicContact CD1-CG2 4.12Å; L225-V273 HydrophobicContact CG-CG1 4.11Å; L225-V273 HydrophobicContact CG-CG2 3.87Å; L225-E278 HydrophobicContact CD1-CB 4.13Å; L225-E278 HydrophobicContact CD2-CB 4.41Å; L225-E278 HydrophobicContact CD2-CG 4.33Å; L225-W298 HydrophobicContact CD1-CB 4.45Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.34Å; L225-W298 HydrophobicContact CD2-CG 3.95Å
226	R	98.1	Very high	95.5	Very high	45 Å²	45	51.7 Å²	51.7	17%	0.17	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	112.7	175.4	-176	174.9	-72.6	105.9	4.8	110.2	V213 T214 W228 E253 W268 A270	V213-R226 WeakPolarHBondContact CA-O 2.98Å; T214-R226 PolarHBondContact N-O 3.48Å; T214-R226 PolarHBondContact O-N 3.33Å; T214-R226 PolarHBondContact OG1-O 3.11Å; R226-W228 VanDerWaalsContact CD-CZ2 3.48Å; R226-W228 HydrophobicContact CG-CZ2 4.38Å; R226-E253 IonicContact NH2-OE2 3.43Å; R226-E253 PolarHBondContact NH2-OE2 3Å; R226-W268 HydrophobicContact CG-CB 4.05Å; R226-W268 HydrophobicContact CG-CD2 4.02Å; R226-W268 HydrophobicContact CG-CE3 3.76Å; R226-W268 HydrophobicContact CG-CG 4.2Å; R226-W268 HydrophobicContact CG-CZ3 4.48Å; R226-W268 VanDerWaalsContact NE-CE3 3.29Å; R226-A270 HydrophobicContact CB-CB 3.97Å; R226-A270 HydrophobicContact CG-CB 4.03Å
227	C	98.2	Very high	95.6	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	125.1	173.9	-174.2	0	0	0	0	109.7	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.34Å; C227-W241 HydrophobicContact CB-CH2 4.42Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; C227-W268 CarbonylContact O-C 3.57Å; C227-W268 WeakPolarHBondContact O-CA 3.21Å; C227-W268 WeakPolarHBondContact O-CB 3.38Å; C227-A269 PolarHBondContact N-O 2.98Å; C227-A269 PolarHBondContact O-N 2.83Å; C227-C283 HydrophobicContact CB-CB 3.46Å; C227-C283 VanDerWaalsContact CB-CB 3.46Å; C227-C283 WeakPolarHBondContact CB-SG 3.45Å; C227-C283 WeakPolarHBondContact SG-CB 3.2Å; C227-C283 CovalentContact SG-SG 2.02Å; C227-C283 PolarHBondContact SG-SG 2.91Å
228	W	98.3	Very high	95.7	Very high	55 Å²	55	46.2 Å²	46.2	21%	0.208	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	143.3	-179.8	-67.4	84	0	0	0	111.1	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.39Å; H212-W228 VanDerWaalsContact CE1-CB 3.49Å; H212-W228 WeakPolarHBondContact CE1-CB 3.43Å; H212-W228 AromaticContact CE1-CD1 3.95Å; H212-W228 AromaticContact CE1-CG 3.71Å; H212-W228 PolarHBondContact N-O 3.09Å; H212-W228 AromaticContact NE2-CD1 3.7Å; H212-W228 AromaticContact NE2-CG 3.91Å; H212-W228 PolarHBondContact O-N 2.77Å; T214-W228 PolarHBondContact OG1-NE1 2.88Å; R226-W228 VanDerWaalsContact CD-CZ2 3.48Å; R226-W228 HydrophobicContact CG-CZ2 4.38Å; W228-L230 HydrophobicContact CE3-CD2 3.96Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.38Å; W228-W268 HydrophobicContact CE3-CB 3.95Å; W228-W268 AromaticContact CE3-CD1 3.72Å; W228-W268 HydrophobicContact CE3-CG 4.12Å; W228-W268 HydrophobicContact CG-CB 4.32Å; W228-W268 AromaticContact CH2-CD1 3.72Å; W228-W268 HydrophobicContact CH2-CG 4.37Å; W228-W268 AromaticContact CH2-NE1 3.98Å; W228-W268 HydrophobicContact CZ3-CB 4.45Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.12Å
229	A	98.4	Very high	96	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.4	160.3	0	0	0	0	0	108.1	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.78Å; T211-A229 HydrophobicContact CG2-CB 4.34Å; A229-F232 HydrophobicContact CB-CD1 4.02Å; A229-F232 HydrophobicContact CB-CE1 3.71Å; A229-F232 WeakPolarHBondContact O-CE1 3.48Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.27Å; A229-Q266 WeakPolarHBondContact O-CA 3.46Å; A229-K267 PolarHBondContact N-O 2.81Å; A229-K267 PolarHBondContact O-N 2.87Å
230	L	98.1	Very high	96.3	Very high	56 Å²	56	41.5 Å²	41.5	29%	0.293	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	142.2	-175.5	-61.5	176.9	0	0	0	111.3	K210 W228 Q266	K210-L230 WeakPolarHBondContact CB-O 3.25Å; K210-L230 PolarHBondContact N-O 3.06Å; K210-L230 PolarHBondContact O-N 3.33Å; W228-L230 HydrophobicContact CE3-CD2 3.96Å; L230-Q266 HydrophobicContact CD2-CB 3.62Å
231	G	97.2	Very high	96.7	Very high	12 Å²	12	34.2 Å²	34.2	12%	0.124	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	70.5	42.4	168.7	0	0	0	0	0	113.8	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.35Å; G231-F265 PolarHBondContact N-O 3.15Å
232	F	97	Very high	96.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	158.7	179.3	58.3	-91.6	0	0	0	113.2	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.45Å; E207-F232 VanDerWaalsContact O-CB 3.26Å; E207-F232 WeakPolarHBondContact O-CB 3.27Å; P209-F232 HydrophobicContact CB-CB 3.98Å; P209-F232 HydrophobicContact CB-CD1 3.89Å; P209-F232 HydrophobicContact CB-CG 4.2Å; A229-F232 HydrophobicContact CB-CD1 4.02Å; A229-F232 HydrophobicContact CB-CE1 3.71Å; A229-F232 WeakPolarHBondContact O-CE1 3.48Å; F232-P234 WeakPolarHBondContact CD2-O 3.48Å; F232-I237 HydrophobicContact CD1-CD1 3.92Å; F232-I237 HydrophobicContact CD2-CB 4.43Å; F232-I237 HydrophobicContact CD2-CD1 3.97Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE2-CB 3.87Å; F232-I237 HydrophobicContact CE2-CD1 3.84Å; F232-I237 HydrophobicContact CE2-CG1 4.46Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 4.03Å; F232-I237 HydrophobicContact CZ-CB 4.26Å; F232-I237 HydrophobicContact CZ-CD1 3.77Å; F232-I237 HydrophobicContact CZ-CG2 3.61Å; F232-T257 HydrophobicContact CE2-CG2 4.02Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; F232-T264 CarbonylContact O-C 3.56Å; F232-T264 WeakPolarHBondContact O-CA 3.28Å; F232-T264 WeakPolarHBondContact O-CB 3.46Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.38Å; F232-F265 HydrophobicContact CD2-CB 3.86Å; F232-F265 HydrophobicContact CE1-CB 4.37Å; F232-F265 WeakPolarHBondContact CE1-O 3.24Å; F232-F265 HydrophobicContact CE2-CB 3.45Å; F232-F265 VanDerWaalsContact CE2-CB 3.45Å; F232-F265 HydrophobicContact CG-CB 4.45Å; F232-F265 HydrophobicContact CZ-CB 3.72Å; F232-F265 PolarHBondContact N-O 3.1Å; F232-F265 PolarHBondContact O-N 3.04Å; F232-K267 HydrophobicContact CE1-CB 4.43Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; F232-H287 AromaticContact CD2-CD2 3.79Å; F232-H287 AromaticContact CD2-NE2 3.7Å
233	Y	95.5	Very high	97	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.016	14%	0.141	C	C	.	.	B	Isolated β-bridge	trans	-153.9	136.9	174.3	179.7	-81.8	0	0	0	108.8	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.05Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.46Å; T55-Y233 PolarHBondContact OG1-OH 2.9Å; R205-Y233 HydrophobicContact CG-CD1 4.02Å; R205-Y233 HydrophobicContact CG-CE1 4.43Å; R205-Y233 WeakPolarHBondContact O-CD1 3.45Å; A206-Y233 CarbonylContact C-O 3.58Å; A206-Y233 VanDerWaalsContact CA-O 3.31Å; A206-Y233 WeakPolarHBondContact CA-O 3.46Å; E207-Y233 PolarHBondContact N-O 2.85Å; E207-Y233 PolarHBondContact O-N 3.36Å; E207-Y233 VanDerWaalsContact O-N 3.15Å; Y233-G263 WeakPolarHBondContact CD2-O 3.38Å; Y233-F265 HydrophobicContact CD2-CD2 4.47Å; Y233-F265 HydrophobicContact CD2-CE2 4.08Å; Y233-H287 PolarHBondContact O-CE1 3.46Å
234	P	94.8	Very high	97	Very high	15 Å²	15	33 Å²	33	10%	0.097	17%	0.167	C	C	.	.	S	Bend	cis	-68.9	-179.5	-0.5	30.7	-37.4	0	0	0	113	D54 F232 H287 E288	D54-P234 VanDerWaalsContact OD2-CB 3.27Å; D54-P234 WeakPolarHBondContact OD2-CB 3.29Å; F232-P234 WeakPolarHBondContact CD2-O 3.48Å; P234-H287 PolarHBondContact O-NE2 3.17Å; P234-E288 HydrophobicContact CG-CB 4.37Å; P234-E288 VanDerWaalsContact CG-OE2 3.32Å; P234-E288 WeakPolarHBondContact CG-OE2 3.01Å
235	A	96.1	Very high	96.7	Very high	14 Å²	14	34.2 Å²	34.2	12%	0.116	18%	0.184	C	C	.	.	S	Bend	trans	-74.7	-21.7	-176	0	0	0	0	0	114.1	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.39Å; D54-A235 VanDerWaalsContact CG-CB 3.46Å; D54-A235 WeakPolarHBondContact OD1-CB 3.07Å; D54-A235 WeakPolarHBondContact OD2-CB 3.37Å; D54-A235 PolarHBondContact OD2-N 3.04Å; A235-I237 PolarHBondContact O-N 2.75Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; A235-T257 WeakPolarHBondContact O-CG2 3.34Å; A235-F265 HydrophobicContact CB-CD1 3.77Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.85Å; A235-F265 HydrophobicContact CB-CE2 3.78Å; A235-F265 HydrophobicContact CB-CG 3.71Å; A235-F265 HydrophobicContact CB-CZ 3.87Å
236	E	95.2	Very high	96.5	Very high	144 Å²	144	41.2 Å²	41.2	67%	0.673	22%	0.217	S	C	*	.			trans	-67.2	120.2	-179.5	-172.4	49.1	-117.7	0	0	110.6	H287	E236-H287 PolarHBondContact O-CD2 2.75Å; E236-H287 VanDerWaalsContact O-CD2 3.27Å
237	I	96.1	Very high	96.4	Very high	7 Å²	7	43.6 Å²	43.6	4%	0.036	23%	0.233	C	C	.	.			trans	-158.2	130.5	-173	-165.8	169.8	0	0	0	111.1	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.08Å; P209-I237 HydrophobicContact CG-CD1 4.18Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; F232-I237 HydrophobicContact CD1-CD1 3.92Å; F232-I237 HydrophobicContact CD2-CB 4.43Å; F232-I237 HydrophobicContact CD2-CD1 3.97Å; F232-I237 HydrophobicContact CE1-CD1 3.78Å; F232-I237 HydrophobicContact CE2-CB 3.87Å; F232-I237 HydrophobicContact CE2-CD1 3.84Å; F232-I237 HydrophobicContact CE2-CG1 4.46Å; F232-I237 HydrophobicContact CE2-CG2 3.59Å; F232-I237 HydrophobicContact CG-CD1 4.03Å; F232-I237 HydrophobicContact CZ-CB 4.26Å; F232-I237 HydrophobicContact CZ-CD1 3.77Å; F232-I237 HydrophobicContact CZ-CG2 3.61Å; A235-I237 PolarHBondContact O-N 2.75Å; I237-L239 HydrophobicContact CD1-CD1 3.72Å; I237-L239 HydrophobicContact CG1-CD1 3.65Å; I237-L239 HydrophobicContact CG2-CD1 4.33Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.51Å; I237-V285 HydrophobicContact CD1-CG1 4.08Å; I237-V285 HydrophobicContact CG1-CG1 4.36Å; I237-Q286 WeakPolarHBondContact CG1-O 3.4Å; I237-H287 HydrophobicContact CD1-CB 4.1Å; I237-H287 HydrophobicContact CG1-CB 3.98Å
238	T	97	Very high	96.2	Very high	58 Å²	58	44.8 Å²	44.8	36%	0.356	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	121.9	173.5	-62.9	0	0	0	0	110.2	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 4Å; T238-V285 WeakPolarHBondContact O-CA 3.39Å; T238-Q286 PolarHBondContact N-O 2.83Å; T238-Q286 PolarHBondContact O-N 2.99Å
239	L	97.6	Very high	95.7	Very high	6 Å²	6	47.2 Å²	47.2	3%	0.031	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	121.2	168.7	-90.8	62.8	0	0	0	108	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.01Å; A229-L239 HydrophobicContact CB-CD2 4.27Å; I237-L239 HydrophobicContact CD1-CD1 3.72Å; I237-L239 HydrophobicContact CG1-CD1 3.65Å; I237-L239 HydrophobicContact CG2-CD1 4.33Å; L239-L254 HydrophobicContact CB-CD1 4.08Å; L239-K267 HydrophobicContact CD1-CD 4.36Å; L239-K267 HydrophobicContact CD2-CB 4.37Å; L239-K267 HydrophobicContact CD2-CG 4.43Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; L239-H284 WeakPolarHBondContact CA-O 3.46Å; L239-V285 HydrophobicContact CD1-CG1 3.99Å; L239-V285 HydrophobicContact CD1-CG2 4.34Å; L239-V285 HydrophobicContact CG-CG2 4.24Å
240	T	97.3	Very high	95.1	Very high	39 Å²	39	56.4 Å²	56.4	24%	0.239	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130	149.1	174	55.1	0	0	0	0	111.5	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.48Å; T240-H284 PolarHBondContact N-O 3.33Å; T240-H284 PolarHBondContact O-N 3.1Å
241	W	97.9	Very high	94.5	Very high	2 Å²	2	59.1 Å²	59.1	1%	0.008	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	136.5	167.8	-82.8	107.7	0	0	0	110	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.83Å; V213-W241 HydrophobicContact CG1-CZ2 4.25Å; V213-W241 HydrophobicContact CG2-CH2 4.25Å; L225-W241 HydrophobicContact CB-CH2 3.69Å; L225-W241 HydrophobicContact CB-CZ2 3.73Å; L225-W241 HydrophobicContact CD1-CH2 3.94Å; L225-W241 HydrophobicContact CD1-CZ3 4.14Å; L225-W241 HydrophobicContact CG-CH2 4.47Å; C227-W241 HydrophobicContact CB-CH2 4.42Å; C227-W241 HydrophobicContact CB-CZ2 3.61Å; W241-Q248 HydrophobicContact CB-CB 4.31Å; W241-Q248 PolarHBondContact O-N 3.27Å; W241-A269 PolarHBondContact NE1-O 3.39Å; W241-V271 HydrophobicContact CB-CG1 4.31Å; W241-V271 HydrophobicContact CD2-CG1 3.57Å; W241-V271 HydrophobicContact CE3-CG1 4.05Å; W241-V271 HydrophobicContact CG-CB 4.14Å; W241-V271 HydrophobicContact CG-CG1 3.7Å; W241-V271 HydrophobicContact CZ2-CG1 4.28Å; W241-T282 WeakPolarHBondContact CA-O 3.42Å; W241-C283 HydrophobicContact CD2-CB 4.08Å; W241-C283 HydrophobicContact CE3-CB 3.98Å; W241-C283 HydrophobicContact CH2-CB 3.96Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 3.92Å
242	Q	97.5	Very high	94.4	Very high	41 Å²	41	59.8 Å²	59.8	19%	0.192	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	149	170.3	-72	-175.2	-6.7	0	0	110.6	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.6Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.36Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.49Å; Q242-D247 PolarHBondContact NE2-OD1 3.09Å; Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.18Å; Q242-T282 PolarHBondContact N-O 2.73Å; Q242-T282 PolarHBondContact O-N 2.79Å; Q242-H284 PolarHBondContact OE1-NE2 3.01Å
243	R	96.9	Very high	94.3	Very high	70 Å²	70	65 Å²	65	26%	0.264	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	116.2	168.8	-174.2	-172.3	-171.6	178.4	2.9	108	G245 E246 Q248 E277 R280 Y281	R243-G245 PolarHBondContact O-N 3.08Å; R243-E246 PolarHBondContact N-O 2.98Å; R243-E246 PolarHBondContact O-N 3.25Å; R243-Q248 VanDerWaalsContact CB-CD 3.49Å; R243-Q248 HydrophobicContact CB-CG 3.93Å; R243-E277 IonicContact CZ-OE2 3.67Å; R243-E277 IonicContact NE-OE2 3.69Å; R243-E277 IonicContact NH2-OE1 2.77Å; R243-E277 PolarHBondContact NH2-OE1 2.03Å; R243-E277 IonicContact NH2-OE2 3.76Å; R243-E277 PolarHBondContact NH2-OE2 2.82Å; R243-R280 WeakPolarHBondContact CA-O 3.42Å; R243-R280 HydrophobicContact CG-CB 4.32Å; R243-Y281 HydrophobicContact CB-CD1 4.01Å; R243-Y281 HydrophobicContact CB-CE1 3.83Å; R243-Y281 WeakPolarHBondContact CD-OH 3.22Å; R243-Y281 HydrophobicContact CG-CD1 4.28Å; R243-Y281 HydrophobicContact CG-CE1 3.89Å; R243-Y281 HydrophobicContact CG-CE2 4.12Å; R243-Y281 PolarHBondContact NE-OH 3.26Å
244	D	94.4	Very high	94.4	Very high	104 Å²	104	69.1 Å²	69.1	56%	0.556	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.2	16.8	-174.5	-53.4	-54.6	0	0	0	115.7	R280	D244-R280 PolarHBondContact N-O 3Å; D244-R280 WeakPolarHBondContact OD1-CB 3.35Å; D244-R280 IonicContact OD1-NE 3.53Å; D244-R280 IonicContact OD2-CZ 3.36Å; D244-R280 IonicContact OD2-NE 2.74Å; D244-R280 PolarHBondContact OD2-NE 2.92Å; D244-R280 IonicContact OD2-NH2 3.12Å; D244-R280 PolarHBondContact OD2-NH2 3.01Å
245	G	90.9	Very high	94.4	Very high	47 Å²	47	70 Å²	70	49%	0.485	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	107.9	-4.1	-176.7	0	0	0	0	0	115.6	R243	R243-G245 PolarHBondContact O-N 3.08Å
246	E	95.1	Very high	94.5	Very high	147 Å²	147	77.6 Å²	77.6	69%	0.687	40%	0.403	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	127	176.9	-61.6	-173	161.7	0	0	111.5	Q242 R243 Q248	Q242-E246 CarbonylContact C-O 3.6Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.36Å; R243-E246 PolarHBondContact N-O 2.98Å; R243-E246 PolarHBondContact O-N 3.25Å; E246-Q248 PolarHBondContact O-N 2.69Å; E246-Q248 PolarHBondContact O-NE2 2.69Å
247	D	94.8	Very high	94.6	Very high	94 Å²	94	73 Å²	73	50%	0.503	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129.1	-178.5	-67.7	-42.9	0	0	0	112.6	Q242 T249	Q242-D247 WeakPolarHBondContact CG-OD1 3.49Å; Q242-D247 PolarHBondContact NE2-OD1 3.09Å; D247-T249 PolarHBondContact O-N 2.91Å
248	Q	94.2	Very high	94.6	Very high	26 Å²	26	77.3 Å²	77.3	12%	0.121	40%	0.4	C	S	.	.			trans	-97.6	38.7	-175.7	-53.7	-63.3	-89.4	0	0	112.1	W241 R243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.31Å; W241-Q248 PolarHBondContact O-N 3.27Å; R243-Q248 VanDerWaalsContact CB-CD 3.49Å; R243-Q248 HydrophobicContact CB-CG 3.93Å; E246-Q248 PolarHBondContact O-N 2.69Å; E246-Q248 PolarHBondContact O-NE2 2.69Å; Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.19Å; Q248-D251 PolarHBondContact O-N 3.1Å; Q248-T252 WeakPolarHBondContact O-CB 3.32Å; Q248-T252 PolarHBondContact O-N 3.45Å; Q248-T252 VanDerWaalsContact O-N 3.16Å; Q248-T252 PolarHBondContact O-OG1 2.83Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å
249	T	87.4	Confident	94.6	Very high	106 Å²	106	78.7 Å²	78.7	65%	0.65	41%	0.411	S	S	*	.			trans	-63.2	-28.1	-165.1	-48	0	0	0	0	114.7	D247	D247-T249 PolarHBondContact O-N 2.91Å
250	Q	87	Confident	94.6	Very high	192 Å²	192	80.9 Å²	80.9	90%	0.897	43%	0.429	S	S	*	.	S	Bend	trans	-81.5	-32.6	178.7	-63.1	-172.5	15.9	0	0	112.5	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.31Å; Q248-Q250 PolarHBondContact O-N 3.19Å; Q250-T252 VanDerWaalsContact C-N 3.34Å
251	D	85.4	Confident	94.3	Very high	114 Å²	114	82.6 Å²	82.6	61%	0.61	46%	0.455	S	S	*	.	S	Bend	trans	-92.7	4.9	-177.9	-49.6	-78.5	0	0	0	112.8	Q248	Q248-D251 PolarHBondContact O-N 3.1Å
252	T	93.6	Very high	94.1	Very high	25 Å²	25	88 Å²	88	15%	0.153	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	116.2	-179.8	-64	0	0	0	0	112	Q248 Q250 L254 A269 A270	Q248-T252 WeakPolarHBondContact O-CB 3.32Å; Q248-T252 PolarHBondContact O-N 3.45Å; Q248-T252 VanDerWaalsContact O-N 3.16Å; Q248-T252 PolarHBondContact O-OG1 2.83Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; T252-L254 HydrophobicContact CG2-CB 4.29Å; T252-L254 PolarHBondContact O-N 3.43Å; T252-L254 VanDerWaalsContact O-N 3.13Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; T252-A270 CarbonylContact C-O 3.53Å; T252-A270 VanDerWaalsContact CA-O 3.3Å; T252-A270 WeakPolarHBondContact CA-O 3.35Å
253	E	96.2	Very high	93.8	Very high	111 Å²	111	87.9 Å²	87.9	52%	0.519	49%	0.494	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	96.4	163.6	-175.8	-171.2	-154.5	0	0	109.2	R226 W268 A269 A270	R226-E253 IonicContact NH2-OE2 3.43Å; R226-E253 PolarHBondContact NH2-OE2 3Å; E253-W268 HydrophobicContact CB-CZ3 4.31Å; E253-W268 HydrophobicContact CG-CH2 3.96Å; E253-W268 HydrophobicContact CG-CZ3 3.77Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.45Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.21Å; E253-A269 CarbonylContact O-C 3.58Å; E253-A269 WeakPolarHBondContact O-CA 3.48Å; E253-A270 HydrophobicContact CB-CB 4.31Å; E253-A270 PolarHBondContact N-O 3.07Å; E253-A270 PolarHBondContact O-N 2.9Å
254	L	96.4	Very high	93.7	Very high	90 Å²	90	84.9 Å²	84.9	47%	0.471	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	119.7	176.9	-175.3	69.8	0	0	0	110.5	L239 T252 A269	L239-L254 HydrophobicContact CB-CD1 4.08Å; T252-L254 HydrophobicContact CG2-CB 4.29Å; T252-L254 PolarHBondContact O-N 3.43Å; T252-L254 VanDerWaalsContact O-N 3.13Å; L254-A269 HydrophobicContact CD1-CB 3.72Å
255	V	96.4	Very high	93.9	Very high	33 Å²	33	81.2 Å²	81.2	20%	0.2	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-84.7	153.6	175.5	-63.7	0	0	0	0	112.8	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 WeakPolarHBondContact O-CE 3.39Å; V255-K267 WeakPolarHBondContact O-CG 3.31Å; V255-K267 PolarHBondContact O-NZ 3.19Å; V255-W268 HydrophobicContact CG1-CD2 4.05Å; V255-W268 HydrophobicContact CG1-CE3 4.3Å; V255-W268 HydrophobicContact CG1-CH2 3.74Å; V255-W268 HydrophobicContact CG1-CZ2 3.42Å; V255-W268 VanDerWaalsContact CG1-CZ2 3.42Å; V255-W268 HydrophobicContact CG1-CZ3 4.15Å; V255-W268 HydrophobicContact CG2-CD2 3.85Å; V255-W268 HydrophobicContact CG2-CG 3.81Å; V255-W268 WeakPolarHBondContact CG2-O 3.43Å; V255-W268 PolarHBondContact N-O 2.81Å
256	E	96.4	Very high	94.2	Very high	174 Å²	174	81 Å²	81	81%	0.813	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-54.8	148.5	165.8	-66.5	-175.2	164	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.18Å
257	T	97.6	Very high	94.4	Very high	46 Å²	46	75 Å²	75	28%	0.282	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-71.7	127.3	175	-54.6	0	0	0	0	108.6	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.02Å; F232-T257 HydrophobicContact CZ-CG2 3.9Å; A235-T257 HydrophobicContact CB-CG2 4.27Å; A235-T257 WeakPolarHBondContact O-CG2 3.34Å; T257-F265 HydrophobicContact CG2-CB 3.87Å; T257-F265 HydrophobicContact CG2-CD1 4.05Å; T257-F265 HydrophobicContact CG2-CG 4.24Å; T257-K267 WeakPolarHBondContact OG1-CD 3.5Å; T257-K267 PolarHBondContact OG1-NZ 3.25Å
258	R	97	Very high	94.6	Very high	98 Å²	98	71.7 Å²	71.7	37%	0.37	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.2	-175.1	70.7	-164.6	-175.7	-170.6	3.4	111.1	E256 Q266	E256-R258 PolarHBondContact O-N 3.18Å; R258-Q266 HydrophobicContact CG-CG 3.67Å; R258-Q266 PolarHBondContact N-O 3.24Å; R258-Q266 VanDerWaalsContact NE-CD 3.26Å; R258-Q266 VanDerWaalsContact O-CG 3.25Å; R258-Q266 WeakPolarHBondContact O-CG 3.47Å; R258-Q266 PolarHBondContact O-N 3.11Å
259	P	97	Very high	94.8	Very high	88 Å²	88	70.4 Å²	70.4	57%	0.571	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	154.5	177.2	27.7	-34.7	0	0	0	111.8	F265 Q266	P259-F265 HydrophobicContact CB-CD1 4.4Å; P259-F265 HydrophobicContact CB-CE1 4.15Å; P259-Q266 PolarHBondContact O-NE2 3.38Å
260	A	96.3	Very high	95.2	Very high	51 Å²	51	65.5 Å²	65.5	42%	0.421	37%	0.365	S	S	.	.			trans	-93.5	-19.7	169.1	0	0	0	0	0	112.8	D262 T264 Q266	A260-D262 WeakPolarHBondContact CB-OD1 3.29Å; A260-T264 WeakPolarHBondContact CB-O 3.35Å; A260-T264 PolarHBondContact N-O 3.05Å; A260-Q266 HydrophobicContact CB-CG 4.45Å
261	G	92.7	Very high	95.7	Very high	75 Å²	75	56.5 Å²	56.5	77%	0.773	32%	0.323	S	S	*	.	S	Bend	trans	98.3	-8.9	178.2	0	0	0	0	0	115
262	D	92.2	Very high	96.3	Very high	115 Å²	115	54.7 Å²	54.7	62%	0.615	32%	0.316	S	S	*	.	S	Bend	trans	-98	6.5	174.7	59	2.9	0	0	0	113.3	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.29Å; D262-T264 WeakPolarHBondContact OD1-CB 3.27Å; D262-T264 PolarHBondContact OD1-N 3.07Å; D262-T264 PolarHBondContact OD1-OG1 3.17Å; D262-T264 PolarHBondContact OD2-OG1 3.18Å
263	G	91	Very high	96.4	Very high	39 Å²	39	53.5 Å²	53.5	40%	0.402	31%	0.309	S	S	.	.	S	Bend	trans	89.4	6.9	-171.8	0	0	0	0	0	114.3	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.38Å
264	T	96.3	Very high	96.4	Very high	8 Å²	8	50.5 Å²	50.5	5%	0.049	30%	0.299	C	S	.	.			trans	-110.8	172.5	171.2	74.7	0	0	0	0	112	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.35Å; F232-T264 CarbonylContact O-C 3.56Å; F232-T264 WeakPolarHBondContact O-CA 3.28Å; F232-T264 WeakPolarHBondContact O-CB 3.46Å; A260-T264 WeakPolarHBondContact CB-O 3.35Å; A260-T264 PolarHBondContact N-O 3.05Å; D262-T264 WeakPolarHBondContact OD1-CB 3.27Å; D262-T264 PolarHBondContact OD1-N 3.07Å; D262-T264 PolarHBondContact OD1-OG1 3.17Å; D262-T264 PolarHBondContact OD2-OG1 3.18Å
265	F	97.9	Very high	96.2	Very high	27 Å²	27	49 Å²	49	12%	0.118	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	164	-175.6	-66.1	-83.5	0	0	0	112.8	D54 G231 F232 Y233 A235 T257 P259	D54-F265 HydrophobicContact CB-CE2 3.69Å; D54-F265 HydrophobicContact CB-CZ 3.71Å; G231-F265 PolarHBondContact N-O 3.15Å; F232-F265 VanDerWaalsContact CD1-O 3.31Å; F232-F265 WeakPolarHBondContact CD1-O 3.38Å; F232-F265 HydrophobicContact CD2-CB 3.86Å; F232-F265 HydrophobicContact CE1-CB 4.37Å; F232-F265 WeakPolarHBondContact CE1-O 3.24Å; F232-F265 HydrophobicContact CE2-CB 3.45Å; F232-F265 VanDerWaalsContact CE2-CB 3.45Å; F232-F265 HydrophobicContact CG-CB 4.45Å; F232-F265 HydrophobicContact CZ-CB 3.72Å; F232-F265 PolarHBondContact N-O 3.1Å; F232-F265 PolarHBondContact O-N 3.04Å; Y233-F265 HydrophobicContact CD2-CD2 4.47Å; Y233-F265 HydrophobicContact CD2-CE2 4.08Å; A235-F265 HydrophobicContact CB-CD1 3.77Å; A235-F265 HydrophobicContact CB-CD2 3.69Å; A235-F265 HydrophobicContact CB-CE1 3.85Å; A235-F265 HydrophobicContact CB-CE2 3.78Å; A235-F265 HydrophobicContact CB-CG 3.71Å; A235-F265 HydrophobicContact CB-CZ 3.87Å; T257-F265 HydrophobicContact CG2-CB 3.87Å; T257-F265 HydrophobicContact CG2-CD1 4.05Å; T257-F265 HydrophobicContact CG2-CG 4.24Å; P259-F265 HydrophobicContact CB-CD1 4.4Å; P259-F265 HydrophobicContact CB-CE1 4.15Å
266	Q	98.1	Very high	95.9	Very high	41 Å²	41	50.5 Å²	50.5	19%	0.192	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	142.9	178.3	38.6	161.7	-25.1	0	0	110	A229 L230 R258 P259 A260	A229-Q266 WeakPolarHBondContact O-CA 3.46Å; L230-Q266 HydrophobicContact CD2-CB 3.62Å; R258-Q266 HydrophobicContact CG-CG 3.67Å; R258-Q266 PolarHBondContact N-O 3.24Å; R258-Q266 VanDerWaalsContact NE-CD 3.26Å; R258-Q266 VanDerWaalsContact O-CG 3.25Å; R258-Q266 WeakPolarHBondContact O-CG 3.47Å; R258-Q266 PolarHBondContact O-N 3.11Å; P259-Q266 PolarHBondContact O-NE2 3.38Å; A260-Q266 HydrophobicContact CB-CG 4.45Å
267	K	98.5	Very high	95.8	Very high	21 Å²	21	44.7 Å²	44.7	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	157.7	177.3	-161.4	-176.2	-169.4	66.2	0	109.1	A229 F232 I237 L239 V255 T257	A229-K267 PolarHBondContact N-O 2.81Å; A229-K267 PolarHBondContact O-N 2.87Å; F232-K267 HydrophobicContact CE1-CB 4.43Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; I237-K267 HydrophobicContact CG2-CB 4.25Å; I237-K267 HydrophobicContact CG2-CD 3.51Å; L239-K267 HydrophobicContact CD1-CD 4.36Å; L239-K267 HydrophobicContact CD2-CB 4.37Å; L239-K267 HydrophobicContact CD2-CG 4.43Å; V255-K267 HydrophobicContact CG2-CG 4.44Å; V255-K267 WeakPolarHBondContact O-CE 3.39Å; V255-K267 WeakPolarHBondContact O-CG 3.31Å; V255-K267 PolarHBondContact O-NZ 3.19Å; T257-K267 WeakPolarHBondContact OG1-CD 3.5Å; T257-K267 PolarHBondContact OG1-NZ 3.25Å
268	W	98.2	Very high	95.6	Very high	25 Å²	25	43.3 Å²	43.3	10%	0.095	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147	157.8	168.4	56.3	-96.7	0	0	0	111.7	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.05Å; R226-W268 HydrophobicContact CG-CD2 4.02Å; R226-W268 HydrophobicContact CG-CE3 3.76Å; R226-W268 HydrophobicContact CG-CG 4.2Å; R226-W268 HydrophobicContact CG-CZ3 4.48Å; R226-W268 VanDerWaalsContact NE-CE3 3.29Å; C227-W268 CarbonylContact O-C 3.57Å; C227-W268 WeakPolarHBondContact O-CA 3.21Å; C227-W268 WeakPolarHBondContact O-CB 3.38Å; W228-W268 HydrophobicContact CD2-CB 3.98Å; W228-W268 HydrophobicContact CD2-CG 4.38Å; W228-W268 HydrophobicContact CE3-CB 3.95Å; W228-W268 AromaticContact CE3-CD1 3.72Å; W228-W268 HydrophobicContact CE3-CG 4.12Å; W228-W268 HydrophobicContact CG-CB 4.32Å; W228-W268 AromaticContact CH2-CD1 3.72Å; W228-W268 HydrophobicContact CH2-CG 4.37Å; W228-W268 AromaticContact CH2-NE1 3.98Å; W228-W268 HydrophobicContact CZ3-CB 4.45Å; W228-W268 AromaticContact CZ3-CD1 3.37Å; W228-W268 HydrophobicContact CZ3-CG 4.12Å; E253-W268 HydrophobicContact CB-CZ3 4.31Å; E253-W268 HydrophobicContact CG-CH2 3.96Å; E253-W268 HydrophobicContact CG-CZ3 3.77Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.45Å; E253-W268 WeakPolarHBondContact OE2-CZ3 3.21Å; V255-W268 HydrophobicContact CG1-CD2 4.05Å; V255-W268 HydrophobicContact CG1-CE3 4.3Å; V255-W268 HydrophobicContact CG1-CH2 3.74Å; V255-W268 HydrophobicContact CG1-CZ2 3.42Å; V255-W268 VanDerWaalsContact CG1-CZ2 3.42Å; V255-W268 HydrophobicContact CG1-CZ3 4.15Å; V255-W268 HydrophobicContact CG2-CD2 3.85Å; V255-W268 HydrophobicContact CG2-CG 3.81Å; V255-W268 WeakPolarHBondContact CG2-O 3.43Å; V255-W268 PolarHBondContact N-O 2.81Å; W268-A270 HydrophobicContact CE3-CB 3.95Å; W268-A270 HydrophobicContact CZ3-CB 3.68Å
269	A	98.2	Very high	95.5	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	129.7	173.2	0	0	0	0	0	108.2	C227 L239 W241 T252 E253 L254	C227-A269 PolarHBondContact N-O 2.98Å; C227-A269 PolarHBondContact O-N 2.83Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.3Å; W241-A269 PolarHBondContact NE1-O 3.39Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; E253-A269 CarbonylContact O-C 3.58Å; E253-A269 WeakPolarHBondContact O-CA 3.48Å; L254-A269 HydrophobicContact CD1-CB 3.72Å
270	A	97.8	Very high	95.4	Very high	2 Å²	2	43.7 Å²	43.7	2%	0.017	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	146.6	177.3	0	0	0	0	0	112	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.84Å; L225-A270 CarbonylContact O-C 3.48Å; L225-A270 WeakPolarHBondContact O-CA 3.22Å; R226-A270 HydrophobicContact CB-CB 3.97Å; R226-A270 HydrophobicContact CG-CB 4.03Å; T252-A270 CarbonylContact C-O 3.53Å; T252-A270 VanDerWaalsContact CA-O 3.3Å; T252-A270 WeakPolarHBondContact CA-O 3.35Å; E253-A270 HydrophobicContact CB-CB 4.31Å; E253-A270 PolarHBondContact N-O 3.07Å; E253-A270 PolarHBondContact O-N 2.9Å; W268-A270 HydrophobicContact CE3-CB 3.95Å; W268-A270 HydrophobicContact CZ3-CB 3.68Å
271	V	97.6	Very high	95.5	Very high	3 Å²	3	41.5 Å²	41.5	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	141.9	177.1	62.4	0	0	0	0	108.9	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.29Å; L225-V271 HydrophobicContact CB-CG1 4.27Å; L225-V271 PolarHBondContact N-O 3.11Å; L225-V271 PolarHBondContact O-N 2.95Å; W241-V271 HydrophobicContact CB-CG1 4.31Å; W241-V271 HydrophobicContact CD2-CG1 3.57Å; W241-V271 HydrophobicContact CE3-CG1 4.05Å; W241-V271 HydrophobicContact CG-CB 4.14Å; W241-V271 HydrophobicContact CG-CG1 3.7Å; W241-V271 HydrophobicContact CZ2-CG1 4.28Å; V271-V273 HydrophobicContact CG1-CG1 3.86Å; V271-V273 HydrophobicContact CG2-CG1 4.47Å; V271-Y281 HydrophobicContact CG1-CD1 4.23Å; V271-Y281 HydrophobicContact CG2-CE1 4.29Å
272	V	96.9	Very high	95.7	Very high	76 Å²	76	38.4 Å²	38.4	46%	0.461	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	129.8	171.9	-176.9	0	0	0	0	108.2	E222	E222-V272 HydrophobicContact CB-CG1 4.07Å; E222-V272 HydrophobicContact CG-CG1 4.33Å
273	V	96	Very high	96	Very high	1 Å²	1	33 Å²	33	1%	0.006	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	146	-175.8	-50.8	0	0	0	0	110.7	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.27Å; A223-V273 PolarHBondContact N-O 2.67Å; A223-V273 PolarHBondContact O-N 2.99Å; L225-V273 HydrophobicContact CD1-CG1 3.99Å; L225-V273 HydrophobicContact CD1-CG2 4.12Å; L225-V273 HydrophobicContact CG-CG1 4.11Å; L225-V273 HydrophobicContact CG-CG2 3.87Å; V271-V273 HydrophobicContact CG1-CG1 3.86Å; V271-V273 HydrophobicContact CG2-CG1 4.47Å; V273-E278 HydrophobicContact CG2-CG 3.87Å; V273-Y281 HydrophobicContact CB-CD2 3.98Å; V273-Y281 HydrophobicContact CB-CE1 4.49Å; V273-Y281 HydrophobicContact CB-CE2 3.63Å; V273-Y281 HydrophobicContact CG1-CD1 3.75Å; V273-Y281 HydrophobicContact CG1-CD2 3.62Å; V273-Y281 HydrophobicContact CG1-CE1 3.67Å; V273-Y281 HydrophobicContact CG1-CE2 3.56Å; V273-Y281 HydrophobicContact CG1-CG 3.71Å
274	P	95.8	Very high	96.3	Very high	47 Å²	47	32.7 Å²	32.7	31%	0.305	18%	0.181	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	139.7	170.3	-20.2	32.4	0	0	0	111.3	H221 G276 E277	H221-P274 CarbonylContact O-C 3.55Å; H221-P274 WeakPolarHBondContact O-CA 3.32Å; P274-G276 PolarHBondContact O-N 2.91Å; P274-E277 HydrophobicContact CB-CB 4.22Å; P274-E277 HydrophobicContact CB-CG 4.08Å; P274-E277 HydrophobicContact CG-CG 4.44Å; P274-E277 WeakPolarHBondContact O-CB 3.44Å; P274-E277 PolarHBondContact O-N 3.31Å
275	S	91.9	Very high	96.3	Very high	58 Å²	58	32.3 Å²	32.3	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	129.2	177.5	-61.7	0	0	0	0	111.6	H221 E222 E278	H221-S275 PolarHBondContact O-N 3.3Å; E222-S275 PolarHBondContact N-OG 3.1Å; S275-E278 WeakPolarHBondContact CA-OE1 3.49Å
276	G	90.6	Very high	96.3	Very high	65 Å²	65	34.4 Å²	34.4	67%	0.67	19%	0.189	S	C	*	.	T	Hydrogen-bonded Turn	trans	87.7	-7.7	-173.2	0	0	0	0	0	115	P274 E278	P274-G276 PolarHBondContact O-N 2.91Å; G276-E278 VanDerWaalsContact C-OE2 3.22Å; G276-E278 WeakPolarHBondContact CA-OE2 3.1Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.14Å; G276-E278 PolarHBondContact N-OE2 2.97Å; G276-E278 VanDerWaalsContact N-OE2 3.15Å
277	E	94.6	Very high	96.1	Very high	52 Å²	52	32.7 Å²	32.7	24%	0.243	18%	0.181	C	C	.	.			trans	-95.8	-0.5	174.8	-72.4	-156.2	-144.8	0	0	114	R243 P274 Q279 R280 Y281	R243-E277 IonicContact CZ-OE2 3.67Å; R243-E277 IonicContact NE-OE2 3.69Å; R243-E277 IonicContact NH2-OE1 2.77Å; R243-E277 PolarHBondContact NH2-OE1 2.03Å; R243-E277 IonicContact NH2-OE2 3.76Å; R243-E277 PolarHBondContact NH2-OE2 2.82Å; P274-E277 HydrophobicContact CB-CB 4.22Å; P274-E277 HydrophobicContact CB-CG 4.08Å; P274-E277 HydrophobicContact CG-CG 4.44Å; P274-E277 WeakPolarHBondContact O-CB 3.44Å; P274-E277 PolarHBondContact O-N 3.31Å; E277-Q279 PolarHBondContact O-N 3.37Å; E277-R280 VanDerWaalsContact O-CB 3.31Å; E277-R280 WeakPolarHBondContact O-CB 3.01Å; E277-R280 PolarHBondContact O-N 3.19Å; E277-R280 IonicContact OE1-NH1 2.67Å; E277-R280 VanDerWaalsContact OE2-CD 3.22Å; E277-R280 WeakPolarHBondContact OE2-CD 3.01Å; E277-R280 IonicContact OE2-CZ 3.41Å; E277-R280 IonicContact OE2-NE 3.7Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 2.73Å; E277-Y281 HydrophobicContact CB-CE2 4.27Å; E277-Y281 WeakPolarHBondContact O-CD2 3.33Å
278	E	93.9	Very high	95.8	Very high	18 Å²	18	35.3 Å²	35.3	8%	0.084	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-57.6	-28.9	-168.5	-52.2	82.2	-177.1	0	0	113.2	L225 V273 S275 G276 R280 Y281 W298	L225-E278 HydrophobicContact CD1-CB 4.13Å; L225-E278 HydrophobicContact CD2-CB 4.41Å; L225-E278 HydrophobicContact CD2-CG 4.33Å; V273-E278 HydrophobicContact CG2-CG 3.87Å; S275-E278 WeakPolarHBondContact CA-OE1 3.49Å; G276-E278 VanDerWaalsContact C-OE2 3.22Å; G276-E278 WeakPolarHBondContact CA-OE2 3.1Å; G276-E278 VanDerWaalsContact N-CD 3.28Å; G276-E278 PolarHBondContact N-OE1 3.14Å; G276-E278 PolarHBondContact N-OE2 2.97Å; G276-E278 VanDerWaalsContact N-OE2 3.15Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 3.1Å; E278-Y281 PolarHBondContact O-N 3.43Å; E278-W298 HydrophobicContact CB-CD2 4.38Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.69Å; E278-W298 HydrophobicContact CG-CE3 3.68Å; E278-W298 HydrophobicContact CG-CH2 4.47Å; E278-W298 HydrophobicContact CG-CZ3 3.58Å
279	Q	94.3	Very high	95.4	Very high	95 Å²	95	34.7 Å²	34.7	44%	0.444	20%	0.195	S	C	.	.	G	3₁₀ helix	trans	-72.3	-14.1	178.6	-62.6	-55.5	-44.5	0	0	114.4	E277 Y281 R297 W298	E277-Q279 PolarHBondContact O-N 3.37Å; Q279-Y281 VanDerWaalsContact C-N 3.3Å; Q279-R297 PolarHBondContact O-NH1 2.96Å; Q279-W298 PolarHBondContact NE2-O 3.45Å
280	R	95.6	Very high	95.2	Very high	98 Å²	98	35.1 Å²	35.1	37%	0.37	20%	0.197	S	C	.	.	G	3₁₀ helix	trans	-77.7	-18.5	172.3	-61.5	174.4	70.2	173.3	5.6	112.3	R243 D244 E277 E278	R243-R280 WeakPolarHBondContact CA-O 3.42Å; R243-R280 HydrophobicContact CG-CB 4.32Å; D244-R280 PolarHBondContact N-O 3Å; D244-R280 WeakPolarHBondContact OD1-CB 3.35Å; D244-R280 IonicContact OD1-NE 3.53Å; D244-R280 IonicContact OD2-CZ 3.36Å; D244-R280 IonicContact OD2-NE 2.74Å; D244-R280 PolarHBondContact OD2-NE 2.92Å; D244-R280 IonicContact OD2-NH2 3.12Å; D244-R280 PolarHBondContact OD2-NH2 3.01Å; E277-R280 VanDerWaalsContact O-CB 3.31Å; E277-R280 WeakPolarHBondContact O-CB 3.01Å; E277-R280 PolarHBondContact O-N 3.19Å; E277-R280 IonicContact OE1-NH1 2.67Å; E277-R280 VanDerWaalsContact OE2-CD 3.22Å; E277-R280 WeakPolarHBondContact OE2-CD 3.01Å; E277-R280 IonicContact OE2-CZ 3.41Å; E277-R280 IonicContact OE2-NE 3.7Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 2.73Å; E278-R280 VanDerWaalsContact C-N 3.26Å; E278-R280 PolarHBondContact O-N 3.1Å
281	Y	96.8	Very high	94.9	Very high	6 Å²	6	40.8 Å²	40.8	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.6	-174.5	-66.8	-97.2	0	0	0	111.7	Q242 R243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.53Å; Q242-Y281 VanDerWaalsContact O-CA 3.26Å; Q242-Y281 WeakPolarHBondContact O-CA 3.18Å; R243-Y281 HydrophobicContact CB-CD1 4.01Å; R243-Y281 HydrophobicContact CB-CE1 3.83Å; R243-Y281 WeakPolarHBondContact CD-OH 3.22Å; R243-Y281 HydrophobicContact CG-CD1 4.28Å; R243-Y281 HydrophobicContact CG-CE1 3.89Å; R243-Y281 HydrophobicContact CG-CE2 4.12Å; R243-Y281 PolarHBondContact NE-OH 3.26Å; Q248-Y281 HydrophobicContact CG-CE1 4.37Å; V271-Y281 HydrophobicContact CG1-CD1 4.23Å; V271-Y281 HydrophobicContact CG2-CE1 4.29Å; V273-Y281 HydrophobicContact CB-CD2 3.98Å; V273-Y281 HydrophobicContact CB-CE1 4.49Å; V273-Y281 HydrophobicContact CB-CE2 3.63Å; V273-Y281 HydrophobicContact CG1-CD1 3.75Å; V273-Y281 HydrophobicContact CG1-CD2 3.62Å; V273-Y281 HydrophobicContact CG1-CE1 3.67Å; V273-Y281 HydrophobicContact CG1-CE2 3.56Å; V273-Y281 HydrophobicContact CG1-CG 3.71Å; E277-Y281 HydrophobicContact CB-CE2 4.27Å; E277-Y281 WeakPolarHBondContact O-CD2 3.33Å; E278-Y281 PolarHBondContact O-N 3.43Å; Q279-Y281 VanDerWaalsContact C-N 3.3Å
282	T	97.5	Very high	94.6	Very high	10 Å²	10	47.9 Å²	47.9	6%	0.061	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.3	174.1	40.9	0	0	0	0	111.1	W241 Q242 H284 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.42Å; Q242-T282 PolarHBondContact N-O 2.73Å; Q242-T282 PolarHBondContact O-N 2.79Å; T282-H284 WeakPolarHBondContact CB-NE2 3.46Å; T282-H284 PolarHBondContact OG1-NE2 3.05Å; T282-T295 HydrophobicContact CG2-CG2 3.71Å; T282-L296 CarbonylContact C-O 3.55Å; T282-L296 WeakPolarHBondContact CA-O 3.36Å; T282-R297 HydrophobicContact CG2-CG 3.64Å; T282-R297 VanDerWaalsContact CG2-NE 3.26Å
283	C	97.8	Very high	94.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	130.1	165.6	172.8	0	0	0	0	109.1	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.46Å; C227-C283 VanDerWaalsContact CB-CB 3.46Å; C227-C283 WeakPolarHBondContact CB-SG 3.45Å; C227-C283 WeakPolarHBondContact SG-CB 3.2Å; C227-C283 CovalentContact SG-SG 2.02Å; C227-C283 PolarHBondContact SG-SG 2.91Å; T240-C283 CarbonylContact O-C 3.55Å; T240-C283 WeakPolarHBondContact O-CA 3.48Å; W241-C283 HydrophobicContact CD2-CB 4.08Å; W241-C283 HydrophobicContact CE3-CB 3.98Å; W241-C283 HydrophobicContact CH2-CB 3.96Å; W241-C283 HydrophobicContact CZ2-CB 4.06Å; W241-C283 HydrophobicContact CZ3-CB 3.92Å; C283-T295 CarbonylContact O-C 3.56Å; C283-T295 WeakPolarHBondContact O-CA 3.5Å; C283-L296 HydrophobicContact CB-CB 4.26Å; C283-L296 PolarHBondContact N-O 3.42Å; C283-L296 PolarHBondContact O-N 3.28Å
284	H	97.4	Very high	94.5	Very high	33 Å²	33	50.1 Å²	50.1	15%	0.153	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.2	174.8	-60.8	-93.7	0	0	0	109.8	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.46Å; T240-H284 PolarHBondContact N-O 3.33Å; T240-H284 PolarHBondContact O-N 3.1Å; Q242-H284 PolarHBondContact OE1-NE2 3.01Å; T282-H284 WeakPolarHBondContact CB-NE2 3.46Å; T282-H284 PolarHBondContact OG1-NE2 3.05Å; H284-L294 CarbonylContact C-O 3.48Å; H284-L294 WeakPolarHBondContact CA-O 3.44Å; H284-T295 VanDerWaalsContact CE1-CG2 3.41Å; H284-T295 WeakPolarHBondContact CE1-CG2 3.27Å; H284-T295 PolarHBondContact CE1-OG1 3.35Å; H284-T295 PolarHBondContact ND1-OG1 3.08Å; H284-T295 VanDerWaalsContact ND1-OG1 3.09Å
285	V	97.6	Very high	94.5	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	121.7	-177.6	-175.6	0	0	0	0	110	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.94Å; T211-V285 HydrophobicContact CG2-CB 4.41Å; T211-V285 HydrophobicContact CG2-CG1 4.13Å; T211-V285 HydrophobicContact CG2-CG2 4.07Å; I237-V285 HydrophobicContact CD1-CG1 4.08Å; I237-V285 HydrophobicContact CG1-CG1 4.36Å; T238-V285 WeakPolarHBondContact O-CA 3.39Å; L239-V285 HydrophobicContact CD1-CG1 3.99Å; L239-V285 HydrophobicContact CD1-CG2 4.34Å; L239-V285 HydrophobicContact CG-CG2 4.24Å; V285-L290 HydrophobicContact CG1-CD1 4.14Å; V285-P293 WeakPolarHBondContact O-CA 3.5Å; V285-L294 HydrophobicContact CB-CB 4.37Å; V285-L294 PolarHBondContact N-O 3.2Å; V285-L294 PolarHBondContact O-N 2.87Å; V285-L296 HydrophobicContact CG2-CD1 3.92Å
286	Q	96.7	Very high	94.7	Very high	72 Å²	72	50.8 Å²	50.8	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	128.3	175	-52.1	177.3	10.7	0	0	109	I237 T238 P293	I237-Q286 WeakPolarHBondContact CG1-O 3.4Å; T238-Q286 PolarHBondContact N-O 2.83Å; T238-Q286 PolarHBondContact O-N 2.99Å; Q286-P293 HydrophobicContact CG-CB 4.03Å; Q286-P293 HydrophobicContact CG-CG 4.13Å
287	H	95.1	Very high	94.9	Very high	4 Å²	4	54.6 Å²	54.6	2%	0.019	27%	0.273	C	S	.	.			trans	-159.2	138.5	-174.5	178.9	-98	0	0	0	109.6	W23 E207 P209 F232 Y233 P234 E236 I237 G289 L290	W23-H287 WeakPolarHBondContact CH2-O 3.41Å; W23-H287 WeakPolarHBondContact CZ3-O 3.47Å; E207-H287 PolarHBondContact O-CE1 3.1Å; P209-H287 HydrophobicContact CG-CB 4.04Å; F232-H287 AromaticContact CD2-CD2 3.79Å; F232-H287 AromaticContact CD2-NE2 3.7Å; Y233-H287 PolarHBondContact O-CE1 3.46Å; P234-H287 PolarHBondContact O-NE2 3.17Å; E236-H287 PolarHBondContact O-CD2 2.75Å; E236-H287 VanDerWaalsContact O-CD2 3.27Å; I237-H287 HydrophobicContact CD1-CB 4.1Å; I237-H287 HydrophobicContact CG1-CB 3.98Å; H287-G289 PolarHBondContact ND1-N 3.36Å; H287-G289 VanDerWaalsContact ND1-N 3.11Å; H287-G289 PolarHBondContact O-N 3.25Å; H287-L290 HydrophobicContact CB-CD1 4.03Å; H287-L290 HydrophobicContact CB-CG 4.23Å; H287-L290 WeakPolarHBondContact O-CB 3.36Å; H287-L290 PolarHBondContact O-N 3.21Å
288	E	91.1	Very high	94.8	Very high	76 Å²	76	55.9 Å²	55.9	36%	0.355	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.5	-26.7	-173	-169	-178.7	172	0	0	114.9	W23 C25 P234	W23-E288 VanDerWaalsContact CZ3-CA 3.43Å; W23-E288 VanDerWaalsContact CZ3-O 3.29Å; W23-E288 WeakPolarHBondContact CZ3-O 3.31Å; C25-E288 PolarHBondContact SG-OE1 2.83Å; P234-E288 HydrophobicContact CG-CB 4.37Å; P234-E288 VanDerWaalsContact CG-OE2 3.32Å; P234-E288 WeakPolarHBondContact CG-OE2 3.01Å
289	G	90.8	Very high	94.2	Very high	13 Å²	13	57 Å²	57	13%	0.134	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-35.1	174.6	0	0	0	0	0	113.9	H208 H287	H208-G289 PolarHBondContact CE1-O 2.87Å; H208-G289 PolarHBondContact ND1-O 3.05Å; H287-G289 PolarHBondContact ND1-N 3.36Å; H287-G289 VanDerWaalsContact ND1-N 3.11Å; H287-G289 PolarHBondContact O-N 3.25Å
290	L	93.1	Very high	92.4	Very high	8 Å²	8	58.8 Å²	58.8	4%	0.042	31%	0.312	C	S	.	.			trans	-72.4	123.2	-169	-65.2	172.6	0	0	0	111.8	W23 H208 P209 V285 H287 E292 L294	W23-L290 HydrophobicContact CH2-CB 4.42Å; W23-L290 WeakPolarHBondContact CH2-O 3.48Å; W23-L290 WeakPolarHBondContact CZ3-O 3.27Å; H208-L290 HydrophobicContact CB-CD2 4.09Å; P209-L290 HydrophobicContact CG-CD1 3.9Å; P209-L290 HydrophobicContact CG-CD2 4.3Å; P209-L290 HydrophobicContact CG-CG 4.19Å; V285-L290 HydrophobicContact CG1-CD1 4.14Å; H287-L290 HydrophobicContact CB-CD1 4.03Å; H287-L290 HydrophobicContact CB-CG 4.23Å; H287-L290 WeakPolarHBondContact O-CB 3.36Å; H287-L290 PolarHBondContact O-N 3.21Å; L290-E292 PolarHBondContact O-N 3.41Å; L290-L294 HydrophobicContact CD1-CD1 4.11Å; L290-L294 HydrophobicContact CD1-CG 3.95Å; L290-L294 HydrophobicContact CD2-CD1 3.68Å; L290-L294 HydrophobicContact CD2-CG 3.89Å
291	P	91.4	Very high	90.2	Very high	122 Å²	122	59.2 Å²	59.2	79%	0.792	33%	0.33	S	S	*	.	S	Bend	trans	-66.7	-25.3	179.1	28.4	-35.6	0	0	0	113
292	E	91.9	Very high	87.7	Confident	152 Å²	152	64.5 Å²	64.5	71%	0.71	37%	0.368	S	S	*	.	S	Bend	trans	-143	147.2	171.3	-65.3	-176.9	174.3	0	0	108.7	L290 L294	L290-E292 PolarHBondContact O-N 3.41Å; E292-L294 PolarHBondContact O-N 3.38Å
293	P	94.7	Very high	85.1	Confident	65 Å²	65	71.3 Å²	71.3	42%	0.422	40%	0.399	S	S	.	.			trans	-54.8	132.9	174.7	-29	37.3	0	0	0	113.5	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.5Å; Q286-P293 HydrophobicContact CG-CB 4.03Å; Q286-P293 HydrophobicContact CG-CG 4.13Å
294	L	95.6	Very high	82.3	Confident	59 Å²	59	77 Å²	77	31%	0.309	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	134.7	176.9	-64.5	177.7	0	0	0	110.7	T211 H284 V285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.25Å; H284-L294 CarbonylContact C-O 3.48Å; H284-L294 WeakPolarHBondContact CA-O 3.44Å; V285-L294 HydrophobicContact CB-CB 4.37Å; V285-L294 PolarHBondContact N-O 3.2Å; V285-L294 PolarHBondContact O-N 2.87Å; L290-L294 HydrophobicContact CD1-CD1 4.11Å; L290-L294 HydrophobicContact CD1-CG 3.95Å; L290-L294 HydrophobicContact CD2-CD1 3.68Å; L290-L294 HydrophobicContact CD2-CG 3.89Å; E292-L294 PolarHBondContact O-N 3.38Å
295	T	96.8	Very high	79.8	Confident	84 Å²	84	81.6 Å²	81.6	52%	0.515	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	125.2	169.1	-56.9	0	0	0	0	109.3	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.71Å; C283-T295 CarbonylContact O-C 3.56Å; C283-T295 WeakPolarHBondContact O-CA 3.5Å; H284-T295 VanDerWaalsContact CE1-CG2 3.41Å; H284-T295 WeakPolarHBondContact CE1-CG2 3.27Å; H284-T295 PolarHBondContact CE1-OG1 3.35Å; H284-T295 PolarHBondContact ND1-OG1 3.08Å; H284-T295 VanDerWaalsContact ND1-OG1 3.09Å
296	L	96.1	Very high	77.6	Confident	34 Å²	34	87 Å²	87	18%	0.178	49%	0.494	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	142.3	-170.2	-60.4	159.5	0	0	0	110.2	T211 V213 T282 C283 V285	T211-L296 HydrophobicContact CG2-CD1 4.14Å; V213-L296 HydrophobicContact CG2-CB 3.97Å; T282-L296 CarbonylContact C-O 3.55Å; T282-L296 WeakPolarHBondContact CA-O 3.36Å; C283-L296 HydrophobicContact CB-CB 4.26Å; C283-L296 PolarHBondContact N-O 3.42Å; C283-L296 PolarHBondContact O-N 3.28Å; V285-L296 HydrophobicContact CG2-CD1 3.92Å
297	R	94.9	Very high	75.5	Confident	145 Å²	145	88 Å²	88	55%	0.547	51%	0.507	S	S	.	.			trans	-123.5	160.1	168.4	-65.5	-170.6	-179.2	-163.7	-3.2	109.7	Q279 T282	Q279-R297 PolarHBondContact O-NH1 2.96Å; T282-R297 HydrophobicContact CG2-CG 3.64Å; T282-R297 VanDerWaalsContact CG2-NE 3.26Å
298	W	92.6	Very high	73.8	Confident	80 Å²	80	93.4 Å²	93.4	30%	0.303	54%	0.535	S	S	.	.	S	Bend	trans	-73.1	133.7	166.7	171.7	67	0	0	0	110.6	V213 H215 L225 E278 Q279	V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.85Å; H215-W298 HydrophobicContact CB-CD2 4.15Å; H215-W298 HydrophobicContact CB-CG 4.12Å; H215-W298 HydrophobicContact CB-CZ2 4.03Å; H215-W298 AromaticContact CD2-CE2 3.85Å; H215-W298 AromaticContact CD2-CH2 3.95Å; H215-W298 AromaticContact CD2-CZ2 3.72Å; H215-W298 AromaticContact CG-CE2 3.66Å; H215-W298 AromaticContact CG-CZ2 3.65Å; H215-W298 AromaticContact CG-NE1 3.85Å; H215-W298 AromaticContact ND1-CZ2 3.88Å; H215-W298 AromaticContact NE2-CH2 3.96Å; L225-W298 HydrophobicContact CD1-CB 4.45Å; L225-W298 HydrophobicContact CD2-CB 3.81Å; L225-W298 HydrophobicContact CD2-CD2 4.34Å; L225-W298 HydrophobicContact CD2-CG 3.95Å; E278-W298 HydrophobicContact CB-CD2 4.38Å; E278-W298 HydrophobicContact CB-CE3 3.37Å; E278-W298 HydrophobicContact CB-CZ3 3.69Å; E278-W298 HydrophobicContact CG-CE3 3.68Å; E278-W298 HydrophobicContact CG-CH2 4.47Å; E278-W298 HydrophobicContact CG-CZ3 3.58Å; Q279-W298 PolarHBondContact NE2-O 3.45Å
299	G	80.9	Confident	72.3	Confident	40 Å²	40	95.7 Å²	95.7	41%	0.412	55%	0.553	S	S	.	*	S	Bend	trans	158.1	173.6	-179.6	0	0	0	0	0	111.5	S301	G299-S301 PolarHBondContact O-N 2.93Å
300	P	56.8	Low	71	Confident	133 Å²	133	97.2 Å²	97.2	86%	0.864	57%	0.569	S	S	*	*	S	Bend	trans	-61.3	130.4	170.6	27.3	-33.5	0	0	0	109.4	S302	P300-S302 PolarHBondContact O-N 2.97Å
301	S	49.3	Very low	70	Confident	108 Å²	108	101.2 Å²	101.2	76%	0.755	59%	0.59	S	S	*	*			trans	-66.5	109.9	-172.4	52.3	0	0	0	0	111.5	G299 Q303	G299-S301 PolarHBondContact O-N 2.93Å; S301-Q303 PolarHBondContact O-N 3.06Å
302	S	42.8	Very low	69.1	Low	117 Å²	117	99.7 Å²	99.7	82%	0.818	58%	0.578	S	S	*	*			trans	-72.3	71.9	167.2	59.3	0	0	0	0	110	P300	P300-S302 PolarHBondContact O-N 2.97Å
303	Q	44	Very low	68.2	Low	153 Å²	153	95 Å²	95	72%	0.715	57%	0.565	S	S	*	*			trans	-50.6	134.3	156.4	-74.7	-171.5	-26.6	0	0	107.6	S301 T305	S301-Q303 PolarHBondContact O-N 3.06Å; Q303-T305 PolarHBondContact O-N 2.81Å; Q303-T305 PolarHBondContact O-OG1 2.66Å
304	P	39	Very low	67.4	Low	118 Å²	118	93.6 Å²	93.6	77%	0.766	56%	0.562	S	S	*	*			trans	-63	101.3	180	25.2	-32.9	0	0	0	108.4	I306	P304-I306 PolarHBondContact O-N 3.33Å
305	T	44	Very low	66.8	Low	131 Å²	131	95.9 Å²	95.9	80%	0.804	58%	0.575	S	S	*	*			trans	-70.7	90	177.6	-59.1	0	0	0	0	107	Q303 P307	Q303-T305 PolarHBondContact O-N 2.81Å; Q303-T305 PolarHBondContact O-OG1 2.66Å; T305-P307 VanDerWaalsContact O-N 3.16Å
306	I	52.5	Low	66.1	Low	113 Å²	113	94.5 Å²	94.5	58%	0.579	57%	0.571	S	S	*	*			trans	-48.2	124.6	173.3	-61.6	175.7	0	0	0	106.4	P304 I308 I311	P304-I306 PolarHBondContact O-N 3.33Å; I306-I308 PolarHBondContact O-N 3.42Å; I306-I311 HydrophobicContact CG2-CD1 3.85Å
307	P	51.4	Low	65.5	Low	92 Å²	92	97 Å²	97	60%	0.597	59%	0.588	S	S	*	*			trans	-74.2	78.8	-174.3	29.1	-34.9	0	0	0	109.9	T305 V309 G310 I311	T305-P307 VanDerWaalsContact O-N 3.16Å; P307-V309 PolarHBondContact O-N 3.2Å; P307-V309 VanDerWaalsContact O-N 3.17Å; P307-G310 WeakPolarHBondContact O-CA 3.43Å; P307-G310 PolarHBondContact O-N 3.38Å; P307-I311 PolarHBondContact O-N 2.92Å
308	I	60.1	Low	65	Low	119 Å²	119	95.5 Å²	95.5	61%	0.61	59%	0.59	S	S	*	*	H	α-helix	trans	-53.1	-37.5	177.6	-67.5	163.6	0	0	0	109.9	I306 G310 I311 V312	I306-I308 PolarHBondContact O-N 3.42Å; I308-G310 VanDerWaalsContact C-N 3.31Å; I308-G310 PolarHBondContact O-N 2.67Å; I308-I311 PolarHBondContact O-N 2.77Å; I308-V312 HydrophobicContact CG2-CG2 4.18Å; I308-V312 WeakPolarHBondContact O-CB 2.92Å; I308-V312 WeakPolarHBondContact O-CG2 3.36Å; I308-V312 PolarHBondContact O-N 3.46Å
309	V	59.4	Low	64.6	Low	123 Å²	123	94.4 Å²	94.4	75%	0.745	60%	0.598	S	S	*	*	H	α-helix	trans	-55.6	-42.2	172.6	-178	0	0	0	0	112.2	P307 A313	P307-V309 PolarHBondContact O-N 3.2Å; P307-V309 VanDerWaalsContact O-N 3.17Å; V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.44Å; V309-A313 PolarHBondContact O-N 2.84Å
310	G	64.5	Low	64.7	Low	45 Å²	45	96.7 Å²	96.7	46%	0.464	60%	0.604	S	S	.	*	H	α-helix	trans	-69.5	-39.2	178.1	0	0	0	0	0	112.9	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.43Å; P307-G310 PolarHBondContact O-N 3.38Å; I308-G310 VanDerWaalsContact C-N 3.31Å; I308-G310 PolarHBondContact O-N 2.67Å; G310-G314 PolarHBondContact O-N 2.68Å
311	I	70.7	Confident	66	Low	92 Å²	92	95.3 Å²	95.3	47%	0.472	59%	0.589	S	S	.	*	H	α-helix	trans	-66.5	-46.4	175.8	-62.4	170.3	0	0	0	110.4	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.85Å; P307-I311 PolarHBondContact O-N 2.92Å; I308-I311 PolarHBondContact O-N 2.77Å; I311-G314 PolarHBondContact O-N 2.89Å; I311-L315 HydrophobicContact CG2-CD1 4.03Å; I311-L315 WeakPolarHBondContact O-CG 3.47Å; I311-L315 PolarHBondContact O-N 2.92Å
312	V	73.1	Confident	67.6	Low	90 Å²	90	93.2 Å²	93.2	55%	0.545	58%	0.578	S	S	.	*	H	α-helix	trans	-63	-42.4	177.1	170.8	0	0	0	0	111.3	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.18Å; I308-V312 WeakPolarHBondContact O-CB 2.92Å; I308-V312 WeakPolarHBondContact O-CG2 3.36Å; I308-V312 PolarHBondContact O-N 3.46Å; V312-L315 PolarHBondContact O-N 3.31Å; V312-A316 WeakPolarHBondContact O-CB 3.13Å; V312-A316 PolarHBondContact O-N 3.42Å
313	A	72.9	Confident	69.5	Low	53 Å²	53	92.1 Å²	92.1	44%	0.438	57%	0.566	S	S	.	*	H	α-helix	trans	-63.1	-44.2	175.3	0	0	0	0	0	112.2	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.23Å; V309-A313 WeakPolarHBondContact O-CB 3.44Å; V309-A313 PolarHBondContact O-N 2.84Å; A313-A316 PolarHBondContact O-N 2.87Å; A313-V317 WeakPolarHBondContact O-CG2 3.5Å; A313-V317 PolarHBondContact O-N 3.18Å
314	G	78.3	Confident	71.3	Confident	36 Å²	36	89.6 Å²	89.6	37%	0.371	56%	0.557	S	S	.	*	H	α-helix	trans	-61.4	-44.1	176.8	0	0	0	0	0	112.9	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 2.68Å; I311-G314 PolarHBondContact O-N 2.89Å; G314-V317 PolarHBondContact O-N 3.13Å; G314-L318 WeakPolarHBondContact O-CG 3.46Å; G314-L318 PolarHBondContact O-N 3.41Å
315	L	83.5	Confident	73.2	Confident	108 Å²	108	86 Å²	86	57%	0.565	54%	0.541	S	S	*	.	H	α-helix	trans	-64.9	-39.6	175.7	-71.3	171.5	0	0	0	112.3	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 4.03Å; I311-L315 WeakPolarHBondContact O-CG 3.47Å; I311-L315 PolarHBondContact O-N 2.92Å; V312-L315 PolarHBondContact O-N 3.31Å; L315-L318 PolarHBondContact O-N 3.1Å; L315-A319 WeakPolarHBondContact O-CB 3.18Å; L315-A319 PolarHBondContact O-N 2.97Å
316	A	81.7	Confident	74.9	Confident	54 Å²	54	82.4 Å²	82.4	45%	0.446	53%	0.525	S	S	.	.	H	α-helix	trans	-63.5	-43	175.8	0	0	0	0	0	112.1	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.13Å; V312-A316 PolarHBondContact O-N 3.42Å; A313-A316 PolarHBondContact O-N 2.87Å; A316-A319 PolarHBondContact O-N 3.18Å; A316-V320 WeakPolarHBondContact O-CG2 3.31Å; A316-V320 PolarHBondContact O-N 3.23Å
317	V	83.6	Confident	76.2	Confident	88 Å²	88	80.9 Å²	80.9	53%	0.533	52%	0.52	S	S	.	.	H	α-helix	trans	-63.6	-44.2	175.6	171.4	0	0	0	0	111.3	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.5Å; A313-V317 PolarHBondContact O-N 3.18Å; G314-V317 PolarHBondContact O-N 3.13Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 2.75Å; V317-V320 PolarHBondContact O-N 2.91Å; V317-L321 HydrophobicContact CG1-CD1 3.91Å; V317-L321 HydrophobicContact CG1-CG 4.4Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.36Å
318	L	83.3	Confident	77.3	Confident	113 Å²	113	82.1 Å²	82.1	59%	0.592	52%	0.52	S	S	*	.	H	α-helix	trans	-60.5	-41.6	175.7	-78.1	167.1	0	0	0	112.4	G314 L315 L321 A322	G314-L318 WeakPolarHBondContact O-CG 3.46Å; G314-L318 PolarHBondContact O-N 3.41Å; L315-L318 PolarHBondContact O-N 3.1Å; L318-L321 PolarHBondContact O-N 3.42Å; L318-A322 WeakPolarHBondContact O-CB 3.4Å; L318-A322 PolarHBondContact O-N 3.38Å
319	A	83.9	Confident	77.9	Confident	56 Å²	56	79 Å²	79	46%	0.463	51%	0.511	S	S	.	.	H	α-helix	trans	-63.3	-43.9	176.4	0	0	0	0	0	112.3	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.18Å; L315-A319 PolarHBondContact O-N 2.97Å; A316-A319 PolarHBondContact O-N 3.18Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 2.75Å; A319-A322 PolarHBondContact O-N 3.29Å; A319-V323 WeakPolarHBondContact O-CG2 3.5Å; A319-V323 PolarHBondContact O-N 2.77Å
320	V	84.4	Confident	78.6	Confident	89 Å²	89	77 Å²	77	54%	0.539	50%	0.499	S	S	.	.	H	α-helix	trans	-63.2	-43.5	176.3	171	0	0	0	0	111.3	A316 V317 A322 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.31Å; A316-V320 PolarHBondContact O-N 3.23Å; V317-V320 PolarHBondContact O-N 2.91Å; V320-A322 PolarHBondContact O-N 3.26Å; V320-V323 PolarHBondContact O-N 2.96Å; V320-L324 HydrophobicContact CG1-CD1 3.91Å; V320-L324 HydrophobicContact CG1-CG 4.47Å; V320-L324 WeakPolarHBondContact O-CG 3.5Å; V320-L324 PolarHBondContact O-N 3.29Å
321	L	84	Confident	79.1	Confident	103 Å²	103	78.2 Å²	78.2	54%	0.539	50%	0.498	S	S	.	.	H	α-helix	trans	-63.6	-39.5	176.5	-70.9	172	0	0	0	112.3	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 3.91Å; V317-L321 HydrophobicContact CG1-CG 4.4Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.36Å; L318-L321 PolarHBondContact O-N 3.42Å; L321-L324 PolarHBondContact O-N 2.84Å; L321-G325 PolarHBondContact O-N 2.95Å
322	A	82.1	Confident	79.1	Confident	65 Å²	65	80.1 Å²	80.1	54%	0.537	51%	0.506	S	S	.	.	H	α-helix	trans	-63.8	-42.7	175.5	0	0	0	0	0	112.2	L318 A319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.4Å; L318-A322 PolarHBondContact O-N 3.38Å; A319-A322 PolarHBondContact O-N 3.29Å; V320-A322 PolarHBondContact O-N 3.26Å; A322-G325 PolarHBondContact O-N 3.07Å; A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.7Å
323	V	83.2	Confident	78.6	Confident	94 Å²	94	80 Å²	80	57%	0.57	51%	0.509	S	S	*	.	H	α-helix	trans	-64.1	-44.8	175.5	171.5	0	0	0	0	111.3	A319 V320 G325 A326 V327	A319-V323 WeakPolarHBondContact O-CG2 3.5Å; A319-V323 PolarHBondContact O-N 2.77Å; V320-V323 PolarHBondContact O-N 2.96Å; V323-G325 PolarHBondContact O-N 3.12Å; V323-A326 PolarHBondContact O-N 2.71Å; V323-V327 HydrophobicContact CG1-CG2 4.49Å; V323-V327 WeakPolarHBondContact O-CG2 3.42Å; V323-V327 PolarHBondContact O-N 3.05Å
324	L	81	Confident	78.1	Confident	100 Å²	100	86.4 Å²	86.4	52%	0.524	52%	0.522	S	S	.	.	H	α-helix	trans	-62	-42.5	176.3	-72	168.8	0	0	0	111.9	V320 L321 V327 M328	V320-L324 HydrophobicContact CG1-CD1 3.91Å; V320-L324 HydrophobicContact CG1-CG 4.47Å; V320-L324 WeakPolarHBondContact O-CG 3.5Å; V320-L324 PolarHBondContact O-N 3.29Å; L321-L324 PolarHBondContact O-N 2.84Å; L324-V327 PolarHBondContact O-N 2.84Å; L324-M328 WeakPolarHBondContact O-CB 3.35Å; L324-M328 VanDerWaalsContact O-CG 3.32Å; L324-M328 WeakPolarHBondContact O-CG 3.44Å; L324-M328 PolarHBondContact O-N 2.94Å
325	G	80.4	Confident	77.1	Confident	42 Å²	42	94.5 Å²	94.5	43%	0.433	54%	0.541	S	S	.	.	H	α-helix	trans	-60.5	-44.9	174.3	0	0	0	0	0	112.7	L321 A322 V323 M328 A329	L321-G325 PolarHBondContact O-N 2.95Å; A322-G325 PolarHBondContact O-N 3.07Å; V323-G325 PolarHBondContact O-N 3.12Å; G325-M328 PolarHBondContact O-N 3.02Å; G325-A329 WeakPolarHBondContact O-CB 3.46Å; G325-A329 PolarHBondContact O-N 3.47Å
326	A	78.7	Confident	75.5	Confident	55 Å²	55	98.5 Å²	98.5	46%	0.455	55%	0.554	S	S	.	*	H	α-helix	trans	-63.6	-43.2	176.5	0	0	0	0	0	112.4	A322 V323 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.49Å; A322-A326 PolarHBondContact O-N 2.7Å; V323-A326 PolarHBondContact O-N 2.71Å; A326-A329 PolarHBondContact O-N 3.03Å; A326-V330 WeakPolarHBondContact O-CG2 3.45Å; A326-V330 PolarHBondContact O-N 2.76Å
327	V	79.8	Confident	74	Confident	81 Å²	81	100.4 Å²	100.4	49%	0.491	56%	0.564	S	S	.	*	H	α-helix	trans	-61.9	-45.5	175.5	169.9	0	0	0	0	110.9	V323 L324 A329 V330 V331	V323-V327 HydrophobicContact CG1-CG2 4.49Å; V323-V327 WeakPolarHBondContact O-CG2 3.42Å; V323-V327 PolarHBondContact O-N 3.05Å; L324-V327 PolarHBondContact O-N 2.84Å; V327-A329 PolarHBondContact O-N 3.36Å; V327-V330 PolarHBondContact O-N 3.2Å; V327-V331 HydrophobicContact CG1-CG2 4.44Å; V327-V331 WeakPolarHBondContact O-CB 3.46Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.43Å; V327-V331 PolarHBondContact O-N 3.21Å
328	M	74.4	Confident	72.4	Confident	119 Å²	119	101 Å²	101	59%	0.586	57%	0.572	S	S	*	*	H	α-helix	trans	-62.3	-42.1	177	-73.3	-65.6	-72.7	0	0	112.2	L324 G325 V331 M332	L324-M328 WeakPolarHBondContact O-CB 3.35Å; L324-M328 VanDerWaalsContact O-CG 3.32Å; L324-M328 WeakPolarHBondContact O-CG 3.44Å; L324-M328 PolarHBondContact O-N 2.94Å; G325-M328 PolarHBondContact O-N 3.02Å; M328-V331 PolarHBondContact O-N 3.47Å; M328-M332 WeakPolarHBondContact O-CG 3.27Å; M328-M332 PolarHBondContact O-N 3.49Å
329	A	73.4	Confident	70.4	Confident	52 Å²	52	98.8 Å²	98.8	43%	0.43	58%	0.576	S	S	.	*	H	α-helix	trans	-60.9	-46.7	174.6	0	0	0	0	0	111.9	G325 A326 V327 V331 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.46Å; G325-A329 PolarHBondContact O-N 3.47Å; A326-A329 PolarHBondContact O-N 3.03Å; V327-A329 PolarHBondContact O-N 3.36Å; A329-V331 PolarHBondContact O-N 2.87Å; A329-M332 PolarHBondContact O-N 2.73Å; A329-C333 WeakPolarHBondContact O-CB 3.13Å; A329-C333 PolarHBondContact O-N 3.38Å; A329-C333 PolarHBondContact O-SG 3.47Å; A329-C333 VanDerWaalsContact O-SG 3.4Å
330	V	74.6	Confident	68.2	Low	81 Å²	81	100 Å²	100	49%	0.491	60%	0.595	S	S	.	*	H	α-helix	trans	-62.3	-40	176.9	169.7	0	0	0	0	111.8	A326 V327 C333 R334	A326-V330 WeakPolarHBondContact O-CG2 3.45Å; A326-V330 PolarHBondContact O-N 2.76Å; V327-V330 PolarHBondContact O-N 3.2Å; V330-C333 PolarHBondContact O-N 3.38Å; V330-R334 WeakPolarHBondContact O-CB 3.32Å; V330-R334 WeakPolarHBondContact O-CG 3.48Å; V330-R334 PolarHBondContact O-N 3.06Å
331	V	73.8	Confident	65.8	Low	72 Å²	72	106.2 Å²	106.2	44%	0.436	61%	0.614	S	S	.	*	H	α-helix	trans	-66.2	-41	175.9	169.4	0	0	0	0	111.5	V327 M328 A329 R334 R335	V327-V331 HydrophobicContact CG1-CG2 4.44Å; V327-V331 WeakPolarHBondContact O-CB 3.46Å; V327-V331 VanDerWaalsContact O-CG2 3.32Å; V327-V331 WeakPolarHBondContact O-CG2 3.43Å; V327-V331 PolarHBondContact O-N 3.21Å; M328-V331 PolarHBondContact O-N 3.47Å; A329-V331 PolarHBondContact O-N 2.87Å; V331-R334 PolarHBondContact O-N 3.48Å; V331-R335 PolarHBondContact O-N 2.87Å
332	M	70.7	Confident	63.4	Low	131 Å²	131	105.1 Å²	105.1	65%	0.645	63%	0.628	S	S	*	*	H	α-helix	trans	-66.5	-42.5	175.3	-73.5	-175.1	69.7	0	0	112.3	M328 A329 R334 R335 K336	M328-M332 WeakPolarHBondContact O-CG 3.27Å; M328-M332 PolarHBondContact O-N 3.49Å; A329-M332 PolarHBondContact O-N 2.73Å; M332-R334 PolarHBondContact O-N 3.17Å; M332-R335 PolarHBondContact O-N 2.96Å; M332-K336 PolarHBondContact O-N 3.13Å
333	C	62.9	Low	60.9	Low	89 Å²	89	106 Å²	106	60%	0.601	64%	0.643	S	S	*	*	H	α-helix	trans	-59.7	-45	172.8	-73.6	0	0	0	0	111.7	A329 V330 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.13Å; A329-C333 PolarHBondContact O-N 3.38Å; A329-C333 PolarHBondContact O-SG 3.47Å; A329-C333 VanDerWaalsContact O-SG 3.4Å; V330-C333 PolarHBondContact O-N 3.38Å; C333-K336 PolarHBondContact O-N 2.71Å; C333-K336 VanDerWaalsContact O-N 3.11Å; C333-S337 PolarHBondContact O-N 2.86Å; C333-S337 PolarHBondContact O-OG 3.49Å
334	R	61.8	Low	58.6	Low	187 Å²	187	107.1 Å²	107.1	71%	0.706	66%	0.655	S	S	*	*	H	α-helix	trans	-64.4	-39.5	177.2	-78.5	-176.9	167.6	-173.2	-3.7	112.9	V330 V331 M332 K336 S337	V330-R334 WeakPolarHBondContact O-CB 3.32Å; V330-R334 WeakPolarHBondContact O-CG 3.48Å; V330-R334 PolarHBondContact O-N 3.06Å; V331-R334 PolarHBondContact O-N 3.48Å; M332-R334 PolarHBondContact O-N 3.17Å; R334-K336 VanDerWaalsContact C-N 3.29Å; R334-K336 PolarHBondContact O-N 3.15Å; R334-S337 WeakPolarHBondContact CA-OG 3.5Å; R334-S337 PolarHBondContact O-N 3.16Å; R334-S337 PolarHBondContact O-OG 2.74Å
335	R	57.1	Low	56.3	Low	206 Å²	206	108 Å²	108	78%	0.777	67%	0.668	S	S	*	*	H	α-helix	trans	-62.8	-31.8	170.6	-92.3	-175	166.4	178.5	-3.4	113.2	V331 M332 S338	V331-R335 PolarHBondContact O-N 2.87Å; M332-R335 PolarHBondContact O-N 2.96Å; R335-S338 PolarHBondContact O-OG 3.22Å
336	K	50	Low	54.1	Low	191 Å²	191	110 Å²	110	83%	0.83	68%	0.676	S	S	*	*	H	α-helix	trans	-79.1	-22.5	178	-162.6	169.2	-177.3	178.2	0	113.2	M332 C333 R334	M332-K336 PolarHBondContact O-N 3.13Å; C333-K336 PolarHBondContact O-N 2.71Å; C333-K336 VanDerWaalsContact O-N 3.11Å; R334-K336 VanDerWaalsContact C-N 3.29Å; R334-K336 PolarHBondContact O-N 3.15Å
337	S	51.8	Low	52	Low	94 Å²	94	115.5 Å²	115.5	66%	0.657	69%	0.692	S	S	*	*	S	Bend	trans	-82.8	-8.4	178.1	54.2	0	0	0	0	115.8	C333 R334 G339	C333-S337 PolarHBondContact O-N 2.86Å; C333-S337 PolarHBondContact O-OG 3.49Å; R334-S337 WeakPolarHBondContact CA-OG 3.5Å; R334-S337 PolarHBondContact O-N 3.16Å; R334-S337 PolarHBondContact O-OG 2.74Å; S337-G339 PolarHBondContact O-N 3.08Å
338	S	48.8	Very low	49.6	Very low	102 Å²	102	116.1 Å²	116.1	71%	0.713	71%	0.706	S	S	*	*	S	Bend	trans	-94.7	35.5	-173.6	66.6	0	0	0	0	114.8	R335	R335-S338 PolarHBondContact O-OG 3.22Å
339	G	42.1	Very low	47.5	Very low	66 Å²	66	115.3 Å²	115.3	68%	0.68	72%	0.718	S	S	*	*	S	Bend	trans	-169.1	139	175.3	0	0	0	0	0	115.6	S337	S337-G339 PolarHBondContact O-N 3.08Å
340	G	36.5	Very low	45.7	Very low	82 Å²	82	118.1 Å²	118.1	85%	0.845	73%	0.734	S	S	*	*			trans	98.9	38.2	151.2	0	0	0	0	0	119.6
341	K	34.4	Very low	43.8	Very low	218 Å²	218	120 Å²	120	95%	0.948	75%	0.751	S	S	*	*			trans	-30.7	125.9	159.8	176.7	-178.5	-177.8	177.2	0	116.4
342	G	33.1	Very low	42.1	Very low	80 Å²	80	124 Å²	124	83%	0.825	77%	0.77	S	S	*	*			trans	124	140.8	146.2	0	0	0	0	0	118.6
343	G	30	Very low	40.5	Very low	83 Å²	83	123.8 Å²	123.8	86%	0.856	78%	0.782	S	S	*	*			trans	137.7	115.4	165.7	0	0	0	0	0	115.5
344	S	34.9	Very low	39.3	Very low	118 Å²	118	124.1 Å²	124.1	83%	0.825	79%	0.791	S	S	*	*			trans	-171.8	155.2	175.3	-168.2	0	0	0	0	108.1
345	C	32.6	Very low	38	Very low	119 Å²	119	125.1 Å²	125.1	80%	0.804	80%	0.803	S	S	*	*			cis	-132	-152.3	3.6	-152.8	0	0	0	0	107.3
346	S	35.3	Very low	36.7	Very low	84 Å²	84	118.6 Å²	118.6	59%	0.587	80%	0.8	S	S	*	*			cis	-157.3	-162.8	-2.3	48	0	0	0	0	107
347	Q	34.9	Very low	36	Very low	170 Å²	170	114.6 Å²	114.6	79%	0.794	80%	0.796	S	S	*	*			cis	-165.5	161.9	7.1	-148.3	149.6	-79.8	0	0	110.9
348	A	29.5	Very low	35.1	Very low	95 Å²	95	117.3 Å²	117.3	79%	0.785	80%	0.803	S	S	*	*			trans	65.5	153.3	152.6	0	0	0	0	0	118.9
349	A	29.8	Very low	34.3	Very low	101 Å²	101	120.6 Å²	120.6	84%	0.835	81%	0.807	S	S	*	*			cis	-153.2	170.5	-13.3	0	0	0	0	0	110.8
350	S	36.1	Very low	33.6	Very low	111 Å²	111	121.8 Å²	121.8	78%	0.776	81%	0.805	S	S	*	*			trans	-90	154.8	-177.6	55.7	0	0	0	0	114.9
351	S	34.4	Very low	33.3	Very low	120 Å²	120	124.8 Å²	124.8	84%	0.839	80%	0.801	S	S	*	*			trans	-161.5	155.9	136	45.9	0	0	0	0	112.1
352	N	37.3	Very low	33.1	Very low	157 Å²	157	121.8 Å²	121.8	84%	0.84	79%	0.794	S	S	*	*			trans	-99.2	157.9	-177.9	-63.4	-27.4	0	0	0	111.7
353	S	37.5	Very low	32.9	Very low	127 Å²	127	122.5 Å²	122.5	89%	0.888	79%	0.792	S	S	*	*			trans	-147.1	141.8	151.5	-72	0	0	0	0	108.9
354	A	38	Very low	32.9	Very low	96 Å²	96	124.4 Å²	124.4	79%	0.793	79%	0.791	S	S	*	*			trans	-149.4	123.8	-178.8	0	0	0	0	0	112.4
355	Q	34.3	Very low	32.9	Very low	208 Å²	208	128.8 Å²	128.8	97%	0.972	80%	0.795	S	S	*	*			trans	174.3	146.6	165.5	-101.5	158.9	-16.2	0	0	106.9
356	G	28.6	Very low	33.2	Very low	68 Å²	68	131.2 Å²	131.2	70%	0.701	82%	0.823	S	S	*	*			cis	174.4	155.1	-9.4	0	0	0	0	0	111.4
357	S	35.7	Very low	33.1	Very low	108 Å²	108	133.6 Å²	133.6	76%	0.755	84%	0.835	S	S	*	*			trans	54.1	111.7	156.2	-79.7	0	0	0	0	123
358	D	34.5	Very low	33	Very low	150 Å²	150	131.6 Å²	131.6	80%	0.802	84%	0.837	S	S	*	*				92.3	151.4	115.9	-66.8	-51.3	0	0	0	125
359	E	30	Very low	33.2	Very low	172 Å²	172	133.7 Å²	133.7	80%	0.804	84%	0.84	S	S	*	*			trans	60.9	92.5	160.3	-68.9	-156.8	114.8	0	0	124.6
360	S	28.4	Very low	33.4	Very low	91 Å²	91	135.6 Å²	135.6	64%	0.636	84%	0.841	S	S	*	*				93.9	141.7	105	87.7	0	0	0	0	123.1
361	L	30.5	Very low	33.3	Very low	145 Å²	145	137.1 Å²	137.1	76%	0.759	85%	0.845	S	S	*	*			trans	69.9	126.8	142.7	-69.9	167.2	0	0	0	124.1
362	I	29.3	Very low	33.2	Very low	154 Å²	154	138.3 Å²	138.3	79%	0.79	85%	0.845	S	S	*	*			trans	68.4	114.1	141.2	-60	164.4	0	0	0	119.1
363	A	28.5	Very low	32.9	Very low	95 Å²	95	136.9 Å²	136.9	79%	0.785	85%	0.845	S	S	*	*				-168	138.3	112.9	0	0	0	0	0	112.4
364	C	30.3	Very low	32.5	Very low	124 Å²	124	137.7 Å²	137.7	84%	0.838	84%	0.842	S	S	*	*			trans	-114	136.7	161.3	-65.2	0	0	0	0	109
365	K	35.3	Very low	32.1	Very low	210 Å²	210	141.2 Å²	141.2	91%	0.913	85%	0.846	S	S	*	*			trans	160.8	162.5	150.9	-93.9	169	-179.9	-176.6	0	110.3
366	A	39.5	Very low	31.9	Very low	169 Å²	169	135.1 Å²	135.1	100%	1.397	84%	0.835	S	S	*	*			cis	-120.3	0	3.7	0	0	0	0	0	111.8

Retrieved 366 of 366 residues in 176.9 ms (Link to these results)

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