A0A090KKF1_HUMAN Loading...

HLA class I antigen

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

AlphaFold DB , UniProt , Accession A0A090KKF1, 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	33.9	Very low	41.3	Very low	241 Å²	241	144.5 Å²	144.5	100%	1.187	73%	0.725	S	S	*	*				0	104.1	0	-76.6	163.4	161.7	0	0	107.9	V3	M1-V3 PolarHBondContact O-N 3.24Å
2	R	33.7	Very low	41.5	Very low	253 Å²	253	143.8 Å²	143.8	96%	0.955	72%	0.724	S	S	*	*			trans	-80.7	109.3	171.3	-93.6	-179.8	173.1	164.8	-2.5	106.7	M4	R2-M4 PolarHBondContact O-N 2.66Å; R2-M4 VanDerWaalsContact O-N 3.1Å
3	V	37.7	Very low	41.3	Very low	140 Å²	140	140.3 Å²	140.3	85%	0.848	71%	0.708	S	S	*	*			trans	-69.1	105.9	170.9	179.3	0	0	0	0	106.5	M1 A5	M1-V3 PolarHBondContact O-N 3.24Å; V3-A5 PolarHBondContact O-N 3.16Å
4	M	38.6	Very low	41.3	Very low	177 Å²	177	134.5 Å²	134.5	87%	0.872	69%	0.687	S	S	*	*			trans	-84.8	97.3	177.9	-156	168.4	72.5	0	0	106.3	R2	R2-M4 PolarHBondContact O-N 2.66Å; R2-M4 VanDerWaalsContact O-N 3.1Å
5	A	41.7	Very low	41.4	Very low	58 Å²	58	127.9 Å²	127.9	48%	0.479	67%	0.666	S	S	.	*			trans	-59.6	141.6	174.3	0	0	0	0	0	109.6	V3 R7	V3-A5 PolarHBondContact O-N 3.16Å; A5-R7 PolarHBondContact O-N 2.88Å
6	P	43.6	Very low	41.5	Very low	76 Å²	76	122.8 Å²	122.8	49%	0.494	65%	0.648	S	S	.	*			trans	-64.7	122.8	-177.3	-11.5	25.7	0	0	0	109.2	T8 L9	P6-T8 PolarHBondContact O-N 3.01Å; P6-L9 PolarHBondContact O-N 3.06Å
7	R	45.4	Very low	41.3	Very low	217 Å²	217	121.8 Å²	121.8	82%	0.819	64%	0.642	S	S	*	*	H	α-helix	trans	-55.1	-21.1	178.9	-82.4	177	162.5	145.1	-6.2	113.7	A5 L11	A5-R7 PolarHBondContact O-N 2.88Å; R7-L11 PolarHBondContact O-N 2.72Å
8	T	47.6	Very low	41.1	Very low	101 Å²	101	118 Å²	118	62%	0.62	63%	0.631	S	S	*	*	H	α-helix	trans	-70.9	-34.9	174.4	35.4	0	0	0	0	113.5	P6 I10 L11 L12	P6-T8 PolarHBondContact O-N 3.01Å; T8-I10 VanDerWaalsContact C-N 3.35Å; T8-L11 PolarHBondContact O-N 3.06Å; T8-L12 PolarHBondContact O-N 3.29Å
9	L	42.6	Very low	41	Very low	106 Å²	106	116.6 Å²	116.6	56%	0.555	62%	0.623	S	S	*	*	H	α-helix	trans	-70.6	-34.6	178.5	-133.8	104.4	0	0	0	111.5	P6 L13	P6-L9 PolarHBondContact O-N 3.06Å; L9-L13 HydrophobicContact CD2-CD1 4.34Å; L9-L13 WeakPolarHBondContact O-CD1 3.37Å; L9-L13 PolarHBondContact O-N 2.92Å
10	I	43.2	Very low	40.8	Very low	96 Å²	96	114.5 Å²	114.5	49%	0.492	61%	0.614	S	S	.	*	H	α-helix	trans	-68.2	-38.5	179	-62.3	173.1	0	0	0	110.6	T8 S14	T8-I10 VanDerWaalsContact C-N 3.35Å; I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 2.88Å; I10-S14 PolarHBondContact O-OG 3.27Å
11	L	46.6	Very low	40.7	Very low	125 Å²	125	116.7 Å²	116.7	65%	0.654	62%	0.621	S	S	*	*	H	α-helix	trans	-70.1	-38.1	179.6	-75.4	164.5	0	0	0	113.1	R7 T8 S14 G15	R7-L11 PolarHBondContact O-N 2.72Å; T8-L11 PolarHBondContact O-N 3.06Å; L11-S14 WeakPolarHBondContact O-CB 3.13Å; L11-S14 PolarHBondContact O-N 2.91Å; L11-G15 PolarHBondContact O-N 3.03Å
12	L	43.9	Very low	41.2	Very low	136 Å²	136	109.3 Å²	109.3	71%	0.712	59%	0.59	S	S	*	*	H	α-helix	trans	-68.5	-40.9	176.1	-75.4	165.7	0	0	0	112.1	T8 S14 G15 A16	T8-L12 PolarHBondContact O-N 3.29Å; L12-S14 VanDerWaalsContact C-N 3.3Å; L12-S14 PolarHBondContact O-N 3.02Å; L12-G15 PolarHBondContact O-N 2.93Å; L12-A16 PolarHBondContact O-N 3.45Å; L12-A16 VanDerWaalsContact O-N 3.09Å
13	L	38.5	Very low	41.9	Very low	98 Å²	98	99.8 Å²	99.8	51%	0.513	55%	0.554	S	S	.	*	H	α-helix	trans	-64.6	-34.8	172.6	-78.9	160.7	0	0	0	112	L9 L17	L9-L13 HydrophobicContact CD2-CD1 4.34Å; L9-L13 WeakPolarHBondContact O-CD1 3.37Å; L9-L13 PolarHBondContact O-N 2.92Å; L13-L17 VanDerWaalsContact O-CB 3.25Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CD1 3.27Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.24Å; L13-L17 PolarHBondContact O-N 2.89Å
14	S	41.1	Very low	42.8	Very low	59 Å²	59	95.9 Å²	95.9	41%	0.413	54%	0.536	S	S	.	.	H	α-helix	trans	-67.3	-39.3	176.3	-52.6	0	0	0	0	112.3	I10 L11 L12 A18	I10-S14 WeakPolarHBondContact O-CB 3.39Å; I10-S14 PolarHBondContact O-N 2.88Å; I10-S14 PolarHBondContact O-OG 3.27Å; L11-S14 WeakPolarHBondContact O-CB 3.13Å; L11-S14 PolarHBondContact O-N 2.91Å; L12-S14 VanDerWaalsContact C-N 3.3Å; L12-S14 PolarHBondContact O-N 3.02Å; S14-A18 WeakPolarHBondContact O-CB 3.45Å; S14-A18 PolarHBondContact O-N 2.98Å
15	G	42.7	Very low	44.5	Very low	36 Å²	36	88.7 Å²	88.7	37%	0.371	51%	0.508	S	S	.	.	H	α-helix	trans	-68.8	-41.5	177.2	0	0	0	0	0	112.7	L11 L12 L19	L11-G15 PolarHBondContact O-N 3.03Å; L12-G15 PolarHBondContact O-N 2.93Å; G15-L19 PolarHBondContact O-N 3.27Å
16	A	43.6	Very low	46.9	Very low	46 Å²	46	88.8 Å²	88.8	38%	0.38	51%	0.505	S	S	.	.	H	α-helix	trans	-67.7	-42.6	175.9	0	0	0	0	0	112.3	L12 L19 T20	L12-A16 PolarHBondContact O-N 3.45Å; L12-A16 VanDerWaalsContact O-N 3.09Å; A16-L19 PolarHBondContact O-N 2.87Å; A16-T20 WeakPolarHBondContact O-CG2 3.4Å; A16-T20 PolarHBondContact O-N 3.19Å; A16-T20 PolarHBondContact O-OG1 3.1Å
17	L	37.6	Very low	49.3	Very low	106 Å²	106	86.8 Å²	86.8	56%	0.555	49%	0.489	S	S	*	.	H	α-helix	trans	-67.5	-39.9	177.4	-78.2	163.3	0	0	0	112.7	L13 L19 T20 E21	L13-L17 VanDerWaalsContact O-CB 3.25Å; L13-L17 WeakPolarHBondContact O-CB 3.48Å; L13-L17 WeakPolarHBondContact O-CD1 3.27Å; L13-L17 VanDerWaalsContact O-CG 3.31Å; L13-L17 WeakPolarHBondContact O-CG 3.24Å; L13-L17 PolarHBondContact O-N 2.89Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 2.88Å; L17-T20 VanDerWaalsContact CA-OG1 3.31Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 3.01Å; L17-T20 PolarHBondContact O-OG1 2.89Å; L17-E21 PolarHBondContact O-N 3.35Å
18	A	38.3	Very low	51.8	Low	53 Å²	53	77.5 Å²	77.5	44%	0.438	46%	0.457	S	S	.	.	H	α-helix	trans	-64.3	-36.3	176.9	0	0	0	0	0	112.1	S14 T22	S14-A18 WeakPolarHBondContact O-CB 3.45Å; S14-A18 PolarHBondContact O-N 2.98Å; A18-T22 VanDerWaalsContact O-CG2 3.31Å; A18-T22 WeakPolarHBondContact O-CG2 3.48Å; A18-T22 PolarHBondContact O-N 2.88Å; A18-T22 PolarHBondContact O-OG1 3.16Å
19	L	37.9	Very low	54.2	Low	92 Å²	92	72.7 Å²	72.7	48%	0.482	43%	0.428	S	S	.	.	H	α-helix	trans	-70.2	-42.6	174.1	-84.5	156.1	0	0	0	111.6	G15 A16 L17 E21 T22	G15-L19 PolarHBondContact O-N 3.27Å; A16-L19 PolarHBondContact O-N 2.87Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 2.88Å; L19-E21 PolarHBondContact O-N 3.46Å; L19-T22 WeakPolarHBondContact CA-OG1 3.41Å; L19-T22 PolarHBondContact O-N 2.81Å; L19-T22 VanDerWaalsContact O-N 3.17Å; L19-T22 PolarHBondContact O-OG1 2.8Å
20	T	38.6	Very low	56.9	Low	73 Å²	73	70 Å²	70	45%	0.448	41%	0.41	S	S	.	.	H	α-helix	trans	-64.8	-35.3	176.6	52.3	0	0	0	0	113.4	A16 L17 T22	A16-T20 WeakPolarHBondContact O-CG2 3.4Å; A16-T20 PolarHBondContact O-N 3.19Å; A16-T20 PolarHBondContact O-OG1 3.1Å; L17-T20 VanDerWaalsContact CA-OG1 3.31Å; L17-T20 WeakPolarHBondContact CA-OG1 3.34Å; L17-T20 PolarHBondContact O-N 3.01Å; L17-T20 PolarHBondContact O-OG1 2.89Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 2.93Å
21	E	37.8	Very low	59.5	Low	161 Å²	161	66.1 Å²	66.1	75%	0.752	39%	0.389	S	S	*	.	H	α-helix	trans	-69.8	-26.3	174.8	-90.7	-172.7	156.6	0	0	112.8	L17 L19 W23	L17-E21 PolarHBondContact O-N 3.35Å; L19-E21 PolarHBondContact O-N 3.46Å; E21-W23 VanDerWaalsContact C-N 3.33Å; E21-W23 PolarHBondContact O-N 2.95Å
22	T	45.2	Very low	62	Low	87 Å²	87	64.3 Å²	64.3	53%	0.534	38%	0.377	S	S	.	.	H	α-helix	trans	-76	-16.7	179.9	49.9	0	0	0	0	114.5	A18 L19 T20	A18-T22 VanDerWaalsContact O-CG2 3.31Å; A18-T22 WeakPolarHBondContact O-CG2 3.48Å; A18-T22 PolarHBondContact O-N 2.88Å; A18-T22 PolarHBondContact O-OG1 3.16Å; L19-T22 WeakPolarHBondContact CA-OG1 3.41Å; L19-T22 PolarHBondContact O-N 2.81Å; L19-T22 VanDerWaalsContact O-N 3.17Å; L19-T22 PolarHBondContact O-OG1 2.8Å; T20-T22 VanDerWaalsContact C-N 3.31Å; T20-T22 PolarHBondContact O-N 2.93Å
23	W	47.1	Very low	64.6	Low	52 Å²	52	58.1 Å²	58.1	20%	0.197	34%	0.344	C	S	.	.	H	α-helix	trans	-95.2	-35.9	-171.6	-72.1	40.2	0	0	0	112.7	E21 G25 E236 E288	E21-W23 VanDerWaalsContact C-N 3.33Å; E21-W23 PolarHBondContact O-N 2.95Å; W23-G25 PolarHBondContact O-N 3.37Å; W23-G25 VanDerWaalsContact O-N 3.08Å; W23-E236 HydrophobicContact CE3-CG 4.28Å; W23-E236 HydrophobicContact CH2-CB 4.14Å; W23-E236 HydrophobicContact CH2-CG 3.45Å; W23-E236 VanDerWaalsContact CH2-CG 3.45Å; W23-E236 HydrophobicContact CZ2-CG 3.75Å; W23-E236 HydrophobicContact CZ3-CB 3.96Å; W23-E236 HydrophobicContact CZ3-CG 3.71Å; W23-E236 VanDerWaalsContact CZ3-O 3.29Å; W23-E236 WeakPolarHBondContact CZ3-O 3.21Å; W23-E288 HydrophobicContact CE3-CB 4.28Å
24	A	56.2	Low	67.5	Low	58 Å²	58	55.6 Å²	55.6	48%	0.479	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.9	107.1	-176.7	0	0	0	0	0	111.6
25	G	75.5	Confident	70.2	Confident	27 Å²	27	52.8 Å²	52.8	28%	0.278	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	93.8	9.8	162.8	0	0	0	0	0	117.1	W23 P129	W23-G25 PolarHBondContact O-N 3.37Å; W23-G25 VanDerWaalsContact O-N 3.08Å; G25-P129 VanDerWaalsContact O-CA 3.29Å; G25-P129 WeakPolarHBondContact O-CA 2.98Å
26	S	90.9	Very high	72.8	Confident	59 Å²	59	53.3 Å²	53.3	41%	0.413	31%	0.309	S	S	.	.			trans	-83.4	141.8	164	66.9	0	0	0	0	110.6	L127	S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.47Å; S26-L127 WeakPolarHBondContact CB-O 3.49Å
27	H	95.4	Very high	75.3	Confident	34 Å²	34	52 Å²	52	16%	0.157	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	153.4	-179.9	-66.9	-77.5	0	0	0	111	D53 D126 L127 L192 L196	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.21Å; H27-D53 IonicContact CE1-OD2 3.66Å; H27-D53 IonicContact CG-OD2 3.21Å; H27-D53 IonicContact ND1-OD1 3.07Å; H27-D53 IonicContact ND1-OD2 3.39Å; H27-D53 PolarHBondContact ND1-OD2 3.49Å; H27-D126 CarbonylContact O-C 3.55Å; H27-D126 WeakPolarHBondContact O-CA 3.46Å; H27-L127 PolarHBondContact N-O 3.29Å; H27-L127 VanDerWaalsContact N-O 3.08Å; H27-L127 PolarHBondContact O-N 3.01Å; H27-L192 HydrophobicContact CB-CD1 4.44Å; H27-L196 HydrophobicContact CB-CD1 3.69Å; H27-L196 HydrophobicContact CB-CD2 4.02Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.33Å
28	S	97.5	Very high	77.7	Confident	23 Å²	23	53.9 Å²	53.9	16%	0.161	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	149.8	-180	68.7	0	0	0	0	111.9	V52 D53 C125 D126	S28-V52 CarbonylContact O-C 3.55Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.25Å; S28-D53 PolarHBondContact N-OD1 2.96Å; S28-D53 PolarHBondContact O-N 3.18Å; S28-D53 PolarHBondContact OG-OD1 3.48Å; S28-C125 WeakPolarHBondContact CA-O 3.44Å; S28-D126 WeakPolarHBondContact CB-OD1 3.38Å
29	M	98.5	Very high	79.6	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	119.9	167.6	-175.3	172.1	60.2	0	0	108.2	Y31 Y51 V52 F57 G124 C125 C188 W191 L192 Y195	M29-Y31 HydrophobicContact CE-CE2 4.19Å; M29-Y31 HydrophobicContact CG-CE2 4.03Å; M29-Y31 HydrophobicContact SD-CE2 3.97Å; M29-Y51 CarbonylContact C-O 3.42Å; M29-Y51 WeakPolarHBondContact CA-O 3.5Å; M29-V52 HydrophobicContact CG-CG2 4.38Å; M29-F57 HydrophobicContact CG-CE1 4.46Å; M29-F57 HydrophobicContact SD-CZ 4.35Å; M29-G124 CarbonylContact O-C 3.49Å; M29-G124 WeakPolarHBondContact O-CA 3.4Å; M29-C125 PolarHBondContact N-O 3.22Å; M29-C125 PolarHBondContact O-N 3.02Å; M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 WeakPolarHBondContact CE-O 3.42Å; M29-C188 WeakPolarHBondContact CE-SG 3.45Å; M29-W191 HydrophobicContact CE-CB 4.09Å; M29-W191 HydrophobicContact SD-CB 4.44Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.29Å; M29-L192 HydrophobicContact SD-CB 4.44Å; M29-Y195 HydrophobicContact SD-CD2 3.74Å; M29-Y195 HydrophobicContact SD-CE2 3.58Å; M29-Y195 VanDerWaalsContact SD-CE2 3.58Å
30	R	98.6	Very high	81.4	Confident	48 Å²	48	53.4 Å²	53.4	18%	0.181	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	132	-176.2	-57.3	-62.1	-177	76.4	3.3	110.6	F32 G50 Y51 D126 Y137	R30-F32 HydrophobicContact CB-CD2 4.44Å; R30-F32 HydrophobicContact CB-CE2 3.61Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; R30-G50 CarbonylContact O-C 3.58Å; R30-G50 WeakPolarHBondContact O-CA 3.4Å; R30-Y51 PolarHBondContact N-O 3.32Å; R30-Y51 PolarHBondContact O-N 2.87Å; R30-D126 IonicContact CZ-OD1 3.7Å; R30-D126 IonicContact NE-OD1 3.85Å; R30-D126 PolarHBondContact NE-OD1 2.84Å; R30-D126 VanDerWaalsContact NE-OD1 3.11Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 2.73Å; R30-D126 PolarHBondContact NH2-OD1 2.87Å; R30-D126 IonicContact NH2-OD2 3.33Å; R30-D126 PolarHBondContact NH2-OD2 3.16Å; R30-Y137 VanDerWaalsContact NH2-CZ 3.26Å; R30-Y137 PolarHBondContact NH2-OH 3.01Å
31	Y	98.7	Very high	83.4	Confident	15 Å²	15	59.3 Å²	59.3	6%	0.059	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.7	169.1	-69.3	-90.9	0	0	0	109.5	M29 V49 F57 V58 M122 F123	M29-Y31 HydrophobicContact CE-CE2 4.19Å; M29-Y31 HydrophobicContact CG-CE2 4.03Å; M29-Y31 HydrophobicContact SD-CE2 3.97Å; Y31-V49 WeakPolarHBondContact CA-O 3.33Å; Y31-F57 HydrophobicContact CE1-CZ 4.02Å; Y31-F57 AromaticContact CZ-CZ 3.77Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.4Å; Y31-V58 HydrophobicContact CE1-CG2 3.96Å; Y31-M122 WeakPolarHBondContact O-CA 3.19Å; Y31-F123 VanDerWaalsContact CB-CE1 3.49Å; Y31-F123 VanDerWaalsContact CB-CZ 3.5Å; Y31-F123 HydrophobicContact CD2-CD2 4.45Å; Y31-F123 AromaticContact CD2-CE2 3.75Å; Y31-F123 HydrophobicContact CD2-CE2 3.75Å; Y31-F123 AromaticContact CD2-CZ 3.89Å; Y31-F123 HydrophobicContact CD2-CZ 3.89Å; Y31-F123 HydrophobicContact CG-CE1 4.27Å; Y31-F123 HydrophobicContact CG-CE2 4.12Å; Y31-F123 AromaticContact CG-CZ 3.77Å; Y31-F123 HydrophobicContact CG-CZ 3.77Å; Y31-F123 PolarHBondContact N-O 3.25Å; Y31-F123 PolarHBondContact O-N 3.37Å
32	F	98.8	Very high	85.6	Confident	88 Å²	88	54.4 Å²	54.4	39%	0.386	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	129.6	175.1	-56.3	-95.2	0	0	0	108.4	R30 A48 V49 Y51 R121 M122	R30-F32 HydrophobicContact CB-CD2 4.44Å; R30-F32 HydrophobicContact CB-CE2 3.61Å; R30-F32 HydrophobicContact CB-CZ 3.94Å; F32-A48 CarbonylContact O-C 3.55Å; F32-A48 VanDerWaalsContact O-CA 3.28Å; F32-A48 WeakPolarHBondContact O-CA 3.35Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 2.96Å; F32-V49 PolarHBondContact O-N 2.92Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; F32-R121 CarbonylContact C-O 3.53Å; F32-R121 WeakPolarHBondContact CA-O 3.39Å; F32-M122 HydrophobicContact CD1-CB 3.92Å; F32-M122 HydrophobicContact CD1-CG 3.65Å; F32-M122 HydrophobicContact CE1-CB 4.05Å; F32-M122 HydrophobicContact CE1-CG 3.36Å; F32-M122 HydrophobicContact CG-CG 4.49Å; F32-M122 HydrophobicContact CZ-CG 3.98Å
33	S	98.6	Very high	87.7	Confident	5 Å²	5	55.2 Å²	55.2	4%	0.035	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	142.8	169.9	65.6	0	0	0	0	111.2	I47 Q120 R121	S33-I47 CarbonylContact C-O 3.55Å; S33-I47 VanDerWaalsContact CA-O 3.25Å; S33-I47 WeakPolarHBondContact CA-O 3.32Å; S33-Q120 CarbonylContact O-C 3.59Å; S33-Q120 VanDerWaalsContact O-CA 3.31Å; S33-Q120 WeakPolarHBondContact O-CA 3.45Å; S33-R121 PolarHBondContact N-O 2.72Å; S33-R121 PolarHBondContact O-N 2.86Å
34	T	98.8	Very high	90	Very high	45 Å²	45	53.9 Å²	53.9	28%	0.276	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	123.8	177.6	-56.7	0	0	0	0	108.8	V36 F46 I47 T118 L119 Q120	T34-V36 HydrophobicContact CG2-CG2 3.96Å; T34-F46 WeakPolarHBondContact O-CA 3.39Å; T34-I47 PolarHBondContact N-O 3.36Å; T34-I47 PolarHBondContact O-N 3.38Å; T34-T118 HydrophobicContact CG2-CG2 3.87Å; T34-L119 WeakPolarHBondContact CA-O 3.36Å; T34-Q120 HydrophobicContact CG2-CG 3.98Å
35	S	98.4	Very high	91.9	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.007	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	127.4	169.1	-83.4	0	0	0	0	110.8	R45 F46 D98 T118 L119	S35-R45 CarbonylContact C-O 3.6Å; S35-R45 VanDerWaalsContact CA-O 3.24Å; S35-R45 WeakPolarHBondContact CA-O 3.35Å; S35-F46 WeakPolarHBondContact OG-CD2 3.24Å; S35-D98 VanDerWaalsContact OG-CB 3.23Å; S35-D98 WeakPolarHBondContact OG-CB 3.46Å; S35-T118 CarbonylContact O-C 3.58Å; S35-T118 WeakPolarHBondContact O-CA 3.47Å; S35-L119 PolarHBondContact N-O 3.32Å; S35-L119 PolarHBondContact O-N 3.33Å
36	V	97.7	Very high	93	Very high	46 Å²	46	54.7 Å²	54.7	28%	0.279	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	114.8	178.4	-173	0	0	0	0	109	T34 P44 R45 H117 T118	T34-V36 HydrophobicContact CG2-CG2 3.96Å; V36-P44 CarbonylContact O-C 3.54Å; V36-P44 WeakPolarHBondContact O-CA 3.21Å; V36-P44 WeakPolarHBondContact O-CB 3.32Å; V36-R45 PolarHBondContact N-O 2.95Å; V36-R45 PolarHBondContact O-N 3.35Å; V36-H117 WeakPolarHBondContact CA-O 3.39Å; V36-T118 HydrophobicContact CG2-CG2 4.31Å
37	S	94.6	Very high	93.4	Very high	20 Å²	20	54.3 Å²	54.3	14%	0.14	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	131.3	173.4	60.4	0	0	0	0	110.5	S116 H117	S37-S116 WeakPolarHBondContact O-CA 3.41Å; S37-S116 WeakPolarHBondContact O-CB 3.31Å; S37-S116 PolarHBondContact O-OG 3.48Å; S37-H117 PolarHBondContact N-O 2.95Å; S37-H117 PolarHBondContact OG-N 3.17Å; S37-H117 PolarHBondContact OG-O 3.03Å
38	W	88	Confident	93.5	Very high	144 Å²	144	53 Å²	53	55%	0.545	28%	0.283	S	S	.	.			trans	-121.5	97.4	173.2	-157.9	-56.8	0	0	0	110.7	G40 R41	W38-G40 PolarHBondContact O-N 3.29Å; W38-R41 HydrophobicContact CB-CB 4.12Å; W38-R41 HydrophobicContact CG-CB 3.89Å; W38-R41 HydrophobicContact CG-CG 4.09Å; W38-R41 VanDerWaalsContact NE1-CD 3.27Å; W38-R41 PolarHBondContact O-N 3.46Å; W38-R41 VanDerWaalsContact O-N 3.09Å
39	P	78.7	Confident	93.6	Very high	48 Å²	48	53.2 Å²	53.2	31%	0.312	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	130.3	178.4	-27.2	36.6	0	0	0	111.7	R41 E113 G115	P39-R41 VanDerWaalsContact C-N 3.3Å; P39-R41 PolarHBondContact O-N 2.95Å; P39-E113 WeakPolarHBondContact CB-O 3.21Å; P39-E113 WeakPolarHBondContact CG-O 3.37Å; P39-G115 WeakPolarHBondContact CG-O 3.32Å
40	G	76.4	Confident	93.6	Very high	87 Å²	87	53.2 Å²	53.2	90%	0.897	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.6	0.2	-180	0	0	0	0	0	116.4	W38	W38-G40 PolarHBondContact O-N 3.29Å
41	R	80.5	Confident	93.6	Very high	198 Å²	198	54.3 Å²	54.3	75%	0.747	29%	0.288	S	S	*	.	S	Bend	trans	-117.1	14.4	177.2	-64.8	-166.5	-175.1	-128.5	-1.1	114.9	W38 P39	W38-R41 HydrophobicContact CB-CB 4.12Å; W38-R41 HydrophobicContact CG-CB 3.89Å; W38-R41 HydrophobicContact CG-CG 4.09Å; W38-R41 VanDerWaalsContact NE1-CD 3.27Å; W38-R41 PolarHBondContact O-N 3.46Å; W38-R41 VanDerWaalsContact O-N 3.09Å; P39-R41 VanDerWaalsContact C-N 3.3Å; P39-R41 PolarHBondContact O-N 2.95Å
42	G	83.8	Confident	93.5	Very high	57 Å²	57	53.6 Å²	53.6	59%	0.588	29%	0.285	S	S	*	.	S	Bend	trans	108.5	-149.9	175.6	0	0	0	0	0	112.9
43	E	89.9	Confident	93.4	Very high	104 Å²	104	50.8 Å²	50.8	49%	0.486	27%	0.274	S	S	.	.	S	Bend	trans	-76.2	155.5	-179.8	-63.9	-56.2	162.8	0	0	112.3	R45 R99	E43-R45 PolarHBondContact O-N 3.03Å; E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 VanDerWaalsContact CD-NH2 3.25Å; E43-R99 IonicContact OE1-CZ 2.84Å; E43-R99 IonicContact OE1-NE 3Å; E43-R99 IonicContact OE1-NH1 3.55Å; E43-R99 PolarHBondContact OE1-NH1 3.09Å; E43-R99 IonicContact OE1-NH2 3.01Å; E43-R99 PolarHBondContact OE1-NH2 3.38Å; E43-R99 WeakPolarHBondContact OE2-CD 3.4Å; E43-R99 IonicContact OE2-CZ 3.7Å; E43-R99 IonicContact OE2-NE 3.94Å; E43-R99 PolarHBondContact OE2-NE 3.37Å; E43-R99 IonicContact OE2-NH1 3.88Å; E43-R99 IonicContact OE2-NH2 2.68Å; E43-R99 PolarHBondContact OE2-NH2 2.89Å
44	P	94.1	Very high	93.3	Very high	24 Å²	24	53.6 Å²	53.6	16%	0.156	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-56.1	128.1	173.1	-24.4	34.7	0	0	0	111.3	V36 F46 R99 L102	V36-P44 CarbonylContact O-C 3.54Å; V36-P44 WeakPolarHBondContact O-CA 3.21Å; V36-P44 WeakPolarHBondContact O-CB 3.32Å; P44-F46 PolarHBondContact O-N 3.4Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.28Å; P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.84Å
45	R	96.8	Very high	93.1	Very high	100 Å²	100	52 Å²	52	38%	0.377	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	131.8	172.7	-178.5	179.3	-174.1	-179.5	-2.9	108.7	S35 V36 E43 I47 D61 S62 D63	S35-R45 CarbonylContact C-O 3.6Å; S35-R45 VanDerWaalsContact CA-O 3.24Å; S35-R45 WeakPolarHBondContact CA-O 3.35Å; V36-R45 PolarHBondContact N-O 2.95Å; V36-R45 PolarHBondContact O-N 3.35Å; E43-R45 PolarHBondContact O-N 3.03Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; R45-D61 IonicContact CZ-OD1 2.71Å; R45-D61 IonicContact CZ-OD2 2.68Å; R45-D61 IonicContact NE-OD1 3.15Å; R45-D61 PolarHBondContact NE-OD1 3.31Å; R45-D61 VanDerWaalsContact NE-OD1 3.07Å; R45-D61 IonicContact NE-OD2 3.59Å; R45-D61 IonicContact NH2-OD1 3.57Å; R45-D61 PolarHBondContact NH2-OD1 2.84Å; R45-D61 IonicContact NH2-OD2 3.74Å; R45-D61 PolarHBondContact NH2-OD2 3.29Å; R45-S62 WeakPolarHBondContact CA-OG 3.48Å; R45-D63 WeakPolarHBondContact CD-OD2 3.44Å; R45-D63 WeakPolarHBondContact CG-OD2 3.35Å; R45-D63 IonicContact NE-OD2 3.51Å
46	F	98.3	Very high	93.1	Very high	3 Å²	3	54.5 Å²	54.5	1%	0.013	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122	176.5	174.7	-89.3	0	0	0	109.8	T34 S35 P44 A48 F60 S62 Y91 Q94 A95 D98	T34-F46 WeakPolarHBondContact O-CA 3.39Å; S35-F46 WeakPolarHBondContact OG-CD2 3.24Å; P44-F46 PolarHBondContact O-N 3.4Å; F46-A48 HydrophobicContact CE1-CB 3.68Å; F46-A48 HydrophobicContact CZ-CB 3.82Å; F46-F60 AromaticContact CD1-CD1 3.65Å; F46-F60 HydrophobicContact CD1-CD1 3.65Å; F46-F60 AromaticContact CD1-CE1 3.77Å; F46-F60 HydrophobicContact CD1-CE1 3.77Å; F46-F60 AromaticContact CE1-CD1 3.84Å; F46-F60 HydrophobicContact CE1-CD1 3.84Å; F46-F60 HydrophobicContact CE1-CE1 4.23Å; F46-S62 PolarHBondContact N-OG 3.36Å; F46-S62 PolarHBondContact O-N 2.96Å; F46-S62 PolarHBondContact O-OG 3.42Å; F46-Y91 HydrophobicContact CE1-CD1 4.24Å; F46-Q94 HydrophobicContact CE2-CB 4.12Å; F46-Q94 HydrophobicContact CE2-CG 3.64Å; F46-Q94 HydrophobicContact CZ-CB 3.91Å; F46-Q94 HydrophobicContact CZ-CG 3.78Å; F46-A95 HydrophobicContact CB-CB 3.64Å; F46-A95 HydrophobicContact CD1-CB 3.83Å; F46-A95 HydrophobicContact CD2-CB 4.02Å; F46-A95 HydrophobicContact CE1-CB 4.48Å; F46-A95 HydrophobicContact CG-CB 3.56Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å
47	I	98.6	Very high	93.1	Very high	51 Å²	51	52.3 Å²	52.3	26%	0.262	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	135.2	172.5	-64.4	159.7	0	0	0	107.8	S33 T34 R45 V49 F60	S33-I47 CarbonylContact C-O 3.55Å; S33-I47 VanDerWaalsContact CA-O 3.25Å; S33-I47 WeakPolarHBondContact CA-O 3.32Å; T34-I47 PolarHBondContact N-O 3.36Å; T34-I47 PolarHBondContact O-N 3.38Å; R45-I47 HydrophobicContact CG-CG1 4.4Å; I47-V49 HydrophobicContact CG2-CG1 4.47Å; I47-F60 WeakPolarHBondContact CA-O 3.32Å
48	A	98.6	Very high	93.3	Very high	5 Å²	5	51.4 Å²	51.4	4%	0.041	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	142.3	169.7	0	0	0	0	0	110.8	F32 F46 R59 F60 Y91	F32-A48 CarbonylContact O-C 3.55Å; F32-A48 VanDerWaalsContact O-CA 3.28Å; F32-A48 WeakPolarHBondContact O-CA 3.35Å; F46-A48 HydrophobicContact CE1-CB 3.68Å; F46-A48 HydrophobicContact CZ-CB 3.82Å; A48-R59 CarbonylContact O-C 3.6Å; A48-R59 WeakPolarHBondContact O-CA 3.43Å; A48-F60 HydrophobicContact CB-CB 4.37Å; A48-F60 PolarHBondContact N-O 3.33Å; A48-F60 PolarHBondContact O-N 3.48Å; A48-Y91 HydrophobicContact CB-CD1 3.65Å; A48-Y91 HydrophobicContact CB-CE1 3.59Å
49	V	98.8	Very high	93.7	Very high	28 Å²	28	48.7 Å²	48.7	17%	0.17	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	146.7	175.7	-63.1	0	0	0	0	109.5	Y31 F32 I47 Y51 Q56 V58 R59	Y31-V49 WeakPolarHBondContact CA-O 3.33Å; F32-V49 HydrophobicContact CB-CG2 3.88Å; F32-V49 HydrophobicContact CD2-CG2 4.34Å; F32-V49 PolarHBondContact N-O 2.96Å; F32-V49 PolarHBondContact O-N 2.92Å; I47-V49 HydrophobicContact CG2-CG1 4.47Å; V49-Y51 HydrophobicContact CB-CE2 4.13Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; V49-V58 WeakPolarHBondContact CA-O 3.18Å; V49-R59 HydrophobicContact CG1-CG 4.26Å
50	G	98.6	Very high	94.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	138.8	176.6	0	0	0	0	0	110.4	R30 Q56 F57 V58	R30-G50 CarbonylContact O-C 3.58Å; R30-G50 WeakPolarHBondContact O-CA 3.4Å; G50-Q56 CarbonylContact O-C 3.54Å; G50-Q56 WeakPolarHBondContact O-CA 3.46Å; G50-F57 WeakPolarHBondContact O-CD1 3.34Å; G50-F57 PolarHBondContact O-N 3.49Å; G50-V58 PolarHBondContact N-O 3.28Å; G50-V58 VanDerWaalsContact N-O 3.08Å; G50-V58 PolarHBondContact O-N 3.44Å
51	Y	98.5	Very high	95.7	Very high	71 Å²	71	43.2 Å²	43.2	28%	0.278	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	141.8	178.9	-74.8	-102.4	0	0	0	110.2	M29 R30 F32 V49 T55 Q56	M29-Y51 CarbonylContact C-O 3.42Å; M29-Y51 WeakPolarHBondContact CA-O 3.5Å; R30-Y51 PolarHBondContact N-O 3.32Å; R30-Y51 PolarHBondContact O-N 2.87Å; F32-Y51 HydrophobicContact CD2-CD2 4.14Å; F32-Y51 HydrophobicContact CE2-CD2 4.16Å; V49-Y51 HydrophobicContact CB-CE2 4.13Å; V49-Y51 HydrophobicContact CG2-CD2 4.36Å; V49-Y51 HydrophobicContact CG2-CE2 3.81Å; Y51-T55 VanDerWaalsContact CA-O 3.31Å; Y51-T55 WeakPolarHBondContact CA-O 3.42Å; Y51-T55 VanDerWaalsContact CD1-C 3.5Å; Y51-Q56 HydrophobicContact CD1-CB 3.97Å; Y51-Q56 HydrophobicContact CD2-CG 4.37Å; Y51-Q56 HydrophobicContact CE1-CB 3.48Å; Y51-Q56 VanDerWaalsContact CE1-CB 3.48Å; Y51-Q56 HydrophobicContact CE1-CG 4.22Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.87Å; Y51-Q56 HydrophobicContact CG-CB 4.46Å
52	V	98.1	Very high	96.5	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	119.3	155.7	177.9	0	0	0	0	105.7	S28 M29 D54 T55 F57 W75 L192 Y195 L196 L203	S28-V52 CarbonylContact O-C 3.55Å; S28-V52 VanDerWaalsContact O-CA 3.3Å; S28-V52 WeakPolarHBondContact O-CA 3.25Å; M29-V52 HydrophobicContact CG-CG2 4.38Å; V52-D54 PolarHBondContact O-N 3.36Å; V52-T55 PolarHBondContact N-O 3.21Å; V52-T55 WeakPolarHBondContact O-CB 3.35Å; V52-T55 PolarHBondContact O-N 3.46Å; V52-F57 HydrophobicContact CG2-CD1 3.99Å; V52-F57 HydrophobicContact CG2-CE1 4.01Å; V52-W75 HydrophobicContact CG2-CH2 4Å; V52-L192 HydrophobicContact CG1-CD1 3.62Å; V52-L192 HydrophobicContact CG2-CD1 4.31Å; V52-Y195 HydrophobicContact CG2-CD2 3.97Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.09Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CG1-CG 4.5Å
53	D	95.8	Very high	97.1	Very high	29 Å²	29	37.5 Å²	37.5	16%	0.155	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.6	-123.5	-167.5	-54.4	-40.9	0	0	0	110.6	H27 S28	H27-D53 VanDerWaalsContact CA-OD1 3.25Å; H27-D53 WeakPolarHBondContact CA-OD1 3.21Å; H27-D53 IonicContact CE1-OD2 3.66Å; H27-D53 IonicContact CG-OD2 3.21Å; H27-D53 IonicContact ND1-OD1 3.07Å; H27-D53 IonicContact ND1-OD2 3.39Å; H27-D53 PolarHBondContact ND1-OD2 3.49Å; S28-D53 PolarHBondContact N-OD1 2.96Å; S28-D53 PolarHBondContact O-N 3.18Å; S28-D53 PolarHBondContact OG-OD1 3.48Å
54	D	95.6	Very high	97.3	Very high	65 Å²	65	34.1 Å²	34.1	35%	0.348	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	8.6	179.4	-63.5	-53.9	0	0	0	113.8	V52 Y233 P234 A235 F265	V52-D54 PolarHBondContact O-N 3.36Å; D54-Y233 HydrophobicContact CB-CE2 4.06Å; D54-P234 VanDerWaalsContact OD2-CB 3.28Å; D54-P234 WeakPolarHBondContact OD2-CB 3.42Å; D54-A235 HydrophobicContact CB-CB 4.29Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.33Å; D54-A235 PolarHBondContact OD2-N 3.01Å; D54-F265 HydrophobicContact CB-CE2 3.82Å; D54-F265 HydrophobicContact CB-CZ 3.73Å
55	T	96.5	Very high	97.4	Very high	11 Å²	11	38.6 Å²	38.6	7%	0.067	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	114	-174.5	-57.6	0	0	0	0	111.5	Y51 V52 F57 E73 L203 Y233	Y51-T55 VanDerWaalsContact CA-O 3.31Å; Y51-T55 WeakPolarHBondContact CA-O 3.42Å; Y51-T55 VanDerWaalsContact CD1-C 3.5Å; V52-T55 PolarHBondContact N-O 3.21Å; V52-T55 WeakPolarHBondContact O-CB 3.35Å; V52-T55 PolarHBondContact O-N 3.46Å; T55-F57 PolarHBondContact O-N 2.79Å; T55-E73 VanDerWaalsContact CG2-CD 3.47Å; T55-E73 HydrophobicContact CG2-CG 3.62Å; T55-E73 VanDerWaalsContact CG2-OE1 3.3Å; T55-E73 WeakPolarHBondContact CG2-OE1 3.43Å; T55-L203 HydrophobicContact CG2-CD2 4.12Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.44Å; T55-Y233 PolarHBondContact OG1-OH 2.92Å
56	Q	97.2	Very high	97.3	Very high	53 Å²	53	37.6 Å²	37.6	25%	0.248	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	119.9	176.5	-169.5	-176.3	-8.4	0	0	110.4	V49 G50 Y51 V58 R72 E73	V49-Q56 VanDerWaalsContact CG1-NE2 3.27Å; G50-Q56 CarbonylContact O-C 3.54Å; G50-Q56 WeakPolarHBondContact O-CA 3.46Å; Y51-Q56 HydrophobicContact CD1-CB 3.97Å; Y51-Q56 HydrophobicContact CD2-CG 4.37Å; Y51-Q56 HydrophobicContact CE1-CB 3.48Å; Y51-Q56 VanDerWaalsContact CE1-CB 3.48Å; Y51-Q56 HydrophobicContact CE1-CG 4.22Å; Y51-Q56 HydrophobicContact CE2-CB 4.08Å; Y51-Q56 HydrophobicContact CE2-CG 3.87Å; Y51-Q56 HydrophobicContact CG-CB 4.46Å; Q56-V58 PolarHBondContact NE2-O 3.09Å; Q56-R72 HydrophobicContact CG-CB 4.48Å; Q56-R72 HydrophobicContact CG-CG 4.4Å; Q56-R72 VanDerWaalsContact O-CB 3.22Å; Q56-R72 WeakPolarHBondContact O-CB 3.45Å; Q56-E73 WeakPolarHBondContact O-CG 3.45Å
57	F	97.8	Very high	97.2	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	-21.3	-177.8	75.4	-81.8	0	0	0	114.6	M29 Y31 G50 V52 T55 R72 E73 W75 V76 Y195	M29-F57 HydrophobicContact CG-CE1 4.46Å; M29-F57 HydrophobicContact SD-CZ 4.35Å; Y31-F57 HydrophobicContact CE1-CZ 4.02Å; Y31-F57 AromaticContact CZ-CZ 3.77Å; Y31-F57 WeakPolarHBondContact OH-CZ 3.4Å; G50-F57 WeakPolarHBondContact O-CD1 3.34Å; G50-F57 PolarHBondContact O-N 3.49Å; V52-F57 HydrophobicContact CG2-CD1 3.99Å; V52-F57 HydrophobicContact CG2-CE1 4.01Å; T55-F57 PolarHBondContact O-N 2.79Å; F57-R72 PolarHBondContact O-N 3.09Å; F57-E73 HydrophobicContact CB-CB 4.37Å; F57-E73 HydrophobicContact CB-CG 4.23Å; F57-W75 HydrophobicContact CB-CH2 3.13Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.12Å; F57-W75 AromaticContact CD2-CH2 3.77Å; F57-W75 HydrophobicContact CD2-CH2 3.77Å; F57-W75 HydrophobicContact CD2-CZ3 4.05Å; F57-W75 AromaticContact CG-CH2 3.44Å; F57-W75 HydrophobicContact CG-CH2 3.44Å; F57-W75 VanDerWaalsContact CG-CH2 3.44Å; F57-W75 HydrophobicContact CG-CZ2 4.14Å; F57-W75 HydrophobicContact CG-CZ3 4.19Å; F57-V76 HydrophobicContact CB-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CB 4.34Å; F57-V76 HydrophobicContact CD2-CG1 4.42Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 WeakPolarHBondContact O-CG1 3.43Å; F57-Y195 HydrophobicContact CD2-CE2 4.48Å; F57-Y195 HydrophobicContact CE2-CD2 4.25Å; F57-Y195 AromaticContact CE2-CE2 3.62Å; F57-Y195 HydrophobicContact CE2-CE2 3.62Å; F57-Y195 AromaticContact CE2-CZ 3.78Å; F57-Y195 HydrophobicContact CZ-CD2 4.26Å; F57-Y195 AromaticContact CZ-CE2 3.72Å; F57-Y195 HydrophobicContact CZ-CE2 3.72Å
58	V	98.1	Very high	97.2	Very high	1 Å²	1	44 Å²	44	1%	0.006	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	152.5	178.2	-73.8	0	0	0	0	112.8	Y31 V49 G50 Q56 E70 W84	Y31-V58 HydrophobicContact CE1-CG2 3.96Å; V49-V58 WeakPolarHBondContact CA-O 3.18Å; G50-V58 PolarHBondContact N-O 3.28Å; G50-V58 VanDerWaalsContact N-O 3.08Å; G50-V58 PolarHBondContact O-N 3.44Å; Q56-V58 PolarHBondContact NE2-O 3.09Å; V58-E70 WeakPolarHBondContact CA-O 3.42Å; V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.86Å
59	R	98.3	Very high	97.1	Very high	87 Å²	87	44 Å²	44	33%	0.328	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	149.1	170.9	-179.1	170.6	166.7	175.5	-2.1	111.3	A48 V49 D61 E70 R72	A48-R59 CarbonylContact O-C 3.6Å; A48-R59 WeakPolarHBondContact O-CA 3.43Å; V49-R59 HydrophobicContact CG1-CG 4.26Å; R59-D61 IonicContact NH2-OD2 2.77Å; R59-D61 PolarHBondContact NH2-OD2 2.8Å; R59-E70 PolarHBondContact N-O 2.9Å; R59-E70 PolarHBondContact O-N 3.43Å; R59-R72 HydrophobicContact CB-CG 4.18Å
60	F	98.6	Very high	97	Very high	3 Å²	3	45.5 Å²	45.5	1%	0.013	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	140.9	166	178.7	-84.3	0	0	0	109.3	F46 I47 A48 P67 R68 T88 Y91 K92	F46-F60 AromaticContact CD1-CD1 3.65Å; F46-F60 HydrophobicContact CD1-CD1 3.65Å; F46-F60 AromaticContact CD1-CE1 3.77Å; F46-F60 HydrophobicContact CD1-CE1 3.77Å; F46-F60 AromaticContact CE1-CD1 3.84Å; F46-F60 HydrophobicContact CE1-CD1 3.84Å; F46-F60 HydrophobicContact CE1-CE1 4.23Å; I47-F60 WeakPolarHBondContact CA-O 3.32Å; A48-F60 HydrophobicContact CB-CB 4.37Å; A48-F60 PolarHBondContact N-O 3.33Å; A48-F60 PolarHBondContact O-N 3.48Å; F60-P67 HydrophobicContact CE2-CB 3.94Å; F60-P67 HydrophobicContact CZ-CB 3.69Å; F60-R68 WeakPolarHBondContact CD2-O 3.28Å; F60-T88 HydrophobicContact CE2-CG2 4.5Å; F60-Y91 HydrophobicContact CB-CD1 4.17Å; F60-Y91 HydrophobicContact CB-CD2 3.63Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.73Å; F60-Y91 HydrophobicContact CD1-CG 4.32Å; F60-Y91 AromaticContact CD2-CD2 3.68Å; F60-Y91 HydrophobicContact CD2-CD2 3.68Å; F60-Y91 AromaticContact CD2-CG 3.88Å; F60-Y91 HydrophobicContact CD2-CG 3.88Å; F60-Y91 HydrophobicContact CG-CD1 4.47Å; F60-Y91 AromaticContact CG-CD2 3.81Å; F60-Y91 HydrophobicContact CG-CD2 3.81Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; F60-K92 HydrophobicContact CE2-CG 4.38Å; F60-K92 HydrophobicContact CZ-CG 4.11Å
61	D	98.3	Very high	97	Very high	17 Å²	17	47.7 Å²	47.7	9%	0.091	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	121.9	175.9	-161.7	-27.4	0	0	0	109.3	R45 R59 D63 A64	R45-D61 IonicContact CZ-OD1 2.71Å; R45-D61 IonicContact CZ-OD2 2.68Å; R45-D61 IonicContact NE-OD1 3.15Å; R45-D61 PolarHBondContact NE-OD1 3.31Å; R45-D61 VanDerWaalsContact NE-OD1 3.07Å; R45-D61 IonicContact NE-OD2 3.59Å; R45-D61 IonicContact NH2-OD1 3.57Å; R45-D61 PolarHBondContact NH2-OD1 2.84Å; R45-D61 IonicContact NH2-OD2 3.74Å; R45-D61 PolarHBondContact NH2-OD2 3.29Å; R59-D61 IonicContact NH2-OD2 2.77Å; R59-D61 PolarHBondContact NH2-OD2 2.8Å; D61-D63 PolarHBondContact O-N 2.66Å; D61-D63 PolarHBondContact OD1-N 2.84Å; D61-A64 HydrophobicContact CB-CB 4.41Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 3.12Å
62	S	97.1	Very high	96.9	Very high	33 Å²	33	49.2 Å²	49.2	23%	0.231	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.3	-179.9	62.9	0	0	0	0	113.4	R45 F46 A64 P67	R45-S62 WeakPolarHBondContact CA-OG 3.48Å; F46-S62 PolarHBondContact N-OG 3.36Å; F46-S62 PolarHBondContact O-N 2.96Å; F46-S62 PolarHBondContact O-OG 3.42Å; S62-A64 VanDerWaalsContact C-N 3.34Å; S62-P67 WeakPolarHBondContact O-CG 3.41Å
63	D	95.4	Very high	96.8	Very high	103 Å²	103	51.3 Å²	51.3	55%	0.551	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2	-176.1	-69.8	10.2	0	0	0	112.2	R45 D61	R45-D63 WeakPolarHBondContact CD-OD2 3.44Å; R45-D63 WeakPolarHBondContact CG-OD2 3.35Å; R45-D63 IonicContact NE-OD2 3.51Å; D61-D63 PolarHBondContact O-N 2.66Å; D61-D63 PolarHBondContact OD1-N 2.84Å
64	A	95.3	Very high	96.8	Very high	32 Å²	32	54.2 Å²	54.2	26%	0.264	30%	0.3	S	S	.	.	S	Bend	trans	-61.7	148.3	172.3	0	0	0	0	0	110.6	D61 S62 S66 P67	D61-A64 HydrophobicContact CB-CB 4.41Å; D61-A64 WeakPolarHBondContact O-CB 3.3Å; D61-A64 PolarHBondContact O-N 3.12Å; S62-A64 VanDerWaalsContact C-N 3.34Å; A64-S66 PolarHBondContact O-N 2.82Å; A64-S66 VanDerWaalsContact O-N 3.12Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.48Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.38Å
65	A	95.1	Very high	96.7	Very high	118 Å²	118	51.7 Å²	51.7	98%	0.975	29%	0.286	S	S	*	.	S	Bend	trans	-57.6	-30.7	179.4	0	0	0	0	0	113.1
66	S	95	Very high	96.7	Very high	79 Å²	79	51.2 Å²	51.2	55%	0.552	28%	0.282	S	S	*	.	S	Bend	trans	-134.7	90.2	171.6	-173.5	0	0	0	0	109.2	A64 R68	A64-S66 PolarHBondContact O-N 2.82Å; A64-S66 VanDerWaalsContact O-N 3.12Å; S66-R68 PolarHBondContact O-N 2.93Å; S66-R68 VanDerWaalsContact O-N 3.08Å
67	P	96.3	Very high	96.6	Very high	36 Å²	36	54.3 Å²	54.3	23%	0.234	30%	0.297	C	S	.	.			trans	-65.2	110.7	-175	-24	35.4	0	0	0	112	F60 S62 A64 K92	F60-P67 HydrophobicContact CE2-CB 3.94Å; F60-P67 HydrophobicContact CZ-CB 3.69Å; S62-P67 WeakPolarHBondContact O-CG 3.41Å; A64-P67 VanDerWaalsContact O-CD 3.22Å; A64-P67 WeakPolarHBondContact O-CD 3.48Å; A64-P67 VanDerWaalsContact O-CG 3.29Å; A64-P67 WeakPolarHBondContact O-CG 3.38Å; P67-K92 WeakPolarHBondContact O-CE 3.24Å; P67-K92 PolarHBondContact O-NZ 2.94Å
68	R	97.4	Very high	96.4	Very high	152 Å²	152	60.2 Å²	60.2	57%	0.574	32%	0.324	S	S	*	.			trans	-145.3	159.5	177.2	63	-176	171.1	177.3	-0.8	110.8	F60 S66 E70 T88	F60-R68 WeakPolarHBondContact CD2-O 3.28Å; S66-R68 PolarHBondContact O-N 2.93Å; S66-R68 VanDerWaalsContact O-N 3.08Å; R68-E70 HydrophobicContact CG-CG 4.4Å; R68-E70 PolarHBondContact O-N 3.34Å; R68-T88 HydrophobicContact CB-CG2 4.22Å
69	G	97	Very high	96.3	Very high	6 Å²	6	60.8 Å²	60.8	6%	0.062	33%	0.327	C	S	.	.			trans	-64.9	128.8	168.4	0	0	0	0	0	109.4	T88	G69-T88 PolarHBondContact N-OG1 3.33Å
70	E	97.3	Very high	96.1	Very high	60 Å²	60	58.3 Å²	58.3	28%	0.28	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	131.4	-179.1	-65	177.5	163.1	0	0	109.6	V58 R59 R68 R72	V58-E70 WeakPolarHBondContact CA-O 3.42Å; R59-E70 PolarHBondContact N-O 2.9Å; R59-E70 PolarHBondContact O-N 3.43Å; R68-E70 HydrophobicContact CG-CG 4.4Å; R68-E70 PolarHBondContact O-N 3.34Å; E70-R72 IonicContact OE2-CZ 3.39Å; E70-R72 IonicContact OE2-NH2 3.34Å; E70-R72 PolarHBondContact OE2-NH2 2.92Å
71	P	97.6	Very high	96	Very high	45 Å²	45	62.8 Å²	62.8	29%	0.292	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	149	171	28.3	-33	0	0	0	110.5	V76 E77 W84	P71-V76 HydrophobicContact CB-CG1 3.83Å; P71-E77 HydrophobicContact CB-CG 3.55Å; P71-E77 HydrophobicContact CG-CG 3.74Å; P71-W84 HydrophobicContact CB-CH2 3.58Å; P71-W84 HydrophobicContact CB-CZ2 3.74Å; P71-W84 HydrophobicContact CG-CH2 4.19Å; P71-W84 HydrophobicContact CG-CZ2 4.17Å
72	R	96.9	Very high	96	Very high	104 Å²	104	69.7 Å²	69.7	39%	0.392	39%	0.39	S	S	.	.			trans	-124	-6.6	173.3	-61.4	-65.5	167.3	175.1	-5.6	112.8	Q56 F57 R59 E70	Q56-R72 HydrophobicContact CG-CB 4.48Å; Q56-R72 HydrophobicContact CG-CG 4.4Å; Q56-R72 VanDerWaalsContact O-CB 3.22Å; Q56-R72 WeakPolarHBondContact O-CB 3.45Å; F57-R72 PolarHBondContact O-N 3.09Å; R59-R72 HydrophobicContact CB-CG 4.18Å; E70-R72 IonicContact OE2-CZ 3.39Å; E70-R72 IonicContact OE2-NH2 3.34Å; E70-R72 PolarHBondContact OE2-NH2 2.92Å
73	E	95.8	Very high	96	Very high	43 Å²	43	68.5 Å²	68.5	20%	0.201	38%	0.38	C	S	.	.	S	Bend	trans	-136.1	143.3	178.6	-73.5	-63.8	148.4	0	0	111.5	T55 Q56 F57 W75 V76 E77	T55-E73 VanDerWaalsContact CG2-CD 3.47Å; T55-E73 HydrophobicContact CG2-CG 3.62Å; T55-E73 VanDerWaalsContact CG2-OE1 3.3Å; T55-E73 WeakPolarHBondContact CG2-OE1 3.43Å; Q56-E73 WeakPolarHBondContact O-CG 3.45Å; F57-E73 HydrophobicContact CB-CB 4.37Å; F57-E73 HydrophobicContact CB-CG 4.23Å; E73-W75 VanDerWaalsContact C-N 3.28Å; E73-W75 HydrophobicContact CB-CD2 4.1Å; E73-W75 HydrophobicContact CB-CG 4.26Å; E73-W75 HydrophobicContact CB-CZ2 3.98Å; E73-W75 VanDerWaalsContact CB-NE1 3.32Å; E73-W75 HydrophobicContact CG-CZ2 4.02Å; E73-W75 PolarHBondContact O-N 3.26Å; E73-V76 HydrophobicContact CB-CG1 4.43Å; E73-V76 WeakPolarHBondContact O-CG1 3.49Å; E73-V76 PolarHBondContact O-N 2.93Å; E73-E77 PolarHBondContact O-N 3.45Å
74	P	95.5	Very high	96.1	Very high	90 Å²	90	65.4 Å²	65.4	58%	0.584	36%	0.361	S	S	*	.	H	α-helix	trans	-58.2	-36.1	-179.3	-25.9	34.8	0	0	0	114	V76 E77	P74-V76 PolarHBondContact O-N 2.92Å; P74-E77 WeakPolarHBondContact O-CB 3.44Å; P74-E77 PolarHBondContact O-N 2.68Å; P74-E77 VanDerWaalsContact O-N 3.11Å
75	W	95.4	Very high	96.2	Very high	13 Å²	13	69 Å²	69	5%	0.049	38%	0.376	C	S	.	.	H	α-helix	trans	-70.8	-14.1	-176.4	55.3	-104.3	0	0	0	114.1	V52 F57 E73 Q78 Y195 N198 L203	V52-W75 HydrophobicContact CG2-CH2 4Å; F57-W75 HydrophobicContact CB-CH2 3.13Å; F57-W75 HydrophobicContact CB-CZ2 3.35Å; F57-W75 HydrophobicContact CB-CZ3 4.02Å; F57-W75 HydrophobicContact CD1-CH2 4.12Å; F57-W75 AromaticContact CD2-CH2 3.77Å; F57-W75 HydrophobicContact CD2-CH2 3.77Å; F57-W75 HydrophobicContact CD2-CZ3 4.05Å; F57-W75 AromaticContact CG-CH2 3.44Å; F57-W75 HydrophobicContact CG-CH2 3.44Å; F57-W75 VanDerWaalsContact CG-CH2 3.44Å; F57-W75 HydrophobicContact CG-CZ2 4.14Å; F57-W75 HydrophobicContact CG-CZ3 4.19Å; E73-W75 VanDerWaalsContact C-N 3.28Å; E73-W75 HydrophobicContact CB-CD2 4.1Å; E73-W75 HydrophobicContact CB-CG 4.26Å; E73-W75 HydrophobicContact CB-CZ2 3.98Å; E73-W75 VanDerWaalsContact CB-NE1 3.32Å; E73-W75 HydrophobicContact CG-CZ2 4.02Å; E73-W75 PolarHBondContact O-N 3.26Å; W75-Q78 VanDerWaalsContact O-CG 3.31Å; W75-Q78 WeakPolarHBondContact O-CG 3.4Å; W75-Q78 PolarHBondContact O-NE2 2.73Å; W75-Y195 HydrophobicContact CE3-CD1 4.25Å; W75-Y195 HydrophobicContact CH2-CG 4.22Å; W75-Y195 AromaticContact CZ3-CD1 3.59Å; W75-Y195 HydrophobicContact CZ3-CD1 3.59Å; W75-Y195 HydrophobicContact CZ3-CD2 4.39Å; W75-Y195 HydrophobicContact CZ3-CE1 4.33Å; W75-Y195 AromaticContact CZ3-CG 3.63Å; W75-Y195 HydrophobicContact CZ3-CG 3.63Å; W75-N198 HydrophobicContact CB-CB 4.37Å; W75-N198 WeakPolarHBondContact CB-O 3.44Å; W75-L203 HydrophobicContact CD2-CD1 4.5Å; W75-L203 HydrophobicContact CH2-CD1 4.31Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.18Å; W75-L203 HydrophobicContact CZ2-CG 4.4Å
76	V	96.6	Very high	96.3	Very high	0 Å²	0	68.3 Å²	68.3	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-96.8	-20	170.8	70.8	0	0	0	0	112.1	F57 P71 E73 P74 Q78 E79 Y83 W84 Y195	F57-V76 HydrophobicContact CB-CG1 4.39Å; F57-V76 HydrophobicContact CD2-CB 4.34Å; F57-V76 HydrophobicContact CD2-CG1 4.42Å; F57-V76 HydrophobicContact CD2-CG2 4.07Å; F57-V76 WeakPolarHBondContact O-CG1 3.43Å; P71-V76 HydrophobicContact CB-CG1 3.83Å; E73-V76 HydrophobicContact CB-CG1 4.43Å; E73-V76 WeakPolarHBondContact O-CG1 3.49Å; E73-V76 PolarHBondContact O-N 2.93Å; P74-V76 PolarHBondContact O-N 2.92Å; V76-Q78 PolarHBondContact O-N 2.96Å; V76-E79 HydrophobicContact CG2-CG 4.02Å; V76-E79 VanDerWaalsContact O-CB 3.3Å; V76-E79 WeakPolarHBondContact O-CB 3.5Å; V76-E79 WeakPolarHBondContact O-CG 3.33Å; V76-E79 PolarHBondContact O-N 3.5Å; V76-Y83 HydrophobicContact CG2-CE1 4.11Å; V76-W84 HydrophobicContact CG1-CH2 4.15Å; V76-W84 HydrophobicContact CG1-CZ2 4.37Å; V76-W84 HydrophobicContact CG2-CH2 3.94Å; V76-W84 HydrophobicContact CG2-CZ2 3.99Å; V76-W84 WeakPolarHBondContact O-CZ2 3.04Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å
77	E	94.5	Very high	96.4	Very high	118 Å²	118	65.1 Å²	65.1	55%	0.551	32%	0.324	S	S	*	.	H	α-helix	trans	-60.7	-29.2	177.8	-68.4	-177.6	175.5	0	0	112.8	P71 E73 P74 E79	P71-E77 HydrophobicContact CB-CG 3.55Å; P71-E77 HydrophobicContact CG-CG 3.74Å; E73-E77 PolarHBondContact O-N 3.45Å; P74-E77 WeakPolarHBondContact O-CB 3.44Å; P74-E77 PolarHBondContact O-N 2.68Å; P74-E77 VanDerWaalsContact O-N 3.11Å; E77-E79 PolarHBondContact O-N 3.38Å
78	Q	93.4	Very high	96.4	Very high	124 Å²	124	64 Å²	64	58%	0.579	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-11.3	176.1	66.4	-179.3	9.9	0	0	114.2	W75 V76 N198	W75-Q78 VanDerWaalsContact O-CG 3.31Å; W75-Q78 WeakPolarHBondContact O-CG 3.4Å; W75-Q78 PolarHBondContact O-NE2 2.73Å; V76-Q78 PolarHBondContact O-N 2.96Å; Q78-N198 VanDerWaalsContact NE2-CB 3.31Å; Q78-N198 PolarHBondContact NE2-ND2 3.33Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.12Å; Q78-N198 PolarHBondContact NE2-OD1 3Å
79	E	95.7	Very high	96.5	Very high	13 Å²	13	61.5 Å²	61.5	6%	0.061	31%	0.312	C	S	.	.	S	Bend	trans	-65.3	136.4	174.1	-66.6	-63.1	161.8	0	0	111	V76 E77 Y83 W84 R194 N198	V76-E79 HydrophobicContact CG2-CG 4.02Å; V76-E79 VanDerWaalsContact O-CB 3.3Å; V76-E79 WeakPolarHBondContact O-CB 3.5Å; V76-E79 WeakPolarHBondContact O-CG 3.33Å; V76-E79 PolarHBondContact O-N 3.5Å; E77-E79 PolarHBondContact O-N 3.38Å; E79-Y83 HydrophobicContact CB-CD1 3.5Å; E79-Y83 HydrophobicContact CB-CE1 4.11Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.05Å; E79-Y83 HydrophobicContact CG-CD2 4.47Å; E79-Y83 HydrophobicContact CG-CE1 4.25Å; E79-Y83 HydrophobicContact CG-CG 4.17Å; E79-W84 PolarHBondContact O-NE1 3.03Å; E79-W84 VanDerWaalsContact O-NE1 3.1Å; E79-R194 VanDerWaalsContact CD-NH2 3.34Å; E79-R194 IonicContact OE1-CZ 3.88Å; E79-R194 IonicContact OE1-NE 3.11Å; E79-R194 PolarHBondContact OE1-NE 2.84Å; E79-R194 IonicContact OE1-NH2 2.74Å; E79-R194 PolarHBondContact OE1-NH2 3.09Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 2.76Å; E79-R194 IonicContact OE2-NE 2.73Å; E79-R194 IonicContact OE2-NH2 3.53Å; E79-R194 PolarHBondContact OE2-NH2 3Å; E79-N198 PolarHBondContact OE1-ND2 2.96Å
80	G	94.9	Very high	96.5	Very high	35 Å²	35	64.6 Å²	64.6	36%	0.361	32%	0.323	S	S	.	.			trans	-67.9	167.5	-174.7	0	0	0	0	0	114.3	E82 Y83 W84	G80-E82 PolarHBondContact O-N 2.93Å; G80-E82 VanDerWaalsContact O-N 3.17Å; G80-Y83 WeakPolarHBondContact O-CB 3.38Å; G80-Y83 PolarHBondContact O-N 2.93Å; G80-W84 PolarHBondContact O-N 2.96Å
81	P	96.1	Very high	96.5	Very high	97 Å²	97	62.5 Å²	62.5	63%	0.63	31%	0.313	S	S	*	.	H	α-helix	trans	-57.4	-34.6	-178	22.6	-33.5	0	0	0	113.2	Y83 W84 D85	P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.97Å; P81-W84 PolarHBondContact O-N 3.4Å; P81-W84 VanDerWaalsContact O-N 3.17Å; P81-D85 WeakPolarHBondContact O-CB 3.35Å; P81-D85 PolarHBondContact O-N 3.03Å
82	E	97	Very high	96.5	Very high	163 Å²	163	64.1 Å²	64.1	76%	0.762	32%	0.315	S	S	*	.	H	α-helix	trans	-60.2	-34.8	177.2	-62.6	-179.8	-179.9	0	0	113.1	G80 R86	G80-E82 PolarHBondContact O-N 2.93Å; G80-E82 VanDerWaalsContact O-N 3.17Å; E82-R86 WeakPolarHBondContact O-CB 3.35Å; E82-R86 PolarHBondContact O-N 2.92Å
83	Y	96.9	Very high	96.6	Very high	8 Å²	8	66.4 Å²	66.4	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-65.3	-51.6	174.7	168.2	-92.4	0	0	0	110.1	V76 E79 G80 P81 D85 R86 E87 W191 Y195	V76-Y83 HydrophobicContact CG2-CE1 4.11Å; E79-Y83 HydrophobicContact CB-CD1 3.5Å; E79-Y83 HydrophobicContact CB-CE1 4.11Å; E79-Y83 HydrophobicContact CB-CG 3.74Å; E79-Y83 HydrophobicContact CG-CD1 4.05Å; E79-Y83 HydrophobicContact CG-CD2 4.47Å; E79-Y83 HydrophobicContact CG-CE1 4.25Å; E79-Y83 HydrophobicContact CG-CG 4.17Å; G80-Y83 WeakPolarHBondContact O-CB 3.38Å; G80-Y83 PolarHBondContact O-N 2.93Å; P81-Y83 VanDerWaalsContact C-N 3.26Å; P81-Y83 PolarHBondContact O-N 2.97Å; Y83-D85 PolarHBondContact O-N 3.33Å; Y83-R86 PolarHBondContact O-N 2.9Å; Y83-E87 HydrophobicContact CD1-CG 4.41Å; Y83-E87 HydrophobicContact CD2-CG 4.16Å; Y83-E87 HydrophobicContact CE1-CG 4.01Å; Y83-E87 HydrophobicContact CE2-CG 3.72Å; Y83-E87 HydrophobicContact CG-CG 4.47Å; Y83-E87 WeakPolarHBondContact O-CG 3.46Å; Y83-E87 PolarHBondContact O-N 3.38Å; Y83-W191 AromaticContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CH2 3.49Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CZ2 4.19Å; Y83-W191 AromaticContact CD2-CZ3 3.76Å; Y83-W191 HydrophobicContact CD2-CZ3 3.76Å; Y83-W191 HydrophobicContact CE2-CE3 4.21Å; Y83-W191 AromaticContact CE2-CH2 3.84Å; Y83-W191 HydrophobicContact CE2-CH2 3.84Å; Y83-W191 HydrophobicContact CE2-CZ2 4.45Å; Y83-W191 AromaticContact CE2-CZ3 3.68Å; Y83-W191 HydrophobicContact CE2-CZ3 3.68Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.26Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.49Å; Y83-Y195 PolarHBondContact OH-OH 2.88Å
84	W	97.6	Very high	96.7	Very high	37 Å²	37	66.2 Å²	66.2	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-64.2	-38.8	-177.9	-67.7	111.9	0	0	0	113	V58 P71 V76 E79 G80 P81 T88	V58-W84 HydrophobicContact CG1-CH2 3.9Å; V58-W84 HydrophobicContact CG1-CZ3 3.86Å; P71-W84 HydrophobicContact CB-CH2 3.58Å; P71-W84 HydrophobicContact CB-CZ2 3.74Å; P71-W84 HydrophobicContact CG-CH2 4.19Å; P71-W84 HydrophobicContact CG-CZ2 4.17Å; V76-W84 HydrophobicContact CG1-CH2 4.15Å; V76-W84 HydrophobicContact CG1-CZ2 4.37Å; V76-W84 HydrophobicContact CG2-CH2 3.94Å; V76-W84 HydrophobicContact CG2-CZ2 3.99Å; V76-W84 WeakPolarHBondContact O-CZ2 3.04Å; E79-W84 PolarHBondContact O-NE1 3.03Å; E79-W84 VanDerWaalsContact O-NE1 3.1Å; G80-W84 PolarHBondContact O-N 2.96Å; P81-W84 PolarHBondContact O-N 3.4Å; P81-W84 VanDerWaalsContact O-N 3.17Å; W84-T88 WeakPolarHBondContact O-CB 2.94Å; W84-T88 PolarHBondContact O-N 2.85Å; W84-T88 PolarHBondContact O-OG1 3.45Å
85	D	97.6	Very high	96.8	Very high	108 Å²	108	62.9 Å²	62.9	58%	0.578	30%	0.303	S	S	*	.	H	α-helix	trans	-63.8	-47.2	174.2	-75.9	-22.2	0	0	0	110.7	P81 Y83 T88 Q89	P81-D85 WeakPolarHBondContact O-CB 3.35Å; P81-D85 PolarHBondContact O-N 3.03Å; Y83-D85 PolarHBondContact O-N 3.33Å; D85-T88 PolarHBondContact O-N 2.93Å; D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 3.2Å; D85-Q89 PolarHBondContact O-N 3.39Å
86	R	97	Very high	96.9	Very high	104 Å²	104	68.5 Å²	68.5	39%	0.392	33%	0.33	S	S	.	.	H	α-helix	trans	-62.2	-46.5	178.8	-176.3	179.9	65.5	-143.3	-5.2	112.1	E82 Y83 Q89 K90	E82-R86 WeakPolarHBondContact O-CB 3.35Å; E82-R86 PolarHBondContact O-N 2.92Å; Y83-R86 PolarHBondContact O-N 2.9Å; R86-Q89 PolarHBondContact O-N 2.96Å; R86-K90 WeakPolarHBondContact O-CG 3.45Å; R86-K90 PolarHBondContact O-N 3.32Å
87	E	97	Very high	96.9	Very high	12 Å²	12	70.3 Å²	70.3	6%	0.056	35%	0.345	C	S	.	.	H	α-helix	trans	-65.7	-42.8	178.5	-66.7	-44.2	118.1	0	0	111.2	Y83 Q89 K90 Y91	Y83-E87 HydrophobicContact CD1-CG 4.41Å; Y83-E87 HydrophobicContact CD2-CG 4.16Å; Y83-E87 HydrophobicContact CE1-CG 4.01Å; Y83-E87 HydrophobicContact CE2-CG 3.72Å; Y83-E87 HydrophobicContact CG-CG 4.47Å; Y83-E87 WeakPolarHBondContact O-CG 3.46Å; Y83-E87 PolarHBondContact O-N 3.38Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.39Å; E87-K90 WeakPolarHBondContact O-CB 3.11Å; E87-K90 PolarHBondContact O-N 2.95Å; E87-K90 VanDerWaalsContact O-N 3.07Å; E87-K90 IonicContact OE1-NZ 3.69Å; E87-K90 PolarHBondContact OE1-NZ 3.47Å; E87-K90 WeakPolarHBondContact OE2-CD 3.4Å; E87-K90 IonicContact OE2-NZ 3.74Å; E87-Y91 HydrophobicContact CB-CE2 4.13Å; E87-Y91 WeakPolarHBondContact O-CD2 3.39Å; E87-Y91 PolarHBondContact O-N 2.87Å
88	T	98.1	Very high	97.1	Very high	11 Å²	11	64.8 Å²	64.8	7%	0.067	32%	0.319	C	S	.	.	H	α-helix	trans	-56.3	-44.4	173.8	-64.4	0	0	0	0	111.9	F60 R68 G69 W84 D85 Y91 K92	F60-T88 HydrophobicContact CE2-CG2 4.5Å; R68-T88 HydrophobicContact CB-CG2 4.22Å; G69-T88 PolarHBondContact N-OG1 3.33Å; W84-T88 WeakPolarHBondContact O-CB 2.94Å; W84-T88 PolarHBondContact O-N 2.85Å; W84-T88 PolarHBondContact O-OG1 3.45Å; D85-T88 PolarHBondContact O-N 2.93Å; T88-Y91 PolarHBondContact O-N 3.29Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.48Å; T88-K92 PolarHBondContact O-N 3.41Å
89	Q	98.1	Very high	97.2	Very high	101 Å²	101	63 Å²	63	47%	0.472	31%	0.307	S	S	.	.	H	α-helix	trans	-69.1	-31.5	177.4	-67.6	-57.8	-26.4	0	0	113	D85 R86 E87 R93	D85-Q89 VanDerWaalsContact O-CG 3.29Å; D85-Q89 WeakPolarHBondContact O-CG 3.2Å; D85-Q89 PolarHBondContact O-N 3.39Å; R86-Q89 PolarHBondContact O-N 2.96Å; E87-Q89 VanDerWaalsContact C-N 3.31Å; E87-Q89 PolarHBondContact O-N 3.39Å; Q89-R93 WeakPolarHBondContact O-CB 3.42Å; Q89-R93 WeakPolarHBondContact O-CG 3.17Å; Q89-R93 PolarHBondContact O-N 2.91Å; Q89-R93 VanDerWaalsContact O-N 3.07Å; Q89-R93 PolarHBondContact O-NE 2.98Å
90	K	97.1	Very high	97.2	Very high	70 Å²	70	65.3 Å²	65.3	30%	0.304	32%	0.322	S	S	.	.	H	α-helix	trans	-64.9	-46.4	171.6	-73.4	171.6	179.2	173	0	110.9	R86 E87 K92 R93 Q94	R86-K90 WeakPolarHBondContact O-CG 3.45Å; R86-K90 PolarHBondContact O-N 3.32Å; E87-K90 WeakPolarHBondContact O-CB 3.11Å; E87-K90 PolarHBondContact O-N 2.95Å; E87-K90 VanDerWaalsContact O-N 3.07Å; E87-K90 IonicContact OE1-NZ 3.69Å; E87-K90 PolarHBondContact OE1-NZ 3.47Å; E87-K90 WeakPolarHBondContact OE2-CD 3.4Å; E87-K90 IonicContact OE2-NZ 3.74Å; K90-K92 PolarHBondContact O-N 3.35Å; K90-R93 PolarHBondContact O-N 2.88Å; K90-Q94 PolarHBondContact O-N 3.33Å
91	Y	98.3	Very high	97.3	Very high	16 Å²	16	66 Å²	66	6%	0.063	32%	0.318	C	S	.	.	H	α-helix	trans	-60.6	-45.4	176.9	-65.1	-52	0	0	0	112.2	F46 A48 F60 E87 T88 R93 Q94 A95	F46-Y91 HydrophobicContact CE1-CD1 4.24Å; A48-Y91 HydrophobicContact CB-CD1 3.65Å; A48-Y91 HydrophobicContact CB-CE1 3.59Å; F60-Y91 HydrophobicContact CB-CD1 4.17Å; F60-Y91 HydrophobicContact CB-CD2 3.63Å; F60-Y91 HydrophobicContact CB-CE2 4.01Å; F60-Y91 HydrophobicContact CB-CG 3.73Å; F60-Y91 HydrophobicContact CD1-CG 4.32Å; F60-Y91 AromaticContact CD2-CD2 3.68Å; F60-Y91 HydrophobicContact CD2-CD2 3.68Å; F60-Y91 AromaticContact CD2-CG 3.88Å; F60-Y91 HydrophobicContact CD2-CG 3.88Å; F60-Y91 HydrophobicContact CG-CD1 4.47Å; F60-Y91 AromaticContact CG-CD2 3.81Å; F60-Y91 HydrophobicContact CG-CD2 3.81Å; F60-Y91 AromaticContact CG-CG 3.71Å; F60-Y91 HydrophobicContact CG-CG 3.71Å; E87-Y91 HydrophobicContact CB-CE2 4.13Å; E87-Y91 WeakPolarHBondContact O-CD2 3.39Å; E87-Y91 PolarHBondContact O-N 2.87Å; T88-Y91 PolarHBondContact O-N 3.29Å; Y91-R93 PolarHBondContact O-N 2.9Å; Y91-Q94 PolarHBondContact O-N 2.9Å; Y91-A95 WeakPolarHBondContact O-CB 3.31Å; Y91-A95 PolarHBondContact O-N 3.47Å
92	K	98	Very high	97.4	Very high	79 Å²	79	61.7 Å²	61.7	34%	0.343	29%	0.289	S	S	.	.	H	α-helix	trans	-60.8	-41.8	177	-73	177.9	178.5	176.5	0	112.6	F60 P67 T88 K90 Q96	F60-K92 HydrophobicContact CE2-CG 4.38Å; F60-K92 HydrophobicContact CZ-CG 4.11Å; P67-K92 WeakPolarHBondContact O-CE 3.24Å; P67-K92 PolarHBondContact O-NZ 2.94Å; T88-K92 HydrophobicContact CG2-CD 4.18Å; T88-K92 WeakPolarHBondContact O-CG 3.48Å; T88-K92 PolarHBondContact O-N 3.41Å; K90-K92 PolarHBondContact O-N 3.35Å; K92-Q96 WeakPolarHBondContact O-CG 3.25Å; K92-Q96 PolarHBondContact O-N 3.24Å; K92-Q96 VanDerWaalsContact O-N 3.15Å
93	R	97.9	Very high	97.3	Very high	152 Å²	152	59.9 Å²	59.9	57%	0.574	28%	0.276	S	S	*	.	H	α-helix	trans	-65.7	-40.6	175	-76	-175.6	-70.1	173	-3.1	112.2	Q89 K90 Y91 Q96 A97	Q89-R93 WeakPolarHBondContact O-CB 3.42Å; Q89-R93 WeakPolarHBondContact O-CG 3.17Å; Q89-R93 PolarHBondContact O-N 2.91Å; Q89-R93 VanDerWaalsContact O-N 3.07Å; Q89-R93 PolarHBondContact O-NE 2.98Å; K90-R93 PolarHBondContact O-N 2.88Å; Y91-R93 PolarHBondContact O-N 2.9Å; R93-Q96 PolarHBondContact O-N 3.09Å; R93-A97 PolarHBondContact O-N 3.25Å
94	Q	97.9	Very high	97.2	Very high	39 Å²	39	64.4 Å²	64.4	18%	0.182	30%	0.295	C	S	.	.	H	α-helix	trans	-65.2	-44	176.6	-172.1	64.8	59.2	0	0	111.4	F46 K90 Y91 Q96 A97 D98 R121	F46-Q94 HydrophobicContact CE2-CB 4.12Å; F46-Q94 HydrophobicContact CE2-CG 3.64Å; F46-Q94 HydrophobicContact CZ-CB 3.91Å; F46-Q94 HydrophobicContact CZ-CG 3.78Å; K90-Q94 PolarHBondContact O-N 3.33Å; Y91-Q94 PolarHBondContact O-N 2.9Å; Q94-Q96 VanDerWaalsContact C-N 3.29Å; Q94-Q96 PolarHBondContact O-N 3.5Å; Q94-A97 WeakPolarHBondContact O-CB 3.31Å; Q94-A97 PolarHBondContact O-N 3.35Å; Q94-A97 VanDerWaalsContact O-N 3.08Å; Q94-D98 PolarHBondContact NE2-OD1 3.18Å; Q94-D98 PolarHBondContact O-N 3.23Å; Q94-R121 VanDerWaalsContact OE1-NH1 3.1Å
95	A	97.8	Very high	97.2	Very high	21 Å²	21	63 Å²	63	17%	0.174	29%	0.291	C	S	.	.	H	α-helix	trans	-57.3	-41.8	175.7	0	0	0	0	0	112.3	F46 Y91 D98 R99	F46-A95 HydrophobicContact CB-CB 3.64Å; F46-A95 HydrophobicContact CD1-CB 3.83Å; F46-A95 HydrophobicContact CD2-CB 4.02Å; F46-A95 HydrophobicContact CE1-CB 4.48Å; F46-A95 HydrophobicContact CG-CB 3.56Å; Y91-A95 WeakPolarHBondContact O-CB 3.31Å; Y91-A95 PolarHBondContact O-N 3.47Å; A95-D98 PolarHBondContact O-N 3.33Å; A95-R99 WeakPolarHBondContact O-CB 3.4Å; A95-R99 PolarHBondContact O-N 3.05Å
96	Q	97.2	Very high	97.1	Very high	130 Å²	130	60.9 Å²	60.9	61%	0.607	28%	0.275	S	S	*	.	H	α-helix	trans	-65.4	-41.5	174.4	-72	176.9	-12.1	0	0	112.4	K92 R93 Q94 V100	K92-Q96 WeakPolarHBondContact O-CG 3.25Å; K92-Q96 PolarHBondContact O-N 3.24Å; K92-Q96 VanDerWaalsContact O-N 3.15Å; R93-Q96 PolarHBondContact O-N 3.09Å; Q94-Q96 VanDerWaalsContact C-N 3.29Å; Q94-Q96 PolarHBondContact O-N 3.5Å; Q96-V100 PolarHBondContact O-N 3Å
97	A	97.1	Very high	97.1	Very high	39 Å²	39	58 Å²	58	32%	0.322	28%	0.277	S	S	.	.	H	α-helix	trans	-63.6	-44.5	176.3	0	0	0	0	0	111.4	R93 Q94 R99 V100 N101	R93-A97 PolarHBondContact O-N 3.25Å; Q94-A97 WeakPolarHBondContact O-CB 3.31Å; Q94-A97 PolarHBondContact O-N 3.35Å; Q94-A97 VanDerWaalsContact O-N 3.08Å; A97-R99 VanDerWaalsContact C-N 3.35Å; A97-R99 PolarHBondContact O-N 2.61Å; A97-V100 PolarHBondContact O-N 2.98Å; A97-V100 VanDerWaalsContact O-N 3.11Å; A97-N101 WeakPolarHBondContact O-CB 3.3Å; A97-N101 PolarHBondContact O-N 3.47Å; A97-N101 PolarHBondContact O-ND2 3.28Å
98	D	97.6	Very high	97.1	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-66.7	-37	-179	-71.6	-5.4	0	0	0	111.8	S35 F46 Q94 A95 V100 N101 L102 L119	S35-D98 VanDerWaalsContact OG-CB 3.23Å; S35-D98 WeakPolarHBondContact OG-CB 3.46Å; F46-D98 WeakPolarHBondContact CE2-OD2 3.3Å; Q94-D98 PolarHBondContact NE2-OD1 3.18Å; Q94-D98 PolarHBondContact O-N 3.23Å; A95-D98 PolarHBondContact O-N 3.33Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 2.79Å; D98-N101 PolarHBondContact O-N 2.03Å; D98-L102 WeakPolarHBondContact O-CB 3.45Å; D98-L102 WeakPolarHBondContact O-CG 3.47Å; D98-L102 PolarHBondContact O-N 2.96Å; D98-L119 HydrophobicContact CB-CD2 4.08Å
99	R	96.1	Very high	97.1	Very high	86 Å²	86	63 Å²	63	33%	0.325	30%	0.295	S	S	.	.	H	α-helix	trans	-55.3	-45.4	169.3	175.3	-170.4	177.2	-175.6	1.6	112.2	E43 P44 A95 A97 R103	E43-R99 VanDerWaalsContact CD-NE 3.32Å; E43-R99 VanDerWaalsContact CD-NH2 3.25Å; E43-R99 IonicContact OE1-CZ 2.84Å; E43-R99 IonicContact OE1-NE 3Å; E43-R99 IonicContact OE1-NH1 3.55Å; E43-R99 PolarHBondContact OE1-NH1 3.09Å; E43-R99 IonicContact OE1-NH2 3.01Å; E43-R99 PolarHBondContact OE1-NH2 3.38Å; E43-R99 WeakPolarHBondContact OE2-CD 3.4Å; E43-R99 IonicContact OE2-CZ 3.7Å; E43-R99 IonicContact OE2-NE 3.94Å; E43-R99 PolarHBondContact OE2-NE 3.37Å; E43-R99 IonicContact OE2-NH1 3.88Å; E43-R99 IonicContact OE2-NH2 2.68Å; E43-R99 PolarHBondContact OE2-NH2 2.89Å; P44-R99 HydrophobicContact CG-CB 4.37Å; P44-R99 HydrophobicContact CG-CG 4.28Å; A95-R99 WeakPolarHBondContact O-CB 3.4Å; A95-R99 PolarHBondContact O-N 3.05Å; A97-R99 VanDerWaalsContact C-N 3.35Å; A97-R99 PolarHBondContact O-N 2.61Å; R99-R103 VanDerWaalsContact CZ-NH2 3.33Å
100	V	96.4	Very high	97	Very high	63 Å²	63	65.3 Å²	65.3	38%	0.382	31%	0.311	S	S	.	.	H	α-helix	trans	-69.5	-39.7	177.7	174.2	0	0	0	0	110.8	Q96 A97 D98 R103 K104	Q96-V100 PolarHBondContact O-N 3Å; A97-V100 PolarHBondContact O-N 2.98Å; A97-V100 VanDerWaalsContact O-N 3.11Å; D98-V100 VanDerWaalsContact C-N 3.31Å; D98-V100 PolarHBondContact O-N 2.79Å; V100-R103 PolarHBondContact O-N 2.82Å; V100-K104 HydrophobicContact CG1-CD 4.3Å; V100-K104 WeakPolarHBondContact O-CG 3.31Å; V100-K104 PolarHBondContact O-N 2.85Å; V100-K104 VanDerWaalsContact O-N 3.15Å
101	N	97.3	Very high	97	Very high	49 Å²	49	64.9 Å²	64.9	26%	0.262	31%	0.31	S	S	.	.	H	α-helix	trans	-65.9	-41.9	179.9	-68.8	-27	0	0	0	111.9	A97 D98 R103 K104 L105 L119	A97-N101 WeakPolarHBondContact O-CB 3.3Å; A97-N101 PolarHBondContact O-N 3.47Å; A97-N101 PolarHBondContact O-ND2 3.28Å; D98-N101 PolarHBondContact O-N 2.03Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.78Å; N101-K104 WeakPolarHBondContact O-CB 3.17Å; N101-K104 PolarHBondContact O-N 3.26Å; N101-K104 VanDerWaalsContact O-N 3.08Å; N101-L105 WeakPolarHBondContact O-CB 3.46Å; N101-L105 VanDerWaalsContact O-CG 3.27Å; N101-L105 WeakPolarHBondContact O-CG 3.29Å; N101-L105 PolarHBondContact O-N 2.83Å; N101-L119 HydrophobicContact CB-CD2 3.77Å
102	L	97.1	Very high	96.7	Very high	7 Å²	7	67.9 Å²	67.9	4%	0.037	33%	0.333	C	S	.	.	H	α-helix	trans	-56.1	-43.2	175.1	-78.9	167.1	0	0	0	112	P44 D98 R106 H117 L119 Y142	P44-L102 HydrophobicContact CB-CD1 3.69Å; P44-L102 HydrophobicContact CG-CD1 3.84Å; D98-L102 WeakPolarHBondContact O-CB 3.45Å; D98-L102 WeakPolarHBondContact O-CG 3.47Å; D98-L102 PolarHBondContact O-N 2.96Å; L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 3.19Å; L102-H117 HydrophobicContact CD2-CB 4.17Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.05Å; L102-Y142 HydrophobicContact CD2-CE2 3.97Å
103	R	94.9	Very high	96.2	Very high	125 Å²	125	70.2 Å²	70.2	47%	0.472	35%	0.346	S	S	.	.	H	α-helix	trans	-64.9	-40.1	175.5	-66.4	177.3	-172.6	150.8	-2.2	112.7	R99 V100 N101 G107	R99-R103 VanDerWaalsContact CZ-NH2 3.33Å; V100-R103 PolarHBondContact O-N 2.82Å; N101-R103 VanDerWaalsContact C-N 3.3Å; N101-R103 PolarHBondContact O-N 2.78Å; R103-G107 PolarHBondContact O-N 3.46Å
104	K	96.2	Very high	95.7	Very high	103 Å²	103	69.9 Å²	69.9	45%	0.448	36%	0.355	S	S	.	.	H	α-helix	trans	-66.3	-46.6	177.8	-73.2	174.9	179.3	170.3	0	111.3	V100 N101 G107 Y108	V100-K104 HydrophobicContact CG1-CD 4.3Å; V100-K104 WeakPolarHBondContact O-CG 3.31Å; V100-K104 PolarHBondContact O-N 2.85Å; V100-K104 VanDerWaalsContact O-N 3.15Å; N101-K104 WeakPolarHBondContact O-CB 3.17Å; N101-K104 PolarHBondContact O-N 3.26Å; N101-K104 VanDerWaalsContact O-N 3.08Å; K104-G107 CarbonylContact O-C 3.55Å; K104-G107 WeakPolarHBondContact O-CA 3.42Å; K104-G107 PolarHBondContact O-N 3.14Å; K104-G107 VanDerWaalsContact O-N 3.12Å; K104-Y108 WeakPolarHBondContact O-CD1 3.41Å; K104-Y108 PolarHBondContact O-N 3.43Å
105	L	97.6	Very high	95.3	Very high	7 Å²	7	69 Å²	69	4%	0.037	36%	0.356	C	S	.	.	H	α-helix	trans	-60.3	-48.4	179.5	-70.6	167.2	0	0	0	110.6	N101 G107 Y108 Y109 L119 Y142 Y147	N101-L105 WeakPolarHBondContact O-CB 3.46Å; N101-L105 VanDerWaalsContact O-CG 3.27Å; N101-L105 WeakPolarHBondContact O-CG 3.29Å; N101-L105 PolarHBondContact O-N 2.83Å; L105-G107 PolarHBondContact O-N 3.32Å; L105-Y108 HydrophobicContact CD2-CD2 4.49Å; L105-Y108 PolarHBondContact O-N 2.96Å; L105-Y109 HydrophobicContact CD2-CE2 4.32Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.37Å; L105-Y109 PolarHBondContact O-N 2.94Å; L105-L119 HydrophobicContact CD1-CD1 3.82Å; L105-L119 HydrophobicContact CD1-CD2 4.31Å; L105-Y142 HydrophobicContact CB-CD1 4.34Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.97Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.61Å; L105-Y142 HydrophobicContact CD1-CE2 3.96Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.44Å; L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.08Å; L105-Y147 HydrophobicContact CD2-CE1 3.81Å; L105-Y147 HydrophobicContact CD2-CE2 3.41Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.41Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.37Å
106	R	95.8	Very high	95.2	Very high	64 Å²	64	71 Å²	71	24%	0.242	37%	0.368	C	S	.	.	H	α-helix	trans	-51.1	-43.4	172.9	-170.7	-173.4	67.8	175.9	9.8	112.4	L102 N110 Q111 S112 E113	L102-R106 WeakPolarHBondContact O-CB 3.45Å; L102-R106 PolarHBondContact O-N 3.19Å; R106-N110 PolarHBondContact O-N 2.97Å; R106-N110 VanDerWaalsContact O-N 3.13Å; R106-Q111 HydrophobicContact CG-CB 3.8Å; R106-Q111 PolarHBondContact O-N 3.44Å; R106-S112 WeakPolarHBondContact CD-O 3.47Å; R106-E113 IonicContact CZ-OE1 2.96Å; R106-E113 IonicContact NH1-OE1 3.7Å; R106-E113 IonicContact NH2-OE1 2.96Å; R106-E113 PolarHBondContact NH2-OE1 3.44Å
107	G	96.2	Very high	95.2	Very high	44 Å²	44	65.4 Å²	65.4	45%	0.454	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-43.2	175.4	0	0	0	0	0	113.7	R103 K104 L105 Y109 N110	R103-G107 PolarHBondContact O-N 3.46Å; K104-G107 CarbonylContact O-C 3.55Å; K104-G107 WeakPolarHBondContact O-CA 3.42Å; K104-G107 PolarHBondContact O-N 3.14Å; K104-G107 VanDerWaalsContact O-N 3.12Å; L105-G107 PolarHBondContact O-N 3.32Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.25Å; G107-N110 PolarHBondContact O-N 2.94Å; G107-N110 PolarHBondContact O-OD1 2.93Å
108	Y	97.8	Very high	95.3	Very high	58 Å²	58	65.3 Å²	65.3	23%	0.227	34%	0.338	C	S	.	.	H	α-helix	trans	-63.1	-34.3	178.2	-64.3	-13.8	0	0	0	112.7	K104 L105 I166 K170	K104-Y108 WeakPolarHBondContact O-CD1 3.41Å; K104-Y108 PolarHBondContact O-N 3.43Å; L105-Y108 HydrophobicContact CD2-CD2 4.49Å; L105-Y108 PolarHBondContact O-N 2.96Å; Y108-I166 HydrophobicContact CD1-CD1 4.22Å; Y108-I166 HydrophobicContact CE1-CG2 4.14Å; Y108-I166 HydrophobicContact CE2-CB 4.27Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.23Å; Y108-K170 PolarHBondContact OH-NZ 3.04Å
109	Y	97.6	Very high	95.3	Very high	68 Å²	68	65.5 Å²	65.5	27%	0.267	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	3.2	178.6	-69.8	-72.3	0	0	0	114	L105 G107 Q111 Y142 Y147 D161 A163	L105-Y109 HydrophobicContact CD2-CE2 4.32Å; L105-Y109 VanDerWaalsContact O-CD2 3.25Å; L105-Y109 WeakPolarHBondContact O-CD2 3.37Å; L105-Y109 PolarHBondContact O-N 2.94Å; G107-Y109 VanDerWaalsContact C-N 3.27Å; G107-Y109 PolarHBondContact O-N 3.25Å; Y109-Q111 PolarHBondContact O-N 3.04Å; Y109-Y142 AromaticContact CD2-CD1 3.74Å; Y109-Y142 HydrophobicContact CD2-CD1 3.74Å; Y109-Y142 AromaticContact CD2-CE1 3.51Å; Y109-Y142 HydrophobicContact CD2-CE1 3.51Å; Y109-Y142 AromaticContact CE2-CD1 3.51Å; Y109-Y142 HydrophobicContact CE2-CD1 3.51Å; Y109-Y142 AromaticContact CE2-CE1 3.81Å; Y109-Y142 HydrophobicContact CE2-CE1 3.81Å; Y109-Y142 HydrophobicContact CG-CE1 4.42Å; Y109-Y147 HydrophobicContact CE2-CD2 4.37Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.03Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.39Å; Y109-D161 WeakPolarHBondContact CE1-OD2 3.42Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.25Å; Y109-D161 PolarHBondContact OH-OD1 2.93Å; Y109-D161 PolarHBondContact OH-OD2 3.45Å; Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.39Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.87Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å
110	N	96.3	Very high	95.4	Very high	151 Å²	151	64.9 Å²	64.9	81%	0.807	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	39.9	-177.3	-56.3	-55.7	0	0	0	113.4	R106 G107	R106-N110 PolarHBondContact O-N 2.97Å; R106-N110 VanDerWaalsContact O-N 3.13Å; G107-N110 PolarHBondContact O-N 2.94Å; G107-N110 PolarHBondContact O-OD1 2.93Å
111	Q	95.9	Very high	95.5	Very high	61 Å²	61	62.5 Å²	62.5	29%	0.285	32%	0.324	S	S	.	.			trans	-86	154.5	-177.8	-70.6	164.8	-38.2	0	0	111.8	R106 Y109 H117 Y142 D143	R106-Q111 HydrophobicContact CG-CB 3.8Å; R106-Q111 PolarHBondContact O-N 3.44Å; Y109-Q111 PolarHBondContact O-N 3.04Å; Q111-H117 PolarHBondContact NE2-CE1 2.75Å; Q111-H117 PolarHBondContact OE1-CE1 2.89Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.26Å; Q111-Y142 PolarHBondContact OE1-OH 3.22Å; Q111-D143 PolarHBondContact NE2-OD2 3.16Å
112	S	92.4	Very high	95.6	Very high	78 Å²	78	61.3 Å²	61.3	55%	0.545	32%	0.317	S	S	.	.			trans	-70.1	156.9	-179.6	64.9	0	0	0	0	112.6	R106 D114	R106-S112 WeakPolarHBondContact CD-O 3.47Å; S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 3.3Å
113	E	87	Confident	95.7	Very high	129 Å²	129	62.5 Å²	62.5	60%	0.603	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-22.9	179.5	-58.6	-150.8	125.3	0	0	113.7	P39 R106 G115	P39-E113 WeakPolarHBondContact CB-O 3.21Å; P39-E113 WeakPolarHBondContact CG-O 3.37Å; R106-E113 IonicContact CZ-OE1 2.96Å; R106-E113 IonicContact NH1-OE1 3.7Å; R106-E113 IonicContact NH2-OE1 2.96Å; R106-E113 PolarHBondContact NH2-OE1 3.44Å; E113-G115 VanDerWaalsContact C-N 3.28Å; E113-G115 PolarHBondContact O-N 3.28Å
114	D	87.2	Confident	95.8	Very high	145 Å²	145	56.5 Å²	56.5	78%	0.775	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-6.6	-177.9	-56.1	-42.4	0	0	0	113	S112	S112-D114 VanDerWaalsContact C-N 3.29Å; S112-D114 PolarHBondContact O-N 3.3Å
115	G	90.2	Very high	96	Very high	19 Å²	19	51.6 Å²	51.6	20%	0.196	28%	0.278	C	S	.	.			trans	-74.7	133.3	177.5	0	0	0	0	0	113.2	P39 E113 H117	P39-G115 WeakPolarHBondContact CG-O 3.32Å; E113-G115 VanDerWaalsContact C-N 3.28Å; E113-G115 PolarHBondContact O-N 3.28Å; G115-H117 PolarHBondContact O-CD2 3.43Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å
116	S	95.3	Very high	96	Very high	63 Å²	63	52.3 Å²	52.3	44%	0.441	28%	0.282	S	S	.	.			trans	-79	136.2	163.8	-179.9	0	0	0	0	109.3	S37	S37-S116 WeakPolarHBondContact O-CA 3.41Å; S37-S116 WeakPolarHBondContact O-CB 3.31Å; S37-S116 PolarHBondContact O-OG 3.48Å
117	H	97.3	Very high	96	Very high	14 Å²	14	49.5 Å²	49.5	7%	0.065	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	149.5	-176.8	-64.3	-72.2	0	0	0	110.8	V36 S37 L102 Q111 G115 Y142 D143	V36-H117 WeakPolarHBondContact CA-O 3.39Å; S37-H117 PolarHBondContact N-O 2.95Å; S37-H117 PolarHBondContact OG-N 3.17Å; S37-H117 PolarHBondContact OG-O 3.03Å; L102-H117 HydrophobicContact CD2-CB 4.17Å; Q111-H117 PolarHBondContact NE2-CE1 2.75Å; Q111-H117 PolarHBondContact OE1-CE1 2.89Å; Q111-H117 VanDerWaalsContact OE1-CE1 3.26Å; G115-H117 PolarHBondContact O-CD2 3.43Å; G115-H117 VanDerWaalsContact O-CD2 3.25Å; H117-Y142 HydrophobicContact CB-CE2 3.82Å; H117-Y142 WeakPolarHBondContact CB-OH 3.5Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.84Å; H117-Y142 PolarHBondContact ND1-OH 3.43Å; H117-D143 WeakPolarHBondContact CA-OD1 3.49Å; H117-D143 WeakPolarHBondContact CB-OD1 3.5Å; H117-D143 IonicContact CE1-OD2 3.24Å; H117-D143 IonicContact CG-OD1 3.37Å; H117-D143 IonicContact CG-OD2 2.75Å; H117-D143 IonicContact ND1-OD1 3.57Å; H117-D143 IonicContact ND1-OD2 2.88Å; H117-D143 PolarHBondContact ND1-OD2 2.68Å
118	T	98.4	Very high	95.9	Very high	37 Å²	37	47.7 Å²	47.7	23%	0.227	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	126.8	-176.7	-56.8	0	0	0	0	110.5	T34 S35 V36 Q120 Y142 D143	T34-T118 HydrophobicContact CG2-CG2 3.87Å; S35-T118 CarbonylContact O-C 3.58Å; S35-T118 WeakPolarHBondContact O-CA 3.47Å; V36-T118 HydrophobicContact CG2-CG2 4.31Å; T118-Q120 HydrophobicContact CG2-CG 3.95Å; T118-Y142 CarbonylContact O-C 3.48Å; T118-Y142 WeakPolarHBondContact O-CA 3.48Å; T118-Y142 VanDerWaalsContact O-CD2 3.25Å; T118-Y142 WeakPolarHBondContact O-CD2 3.38Å; T118-D143 PolarHBondContact N-OD1 2.79Å; T118-D143 PolarHBondContact O-N 3.5Å
119	L	98.7	Very high	95.5	Very high	4 Å²	4	49.6 Å²	49.6	2%	0.021	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	123.2	169.8	177	61.8	0	0	0	108.7	T34 S35 D98 N101 L102 L105 F140	T34-L119 WeakPolarHBondContact CA-O 3.36Å; S35-L119 PolarHBondContact N-O 3.32Å; S35-L119 PolarHBondContact O-N 3.33Å; D98-L119 HydrophobicContact CB-CD2 4.08Å; N101-L119 HydrophobicContact CB-CD2 3.77Å; L102-L119 HydrophobicContact CD2-CB 3.66Å; L102-L119 HydrophobicContact CG-CB 4.05Å; L105-L119 HydrophobicContact CD1-CD1 3.82Å; L105-L119 HydrophobicContact CD1-CD2 4.31Å; L119-F140 HydrophobicContact CD1-CD1 4.18Å
120	Q	98.8	Very high	95.1	Very high	74 Å²	74	51 Å²	51	35%	0.346	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	146	177.4	-69.5	169	-75	0	0	110.1	S33 T34 T118 F140 A141	S33-Q120 CarbonylContact O-C 3.59Å; S33-Q120 VanDerWaalsContact O-CA 3.31Å; S33-Q120 WeakPolarHBondContact O-CA 3.45Å; T34-Q120 HydrophobicContact CG2-CG 3.98Å; T118-Q120 HydrophobicContact CG2-CG 3.95Å; Q120-F140 CarbonylContact O-C 3.5Å; Q120-F140 VanDerWaalsContact O-CA 3.23Å; Q120-F140 WeakPolarHBondContact O-CA 3.39Å; Q120-A141 HydrophobicContact CB-CB 4.32Å; Q120-A141 PolarHBondContact N-O 3.19Å; Q120-A141 PolarHBondContact O-N 2.92Å
121	R	98.6	Very high	94.8	Very high	13 Å²	13	44.8 Å²	44.8	5%	0.049	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	134.9	173.1	-174	-172.2	-178.7	-147.5	-16.6	109.6	F32 S33 Q94 F123 N138 Q139 F140 R180	F32-R121 CarbonylContact C-O 3.53Å; F32-R121 WeakPolarHBondContact CA-O 3.39Å; S33-R121 PolarHBondContact N-O 2.72Å; S33-R121 PolarHBondContact O-N 2.86Å; Q94-R121 VanDerWaalsContact OE1-NH1 3.1Å; R121-F123 HydrophobicContact CG-CD1 4.29Å; R121-F123 VanDerWaalsContact CZ-CD1 3.47Å; R121-N138 PolarHBondContact NE-OD1 2.65Å; R121-N138 PolarHBondContact NH2-OD1 3.12Å; R121-Q139 WeakPolarHBondContact CA-O 3.12Å; R121-F140 HydrophobicContact CB-CD1 3.83Å; R121-F140 HydrophobicContact CB-CE1 3.78Å; R121-F140 HydrophobicContact CB-CG 4.47Å; R121-F140 HydrophobicContact CB-CZ 4.35Å; R121-F140 VanDerWaalsContact CD-CE1 3.43Å; R121-F140 HydrophobicContact CG-CD1 3.88Å; R121-F140 HydrophobicContact CG-CD2 4.32Å; R121-F140 HydrophobicContact CG-CE1 3.53Å; R121-F140 HydrophobicContact CG-CE2 3.96Å; R121-F140 HydrophobicContact CG-CG 4.28Å; R121-F140 HydrophobicContact CG-CZ 3.59Å; R121-F140 VanDerWaalsContact NE-CZ 3.29Å; R121-R180 VanDerWaalsContact NH2-NH1 3.2Å
122	M	98.6	Very high	94.7	Very high	23 Å²	23	50.1 Å²	50.1	11%	0.113	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.5	165.9	-176.4	-79.7	-78.7	0	0	108.8	Y31 F32 Y137 N138 Q139	Y31-M122 WeakPolarHBondContact O-CA 3.19Å; F32-M122 HydrophobicContact CD1-CB 3.92Å; F32-M122 HydrophobicContact CD1-CG 3.65Å; F32-M122 HydrophobicContact CE1-CB 4.05Å; F32-M122 HydrophobicContact CE1-CG 3.36Å; F32-M122 HydrophobicContact CG-CG 4.49Å; F32-M122 HydrophobicContact CZ-CG 3.98Å; M122-Y137 HydrophobicContact CE-CD1 4.08Å; M122-Y137 HydrophobicContact CE-CG 4.13Å; M122-Y137 HydrophobicContact SD-CG 4.39Å; M122-N138 WeakPolarHBondContact O-CA 3.26Å; M122-Q139 HydrophobicContact CB-CG 4.08Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 4Å; M122-Q139 VanDerWaalsContact CE-OE1 3.24Å; M122-Q139 PolarHBondContact N-O 3.49Å; M122-Q139 PolarHBondContact O-N 2.82Å
123	F	98.5	Very high	94.9	Very high	32 Å²	32	48.9 Å²	48.9	14%	0.14	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	154.4	171.7	70.6	-83.5	0	0	0	110.9	Y31 R121 Y137 N138 Y183	Y31-F123 VanDerWaalsContact CB-CE1 3.49Å; Y31-F123 VanDerWaalsContact CB-CZ 3.5Å; Y31-F123 HydrophobicContact CD2-CD2 4.45Å; Y31-F123 AromaticContact CD2-CE2 3.75Å; Y31-F123 HydrophobicContact CD2-CE2 3.75Å; Y31-F123 AromaticContact CD2-CZ 3.89Å; Y31-F123 HydrophobicContact CD2-CZ 3.89Å; Y31-F123 HydrophobicContact CG-CE1 4.27Å; Y31-F123 HydrophobicContact CG-CE2 4.12Å; Y31-F123 AromaticContact CG-CZ 3.77Å; Y31-F123 HydrophobicContact CG-CZ 3.77Å; Y31-F123 PolarHBondContact N-O 3.25Å; Y31-F123 PolarHBondContact O-N 3.37Å; R121-F123 HydrophobicContact CG-CD1 4.29Å; R121-F123 VanDerWaalsContact CZ-CD1 3.47Å; F123-Y137 WeakPolarHBondContact CA-O 3.37Å; F123-Y137 VanDerWaalsContact CB-O 3.31Å; F123-Y137 WeakPolarHBondContact CB-O 3.45Å; F123-N138 HydrophobicContact CB-CB 4.19Å; F123-Y183 AromaticContact CD2-CE1 3.84Å; F123-Y183 HydrophobicContact CD2-CE1 3.84Å; F123-Y183 AromaticContact CE2-CE1 3.8Å; F123-Y183 HydrophobicContact CE2-CE1 3.8Å; F123-Y183 AromaticContact CE2-CZ 3.99Å
124	G	98.5	Very high	95.3	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	164	-177.7	-174.9	0	0	0	0	0	113.7	M29 Y137 L184	M29-G124 CarbonylContact O-C 3.49Å; M29-G124 WeakPolarHBondContact O-CA 3.4Å; G124-Y137 PolarHBondContact N-O 3.27Å; G124-Y137 VanDerWaalsContact N-O 3.1Å; G124-Y137 PolarHBondContact O-N 3.44Å; G124-L184 WeakPolarHBondContact O-CD2 3.43Å
125	C	98.5	Very high	95.8	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	148.6	-178.7	52.3	0	0	0	0	111	S28 M29 L133 R135 C188	S28-C125 WeakPolarHBondContact CA-O 3.44Å; M29-C125 PolarHBondContact N-O 3.22Å; M29-C125 PolarHBondContact O-N 3.02Å; C125-L133 HydrophobicContact CB-CD1 3.56Å; C125-R135 CarbonylContact C-O 3.53Å; C125-R135 WeakPolarHBondContact CA-O 3.36Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.36Å; C125-C188 PolarHBondContact N-SG 2.83Å; C125-C188 WeakPolarHBondContact SG-CB 3.33Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.12Å
126	D	98.1	Very high	96.1	Very high	22 Å²	22	45.5 Å²	45.5	12%	0.118	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	136.9	171.7	-58	-11.7	0	0	0	108.6	H27 S28 R30 L134 R135 Y137	H27-D126 CarbonylContact O-C 3.55Å; H27-D126 WeakPolarHBondContact O-CA 3.46Å; S28-D126 WeakPolarHBondContact CB-OD1 3.38Å; R30-D126 IonicContact CZ-OD1 3.7Å; R30-D126 IonicContact NE-OD1 3.85Å; R30-D126 PolarHBondContact NE-OD1 2.84Å; R30-D126 VanDerWaalsContact NE-OD1 3.11Å; R30-D126 VanDerWaalsContact NH2-CG 3.27Å; R30-D126 IonicContact NH2-OD1 2.73Å; R30-D126 PolarHBondContact NH2-OD1 2.87Å; R30-D126 IonicContact NH2-OD2 3.33Å; R30-D126 PolarHBondContact NH2-OD2 3.16Å; D126-L134 HydrophobicContact CB-CB 4.45Å; D126-L134 HydrophobicContact CB-CD2 4.37Å; D126-L134 PolarHBondContact O-N 2.95Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 3.11Å; D126-R135 PolarHBondContact O-N 2.91Å; D126-Y137 WeakPolarHBondContact OD1-CE2 3.34Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.25Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 2.94Å
127	L	96.9	Very high	96.3	Very high	4 Å²	4	44.2 Å²	44.2	2%	0.021	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	138.1	173.5	-54.8	-176.9	0	0	0	109.9	S26 H27 R132 V189 L192 R193	S26-L127 VanDerWaalsContact CA-O 3.28Å; S26-L127 WeakPolarHBondContact CA-O 3.47Å; S26-L127 WeakPolarHBondContact CB-O 3.49Å; H27-L127 PolarHBondContact N-O 3.29Å; H27-L127 VanDerWaalsContact N-O 3.08Å; H27-L127 PolarHBondContact O-N 3.01Å; L127-R132 CarbonylContact C-O 3.59Å; L127-R132 VanDerWaalsContact CA-O 3.23Å; L127-R132 WeakPolarHBondContact CA-O 3.31Å; L127-V189 HydrophobicContact CD1-CG1 4.46Å; L127-V189 HydrophobicContact CD2-CB 4.21Å; L127-V189 HydrophobicContact CD2-CG1 3.81Å; L127-V189 HydrophobicContact CD2-CG2 3.87Å; L127-L192 HydrophobicContact CD1-CB 4.24Å; L127-L192 HydrophobicContact CD1-CD2 3.67Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.24Å; L127-R193 HydrophobicContact CD1-CG 3.99Å
128	G	93.8	Very high	96.3	Very high	7 Å²	7	43.7 Å²	43.7	7%	0.072	22%	0.219	C	C	.	.			trans	-73.8	176	166.7	0	0	0	0	0	112	D130 G131 R132	G128-D130 PolarHBondContact O-N 3.38Å; G128-D130 VanDerWaalsContact O-N 3.13Å; G128-G131 WeakPolarHBondContact O-CA 3.25Å; G128-G131 PolarHBondContact O-N 2.93Å; G128-R132 PolarHBondContact N-O 3.41Å
129	P	89.3	Confident	96.3	Very high	97 Å²	97	45.2 Å²	45.2	63%	0.63	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-23.3	177.8	-25	35	0	0	0	114.9	G25 G131	G25-P129 VanDerWaalsContact O-CA 3.29Å; G25-P129 WeakPolarHBondContact O-CA 2.98Å; P129-G131 PolarHBondContact O-N 3.27Å
130	D	89.1	Confident	96.4	Very high	99 Å²	99	45.8 Å²	45.8	53%	0.529	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81	3.1	173.8	70.5	-13.3	0	0	0	113.3	G128 R132	G128-D130 PolarHBondContact O-N 3.38Å; G128-D130 VanDerWaalsContact O-N 3.13Å; D130-R132 PolarHBondContact O-N 2.6Å; D130-R132 WeakPolarHBondContact OD1-CB 3.44Å; D130-R132 PolarHBondContact OD1-N 3.04Å; D130-R132 WeakPolarHBondContact OD2-CD 3.28Å; D130-R132 WeakPolarHBondContact OD2-CG 3.41Å; D130-R132 IonicContact OD2-CZ 3.66Å; D130-R132 IonicContact OD2-NE 2.72Å; D130-R132 IonicContact OD2-NH1 3.68Å
131	G	89.1	Confident	96.4	Very high	20 Å²	20	43 Å²	43	21%	0.206	22%	0.216	C	C	.	.	S	Bend	trans	71.6	9.9	-178.1	0	0	0	0	0	114	G128 P129 R193	G128-G131 WeakPolarHBondContact O-CA 3.25Å; G128-G131 PolarHBondContact O-N 2.93Å; P129-G131 PolarHBondContact O-N 3.27Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.18Å; G131-R193 VanDerWaalsContact O-NE 3.07Å; G131-R193 PolarHBondContact O-NH2 3.49Å
132	R	93.9	Very high	96.4	Very high	172 Å²	172	42.9 Å²	42.9	65%	0.649	22%	0.216	S	C	*	.			trans	-88.9	153.8	178.5	-62.2	-173.4	-176.5	162.1	-3	111.4	L127 G128 D130 L134	L127-R132 CarbonylContact C-O 3.59Å; L127-R132 VanDerWaalsContact CA-O 3.23Å; L127-R132 WeakPolarHBondContact CA-O 3.31Å; G128-R132 PolarHBondContact N-O 3.41Å; D130-R132 PolarHBondContact O-N 2.6Å; D130-R132 WeakPolarHBondContact OD1-CB 3.44Å; D130-R132 PolarHBondContact OD1-N 3.04Å; D130-R132 WeakPolarHBondContact OD2-CD 3.28Å; D130-R132 WeakPolarHBondContact OD2-CG 3.41Å; D130-R132 IonicContact OD2-CZ 3.66Å; D130-R132 IonicContact OD2-NE 2.72Å; D130-R132 IonicContact OD2-NH1 3.68Å; R132-L134 PolarHBondContact O-N 3.34Å; R132-L134 VanDerWaalsContact O-N 3.14Å
133	L	96.8	Very high	96.3	Very high	53 Å²	53	44.7 Å²	44.7	28%	0.277	23%	0.226	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	118.4	175.5	-177.2	72.6	0	0	0	109.9	C125 R135 L154 E185 V189	C125-L133 HydrophobicContact CB-CD1 3.56Å; L133-R135 WeakPolarHBondContact CD1-O 3.35Å; L133-L154 HydrophobicContact CD2-CD1 4.24Å; L133-E185 HydrophobicContact CD2-CB 4.4Å; L133-E185 HydrophobicContact CD2-CG 3.71Å; L133-V189 HydrophobicContact CB-CG2 4.02Å; L133-V189 HydrophobicContact CD1-CG2 4.07Å
134	L	96.3	Very high	96.3	Very high	124 Å²	124	46 Å²	46	65%	0.649	25%	0.248	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	-45.2	171.9	-175.6	127	0	0	0	110.3	D126 R132	D126-L134 HydrophobicContact CB-CB 4.45Å; D126-L134 HydrophobicContact CB-CD2 4.37Å; D126-L134 PolarHBondContact O-N 2.95Å; R132-L134 PolarHBondContact O-N 3.34Å; R132-L134 VanDerWaalsContact O-N 3.14Å
135	R	96.7	Very high	96.3	Very high	92 Å²	92	53.6 Å²	53.6	35%	0.347	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	145.3	-178.4	-172.8	162.5	169.6	147	11.5	112.2	C125 D126 L133 Y137 E152	C125-R135 CarbonylContact C-O 3.53Å; C125-R135 WeakPolarHBondContact CA-O 3.36Å; D126-R135 HydrophobicContact CB-CB 4.46Å; D126-R135 PolarHBondContact N-O 3.11Å; D126-R135 PolarHBondContact O-N 2.91Å; L133-R135 WeakPolarHBondContact CD1-O 3.35Å; R135-Y137 HydrophobicContact CB-CE2 4.06Å; R135-Y137 VanDerWaalsContact CD-CZ 3.46Å; R135-Y137 WeakPolarHBondContact CD-OH 3.2Å; R135-Y137 HydrophobicContact CG-CD2 4.44Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.74Å; R135-Y137 PolarHBondContact NE-OH 2.83Å; R135-E152 VanDerWaalsContact CZ-CD 3.5Å; R135-E152 IonicContact CZ-OE1 3.96Å; R135-E152 VanDerWaalsContact NH1-CD 3.29Å; R135-E152 IonicContact NH1-OE1 3.58Å; R135-E152 PolarHBondContact NH1-OE1 3.24Å; R135-E152 IonicContact NH1-OE2 3.61Å; R135-E152 IonicContact NH2-OE1 3.91Å; R135-E152 PolarHBondContact NH2-OE1 3.02Å
136	G	98	Very high	96.3	Very high	6 Å²	6	59.4 Å²	59.4	6%	0.062	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	148.6	172.3	0	0	0	0	0	111.6
137	Y	98.3	Very high	96.3	Very high	36 Å²	36	58.8 Å²	58.8	14%	0.141	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	141.9	-177.1	-53.9	-96.9	0	0	0	110.8	R30 M122 F123 G124 D126 R135	R30-Y137 VanDerWaalsContact NH2-CZ 3.26Å; R30-Y137 PolarHBondContact NH2-OH 3.01Å; M122-Y137 HydrophobicContact CE-CD1 4.08Å; M122-Y137 HydrophobicContact CE-CG 4.13Å; M122-Y137 HydrophobicContact SD-CG 4.39Å; F123-Y137 WeakPolarHBondContact CA-O 3.37Å; F123-Y137 VanDerWaalsContact CB-O 3.31Å; F123-Y137 WeakPolarHBondContact CB-O 3.45Å; G124-Y137 PolarHBondContact N-O 3.27Å; G124-Y137 VanDerWaalsContact N-O 3.1Å; G124-Y137 PolarHBondContact O-N 3.44Å; D126-Y137 WeakPolarHBondContact OD1-CE2 3.34Å; D126-Y137 WeakPolarHBondContact OD2-CE2 3.25Å; D126-Y137 VanDerWaalsContact OD2-CZ 3.28Å; D126-Y137 PolarHBondContact OD2-OH 2.94Å; R135-Y137 HydrophobicContact CB-CE2 4.06Å; R135-Y137 VanDerWaalsContact CD-CZ 3.46Å; R135-Y137 WeakPolarHBondContact CD-OH 3.2Å; R135-Y137 HydrophobicContact CG-CD2 4.44Å; R135-Y137 HydrophobicContact CG-CE1 4.03Å; R135-Y137 HydrophobicContact CG-CE2 3.74Å; R135-Y137 PolarHBondContact NE-OH 2.83Å
138	N	98.4	Very high	96.4	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.011	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	101.3	163.8	-179.6	57.2	0	0	0	108.8	R121 M122 F123 L150 W157	R121-N138 PolarHBondContact NE-OD1 2.65Å; R121-N138 PolarHBondContact NH2-OD1 3.12Å; M122-N138 WeakPolarHBondContact O-CA 3.26Å; F123-N138 HydrophobicContact CB-CB 4.19Å; N138-L150 HydrophobicContact CB-CB 4.09Å; N138-L150 HydrophobicContact CB-CD2 4.21Å; N138-L150 WeakPolarHBondContact O-CB 3.49Å; N138-L150 PolarHBondContact O-N 3.26Å; N138-W157 WeakPolarHBondContact ND2-CH2 3.21Å
139	Q	98.6	Very high	96.6	Very high	70 Å²	70	59.9 Å²	59.9	33%	0.327	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	149.9	-174.7	64	-166.9	71.4	0	0	111.5	R121 M122 I148 A149	R121-Q139 WeakPolarHBondContact CA-O 3.12Å; M122-Q139 HydrophobicContact CB-CG 4.08Å; M122-Q139 VanDerWaalsContact CE-CD 3.48Å; M122-Q139 HydrophobicContact CE-CG 4Å; M122-Q139 VanDerWaalsContact CE-OE1 3.24Å; M122-Q139 PolarHBondContact N-O 3.49Å; M122-Q139 PolarHBondContact O-N 2.82Å; Q139-I148 WeakPolarHBondContact CA-O 3.47Å; Q139-A149 HydrophobicContact CB-CB 3.89Å
140	F	98.8	Very high	97.1	Very high	16 Å²	16	56 Å²	56	7%	0.07	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	143.5	-179.7	-66.6	-103.6	0	0	0	110.1	L119 Q120 R121 Y147 I148 W171	L119-F140 HydrophobicContact CD1-CD1 4.18Å; Q120-F140 CarbonylContact O-C 3.5Å; Q120-F140 VanDerWaalsContact O-CA 3.23Å; Q120-F140 WeakPolarHBondContact O-CA 3.39Å; R121-F140 HydrophobicContact CB-CD1 3.83Å; R121-F140 HydrophobicContact CB-CE1 3.78Å; R121-F140 HydrophobicContact CB-CG 4.47Å; R121-F140 HydrophobicContact CB-CZ 4.35Å; R121-F140 VanDerWaalsContact CD-CE1 3.43Å; R121-F140 HydrophobicContact CG-CD1 3.88Å; R121-F140 HydrophobicContact CG-CD2 4.32Å; R121-F140 HydrophobicContact CG-CE1 3.53Å; R121-F140 HydrophobicContact CG-CE2 3.96Å; R121-F140 HydrophobicContact CG-CG 4.28Å; R121-F140 HydrophobicContact CG-CZ 3.59Å; R121-F140 VanDerWaalsContact NE-CZ 3.29Å; F140-Y147 HydrophobicContact CB-CD1 4.44Å; F140-Y147 WeakPolarHBondContact O-CB 3.25Å; F140-Y147 PolarHBondContact O-N 3.49Å; F140-I148 HydrophobicContact CB-CG2 4.23Å; F140-I148 HydrophobicContact CD2-CG2 4.12Å; F140-I148 HydrophobicContact CG-CG2 4.49Å; F140-I148 PolarHBondContact N-O 2.61Å; F140-I148 PolarHBondContact O-N 2.87Å; F140-W171 AromaticContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CZ3 4.32Å; F140-W171 AromaticContact CE2-CH2 3.46Å; F140-W171 HydrophobicContact CE2-CH2 3.46Å; F140-W171 VanDerWaalsContact CE2-CH2 3.46Å; F140-W171 HydrophobicContact CE2-CZ2 4.48Å; F140-W171 HydrophobicContact CE2-CZ3 4.09Å; F140-W171 AromaticContact CZ-CH2 3.94Å; F140-W171 HydrophobicContact CZ-CH2 3.94Å
141	A	98.8	Very high	97.5	Very high	16 Å²	16	53.4 Å²	53.4	13%	0.132	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	145.2	170.8	0	0	0	0	0	109.9	Q120 K145	Q120-A141 HydrophobicContact CB-CB 4.32Å; Q120-A141 PolarHBondContact N-O 3.19Å; Q120-A141 PolarHBondContact O-N 2.92Å; A141-K145 CarbonylContact C-O 3.58Å; A141-K145 WeakPolarHBondContact CA-O 3.2Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.49Å
142	Y	98.7	Very high	97.9	Very high	10 Å²	10	58.9 Å²	58.9	4%	0.039	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	127.5	177.5	-175.4	-120.9	0	0	0	109.7	L102 L105 Y109 Q111 H117 T118 G144 K145	L102-Y142 HydrophobicContact CD2-CE2 3.97Å; L105-Y142 HydrophobicContact CB-CD1 4.34Å; L105-Y142 HydrophobicContact CB-CD2 4.2Å; L105-Y142 HydrophobicContact CB-CE1 3.97Å; L105-Y142 HydrophobicContact CB-CE2 3.85Å; L105-Y142 HydrophobicContact CB-CG 4.43Å; L105-Y142 HydrophobicContact CD1-CD2 3.61Å; L105-Y142 HydrophobicContact CD1-CE2 3.96Å; L105-Y142 HydrophobicContact CD1-CG 4.03Å; L105-Y142 HydrophobicContact CG-CD2 4.44Å; Y109-Y142 AromaticContact CD2-CD1 3.74Å; Y109-Y142 HydrophobicContact CD2-CD1 3.74Å; Y109-Y142 AromaticContact CD2-CE1 3.51Å; Y109-Y142 HydrophobicContact CD2-CE1 3.51Å; Y109-Y142 AromaticContact CE2-CD1 3.51Å; Y109-Y142 HydrophobicContact CE2-CD1 3.51Å; Y109-Y142 AromaticContact CE2-CE1 3.81Å; Y109-Y142 HydrophobicContact CE2-CE1 3.81Å; Y109-Y142 HydrophobicContact CG-CE1 4.42Å; Q111-Y142 PolarHBondContact OE1-OH 3.22Å; H117-Y142 HydrophobicContact CB-CE2 3.82Å; H117-Y142 WeakPolarHBondContact CB-OH 3.5Å; H117-Y142 AromaticContact CG-CZ 3.98Å; H117-Y142 AromaticContact ND1-CZ 3.84Å; H117-Y142 PolarHBondContact ND1-OH 3.43Å; T118-Y142 CarbonylContact O-C 3.48Å; T118-Y142 WeakPolarHBondContact O-CA 3.48Å; T118-Y142 VanDerWaalsContact O-CD2 3.25Å; T118-Y142 WeakPolarHBondContact O-CD2 3.38Å; Y142-G144 PolarHBondContact O-N 2.64Å; Y142-K145 PolarHBondContact N-O 3.1Å; Y142-K145 PolarHBondContact O-N 3.47Å
143	D	97.9	Very high	98.1	Very high	60 Å²	60	54.4 Å²	54.4	32%	0.321	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	40.8	-174.7	-65.1	-21.5	0	0	0	113.1	Q111 H117 T118 K145	Q111-D143 PolarHBondContact NE2-OD2 3.16Å; H117-D143 WeakPolarHBondContact CA-OD1 3.49Å; H117-D143 WeakPolarHBondContact CB-OD1 3.5Å; H117-D143 IonicContact CE1-OD2 3.24Å; H117-D143 IonicContact CG-OD1 3.37Å; H117-D143 IonicContact CG-OD2 2.75Å; H117-D143 IonicContact ND1-OD1 3.57Å; H117-D143 IonicContact ND1-OD2 2.88Å; H117-D143 PolarHBondContact ND1-OD2 2.68Å; T118-D143 PolarHBondContact N-OD1 2.79Å; T118-D143 PolarHBondContact O-N 3.5Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 3.08Å
144	G	97.3	Very high	98.1	Very high	59 Å²	59	52.3 Å²	52.3	61%	0.608	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.4	6	178.1	0	0	0	0	0	115.4	Y142	Y142-G144 PolarHBondContact O-N 2.64Å
145	K	98.5	Very high	98.2	Very high	161 Å²	161	54.2 Å²	54.2	70%	0.7	27%	0.274	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	144.8	177.1	-61.3	-179.3	-176.4	177.7	0	110.9	A141 Y142 D143 Y147	A141-K145 CarbonylContact C-O 3.58Å; A141-K145 WeakPolarHBondContact CA-O 3.2Å; A141-K145 VanDerWaalsContact CB-O 3.26Å; A141-K145 WeakPolarHBondContact CB-O 3.49Å; Y142-K145 PolarHBondContact N-O 3.1Å; Y142-K145 PolarHBondContact O-N 3.47Å; D143-K145 VanDerWaalsContact C-N 3.3Å; D143-K145 PolarHBondContact O-N 3.08Å; K145-Y147 PolarHBondContact O-N 2.96Å
146	D	98.7	Very high	98.3	Very high	121 Å²	121	51.7 Å²	51.7	65%	0.647	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-53.8	135.5	173.6	-69.7	-34.5	0	0	0	110.7	A160	D146-A160 HydrophobicContact CB-CB 4.43Å; D146-A160 WeakPolarHBondContact O-CB 3.4Å
147	Y	98.8	Very high	98.3	Very high	9 Å²	9	51.8 Å²	51.8	4%	0.035	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	-63.9	179.9	179.6	-108	0	0	0	110.6	L105 Y109 F140 K145 A160 A163 A164 T167	L105-Y147 HydrophobicContact CD2-CD1 4.4Å; L105-Y147 HydrophobicContact CD2-CD2 4.08Å; L105-Y147 HydrophobicContact CD2-CE1 3.81Å; L105-Y147 HydrophobicContact CD2-CE2 3.41Å; L105-Y147 VanDerWaalsContact CD2-CE2 3.41Å; L105-Y147 WeakPolarHBondContact CD2-OH 3.37Å; Y109-Y147 HydrophobicContact CE2-CD2 4.37Å; Y109-Y147 HydrophobicContact CE2-CE2 4.08Å; Y109-Y147 WeakPolarHBondContact OH-CD2 3.03Å; Y109-Y147 WeakPolarHBondContact OH-CE2 3.39Å; F140-Y147 HydrophobicContact CB-CD1 4.44Å; F140-Y147 WeakPolarHBondContact O-CB 3.25Å; F140-Y147 PolarHBondContact O-N 3.49Å; K145-Y147 PolarHBondContact O-N 2.96Å; Y147-A160 WeakPolarHBondContact O-CB 3.5Å; Y147-A160 PolarHBondContact O-N 3Å; Y147-A163 HydrophobicContact CE2-CB 4.47Å; Y147-A163 PolarHBondContact OH-O 3.22Å; Y147-A164 HydrophobicContact CD2-CB 3.85Å; Y147-A164 HydrophobicContact CE1-CB 4.45Å; Y147-A164 HydrophobicContact CE2-CB 3.71Å; Y147-A164 HydrophobicContact CG-CB 4.29Å; Y147-A164 WeakPolarHBondContact O-CB 3.28Å; Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 WeakPolarHBondContact OH-CB 3.2Å; Y147-T167 PolarHBondContact OH-OG1 3.19Å
148	I	98.8	Very high	98.3	Very high	3 Å²	3	53.9 Å²	53.9	2%	0.015	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.7	139.1	178.8	-161.3	173.7	0	0	0	110.7	Q139 F140 W157 T158 T167 Q168 W171	Q139-I148 WeakPolarHBondContact CA-O 3.47Å; F140-I148 HydrophobicContact CB-CG2 4.23Å; F140-I148 HydrophobicContact CD2-CG2 4.12Å; F140-I148 HydrophobicContact CG-CG2 4.49Å; F140-I148 PolarHBondContact N-O 2.61Å; F140-I148 PolarHBondContact O-N 2.87Å; I148-W157 HydrophobicContact CD1-CB 4.18Å; I148-W157 HydrophobicContact CD1-CD2 4.45Å; I148-W157 HydrophobicContact CD1-CE3 4.28Å; I148-W157 HydrophobicContact CD1-CG 4.43Å; I148-W157 HydrophobicContact CG1-CB 4.26Å; I148-W157 HydrophobicContact CG1-CE3 4.14Å; I148-T158 WeakPolarHBondContact CA-O 3.37Å; I148-T158 WeakPolarHBondContact CG1-O 3.47Å; I148-T167 HydrophobicContact CD1-CG2 4.02Å; I148-Q168 HydrophobicContact CD1-CB 3.93Å; I148-W171 HydrophobicContact CD1-CE3 4.09Å; I148-W171 HydrophobicContact CD1-CZ3 4.28Å; I148-W171 HydrophobicContact CG2-CE3 4.5Å; I148-W171 HydrophobicContact CG2-CH2 4Å; I148-W171 HydrophobicContact CG2-CZ3 3.69Å
149	A	98.8	Very high	98.3	Very high	32 Å²	32	54.9 Å²	54.9	26%	0.264	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.2	179.5	0	0	0	0	0	111.6	Q139 W157 T158	Q139-A149 HydrophobicContact CB-CB 3.89Å; A149-W157 CarbonylContact O-C 3.59Å; A149-W157 WeakPolarHBondContact O-CA 3.29Å; A149-T158 PolarHBondContact N-O 2.87Å; A149-T158 PolarHBondContact O-N 3.23Å
150	L	98.8	Very high	98.3	Very high	14 Å²	14	54.5 Å²	54.5	7%	0.073	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	128.6	167.9	-175.4	67.5	0	0	0	108.6	N138 L154 W157 A177 R180 L184	N138-L150 HydrophobicContact CB-CB 4.09Å; N138-L150 HydrophobicContact CB-CD2 4.21Å; N138-L150 WeakPolarHBondContact O-CB 3.49Å; N138-L150 PolarHBondContact O-N 3.26Å; L150-L154 HydrophobicContact CD2-CB 4.49Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.31Å; L150-W157 HydrophobicContact CB-CE3 3.97Å; L150-W157 HydrophobicContact CB-CH2 4.14Å; L150-W157 HydrophobicContact CB-CZ3 3.66Å; L150-W157 HydrophobicContact CD1-CD2 4.13Å; L150-W157 HydrophobicContact CD1-CE3 4.25Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.9Å; L150-W157 HydrophobicContact CD1-CZ3 4.2Å; L150-A177 HydrophobicContact CD1-CB 4.03Å; L150-R180 HydrophobicContact CD2-CB 4.01Å; L150-L184 HydrophobicContact CD2-CD1 3.92Å
151	N	98.5	Very high	98.3	Very high	45 Å²	45	56.2 Å²	56.2	24%	0.241	31%	0.313	C	S	.	.			trans	-72.6	163.7	-179.7	-67.3	-26	0	0	0	111.5	D153 L154 S156 T158	N151-D153 PolarHBondContact O-N 3.35Å; N151-D153 VanDerWaalsContact O-N 3.11Å; N151-L154 WeakPolarHBondContact O-CA 3.15Å; N151-L154 PolarHBondContact O-N 3.33Å; N151-S156 WeakPolarHBondContact CB-O 3.49Å; N151-S156 WeakPolarHBondContact CB-OG 3.38Å; N151-S156 PolarHBondContact N-O 3.39Å; N151-S156 PolarHBondContact ND2-OG 2.8Å; N151-T158 PolarHBondContact ND2-OG1 3.07Å; N151-T158 WeakPolarHBondContact OD1-CB 3.47Å; N151-T158 PolarHBondContact OD1-N 2.97Å; N151-T158 PolarHBondContact OD1-OG1 2.89Å
152	E	97.3	Very high	98.3	Very high	136 Å²	136	60.7 Å²	60.7	64%	0.636	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.1	-179.4	-67	178.7	-165.8	0	0	113.4	R135 L154	R135-E152 VanDerWaalsContact CZ-CD 3.5Å; R135-E152 IonicContact CZ-OE1 3.96Å; R135-E152 VanDerWaalsContact NH1-CD 3.29Å; R135-E152 IonicContact NH1-OE1 3.58Å; R135-E152 PolarHBondContact NH1-OE1 3.24Å; R135-E152 IonicContact NH1-OE2 3.61Å; R135-E152 IonicContact NH2-OE1 3.91Å; R135-E152 PolarHBondContact NH2-OE1 3.02Å; E152-L154 PolarHBondContact O-N 3.31Å
153	D	97.3	Very high	98.2	Very high	77 Å²	77	60.4 Å²	60.4	41%	0.412	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-8.1	174.4	70.5	3.7	0	0	0	114	N151 R155 S156	N151-D153 PolarHBondContact O-N 3.35Å; N151-D153 VanDerWaalsContact O-N 3.11Å; D153-R155 WeakPolarHBondContact O-CG 3.36Å; D153-R155 PolarHBondContact O-N 2.87Å; D153-R155 VanDerWaalsContact O-N 3.14Å; D153-R155 PolarHBondContact OD1-N 2.89Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 3.03Å; D153-S156 PolarHBondContact OD1-OG 2.95Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.33Å; D153-S156 PolarHBondContact OD2-OG 3.21Å
154	L	97.8	Very high	98.3	Very high	10 Å²	10	57.6 Å²	57.6	5%	0.052	32%	0.323	C	S	.	.	S	Bend	trans	53.5	25.6	-175.1	-53.8	-178.6	0	0	0	113.9	L133 L150 N151 E152 R181 L184 E185	L133-L154 HydrophobicContact CD2-CD1 4.24Å; L150-L154 HydrophobicContact CD2-CB 4.49Å; L150-L154 HydrophobicContact CD2-CD2 3.77Å; L150-L154 HydrophobicContact CG-CD2 4.31Å; N151-L154 WeakPolarHBondContact O-CA 3.15Å; N151-L154 PolarHBondContact O-N 3.33Å; E152-L154 PolarHBondContact O-N 3.31Å; L154-R181 HydrophobicContact CB-CB 4.11Å; L154-R181 HydrophobicContact CB-CG 3.88Å; L154-R181 HydrophobicContact CD1-CG 4.22Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; L154-E185 HydrophobicContact CD1-CG 4.2Å
155	R	97.6	Very high	98.3	Very high	163 Å²	163	58.3 Å²	58.3	62%	0.615	31%	0.311	S	S	*	.	S	Bend	trans	-132.1	-32.8	-173.6	-71.8	169.5	-176.1	-99.9	12.1	112.6	D153 A177 R181	D153-R155 WeakPolarHBondContact O-CG 3.36Å; D153-R155 PolarHBondContact O-N 2.87Å; D153-R155 VanDerWaalsContact O-N 3.14Å; D153-R155 PolarHBondContact OD1-N 2.89Å; R155-A177 WeakPolarHBondContact O-CB 3.46Å; R155-R181 VanDerWaalsContact CZ-NH1 3.31Å
156	S	97.9	Very high	98.3	Very high	39 Å²	39	53.5 Å²	53.5	27%	0.273	29%	0.292	S	S	.	.			trans	-114.6	163.9	-177.6	63.4	0	0	0	0	112	N151 D153	N151-S156 WeakPolarHBondContact CB-O 3.49Å; N151-S156 WeakPolarHBondContact CB-OG 3.38Å; N151-S156 PolarHBondContact N-O 3.39Å; N151-S156 PolarHBondContact ND2-OG 2.8Å; D153-S156 VanDerWaalsContact CG-OG 3.23Å; D153-S156 PolarHBondContact OD1-N 3.03Å; D153-S156 PolarHBondContact OD1-OG 2.95Å; D153-S156 VanDerWaalsContact OD1-OG 3.12Å; D153-S156 WeakPolarHBondContact OD2-CB 3.33Å; D153-S156 PolarHBondContact OD2-OG 3.21Å
157	W	98.7	Very high	98.3	Very high	9 Å²	9	48.6 Å²	48.6	3%	0.034	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	145.9	-178.5	-59.7	90.5	0	0	0	110.8	N138 I148 A149 L150 Q168 W171 E176 A177 R180	N138-W157 WeakPolarHBondContact ND2-CH2 3.21Å; I148-W157 HydrophobicContact CD1-CB 4.18Å; I148-W157 HydrophobicContact CD1-CD2 4.45Å; I148-W157 HydrophobicContact CD1-CE3 4.28Å; I148-W157 HydrophobicContact CD1-CG 4.43Å; I148-W157 HydrophobicContact CG1-CB 4.26Å; I148-W157 HydrophobicContact CG1-CE3 4.14Å; A149-W157 CarbonylContact O-C 3.59Å; A149-W157 WeakPolarHBondContact O-CA 3.29Å; L150-W157 HydrophobicContact CB-CE3 3.97Å; L150-W157 HydrophobicContact CB-CH2 4.14Å; L150-W157 HydrophobicContact CB-CZ3 3.66Å; L150-W157 HydrophobicContact CD1-CD2 4.13Å; L150-W157 HydrophobicContact CD1-CE3 4.25Å; L150-W157 HydrophobicContact CD1-CH2 4.04Å; L150-W157 HydrophobicContact CD1-CZ2 3.9Å; L150-W157 HydrophobicContact CD1-CZ3 4.2Å; W157-Q168 HydrophobicContact CB-CG 4.21Å; W157-Q168 PolarHBondContact O-NE2 3.18Å; W157-W171 AromaticContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CZ3 4.42Å; W157-W171 AromaticContact CE2-CE3 3.77Å; W157-W171 AromaticContact CE3-CE3 3.79Å; W157-W171 HydrophobicContact CE3-CE3 3.79Å; W157-W171 AromaticContact CE3-CZ3 3.83Å; W157-W171 HydrophobicContact CE3-CZ3 3.83Å; W157-W171 AromaticContact CH2-CE3 3.4Å; W157-W171 HydrophobicContact CH2-CE3 3.4Å; W157-W171 VanDerWaalsContact CH2-CE3 3.4Å; W157-W171 AromaticContact CH2-CZ3 3.42Å; W157-W171 HydrophobicContact CH2-CZ3 3.42Å; W157-W171 VanDerWaalsContact CH2-CZ3 3.42Å; W157-W171 HydrophobicContact CZ2-CD2 4.42Å; W157-W171 AromaticContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CZ3 4.06Å; W157-W171 AromaticContact CZ3-CE3 3.56Å; W157-W171 HydrophobicContact CZ3-CE3 3.56Å; W157-W171 AromaticContact CZ3-CZ3 3.3Å; W157-W171 HydrophobicContact CZ3-CZ3 3.3Å; W157-E176 HydrophobicContact CZ2-CB 4.22Å; W157-A177 HydrophobicContact CZ2-CB 4.31Å; W157-R180 HydrophobicContact CH2-CG 4.29Å
158	T	98.7	Very high	98.3	Very high	79 Å²	79	50.1 Å²	50.1	49%	0.485	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	119.2	166.6	-65.6	0	0	0	0	108.9	I148 A149 N151	I148-T158 WeakPolarHBondContact CA-O 3.37Å; I148-T158 WeakPolarHBondContact CG1-O 3.47Å; A149-T158 PolarHBondContact N-O 2.87Å; A149-T158 PolarHBondContact O-N 3.23Å; N151-T158 PolarHBondContact ND2-OG1 3.07Å; N151-T158 WeakPolarHBondContact OD1-CB 3.47Å; N151-T158 PolarHBondContact OD1-N 2.97Å; N151-T158 PolarHBondContact OD1-OG1 2.89Å
159	A	98.7	Very high	98.3	Very high	23 Å²	23	57.4 Å²	57.4	19%	0.19	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.6	175.7	0	0	0	0	0	110.3	A164 Q165 Q168	A159-A164 HydrophobicContact CB-CB 3.7Å; A159-Q165 HydrophobicContact CB-CG 3.99Å; A159-Q168 HydrophobicContact CB-CB 4.38Å
160	A	98.5	Very high	98.2	Very high	62 Å²	62	61.1 Å²	61.1	51%	0.512	31%	0.311	S	S	.	.	S	Bend	trans	-75.1	-31.5	-176.7	0	0	0	0	0	113.4	D146 Y147	D146-A160 HydrophobicContact CB-CB 4.43Å; D146-A160 WeakPolarHBondContact O-CB 3.4Å; Y147-A160 WeakPolarHBondContact O-CB 3.5Å; Y147-A160 PolarHBondContact O-N 3Å
161	D	98.3	Very high	98.2	Very high	53 Å²	53	62.9 Å²	62.9	28%	0.283	32%	0.317	S	S	.	.	S	Bend	trans	-150.5	-175.4	-177.9	67.3	28.6	0	0	0	113.1	Y109 A163 A164 Q165	Y109-D161 WeakPolarHBondContact CE1-OD2 3.42Å; Y109-D161 VanDerWaalsContact CZ-OD2 3.31Å; Y109-D161 VanDerWaalsContact OH-CG 3.25Å; Y109-D161 PolarHBondContact OH-OD1 2.93Å; Y109-D161 PolarHBondContact OH-OD2 3.45Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.82Å; D161-A163 WeakPolarHBondContact OD1-CA 3.38Å; D161-A163 WeakPolarHBondContact OD1-CB 3.33Å; D161-A163 PolarHBondContact OD1-N 2.83Å; D161-A164 PolarHBondContact O-N 3.2Å; D161-A164 PolarHBondContact OD1-N 2.95Å; D161-Q165 WeakPolarHBondContact O-CG 3.41Å; D161-Q165 PolarHBondContact O-N 2.86Å
162	T	98.1	Very high	98.2	Very high	110 Å²	110	65.2 Å²	65.2	68%	0.675	33%	0.327	S	S	*	.	H	α-helix	trans	-64.8	-29.2	-179.4	50.9	0	0	0	0	113.9
163	A	98.1	Very high	98.3	Very high	4 Å²	4	62.9 Å²	62.9	3%	0.033	33%	0.331	C	S	.	.	H	α-helix	trans	-73	-42.9	175.6	0	0	0	0	0	110.2	Y109 Y147 D161 Q165 I166	Y109-A163 HydrophobicContact CD1-CB 4.16Å; Y109-A163 HydrophobicContact CD2-CB 4.39Å; Y109-A163 HydrophobicContact CE1-CB 3.61Å; Y109-A163 HydrophobicContact CE2-CB 3.87Å; Y109-A163 VanDerWaalsContact CZ-CB 3.45Å; Y147-A163 HydrophobicContact CE2-CB 4.47Å; Y147-A163 PolarHBondContact OH-O 3.22Å; D161-A163 VanDerWaalsContact C-N 3.3Å; D161-A163 PolarHBondContact O-N 2.82Å; D161-A163 WeakPolarHBondContact OD1-CA 3.38Å; D161-A163 WeakPolarHBondContact OD1-CB 3.33Å; D161-A163 PolarHBondContact OD1-N 2.83Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 3.38Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.43Å; A163-I166 PolarHBondContact O-N 2.82Å
164	A	98.5	Very high	98.3	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-60.7	-34.6	173.7	0	0	0	0	0	113	Y147 A159 D161 I166 T167 Q168	Y147-A164 HydrophobicContact CD2-CB 3.85Å; Y147-A164 HydrophobicContact CE1-CB 4.45Å; Y147-A164 HydrophobicContact CE2-CB 3.71Å; Y147-A164 HydrophobicContact CG-CB 4.29Å; Y147-A164 WeakPolarHBondContact O-CB 3.28Å; A159-A164 HydrophobicContact CB-CB 3.7Å; D161-A164 PolarHBondContact O-N 3.2Å; D161-A164 PolarHBondContact OD1-N 2.95Å; A164-I166 PolarHBondContact O-N 3.4Å; A164-T167 WeakPolarHBondContact O-CA 3.48Å; A164-T167 WeakPolarHBondContact O-CB 3.4Å; A164-T167 PolarHBondContact O-N 3.13Å; A164-Q168 PolarHBondContact O-N 2.84Å
165	Q	98.7	Very high	98.3	Very high	75 Å²	75	69 Å²	69	35%	0.35	36%	0.358	S	S	.	.	H	α-helix	trans	-59.9	-28.8	173.3	-73.2	174.5	11.3	0	0	112.9	A159 D161 A163 Q168 R169	A159-Q165 HydrophobicContact CB-CG 3.99Å; D161-Q165 WeakPolarHBondContact O-CG 3.41Å; D161-Q165 PolarHBondContact O-N 2.86Å; A163-Q165 VanDerWaalsContact C-N 3.28Å; A163-Q165 PolarHBondContact O-N 3.38Å; Q165-Q168 PolarHBondContact O-N 2.99Å; Q165-R169 WeakPolarHBondContact O-CG 3.43Å; Q165-R169 PolarHBondContact O-N 3.26Å; Q165-R169 VanDerWaalsContact O-N 3.1Å
166	I	98.3	Very high	98.3	Very high	60 Å²	60	63.3 Å²	63.3	31%	0.308	34%	0.339	S	S	.	.	H	α-helix	trans	-66	-44.3	173.9	-57.1	170.5	0	0	0	109.8	Y108 A163 A164 K170	Y108-I166 HydrophobicContact CD1-CD1 4.22Å; Y108-I166 HydrophobicContact CE1-CG2 4.14Å; Y108-I166 HydrophobicContact CE2-CB 4.27Å; Y108-I166 HydrophobicContact CE2-CG2 4.1Å; Y108-I166 HydrophobicContact CG-CD1 4.23Å; A163-I166 VanDerWaalsContact O-CB 3.25Å; A163-I166 WeakPolarHBondContact O-CB 3.43Å; A163-I166 PolarHBondContact O-N 2.82Å; A164-I166 PolarHBondContact O-N 3.4Å; I166-K170 HydrophobicContact CG2-CD 4.5Å; I166-K170 WeakPolarHBondContact O-CG 3.31Å; I166-K170 PolarHBondContact O-N 2.62Å
167	T	98.3	Very high	98.3	Very high	17 Å²	17	61.9 Å²	61.9	10%	0.104	33%	0.33	C	S	.	.	H	α-helix	trans	-64.8	-45.1	174.9	-70.3	0	0	0	0	111.2	Y147 I148 A164 R169 K170 W171	Y147-T167 HydrophobicContact CE1-CG2 4.2Å; Y147-T167 WeakPolarHBondContact OH-CB 3.2Å; Y147-T167 PolarHBondContact OH-OG1 3.19Å; I148-T167 HydrophobicContact CD1-CG2 4.02Å; A164-T167 WeakPolarHBondContact O-CA 3.48Å; A164-T167 WeakPolarHBondContact O-CB 3.4Å; A164-T167 PolarHBondContact O-N 3.13Å; T167-R169 PolarHBondContact O-N 2.85Å; T167-K170 WeakPolarHBondContact O-CB 3.13Å; T167-K170 PolarHBondContact O-N 3.46Å; T167-K170 VanDerWaalsContact O-N 3.12Å; T167-W171 HydrophobicContact CG2-CD2 3.68Å; T167-W171 HydrophobicContact CG2-CE3 4.12Å; T167-W171 HydrophobicContact CG2-CG 4.07Å; T167-W171 HydrophobicContact CG2-CH2 4.24Å; T167-W171 HydrophobicContact CG2-CZ2 3.84Å; T167-W171 HydrophobicContact CG2-CZ3 4.37Å; T167-W171 PolarHBondContact O-N 3.38Å
168	Q	98.6	Very high	98.2	Very high	41 Å²	41	66.7 Å²	66.7	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-52.1	-54.4	178	176.6	175.1	17.1	0	0	111.7	I148 W157 A159 A164 Q165 K170 W171 E172	I148-Q168 HydrophobicContact CD1-CB 3.93Å; W157-Q168 HydrophobicContact CB-CG 4.21Å; W157-Q168 PolarHBondContact O-NE2 3.18Å; A159-Q168 HydrophobicContact CB-CB 4.38Å; A164-Q168 PolarHBondContact O-N 2.84Å; Q165-Q168 PolarHBondContact O-N 2.99Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.25Å; Q168-W171 PolarHBondContact O-N 2.8Å; Q168-W171 VanDerWaalsContact O-N 3.11Å; Q168-E172 HydrophobicContact CG-CG 4.31Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.25Å; Q168-E172 PolarHBondContact NE2-OE1 2.83Å; Q168-E172 WeakPolarHBondContact O-CB 3.21Å; Q168-E172 WeakPolarHBondContact O-CG 3.36Å; Q168-E172 PolarHBondContact O-N 2.82Å
169	R	98.6	Very high	98.1	Very high	156 Å²	156	68.8 Å²	68.8	59%	0.589	36%	0.356	S	S	*	.	H	α-helix	trans	-58.6	-38.5	180	-67.9	171.3	-165.9	155.7	8.2	112.4	Q165 T167 A173	Q165-R169 WeakPolarHBondContact O-CG 3.43Å; Q165-R169 PolarHBondContact O-N 3.26Å; Q165-R169 VanDerWaalsContact O-N 3.1Å; T167-R169 PolarHBondContact O-N 2.85Å; R169-A173 VanDerWaalsContact O-CB 3.32Å; R169-A173 WeakPolarHBondContact O-CB 3.42Å; R169-A173 PolarHBondContact O-N 2.87Å
170	K	98	Very high	98	Very high	111 Å²	111	70.7 Å²	70.7	48%	0.483	36%	0.359	S	S	.	.	H	α-helix	trans	-66.8	-43.4	177.2	-72.4	176.4	179.6	-177.8	0	111.6	Y108 I166 T167 Q168 A174	Y108-K170 PolarHBondContact OH-NZ 3.04Å; I166-K170 HydrophobicContact CG2-CD 4.5Å; I166-K170 WeakPolarHBondContact O-CG 3.31Å; I166-K170 PolarHBondContact O-N 2.62Å; T167-K170 WeakPolarHBondContact O-CB 3.13Å; T167-K170 PolarHBondContact O-N 3.46Å; T167-K170 VanDerWaalsContact O-N 3.12Å; Q168-K170 VanDerWaalsContact C-N 3.27Å; Q168-K170 PolarHBondContact O-N 3.25Å; K170-A174 WeakPolarHBondContact O-CB 3.49Å; K170-A174 PolarHBondContact O-N 3.24Å
171	W	98.2	Very high	98	Very high	50 Å²	50	71.2 Å²	71.2	19%	0.189	35%	0.347	C	S	.	.	H	α-helix	trans	-71.6	-36.1	-179.4	-76.2	6.9	0	0	0	112.8	F140 I148 W157 T167 Q168 A174 R175 E176	F140-W171 AromaticContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CH2 3.83Å; F140-W171 HydrophobicContact CD2-CZ3 4.32Å; F140-W171 AromaticContact CE2-CH2 3.46Å; F140-W171 HydrophobicContact CE2-CH2 3.46Å; F140-W171 VanDerWaalsContact CE2-CH2 3.46Å; F140-W171 HydrophobicContact CE2-CZ2 4.48Å; F140-W171 HydrophobicContact CE2-CZ3 4.09Å; F140-W171 AromaticContact CZ-CH2 3.94Å; F140-W171 HydrophobicContact CZ-CH2 3.94Å; I148-W171 HydrophobicContact CD1-CE3 4.09Å; I148-W171 HydrophobicContact CD1-CZ3 4.28Å; I148-W171 HydrophobicContact CG2-CE3 4.5Å; I148-W171 HydrophobicContact CG2-CH2 4Å; I148-W171 HydrophobicContact CG2-CZ3 3.69Å; W157-W171 AromaticContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CE3 3.91Å; W157-W171 HydrophobicContact CD2-CZ3 4.42Å; W157-W171 AromaticContact CE2-CE3 3.77Å; W157-W171 AromaticContact CE3-CE3 3.79Å; W157-W171 HydrophobicContact CE3-CE3 3.79Å; W157-W171 AromaticContact CE3-CZ3 3.83Å; W157-W171 HydrophobicContact CE3-CZ3 3.83Å; W157-W171 AromaticContact CH2-CE3 3.4Å; W157-W171 HydrophobicContact CH2-CE3 3.4Å; W157-W171 VanDerWaalsContact CH2-CE3 3.4Å; W157-W171 AromaticContact CH2-CZ3 3.42Å; W157-W171 HydrophobicContact CH2-CZ3 3.42Å; W157-W171 VanDerWaalsContact CH2-CZ3 3.42Å; W157-W171 HydrophobicContact CZ2-CD2 4.42Å; W157-W171 AromaticContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CE3 3.53Å; W157-W171 HydrophobicContact CZ2-CZ3 4.06Å; W157-W171 AromaticContact CZ3-CE3 3.56Å; W157-W171 HydrophobicContact CZ3-CE3 3.56Å; W157-W171 AromaticContact CZ3-CZ3 3.3Å; W157-W171 HydrophobicContact CZ3-CZ3 3.3Å; T167-W171 HydrophobicContact CG2-CD2 3.68Å; T167-W171 HydrophobicContact CG2-CE3 4.12Å; T167-W171 HydrophobicContact CG2-CG 4.07Å; T167-W171 HydrophobicContact CG2-CH2 4.24Å; T167-W171 HydrophobicContact CG2-CZ2 3.84Å; T167-W171 HydrophobicContact CG2-CZ3 4.37Å; T167-W171 PolarHBondContact O-N 3.38Å; Q168-W171 PolarHBondContact O-N 2.8Å; Q168-W171 VanDerWaalsContact O-N 3.11Å; W171-A174 CarbonylContact O-C 3.58Å; W171-A174 PolarHBondContact O-N 2.91Å; W171-R175 PolarHBondContact O-N 3.49Å; W171-E176 HydrophobicContact CB-CB 3.93Å; W171-E176 HydrophobicContact CB-CG 3.92Å; W171-E176 HydrophobicContact CD2-CB 4.49Å; W171-E176 HydrophobicContact CD2-CG 4.45Å; W171-E176 HydrophobicContact CG-CB 4.09Å; W171-E176 HydrophobicContact CG-CG 3.82Å; W171-E176 PolarHBondContact O-N 2.91Å
172	E	98.4	Very high	98	Very high	95 Å²	95	73.5 Å²	73.5	44%	0.444	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-46.7	172	-73	169.9	174.5	0	0	111.1	Q168 A174 R175	Q168-E172 HydrophobicContact CG-CG 4.31Å; Q168-E172 WeakPolarHBondContact CG-OE1 3.25Å; Q168-E172 PolarHBondContact NE2-OE1 2.83Å; Q168-E172 WeakPolarHBondContact O-CB 3.21Å; Q168-E172 WeakPolarHBondContact O-CG 3.36Å; Q168-E172 PolarHBondContact O-N 2.82Å; E172-A174 VanDerWaalsContact C-N 3.26Å; E172-A174 PolarHBondContact O-N 3.11Å; E172-R175 PolarHBondContact O-N 3.14Å; E172-R175 VanDerWaalsContact O-N 3.08Å
173	A	98.3	Very high	98	Very high	87 Å²	87	71 Å²	71	72%	0.719	34%	0.342	S	S	*	.	H	α-helix	trans	-61.2	-35.4	175.8	0	0	0	0	0	112.7	R169	R169-A173 VanDerWaalsContact O-CB 3.32Å; R169-A173 WeakPolarHBondContact O-CB 3.42Å; R169-A173 PolarHBondContact O-N 2.87Å
174	A	97.9	Very high	98	Very high	53 Å²	53	70.9 Å²	70.9	44%	0.438	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.4	177	0	0	0	0	0	114.1	K170 W171 E172 E176	K170-A174 WeakPolarHBondContact O-CB 3.49Å; K170-A174 PolarHBondContact O-N 3.24Å; W171-A174 CarbonylContact O-C 3.58Å; W171-A174 PolarHBondContact O-N 2.91Å; E172-A174 VanDerWaalsContact C-N 3.26Å; E172-A174 PolarHBondContact O-N 3.11Å; A174-E176 HydrophobicContact CB-CG 4.08Å; A174-E176 PolarHBondContact O-N 3.14Å
175	R	97.4	Very high	98	Very high	161 Å²	161	75.1 Å²	75.1	61%	0.608	36%	0.361	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	37.9	-176.4	-55.5	-175.8	178.3	-163.5	1.9	114.1	W171 E172 A177 E178	W171-R175 PolarHBondContact O-N 3.49Å; E172-R175 PolarHBondContact O-N 3.14Å; E172-R175 VanDerWaalsContact O-N 3.08Å; R175-A177 PolarHBondContact O-N 2.8Å; R175-A177 VanDerWaalsContact O-N 3.15Å; R175-E178 HydrophobicContact CB-CG 4.25Å; R175-E178 IonicContact NH1-OE1 2.79Å; R175-E178 WeakPolarHBondContact O-CB 3.5Å; R175-E178 PolarHBondContact O-N 2.83Å
176	E	97.3	Very high	97.9	Very high	45 Å²	45	72.5 Å²	72.5	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-57.9	-31.4	-178.2	-72.8	-75.7	169	0	0	112.8	W157 W171 A174 E178 Q179 R180	W157-E176 HydrophobicContact CZ2-CB 4.22Å; W171-E176 HydrophobicContact CB-CB 3.93Å; W171-E176 HydrophobicContact CB-CG 3.92Å; W171-E176 HydrophobicContact CD2-CB 4.49Å; W171-E176 HydrophobicContact CD2-CG 4.45Å; W171-E176 HydrophobicContact CG-CB 4.09Å; W171-E176 HydrophobicContact CG-CG 3.82Å; W171-E176 PolarHBondContact O-N 2.91Å; A174-E176 HydrophobicContact CB-CG 4.08Å; A174-E176 PolarHBondContact O-N 3.14Å; E176-E178 VanDerWaalsContact C-N 3.27Å; E176-E178 PolarHBondContact O-N 3.41Å; E176-Q179 PolarHBondContact O-N 3.08Å; E176-R180 WeakPolarHBondContact O-CG 3.33Å; E176-R180 PolarHBondContact O-N 3.34Å; E176-R180 VanDerWaalsContact O-N 3.09Å
177	A	98.1	Very high	97.9	Very high	9 Å²	9	72 Å²	72	7%	0.074	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-36.8	177.2	0	0	0	0	0	112.4	L150 R155 W157 R175 Q179 R180 R181	L150-A177 HydrophobicContact CD1-CB 4.03Å; R155-A177 WeakPolarHBondContact O-CB 3.46Å; W157-A177 HydrophobicContact CZ2-CB 4.31Å; R175-A177 PolarHBondContact O-N 2.8Å; R175-A177 VanDerWaalsContact O-N 3.15Å; A177-Q179 VanDerWaalsContact C-N 3.34Å; A177-Q179 PolarHBondContact O-N 2.84Å; A177-R180 PolarHBondContact O-N 3.13Å; A177-R181 WeakPolarHBondContact O-CB 3.38Å; A177-R181 PolarHBondContact O-N 2.88Å
178	E	97.7	Very high	97.9	Very high	110 Å²	110	71.2 Å²	71.2	51%	0.514	35%	0.349	S	S	.	.	H	α-helix	trans	-64	-40.2	179.4	-63.8	178.5	176	0	0	111.5	R175 E176 T182	R175-E178 HydrophobicContact CB-CG 4.25Å; R175-E178 IonicContact NH1-OE1 2.79Å; R175-E178 WeakPolarHBondContact O-CB 3.5Å; R175-E178 PolarHBondContact O-N 2.83Å; E176-E178 VanDerWaalsContact C-N 3.27Å; E176-E178 PolarHBondContact O-N 3.41Å; E178-T182 WeakPolarHBondContact O-CB 3.4Å; E178-T182 PolarHBondContact O-N 2.74Å; E178-T182 PolarHBondContact O-OG1 3Å
179	Q	95.9	Very high	97.9	Very high	122 Å²	122	69.7 Å²	69.7	57%	0.57	34%	0.343	S	S	*	.	H	α-helix	trans	-68	-43	176.7	-62.3	-175.3	13	0	0	111.4	E176 A177 T182 Y183	E176-Q179 PolarHBondContact O-N 3.08Å; A177-Q179 VanDerWaalsContact C-N 3.34Å; A177-Q179 PolarHBondContact O-N 2.84Å; Q179-T182 PolarHBondContact O-N 3.25Å; Q179-Y183 PolarHBondContact O-N 3.12Å; Q179-Y183 VanDerWaalsContact O-N 3.13Å
180	R	97.6	Very high	97.9	Very high	64 Å²	64	68.2 Å²	68.2	24%	0.242	34%	0.342	C	S	.	.	H	α-helix	trans	-63.9	-44.8	177.5	-62.4	-59.6	169.3	-162.7	-3	111.2	R121 L150 W157 E176 A177 T182 Y183 L184	R121-R180 VanDerWaalsContact NH2-NH1 3.2Å; L150-R180 HydrophobicContact CD2-CB 4.01Å; W157-R180 HydrophobicContact CH2-CG 4.29Å; E176-R180 WeakPolarHBondContact O-CG 3.33Å; E176-R180 PolarHBondContact O-N 3.34Å; E176-R180 VanDerWaalsContact O-N 3.09Å; A177-R180 PolarHBondContact O-N 3.13Å; R180-T182 PolarHBondContact O-N 3.4Å; R180-Y183 PolarHBondContact O-N 3.11Å; R180-L184 WeakPolarHBondContact O-CB 3.33Å; R180-L184 WeakPolarHBondContact O-CG 3.23Å; R180-L184 PolarHBondContact O-N 2.86Å
181	R	98.1	Very high	97.8	Very high	72 Å²	72	64.9 Å²	64.9	27%	0.272	33%	0.327	S	S	.	.	H	α-helix	trans	-58.6	-47	175.4	-175	172.6	-179	-133.1	-13.1	112.1	L154 R155 A177 Y183 L184 E185	L154-R181 HydrophobicContact CB-CB 4.11Å; L154-R181 HydrophobicContact CB-CG 3.88Å; L154-R181 HydrophobicContact CD1-CG 4.22Å; R155-R181 VanDerWaalsContact CZ-NH1 3.31Å; A177-R181 WeakPolarHBondContact O-CB 3.38Å; A177-R181 PolarHBondContact O-N 2.88Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.73Å; R181-L184 PolarHBondContact O-N 3.46Å; R181-L184 VanDerWaalsContact O-N 3.16Å; R181-E185 HydrophobicContact CG-CG 4.07Å; R181-E185 IonicContact CZ-OE1 3.44Å; R181-E185 VanDerWaalsContact CZ-OE1 3.24Å; R181-E185 IonicContact CZ-OE2 3.94Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 3.52Å; R181-E185 PolarHBondContact NE-OE1 2.76Å; R181-E185 IonicContact NE-OE2 3.98Å; R181-E185 PolarHBondContact NE-OE2 2.91Å; R181-E185 IonicContact NH2-OE1 2.62Å; R181-E185 PolarHBondContact NH2-OE1 2.72Å; R181-E185 IonicContact NH2-OE2 3.97Å; R181-E185 PolarHBondContact NH2-OE2 3.1Å; R181-E185 WeakPolarHBondContact O-CB 3.46Å; R181-E185 PolarHBondContact O-N 2.9Å
182	T	98.2	Very high	97.8	Very high	102 Å²	102	62.5 Å²	62.5	63%	0.626	32%	0.318	S	S	*	.	H	α-helix	trans	-56.9	-43.5	177.1	-57.5	0	0	0	0	111.9	E178 Q179 R180 G186	E178-T182 WeakPolarHBondContact O-CB 3.4Å; E178-T182 PolarHBondContact O-N 2.74Å; E178-T182 PolarHBondContact O-OG1 3Å; Q179-T182 PolarHBondContact O-N 3.25Å; R180-T182 PolarHBondContact O-N 3.4Å; T182-G186 PolarHBondContact O-N 2.82Å; T182-G186 VanDerWaalsContact O-N 3.13Å
183	Y	97.8	Very high	97.8	Very high	56 Å²	56	63.8 Å²	63.8	22%	0.22	32%	0.319	C	S	.	.	I	π-helix	trans	-66.1	-45.5	175.7	172	-95.7	0	0	0	112.3	F123 Q179 R180 R181 T187 C188	F123-Y183 AromaticContact CD2-CE1 3.84Å; F123-Y183 HydrophobicContact CD2-CE1 3.84Å; F123-Y183 AromaticContact CE2-CE1 3.8Å; F123-Y183 HydrophobicContact CE2-CE1 3.8Å; F123-Y183 AromaticContact CE2-CZ 3.99Å; Q179-Y183 PolarHBondContact O-N 3.12Å; Q179-Y183 VanDerWaalsContact O-N 3.13Å; R180-Y183 PolarHBondContact O-N 3.11Å; R181-Y183 VanDerWaalsContact C-N 3.3Å; R181-Y183 PolarHBondContact O-N 2.73Å; Y183-T187 HydrophobicContact CD2-CG2 3.9Å; Y183-T187 HydrophobicContact CE2-CG2 3.69Å; Y183-T187 PolarHBondContact O-N 3.04Å; Y183-T187 VanDerWaalsContact O-N 3.14Å; Y183-C188 HydrophobicContact CD1-CB 4.37Å; Y183-C188 HydrophobicContact CE1-CB 3.96Å; Y183-C188 WeakPolarHBondContact O-CB 3.35Å; Y183-C188 PolarHBondContact O-N 3.11Å
184	L	98.4	Very high	97.7	Very high	2 Å²	2	65.5 Å²	65.5	1%	0.01	31%	0.306	C	S	.	.	I	π-helix	trans	-70.5	-39	-174.9	-70.4	170.9	0	0	0	112.8	G124 L150 L154 R180 R181 V189	G124-L184 WeakPolarHBondContact O-CD2 3.43Å; L150-L184 HydrophobicContact CD2-CD1 3.92Å; L154-L184 HydrophobicContact CD2-CD1 3.97Å; R180-L184 WeakPolarHBondContact O-CB 3.33Å; R180-L184 WeakPolarHBondContact O-CG 3.23Å; R180-L184 PolarHBondContact O-N 2.86Å; R181-L184 PolarHBondContact O-N 3.46Å; R181-L184 VanDerWaalsContact O-N 3.16Å; L184-V189 WeakPolarHBondContact O-CG2 3.29Å
185	E	98	Very high	97.6	Very high	89 Å²	89	63 Å²	63	42%	0.416	29%	0.286	S	S	.	.	I	π-helix	trans	-80.1	-25.1	178.2	-68.6	-179.6	165.6	0	0	113.1	L133 L154 R181	L133-E185 HydrophobicContact CD2-CB 4.4Å; L133-E185 HydrophobicContact CD2-CG 3.71Å; L154-E185 HydrophobicContact CD1-CG 4.2Å; R181-E185 HydrophobicContact CG-CG 4.07Å; R181-E185 IonicContact CZ-OE1 3.44Å; R181-E185 VanDerWaalsContact CZ-OE1 3.24Å; R181-E185 IonicContact CZ-OE2 3.94Å; R181-E185 VanDerWaalsContact NE-CD 3.32Å; R181-E185 IonicContact NE-OE1 3.52Å; R181-E185 PolarHBondContact NE-OE1 2.76Å; R181-E185 IonicContact NE-OE2 3.98Å; R181-E185 PolarHBondContact NE-OE2 2.91Å; R181-E185 IonicContact NH2-OE1 2.62Å; R181-E185 PolarHBondContact NH2-OE1 2.72Å; R181-E185 IonicContact NH2-OE2 3.97Å; R181-E185 PolarHBondContact NH2-OE2 3.1Å; R181-E185 WeakPolarHBondContact O-CB 3.46Å; R181-E185 PolarHBondContact O-N 2.9Å
186	G	97.8	Very high	97.6	Very high	21 Å²	21	56 Å²	56	22%	0.216	26%	0.26	C	S	.	.	I	π-helix	trans	-108	-90.3	-179.2	0	0	0	0	0	112.4	T182 C188 V189 E190	T182-G186 PolarHBondContact O-N 2.82Å; T182-G186 VanDerWaalsContact O-N 3.13Å; G186-C188 VanDerWaalsContact C-N 3.31Å; G186-C188 PolarHBondContact O-N 2.72Å; G186-V189 WeakPolarHBondContact O-CB 3.27Å; G186-V189 PolarHBondContact O-N 2.93Å; G186-V189 VanDerWaalsContact O-N 3.07Å; G186-E190 WeakPolarHBondContact O-CG 3.38Å; G186-E190 PolarHBondContact O-N 2.86Å
187	T	97.7	Very high	97.4	Very high	49 Å²	49	59.8 Å²	59.8	30%	0.301	28%	0.278	S	S	.	.	I	π-helix	trans	-52.8	-43.6	-170.4	-55.6	0	0	0	0	113.3	Y183 V189 E190 W191	Y183-T187 HydrophobicContact CD2-CG2 3.9Å; Y183-T187 HydrophobicContact CE2-CG2 3.69Å; Y183-T187 PolarHBondContact O-N 3.04Å; Y183-T187 VanDerWaalsContact O-N 3.14Å; T187-V189 PolarHBondContact O-N 2.89Å; T187-E190 PolarHBondContact O-N 3.42Å; T187-W191 VanDerWaalsContact CG2-CD1 3.45Å; T187-W191 WeakPolarHBondContact O-CB 3.31Å; T187-W191 PolarHBondContact O-N 3.26Å
188	C	98.3	Very high	97.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-60.6	-47.7	180	-170	0	0	0	0	111.6	M29 C125 Y183 G186 W191 L192	M29-C188 HydrophobicContact CE-CB 4.18Å; M29-C188 WeakPolarHBondContact CE-O 3.42Å; M29-C188 WeakPolarHBondContact CE-SG 3.45Å; C125-C188 HydrophobicContact CB-CB 3.93Å; C125-C188 WeakPolarHBondContact CB-SG 3.36Å; C125-C188 PolarHBondContact N-SG 2.83Å; C125-C188 WeakPolarHBondContact SG-CB 3.33Å; C125-C188 CovalentContact SG-SG 2.04Å; C125-C188 PolarHBondContact SG-SG 3.12Å; Y183-C188 HydrophobicContact CD1-CB 4.37Å; Y183-C188 HydrophobicContact CE1-CB 3.96Å; Y183-C188 WeakPolarHBondContact O-CB 3.35Å; Y183-C188 PolarHBondContact O-N 3.11Å; G186-C188 VanDerWaalsContact C-N 3.31Å; G186-C188 PolarHBondContact O-N 2.72Å; C188-W191 PolarHBondContact O-N 3.26Å; C188-L192 WeakPolarHBondContact O-CB 3.47Å; C188-L192 PolarHBondContact O-N 3.22Å
189	V	98.1	Very high	97.2	Very high	9 Å²	9	56.8 Å²	56.8	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-62.3	-45.2	178.4	177.3	0	0	0	0	111.1	L127 L133 L184 G186 T187 R193	L127-V189 HydrophobicContact CD1-CG1 4.46Å; L127-V189 HydrophobicContact CD2-CB 4.21Å; L127-V189 HydrophobicContact CD2-CG1 3.81Å; L127-V189 HydrophobicContact CD2-CG2 3.87Å; L133-V189 HydrophobicContact CB-CG2 4.02Å; L133-V189 HydrophobicContact CD1-CG2 4.07Å; L184-V189 WeakPolarHBondContact O-CG2 3.29Å; G186-V189 WeakPolarHBondContact O-CB 3.27Å; G186-V189 PolarHBondContact O-N 2.93Å; G186-V189 VanDerWaalsContact O-N 3.07Å; T187-V189 PolarHBondContact O-N 2.89Å; V189-R193 WeakPolarHBondContact O-CG 3.45Å; V189-R193 PolarHBondContact O-N 2.9Å
190	E	97.9	Very high	97.1	Very high	125 Å²	125	56.2 Å²	56.2	58%	0.584	26%	0.261	S	S	*	.	H	α-helix	trans	-61.5	-46.6	179.6	-71	173.1	174.3	0	0	112.2	G186 T187 R194	G186-E190 WeakPolarHBondContact O-CG 3.38Å; G186-E190 PolarHBondContact O-N 2.86Å; T187-E190 PolarHBondContact O-N 3.42Å; E190-R194 PolarHBondContact O-N 3.08Å; E190-R194 VanDerWaalsContact O-N 3.1Å
191	W	97.8	Very high	96.7	Very high	42 Å²	42	61.8 Å²	61.8	16%	0.159	29%	0.289	C	S	.	.	H	α-helix	trans	-69	-41.6	179.5	-82.4	98.8	0	0	0	112.3	M29 Y83 T187 C188 R193 R194 Y195	M29-W191 HydrophobicContact CE-CB 4.09Å; M29-W191 HydrophobicContact SD-CB 4.44Å; Y83-W191 AromaticContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CH2 3.49Å; Y83-W191 VanDerWaalsContact CD2-CH2 3.49Å; Y83-W191 HydrophobicContact CD2-CZ2 4.19Å; Y83-W191 AromaticContact CD2-CZ3 3.76Å; Y83-W191 HydrophobicContact CD2-CZ3 3.76Å; Y83-W191 HydrophobicContact CE2-CE3 4.21Å; Y83-W191 AromaticContact CE2-CH2 3.84Å; Y83-W191 HydrophobicContact CE2-CH2 3.84Å; Y83-W191 HydrophobicContact CE2-CZ2 4.45Å; Y83-W191 AromaticContact CE2-CZ3 3.68Å; Y83-W191 HydrophobicContact CE2-CZ3 3.68Å; T187-W191 VanDerWaalsContact CG2-CD1 3.45Å; T187-W191 WeakPolarHBondContact O-CB 3.31Å; T187-W191 PolarHBondContact O-N 3.26Å; C188-W191 PolarHBondContact O-N 3.26Å; W191-R193 VanDerWaalsContact C-N 3.34Å; W191-R193 PolarHBondContact O-N 3.02Å; W191-R194 WeakPolarHBondContact O-CB 3.34Å; W191-R194 PolarHBondContact O-N 3.15Å; W191-Y195 HydrophobicContact CB-CE2 4.05Å; W191-Y195 HydrophobicContact CE3-CD1 4.41Å; W191-Y195 AromaticContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE2 4.21Å; W191-Y195 AromaticContact CE3-CZ 3.39Å; W191-Y195 AromaticContact CZ3-CE1 3.9Å; W191-Y195 HydrophobicContact CZ3-CE1 3.9Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.42Å; W191-Y195 VanDerWaalsContact O-CG 3.26Å; W191-Y195 PolarHBondContact O-N 2.71Å
192	L	98.1	Very high	96.3	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.9	-44.9	176.4	174.9	50.1	0	0	0	111.2	H27 M29 V52 L127 C188 R194 Y195 L196	H27-L192 HydrophobicContact CB-CD1 4.44Å; M29-L192 HydrophobicContact CB-CB 4.06Å; M29-L192 HydrophobicContact CB-CD1 4.03Å; M29-L192 HydrophobicContact CB-CD2 3.94Å; M29-L192 HydrophobicContact CB-CG 4.23Å; M29-L192 HydrophobicContact CE-CB 4.29Å; M29-L192 HydrophobicContact SD-CB 4.44Å; V52-L192 HydrophobicContact CG1-CD1 3.62Å; V52-L192 HydrophobicContact CG2-CD1 4.31Å; L127-L192 HydrophobicContact CD1-CB 4.24Å; L127-L192 HydrophobicContact CD1-CD2 3.67Å; L127-L192 HydrophobicContact CD1-CG 3.74Å; L127-L192 HydrophobicContact CG-CD2 3.57Å; L127-L192 HydrophobicContact CG-CG 4.24Å; C188-L192 WeakPolarHBondContact O-CB 3.47Å; C188-L192 PolarHBondContact O-N 3.22Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.34Å; L192-Y195 PolarHBondContact O-N 3.28Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.39Å; L192-L196 HydrophobicContact CD1-CG 3.85Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 WeakPolarHBondContact O-CB 3.24Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.03Å
193	R	96.4	Very high	96	Very high	122 Å²	122	55.5 Å²	55.5	46%	0.46	26%	0.259	S	S	.	.	H	α-helix	trans	-59.5	-42.9	174.4	-71.6	174.9	-175.7	165.5	0.1	112.6	L127 G131 V189 W191 L196 E197	L127-R193 HydrophobicContact CD1-CG 3.99Å; G131-R193 VanDerWaalsContact O-CZ 3.29Å; G131-R193 PolarHBondContact O-NE 3.18Å; G131-R193 VanDerWaalsContact O-NE 3.07Å; G131-R193 PolarHBondContact O-NH2 3.49Å; V189-R193 WeakPolarHBondContact O-CG 3.45Å; V189-R193 PolarHBondContact O-N 2.9Å; W191-R193 VanDerWaalsContact C-N 3.34Å; W191-R193 PolarHBondContact O-N 3.02Å; R193-L196 PolarHBondContact O-N 2.93Å; R193-E197 PolarHBondContact O-N 2.82Å
194	R	96.6	Very high	95.5	Very high	122 Å²	122	57.2 Å²	57.2	46%	0.46	27%	0.269	S	S	.	.	H	α-helix	trans	-61.9	-43.6	176.7	178.8	179	174.5	119.2	-4.5	111.6	E79 E190 W191 L192 E197 N198	E79-R194 VanDerWaalsContact CD-NH2 3.34Å; E79-R194 IonicContact OE1-CZ 3.88Å; E79-R194 IonicContact OE1-NE 3.11Å; E79-R194 PolarHBondContact OE1-NE 2.84Å; E79-R194 IonicContact OE1-NH2 2.74Å; E79-R194 PolarHBondContact OE1-NH2 3.09Å; E79-R194 VanDerWaalsContact OE1-NH2 3.15Å; E79-R194 IonicContact OE2-CZ 2.76Å; E79-R194 IonicContact OE2-NE 2.73Å; E79-R194 IonicContact OE2-NH2 3.53Å; E79-R194 PolarHBondContact OE2-NH2 3Å; E190-R194 PolarHBondContact O-N 3.08Å; E190-R194 VanDerWaalsContact O-N 3.1Å; W191-R194 WeakPolarHBondContact O-CB 3.34Å; W191-R194 PolarHBondContact O-N 3.15Å; L192-R194 VanDerWaalsContact C-N 3.34Å; L192-R194 PolarHBondContact O-N 3.34Å; R194-E197 PolarHBondContact O-N 3.29Å; R194-N198 WeakPolarHBondContact O-CB 3.42Å; R194-N198 PolarHBondContact O-N 2.81Å; R194-N198 PolarHBondContact O-OD1 2.84Å
195	Y	97.1	Very high	95.1	Very high	1 Å²	1	61.2 Å²	61.2	0%	0.004	28%	0.284	C	S	.	.	H	α-helix	trans	-67.5	-39.7	178.3	-62.2	-32.4	0	0	0	112.4	M29 V52 F57 W75 V76 Y83 W191 L192 E197 N198 G199 L203	M29-Y195 HydrophobicContact SD-CD2 3.74Å; M29-Y195 HydrophobicContact SD-CE2 3.58Å; M29-Y195 VanDerWaalsContact SD-CE2 3.58Å; V52-Y195 HydrophobicContact CG2-CD2 3.97Å; V52-Y195 HydrophobicContact CG2-CG 4.45Å; F57-Y195 HydrophobicContact CD2-CE2 4.48Å; F57-Y195 HydrophobicContact CE2-CD2 4.25Å; F57-Y195 AromaticContact CE2-CE2 3.62Å; F57-Y195 HydrophobicContact CE2-CE2 3.62Å; F57-Y195 AromaticContact CE2-CZ 3.78Å; F57-Y195 HydrophobicContact CZ-CD2 4.26Å; F57-Y195 AromaticContact CZ-CE2 3.72Å; F57-Y195 HydrophobicContact CZ-CE2 3.72Å; W75-Y195 HydrophobicContact CE3-CD1 4.25Å; W75-Y195 HydrophobicContact CH2-CG 4.22Å; W75-Y195 AromaticContact CZ3-CD1 3.59Å; W75-Y195 HydrophobicContact CZ3-CD1 3.59Å; W75-Y195 HydrophobicContact CZ3-CD2 4.39Å; W75-Y195 HydrophobicContact CZ3-CE1 4.33Å; W75-Y195 AromaticContact CZ3-CG 3.63Å; W75-Y195 HydrophobicContact CZ3-CG 3.63Å; V76-Y195 HydrophobicContact CG2-CE1 4.38Å; Y83-Y195 VanDerWaalsContact CE2-OH 3.26Å; Y83-Y195 WeakPolarHBondContact CE2-OH 3.49Å; Y83-Y195 PolarHBondContact OH-OH 2.88Å; W191-Y195 HydrophobicContact CB-CE2 4.05Å; W191-Y195 HydrophobicContact CE3-CD1 4.41Å; W191-Y195 AromaticContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE1 3.52Å; W191-Y195 HydrophobicContact CE3-CE2 4.21Å; W191-Y195 AromaticContact CE3-CZ 3.39Å; W191-Y195 AromaticContact CZ3-CE1 3.9Å; W191-Y195 HydrophobicContact CZ3-CE1 3.9Å; W191-Y195 VanDerWaalsContact O-CD2 3.27Å; W191-Y195 WeakPolarHBondContact O-CD2 3.42Å; W191-Y195 VanDerWaalsContact O-CG 3.26Å; W191-Y195 PolarHBondContact O-N 2.71Å; L192-Y195 PolarHBondContact O-N 3.28Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.35Å; Y195-N198 PolarHBondContact O-N 3.37Å; Y195-G199 WeakPolarHBondContact O-CA 3.33Å; Y195-G199 PolarHBondContact O-N 3.34Å; Y195-L203 WeakPolarHBondContact O-CD1 3.35Å
196	L	95.7	Very high	94.8	Very high	14 Å²	14	59.1 Å²	59.1	7%	0.073	28%	0.282	C	S	.	.	H	α-helix	trans	-62.9	-34.9	174.7	-70.8	169.3	0	0	0	112.6	H27 V52 L192 R193 K200 L203 Q204	H27-L196 HydrophobicContact CB-CD1 3.69Å; H27-L196 HydrophobicContact CB-CD2 4.02Å; H27-L196 HydrophobicContact CB-CG 4.43Å; H27-L196 WeakPolarHBondContact ND1-CD2 3.33Å; V52-L196 HydrophobicContact CG1-CD2 4.06Å; L192-L196 HydrophobicContact CD1-CD1 3.83Å; L192-L196 HydrophobicContact CD1-CD2 4.39Å; L192-L196 HydrophobicContact CD1-CG 3.85Å; L192-L196 HydrophobicContact CG-CD1 4.03Å; L192-L196 WeakPolarHBondContact O-CB 3.24Å; L192-L196 VanDerWaalsContact O-CG 3.28Å; L192-L196 WeakPolarHBondContact O-CG 3.4Å; L192-L196 PolarHBondContact O-N 3.03Å; R193-L196 PolarHBondContact O-N 2.93Å; L196-K200 VanDerWaalsContact O-CA 3.23Å; L196-K200 WeakPolarHBondContact O-CA 3.16Å; L196-K200 WeakPolarHBondContact O-CB 3.17Å; L196-K200 PolarHBondContact O-N 3.09Å; L196-K200 VanDerWaalsContact O-N 3.17Å; L196-L203 HydrophobicContact CD2-CB 4.16Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; L196-Q204 PolarHBondContact O-NE2 3.06Å
197	E	95.1	Very high	94.7	Very high	125 Å²	125	61.3 Å²	61.3	58%	0.584	29%	0.286	S	S	*	.	H	α-helix	trans	-72.9	-48.2	174.5	-171.4	60.7	-150.9	0	0	111.2	R193 R194 Y195 G199 K200	R193-E197 PolarHBondContact O-N 2.82Å; R194-E197 PolarHBondContact O-N 3.29Å; Y195-E197 VanDerWaalsContact C-N 3.29Å; Y195-E197 PolarHBondContact O-N 3.35Å; E197-G199 VanDerWaalsContact C-N 3.33Å; E197-G199 PolarHBondContact O-N 2.88Å; E197-K200 WeakPolarHBondContact O-CB 3.14Å; E197-K200 PolarHBondContact O-N 2.75Å
198	N	95.9	Very high	94.6	Very high	53 Å²	53	64.3 Å²	64.3	28%	0.283	30%	0.297	S	S	.	.	H	α-helix	trans	-61.5	-40.8	179.6	-73	-2.6	0	0	0	112.6	W75 Q78 E79 R194 Y195	W75-N198 HydrophobicContact CB-CB 4.37Å; W75-N198 WeakPolarHBondContact CB-O 3.44Å; Q78-N198 VanDerWaalsContact NE2-CB 3.31Å; Q78-N198 PolarHBondContact NE2-ND2 3.33Å; Q78-N198 VanDerWaalsContact NE2-ND2 3.12Å; Q78-N198 PolarHBondContact NE2-OD1 3Å; E79-N198 PolarHBondContact OE1-ND2 2.96Å; R194-N198 WeakPolarHBondContact O-CB 3.42Å; R194-N198 PolarHBondContact O-N 2.81Å; R194-N198 PolarHBondContact O-OD1 2.84Å; Y195-N198 PolarHBondContact O-N 3.37Å
199	G	95	Very high	94.5	Very high	3 Å²	3	64.5 Å²	64.5	3%	0.031	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.9	20.9	-175.8	0	0	0	0	0	113.5	Y195 E197 E201 T202 L203	Y195-G199 WeakPolarHBondContact O-CA 3.33Å; Y195-G199 PolarHBondContact O-N 3.34Å; E197-G199 VanDerWaalsContact C-N 3.33Å; E197-G199 PolarHBondContact O-N 2.88Å; G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.07Å; G199-E201 VanDerWaalsContact O-N 3.14Å; G199-T202 PolarHBondContact O-N 3.38Å; G199-L203 WeakPolarHBondContact O-CB 3.23Å; G199-L203 PolarHBondContact O-N 3.4Å
200	K	92.6	Very high	94.5	Very high	110 Å²	110	71 Å²	71	48%	0.478	33%	0.325	S	S	.	.	H	α-helix	trans	-50.2	-42.6	-171.9	-177.5	172.7	-175.2	174.1	0	114	L196 E197 T202 Q204	L196-K200 VanDerWaalsContact O-CA 3.23Å; L196-K200 WeakPolarHBondContact O-CA 3.16Å; L196-K200 WeakPolarHBondContact O-CB 3.17Å; L196-K200 PolarHBondContact O-N 3.09Å; L196-K200 VanDerWaalsContact O-N 3.17Å; E197-K200 WeakPolarHBondContact O-CB 3.14Å; E197-K200 PolarHBondContact O-N 2.75Å; K200-T202 VanDerWaalsContact C-N 3.26Å; K200-T202 PolarHBondContact O-N 2.7Å; K200-Q204 HydrophobicContact CG-CB 4.48Å; K200-Q204 HydrophobicContact CG-CG 4.49Å; K200-Q204 WeakPolarHBondContact O-CB 3.32Å; K200-Q204 PolarHBondContact O-N 3.01Å; K200-Q204 VanDerWaalsContact O-N 3.13Å
201	E	90.1	Very high	94.5	Very high	181 Å²	181	66.6 Å²	66.6	85%	0.846	31%	0.307	S	S	*	.	H	α-helix	trans	-65.7	-27.5	-179.8	-62.7	-174.9	166.7	0	0	113.3	G199	G199-E201 VanDerWaalsContact C-N 3.26Å; G199-E201 PolarHBondContact O-N 3.07Å; G199-E201 VanDerWaalsContact O-N 3.14Å
202	T	89.9	Confident	94.5	Very high	37 Å²	37	68.4 Å²	68.4	23%	0.227	32%	0.317	C	S	.	.	H	α-helix	trans	-100	-39.4	-177.7	-51.9	0	0	0	0	112.6	G199 K200 R205	G199-T202 PolarHBondContact O-N 3.38Å; K200-T202 VanDerWaalsContact C-N 3.26Å; K200-T202 PolarHBondContact O-N 2.7Å; T202-R205 WeakPolarHBondContact O-CD 3.4Å; T202-R205 VanDerWaalsContact O-CG 3.29Å; T202-R205 WeakPolarHBondContact O-CG 3.22Å; T202-R205 PolarHBondContact O-NE 3.33Å
203	L	91.3	Very high	94.5	Very high	4 Å²	4	69.5 Å²	69.5	2%	0.021	32%	0.324	C	S	.	.	H	α-helix	trans	-90.6	-28.2	-171.5	-63.3	172.3	0	0	0	113	V52 T55 W75 Y195 L196 G199	V52-L203 HydrophobicContact CB-CD1 4.26Å; V52-L203 HydrophobicContact CB-CD2 4.09Å; V52-L203 HydrophobicContact CG1-CD1 3.89Å; V52-L203 HydrophobicContact CG1-CD2 4.06Å; V52-L203 HydrophobicContact CG1-CG 4.5Å; T55-L203 HydrophobicContact CG2-CD2 4.12Å; W75-L203 HydrophobicContact CD2-CD1 4.5Å; W75-L203 HydrophobicContact CH2-CD1 4.31Å; W75-L203 HydrophobicContact CZ2-CD1 3.88Å; W75-L203 HydrophobicContact CZ2-CD2 4.18Å; W75-L203 HydrophobicContact CZ2-CG 4.4Å; Y195-L203 WeakPolarHBondContact O-CD1 3.35Å; L196-L203 HydrophobicContact CD2-CB 4.16Å; L196-L203 HydrophobicContact CD2-CD1 4.35Å; G199-L203 WeakPolarHBondContact O-CB 3.23Å; G199-L203 PolarHBondContact O-N 3.4Å
204	Q	88.6	Confident	94.5	Very high	92 Å²	92	65.2 Å²	65.2	43%	0.43	31%	0.311	S	S	.	.	S	Bend	trans	-103.6	20.3	178.2	-57.2	179	32.5	0	0	111.8	L196 K200	L196-Q204 PolarHBondContact O-NE2 3.06Å; K200-Q204 HydrophobicContact CG-CB 4.48Å; K200-Q204 HydrophobicContact CG-CG 4.49Å; K200-Q204 WeakPolarHBondContact O-CB 3.32Å; K200-Q204 PolarHBondContact O-N 3.01Å; K200-Q204 VanDerWaalsContact O-N 3.13Å
205	R	89.8	Confident	94.4	Very high	86 Å²	86	62 Å²	62	33%	0.325	30%	0.302	S	S	.	.			trans	-91.4	146.9	171.1	78.8	-169.7	172.6	168.5	7.6	109.3	T202 E207 Y233	T202-R205 WeakPolarHBondContact O-CD 3.4Å; T202-R205 VanDerWaalsContact O-CG 3.29Å; T202-R205 WeakPolarHBondContact O-CG 3.22Å; T202-R205 PolarHBondContact O-NE 3.33Å; R205-E207 IonicContact CZ-OE1 2.6Å; R205-E207 IonicContact NE-OE1 3.68Å; R205-E207 PolarHBondContact NE-OE1 2.85Å; R205-E207 IonicContact NH1-OE1 3.25Å; R205-E207 PolarHBondContact NH1-OE1 2.92Å; R205-E207 IonicContact NH2-OE1 3.52Å; R205-Y233 HydrophobicContact CG-CD1 4.14Å; R205-Y233 HydrophobicContact CG-CE1 4.49Å; R205-Y233 WeakPolarHBondContact O-CD1 3.45Å
206	A	92.1	Very high	94.3	Very high	46 Å²	46	66 Å²	66	38%	0.38	32%	0.32	S	S	.	.			trans	-120.3	119	165.5	0	0	0	0	0	108.6	Y233	A206-Y233 CarbonylContact C-O 3.55Å; A206-Y233 WeakPolarHBondContact CA-O 3.43Å
207	E	94.2	Very high	94.2	Very high	66 Å²	66	70.1 Å²	70.1	31%	0.308	35%	0.347	S	S	.	.	B	Isolated β-bridge	trans	-97.1	119.4	174.5	-67.1	-171.3	-145.8	0	0	108.7	R205 F232 Y233 H287	R205-E207 IonicContact CZ-OE1 2.6Å; R205-E207 IonicContact NE-OE1 3.68Å; R205-E207 PolarHBondContact NE-OE1 2.85Å; R205-E207 IonicContact NH1-OE1 3.25Å; R205-E207 PolarHBondContact NH1-OE1 2.92Å; R205-E207 IonicContact NH2-OE1 3.52Å; E207-F232 WeakPolarHBondContact O-CA 3.22Å; E207-F232 WeakPolarHBondContact O-CB 3.43Å; E207-Y233 PolarHBondContact N-O 2.84Å; E207-Y233 PolarHBondContact O-N 3.08Å; E207-H287 PolarHBondContact O-CE1 3.44Å; E207-H287 VanDerWaalsContact O-CE1 3.23Å
208	H	95.3	Very high	94	Very high	113 Å²	113	68.6 Å²	68.6	52%	0.523	35%	0.347	S	S	.	.	P	Polyproline II helix	trans	-71.4	146.5	-177.6	57.8	-104.8	0	0	0	111.9	K210 L290	H208-K210 PolarHBondContact O-N 2.93Å; H208-L290 HydrophobicContact CB-CD2 3.94Å
209	P	97.6	Very high	93.8	Very high	4 Å²	4	68.5 Å²	68.5	3%	0.026	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-68.2	131.6	177.7	27.6	-34.7	0	0	0	111.9	T211 A229 F232 I237 V285 H287 L290	P209-T211 HydrophobicContact CB-CG2 3.96Å; P209-T211 HydrophobicContact CG-CG2 4.16Å; P209-T211 PolarHBondContact O-N 3.15Å; P209-A229 HydrophobicContact CB-CB 3.86Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.16Å; P209-I237 HydrophobicContact CB-CD1 4.05Å; P209-I237 HydrophobicContact CG-CD1 4.15Å; P209-V285 HydrophobicContact CG-CG1 3.94Å; P209-H287 HydrophobicContact CG-CB 4.11Å; P209-L290 HydrophobicContact CG-CD1 3.85Å; P209-L290 HydrophobicContact CG-CD2 4.46Å; P209-L290 HydrophobicContact CG-CG 4.21Å
210	K	97.9	Very high	93.5	Very high	145 Å²	145	75.5 Å²	75.5	63%	0.63	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	105.1	165	-65.3	172.1	-172.2	164	0	108.3	H208 L230	H208-K210 PolarHBondContact O-N 2.93Å; K210-L230 PolarHBondContact N-O 2.98Å; K210-L230 PolarHBondContact O-N 2.81Å; K210-L230 VanDerWaalsContact O-N 3.11Å
211	T	97.8	Very high	93.5	Very high	33 Å²	33	77.1 Å²	77.1	20%	0.202	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	140.6	-172	57.2	0	0	0	0	113.5	P209 W228 A229 V285 L294 L296	P209-T211 HydrophobicContact CB-CG2 3.96Å; P209-T211 HydrophobicContact CG-CG2 4.16Å; P209-T211 PolarHBondContact O-N 3.15Å; T211-W228 WeakPolarHBondContact CA-O 3.38Å; T211-A229 HydrophobicContact CG2-CB 4.34Å; T211-V285 HydrophobicContact CG2-CB 4.37Å; T211-V285 HydrophobicContact CG2-CG1 4.11Å; T211-V285 HydrophobicContact CG2-CG2 4.01Å; T211-L294 HydrophobicContact CG2-CD1 4.29Å; T211-L296 HydrophobicContact CG2-CD1 4.12Å; T211-L296 WeakPolarHBondContact OG1-CD2 3.43Å
212	H	97.1	Very high	93.7	Very high	79 Å²	79	73 Å²	73	37%	0.366	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	158.9	170.8	64.1	-75.9	0	0	0	111.3	W228	H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.4Å; H212-W228 AromaticContact CE1-CD1 3.94Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 3.35Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.74Å; H212-W228 PolarHBondContact O-N 3.13Å
213	V	98	Very high	94	Very high	23 Å²	23	71.2 Å²	71.2	14%	0.139	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.8	176.9	-179.3	0	0	0	0	109.4	L225 R226 C227 W241 L296 W298	V213-L225 HydrophobicContact CG1-CB 4.43Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; V213-R226 WeakPolarHBondContact CA-O 3.32Å; V213-C227 HydrophobicContact CG2-CB 4.41Å; V213-W241 HydrophobicContact CG1-CH2 3.86Å; V213-W241 HydrophobicContact CG1-CZ2 4.32Å; V213-W241 HydrophobicContact CG2-CH2 4.27Å; V213-L296 HydrophobicContact CG2-CB 3.84Å; V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.81Å
214	T	96.6	Very high	94.2	Very high	33 Å²	33	72.2 Å²	72.2	20%	0.202	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	148.8	174.7	54.2	0	0	0	0	110.2	H216 L225 R226 W228	T214-H216 PolarHBondContact OG1-CE1 3.28Å; T214-H216 VanDerWaalsContact OG1-CE1 3.32Å; T214-L225 WeakPolarHBondContact O-CA 2.99Å; T214-R226 PolarHBondContact N-O 2.87Å; T214-R226 PolarHBondContact O-N 2.91Å; T214-R226 WeakPolarHBondContact OG1-CB 3.06Å; T214-R226 PolarHBondContact OG1-O 3.01Å; T214-R226 VanDerWaalsContact OG1-O 3.14Å; T214-W228 PolarHBondContact OG1-NE1 2.83Å
215	H	95.6	Very high	94.7	Very high	55 Å²	55	67.8 Å²	67.8	26%	0.255	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	125.4	-178.9	168.4	-89.9	0	0	0	109.2	A223 L225 E278 W298	H215-A223 WeakPolarHBondContact NE2-CB 3.04Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; H215-E278 IonicContact NE2-OE1 3.47Å; H215-W298 HydrophobicContact CB-CD2 4.11Å; H215-W298 HydrophobicContact CB-CG 4.14Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 AromaticContact CG-CE2 3.74Å; H215-W298 AromaticContact CG-CZ2 3.76Å; H215-W298 AromaticContact CG-NE1 3.97Å; H215-W298 AromaticContact ND1-CZ2 3.95Å
216	H	94.2	Very high	95.1	Very high	84 Å²	84	66.2 Å²	66.2	39%	0.389	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	106.3	-179.3	-58	85	0	0	0	108.8	T214 V218 A223 T224 R226	T214-H216 PolarHBondContact OG1-CE1 3.28Å; T214-H216 VanDerWaalsContact OG1-CE1 3.32Å; H216-V218 PolarHBondContact O-N 3.05Å; H216-A223 CarbonylContact O-C 3.6Å; H216-A223 WeakPolarHBondContact O-CA 3.41Å; H216-T224 PolarHBondContact N-O 3.03Å; H216-T224 PolarHBondContact O-N 2.04Å; H216-R226 PolarHBondContact CE1-NH1 3.33Å
217	P	93.4	Very high	95.4	Very high	100 Å²	100	64 Å²	64	65%	0.649	33%	0.327	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-58.5	130.6	172.6	-18.7	29.4	0	0	0	110.3
218	V	90.7	Very high	95.6	Very high	94 Å²	94	63.3 Å²	63.3	57%	0.57	32%	0.322	S	S	*	.			trans	-103.1	-41.8	175.9	-179.1	0	0	0	0	109.9	H216 E222 T224	H216-V218 PolarHBondContact O-N 3.05Å; V218-E222 PolarHBondContact N-O 3.49Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.13Å
219	S	91.6	Very high	95.7	Very high	51 Å²	51	57.9 Å²	57.9	36%	0.357	30%	0.297	S	S	.	.	S	Bend	trans	-146.7	-177.9	174.8	73.2	0	0	0	0	110.4	H221 E222	S219-H221 PolarHBondContact O-N 3.29Å; S219-H221 PolarHBondContact OG-N 3.43Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; S219-E222 PolarHBondContact N-O 3.34Å; S219-E222 VanDerWaalsContact O-O 3.09Å; S219-E222 PolarHBondContact OG-N 3.26Å
220	D	89.1	Confident	95.7	Very high	149 Å²	149	60.3 Å²	60.3	80%	0.797	31%	0.309	S	S	*	.	S	Bend	trans	-63.7	-20.9	172.6	-65.9	-24.3	0	0	0	112.5	S275	D220-S275 PolarHBondContact O-OG 3.34Å
221	H	92.6	Very high	95.7	Very high	145 Å²	145	54.2 Å²	54.2	67%	0.671	29%	0.287	S	S	*	.	S	Bend	trans	-105.9	-15.6	-174.4	-56.4	-50.8	0	0	0	113.9	S219 P274 S275	S219-H221 PolarHBondContact O-N 3.29Å; S219-H221 PolarHBondContact OG-N 3.43Å; S219-H221 VanDerWaalsContact OG-N 3.16Å; H221-P274 WeakPolarHBondContact O-CA 3.49Å; H221-S275 PolarHBondContact O-N 2.83Å; H221-S275 PolarHBondContact O-OG 2.9Å
222	E	94.9	Very high	95.7	Very high	93 Å²	93	52.6 Å²	52.6	44%	0.435	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	144.9	-171.5	-66.5	178.5	172.2	0	0	112.4	V218 S219 V272 V273 S275	V218-E222 PolarHBondContact N-O 3.49Å; S219-E222 PolarHBondContact N-O 3.34Å; S219-E222 VanDerWaalsContact O-O 3.09Å; S219-E222 PolarHBondContact OG-N 3.26Å; E222-V272 HydrophobicContact CB-CG1 4.12Å; E222-V272 HydrophobicContact CG-CG1 4.34Å; E222-V273 WeakPolarHBondContact CA-O 3.34Å; E222-S275 PolarHBondContact N-OG 3.13Å
223	A	95.4	Very high	95.6	Very high	1 Å²	1	49 Å²	49	1%	0.008	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	155	171.6	0	0	0	0	0	110.8	H215 H216 V273	H215-A223 WeakPolarHBondContact NE2-CB 3.04Å; H216-A223 CarbonylContact O-C 3.6Å; H216-A223 WeakPolarHBondContact O-CA 3.41Å; A223-V273 HydrophobicContact CB-CG2 4.45Å; A223-V273 PolarHBondContact N-O 2.97Å; A223-V273 WeakPolarHBondContact O-CG2 3.46Å; A223-V273 PolarHBondContact O-N 3.24Å
224	T	97.1	Very high	95.5	Very high	24 Å²	24	48.8 Å²	48.8	15%	0.147	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	121.2	170.4	-54.3	0	0	0	0	109.7	H216 V218 A270 V271	H216-T224 PolarHBondContact N-O 3.03Å; H216-T224 PolarHBondContact O-N 2.04Å; V218-T224 WeakPolarHBondContact CG2-OG1 3.13Å; T224-A270 HydrophobicContact CG2-CB 3.95Å; T224-V271 WeakPolarHBondContact CA-O 3.44Å
225	L	97.6	Very high	95.4	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	126.5	165.6	-63.9	-175.7	0	0	0	109	V213 T214 H215 W241 A270 V271 V273 E278 W298	V213-L225 HydrophobicContact CG1-CB 4.43Å; V213-L225 HydrophobicContact CG1-CD2 4.43Å; T214-L225 WeakPolarHBondContact O-CA 2.99Å; H215-L225 HydrophobicContact CB-CD2 3.99Å; L225-W241 HydrophobicContact CB-CH2 3.72Å; L225-W241 HydrophobicContact CB-CZ2 3.79Å; L225-W241 HydrophobicContact CD1-CH2 4.06Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; L225-A270 CarbonylContact O-C 3.57Å; L225-A270 WeakPolarHBondContact O-CA 3.48Å; L225-V271 HydrophobicContact CB-CG1 4.23Å; L225-V271 PolarHBondContact N-O 3.41Å; L225-V271 PolarHBondContact O-N 3.13Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.17Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; L225-E278 HydrophobicContact CD1-CB 4.1Å; L225-E278 HydrophobicContact CD2-CB 4.46Å; L225-E278 HydrophobicContact CD2-CG 4.37Å; L225-W298 HydrophobicContact CD1-CB 4.49Å; L225-W298 HydrophobicContact CD2-CB 3.85Å; L225-W298 HydrophobicContact CD2-CD2 4.42Å; L225-W298 HydrophobicContact CD2-CG 4.01Å
226	R	98.1	Very high	95.4	Very high	53 Å²	53	50.7 Å²	50.7	20%	0.2	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	117.7	176.1	-178.5	-178	-62.2	116	3.3	110.6	V213 T214 H216 W228 W268 A269 A270	V213-R226 WeakPolarHBondContact CA-O 3.32Å; T214-R226 PolarHBondContact N-O 2.87Å; T214-R226 PolarHBondContact O-N 2.91Å; T214-R226 WeakPolarHBondContact OG1-CB 3.06Å; T214-R226 PolarHBondContact OG1-O 3.01Å; T214-R226 VanDerWaalsContact OG1-O 3.14Å; H216-R226 PolarHBondContact CE1-NH1 3.33Å; R226-W228 VanDerWaalsContact CD-CE2 3.42Å; R226-W228 VanDerWaalsContact CD-CZ2 3.41Å; R226-W228 HydrophobicContact CG-CZ2 4.44Å; R226-W268 HydrophobicContact CG-CB 4.03Å; R226-W268 HydrophobicContact CG-CD2 4.11Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.23Å; R226-A269 WeakPolarHBondContact CA-O 3.46Å; R226-A270 HydrophobicContact CB-CB 4.01Å; R226-A270 HydrophobicContact CG-CB 4.13Å
227	C	98.3	Very high	95.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	121.5	175.6	-172.2	0	0	0	0	109.5	V213 W241 W268 A269 C283	V213-C227 HydrophobicContact CG2-CB 4.41Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; C227-W268 CarbonylContact O-C 3.56Å; C227-W268 WeakPolarHBondContact O-CA 3.28Å; C227-W268 WeakPolarHBondContact O-CB 3.3Å; C227-A269 PolarHBondContact N-O 3.07Å; C227-A269 PolarHBondContact O-N 3.22Å; C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.23Å; C227-C283 WeakPolarHBondContact SG-CB 3.46Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.96Å
228	W	98.4	Very high	95.7	Very high	50 Å²	50	44.7 Å²	44.7	19%	0.189	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	141.5	179.9	-70	90.1	0	0	0	110.4	T211 H212 T214 R226 L230 W268	T211-W228 WeakPolarHBondContact CA-O 3.38Å; H212-W228 VanDerWaalsContact CE1-CB 3.42Å; H212-W228 WeakPolarHBondContact CE1-CB 3.4Å; H212-W228 AromaticContact CE1-CD1 3.94Å; H212-W228 AromaticContact CE1-CG 3.7Å; H212-W228 PolarHBondContact N-O 3.35Å; H212-W228 AromaticContact NE2-CD1 3.52Å; H212-W228 AromaticContact NE2-CG 3.74Å; H212-W228 PolarHBondContact O-N 3.13Å; T214-W228 PolarHBondContact OG1-NE1 2.83Å; R226-W228 VanDerWaalsContact CD-CE2 3.42Å; R226-W228 VanDerWaalsContact CD-CZ2 3.41Å; R226-W228 HydrophobicContact CG-CZ2 4.44Å; W228-L230 HydrophobicContact CE3-CD2 3.88Å; W228-L230 HydrophobicContact CZ3-CD2 4.42Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.63Å; W228-W268 HydrophobicContact CH2-CG 4.26Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å
229	A	98.4	Very high	96	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	124.1	162.2	0	0	0	0	0	107.7	P209 T211 F232 I237 L239 Q266 K267	P209-A229 HydrophobicContact CB-CB 3.86Å; T211-A229 HydrophobicContact CG2-CB 4.34Å; A229-F232 HydrophobicContact CB-CD1 4.06Å; A229-F232 HydrophobicContact CB-CE1 3.81Å; A229-F232 WeakPolarHBondContact O-CE1 3.46Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; A229-L239 HydrophobicContact CB-CD1 4.05Å; A229-L239 HydrophobicContact CB-CD2 4.21Å; A229-Q266 VanDerWaalsContact O-CA 3.31Å; A229-Q266 WeakPolarHBondContact O-CA 3.34Å; A229-K267 PolarHBondContact N-O 2.73Å; A229-K267 PolarHBondContact O-N 2.86Å; A229-K267 VanDerWaalsContact O-O 3.07Å
230	L	98.2	Very high	96.3	Very high	54 Å²	54	39.9 Å²	39.9	28%	0.283	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	147.1	-174.7	-58.6	176.8	0	0	0	110.9	K210 W228 Q266	K210-L230 PolarHBondContact N-O 2.98Å; K210-L230 PolarHBondContact O-N 2.81Å; K210-L230 VanDerWaalsContact O-N 3.11Å; W228-L230 HydrophobicContact CE3-CD2 3.88Å; W228-L230 HydrophobicContact CZ3-CD2 4.42Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å
231	G	97.3	Very high	96.7	Very high	17 Å²	17	32.9 Å²	32.9	18%	0.175	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	68	36.6	168.6	0	0	0	0	0	113.6	T264 F265	G231-T264 WeakPolarHBondContact CA-OG1 3.41Å; G231-F265 PolarHBondContact N-O 3.47Å
232	F	97.1	Very high	96.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	155.3	179	58.9	-90.5	0	0	0	112.3	E207 P209 A229 P234 I237 T257 T264 F265 K267 H287	E207-F232 WeakPolarHBondContact O-CA 3.22Å; E207-F232 WeakPolarHBondContact O-CB 3.43Å; P209-F232 HydrophobicContact CB-CB 3.87Å; P209-F232 HydrophobicContact CB-CD1 3.92Å; P209-F232 HydrophobicContact CB-CG 4.16Å; A229-F232 HydrophobicContact CB-CD1 4.06Å; A229-F232 HydrophobicContact CB-CE1 3.81Å; A229-F232 WeakPolarHBondContact O-CE1 3.46Å; F232-P234 WeakPolarHBondContact CD2-O 3.49Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.29Å; F232-I237 HydrophobicContact CD2-CD1 3.96Å; F232-I237 HydrophobicContact CE1-CD1 3.79Å; F232-I237 HydrophobicContact CE1-CG2 4.48Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.89Å; F232-I237 HydrophobicContact CE2-CG1 4.41Å; F232-I237 HydrophobicContact CE2-CG2 3.58Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.16Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.56Å; F232-T257 HydrophobicContact CE2-CG2 4.08Å; F232-T257 HydrophobicContact CZ-CG2 3.92Å; F232-T264 WeakPolarHBondContact O-CA 3.33Å; F232-F265 VanDerWaalsContact CD1-O 3.32Å; F232-F265 WeakPolarHBondContact CD1-O 3.34Å; F232-F265 HydrophobicContact CD2-CB 3.92Å; F232-F265 HydrophobicContact CE1-CB 4.3Å; F232-F265 WeakPolarHBondContact CE1-O 3.44Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.48Å; F232-F265 HydrophobicContact CG-CB 4.49Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 3.42Å; F232-F265 PolarHBondContact O-N 3.27Å; F232-K267 HydrophobicContact CE1-CB 4.37Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; F232-H287 AromaticContact CD2-CD2 3.87Å; F232-H287 AromaticContact CD2-NE2 3.7Å
233	Y	95.4	Very high	96.9	Very high	4 Å²	4	27 Å²	27	2%	0.016	14%	0.137	C	C	.	.	B	Isolated β-bridge	trans	-151.4	134.8	173.9	178.3	-84.9	0	0	0	108.9	D54 T55 R205 A206 E207 G263 F265 H287	D54-Y233 HydrophobicContact CB-CE2 4.06Å; T55-Y233 WeakPolarHBondContact OG1-CE2 3.44Å; T55-Y233 PolarHBondContact OG1-OH 2.92Å; R205-Y233 HydrophobicContact CG-CD1 4.14Å; R205-Y233 HydrophobicContact CG-CE1 4.49Å; R205-Y233 WeakPolarHBondContact O-CD1 3.45Å; A206-Y233 CarbonylContact C-O 3.55Å; A206-Y233 WeakPolarHBondContact CA-O 3.43Å; E207-Y233 PolarHBondContact N-O 2.84Å; E207-Y233 PolarHBondContact O-N 3.08Å; Y233-G263 WeakPolarHBondContact CD2-O 3.23Å; Y233-F265 HydrophobicContact CD2-CD2 4.44Å; Y233-F265 AromaticContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CE2-CE2 4.43Å; Y233-H287 PolarHBondContact O-CE1 3.41Å
234	P	94.9	Very high	96.8	Very high	17 Å²	17	31.8 Å²	31.8	11%	0.11	16%	0.162	C	C	.	.	S	Bend	cis	-72.5	178.7	3.8	30.2	-36.5	0	0	0	113.6	D54 F232 E236 H287	D54-P234 VanDerWaalsContact OD2-CB 3.28Å; D54-P234 WeakPolarHBondContact OD2-CB 3.42Å; F232-P234 WeakPolarHBondContact CD2-O 3.49Å; P234-E236 VanDerWaalsContact C-N 3.33Å; P234-E236 PolarHBondContact O-N 2.93Å; P234-H287 PolarHBondContact O-NE2 2.81Å
235	A	96.1	Very high	96.5	Very high	15 Å²	15	33 Å²	33	12%	0.124	18%	0.179	C	C	.	.	S	Bend	trans	-70.8	-26.8	-174.7	0	0	0	0	0	113.7	D54 I237 T257 F265	D54-A235 HydrophobicContact CB-CB 4.29Å; D54-A235 VanDerWaalsContact OD2-CB 3.31Å; D54-A235 WeakPolarHBondContact OD2-CB 3.33Å; D54-A235 PolarHBondContact OD2-N 3.01Å; A235-I237 PolarHBondContact O-N 2.81Å; A235-T257 HydrophobicContact CB-CG2 4.33Å; A235-T257 WeakPolarHBondContact O-CG2 3.49Å; A235-F265 HydrophobicContact CB-CD1 3.69Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.64Å; A235-F265 HydrophobicContact CB-CE2 3.65Å; A235-F265 HydrophobicContact CB-CG 3.72Å; A235-F265 HydrophobicContact CB-CZ 3.65Å
236	E	95.4	Very high	96.3	Very high	114 Å²	114	39.1 Å²	39.1	53%	0.533	21%	0.208	S	C	.	.			trans	-64.8	121	-179.9	-164.1	42.9	-126.8	0	0	109.1	W23 P234 H287	W23-E236 HydrophobicContact CE3-CG 4.28Å; W23-E236 HydrophobicContact CH2-CB 4.14Å; W23-E236 HydrophobicContact CH2-CG 3.45Å; W23-E236 VanDerWaalsContact CH2-CG 3.45Å; W23-E236 HydrophobicContact CZ2-CG 3.75Å; W23-E236 HydrophobicContact CZ3-CB 3.96Å; W23-E236 HydrophobicContact CZ3-CG 3.71Å; W23-E236 VanDerWaalsContact CZ3-O 3.29Å; W23-E236 WeakPolarHBondContact CZ3-O 3.21Å; P234-E236 VanDerWaalsContact C-N 3.33Å; P234-E236 PolarHBondContact O-N 2.93Å; E236-H287 PolarHBondContact O-CD2 3.01Å
237	I	96.2	Very high	96	Very high	8 Å²	8	41.2 Å²	41.2	4%	0.041	22%	0.223	C	C	.	.			trans	-157.6	142.3	-175.6	-165.1	171.8	0	0	0	109.4	P209 A229 F232 A235 L239 K267 V285 Q286 H287	P209-I237 HydrophobicContact CB-CD1 4.05Å; P209-I237 HydrophobicContact CG-CD1 4.15Å; A229-I237 HydrophobicContact CB-CD1 3.72Å; F232-I237 HydrophobicContact CD1-CD1 3.88Å; F232-I237 HydrophobicContact CD2-CB 4.29Å; F232-I237 HydrophobicContact CD2-CD1 3.96Å; F232-I237 HydrophobicContact CE1-CD1 3.79Å; F232-I237 HydrophobicContact CE1-CG2 4.48Å; F232-I237 HydrophobicContact CE2-CB 3.77Å; F232-I237 HydrophobicContact CE2-CD1 3.89Å; F232-I237 HydrophobicContact CE2-CG1 4.41Å; F232-I237 HydrophobicContact CE2-CG2 3.58Å; F232-I237 HydrophobicContact CG-CD1 3.98Å; F232-I237 HydrophobicContact CZ-CB 4.16Å; F232-I237 HydrophobicContact CZ-CD1 3.82Å; F232-I237 HydrophobicContact CZ-CG2 3.56Å; A235-I237 PolarHBondContact O-N 2.81Å; I237-L239 HydrophobicContact CD1-CD1 3.68Å; I237-L239 HydrophobicContact CG1-CD1 3.69Å; I237-L239 HydrophobicContact CG2-CD1 4.16Å; I237-K267 HydrophobicContact CG2-CB 4.28Å; I237-K267 HydrophobicContact CG2-CD 3.59Å; I237-V285 HydrophobicContact CD1-CG1 4.03Å; I237-V285 HydrophobicContact CG1-CG1 4.37Å; I237-Q286 VanDerWaalsContact CG1-O 3.3Å; I237-Q286 WeakPolarHBondContact CG1-O 3.47Å; I237-H287 HydrophobicContact CD1-CB 4.33Å; I237-H287 HydrophobicContact CG1-CB 4.08Å
238	T	97	Very high	95.8	Very high	49 Å²	49	42.7 Å²	42.7	30%	0.301	23%	0.23	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	124.4	175.2	-61.2	0	0	0	0	110.6	T240 V285 Q286	T238-T240 HydrophobicContact CG2-CG2 4.06Å; T238-V285 WeakPolarHBondContact O-CA 3.43Å; T238-Q286 PolarHBondContact N-O 3.17Å; T238-Q286 PolarHBondContact O-N 3.4Å
239	L	97.6	Very high	95.2	Very high	6 Å²	6	45.3 Å²	45.3	3%	0.031	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	122.4	173.2	-87.2	63.2	0	0	0	108.8	A229 I237 L254 K267 A269 H284 V285	A229-L239 HydrophobicContact CB-CD1 4.05Å; A229-L239 HydrophobicContact CB-CD2 4.21Å; I237-L239 HydrophobicContact CD1-CD1 3.68Å; I237-L239 HydrophobicContact CG1-CD1 3.69Å; I237-L239 HydrophobicContact CG2-CD1 4.16Å; L239-L254 HydrophobicContact CB-CD1 4.15Å; L239-K267 HydrophobicContact CD1-CD 4.3Å; L239-K267 HydrophobicContact CD2-CB 4.42Å; L239-K267 HydrophobicContact CD2-CG 4.46Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.29Å; L239-H284 WeakPolarHBondContact CA-O 3.49Å; L239-V285 HydrophobicContact CD1-CG1 4.11Å; L239-V285 HydrophobicContact CD1-CG2 4.49Å; L239-V285 HydrophobicContact CG-CG2 4.27Å
240	T	97.1	Very high	94.7	Very high	38 Å²	38	54.4 Å²	54.4	23%	0.233	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	144.8	176.1	57.6	0	0	0	0	111.6	T238 C283 H284	T238-T240 HydrophobicContact CG2-CG2 4.06Å; T240-C283 CarbonylContact O-C 3.51Å; T240-C283 WeakPolarHBondContact O-CA 3.48Å; T240-H284 PolarHBondContact N-O 3.25Å; T240-H284 PolarHBondContact O-N 3.46Å
241	W	97.8	Very high	94.1	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.008	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	138	168.3	-82.3	106.9	0	0	0	109.9	V213 L225 C227 Q248 A269 V271 T282 C283	V213-W241 HydrophobicContact CG1-CH2 3.86Å; V213-W241 HydrophobicContact CG1-CZ2 4.32Å; V213-W241 HydrophobicContact CG2-CH2 4.27Å; L225-W241 HydrophobicContact CB-CH2 3.72Å; L225-W241 HydrophobicContact CB-CZ2 3.79Å; L225-W241 HydrophobicContact CD1-CH2 4.06Å; L225-W241 HydrophobicContact CD1-CZ3 4.23Å; C227-W241 HydrophobicContact CB-CH2 4.46Å; C227-W241 HydrophobicContact CB-CZ2 3.63Å; W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 3.36Å; W241-A269 PolarHBondContact NE1-O 2.91Å; W241-V271 HydrophobicContact CB-CG1 4.37Å; W241-V271 HydrophobicContact CD2-CG1 3.64Å; W241-V271 HydrophobicContact CE3-CG1 4.08Å; W241-V271 HydrophobicContact CG-CB 4.18Å; W241-V271 HydrophobicContact CG-CG1 3.77Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; W241-T282 WeakPolarHBondContact CA-O 3.27Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; W241-C283 HydrophobicContact CD2-CB 4.11Å; W241-C283 HydrophobicContact CE3-CB 4.01Å; W241-C283 HydrophobicContact CH2-CB 3.94Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 3.92Å
242	Q	97.2	Very high	93.9	Very high	40 Å²	40	57.4 Å²	57.4	19%	0.187	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	145.6	173.5	-69.5	-174.2	-7.7	0	0	110.5	E246 D247 Y281 T282 H284	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.25Å; Q242-D247 WeakPolarHBondContact CG-OD1 3.28Å; Q242-D247 PolarHBondContact NE2-OD1 3.08Å; Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.27Å; Q242-Y281 WeakPolarHBondContact O-CA 3.36Å; Q242-T282 PolarHBondContact N-O 2.98Å; Q242-T282 PolarHBondContact O-N 3.24Å; Q242-H284 PolarHBondContact OE1-NE2 2.84Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.09Å
243	W	95.4	Very high	93.9	Very high	74 Å²	74	62.9 Å²	62.9	28%	0.28	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	115.1	170.2	176.4	73.6	0	0	0	108.6	G245 E246 Q248 R280 Y281	W243-G245 PolarHBondContact O-N 2.86Å; W243-E246 PolarHBondContact N-O 3.45Å; W243-E246 PolarHBondContact O-N 2.86Å; W243-Q248 HydrophobicContact CB-CG 3.96Å; W243-R280 VanDerWaalsContact CE2-NH2 3.3Å; W243-R280 VanDerWaalsContact CZ2-NH1 3.28Å; W243-R280 VanDerWaalsContact NE1-CZ 3.3Å; W243-Y281 HydrophobicContact CB-CD1 4.22Å; W243-Y281 HydrophobicContact CB-CE1 3.98Å; W243-Y281 AromaticContact CD1-CE2 3.56Å; W243-Y281 AromaticContact CD1-CZ 3.58Å; W243-Y281 HydrophobicContact CG-CE1 4.28Å
244	D	92.8	Very high	93.9	Very high	103 Å²	103	67 Å²	67	55%	0.551	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	30.2	-172.9	-69.4	-20.6	0	0	0	114.6	R280	D244-R280 PolarHBondContact N-O 3.11Å; D244-R280 VanDerWaalsContact N-O 3.16Å; D244-R280 IonicContact OD1-NE 2.71Å; D244-R280 IonicContact OD2-CZ 3.42Å; D244-R280 IonicContact OD2-NE 3.26Å; D244-R280 PolarHBondContact OD2-NE 3.47Å; D244-R280 IonicContact OD2-NH2 3.14Å; D244-R280 PolarHBondContact OD2-NH2 2.76Å
245	G	89.5	Confident	94	Very high	48 Å²	48	67.8 Å²	67.8	50%	0.495	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	-1.2	-179.7	0	0	0	0	0	115.5	W243	W243-G245 PolarHBondContact O-N 2.86Å
246	E	93.4	Very high	94	Very high	130 Å²	130	75.3 Å²	75.3	61%	0.607	39%	0.391	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.8	126.8	176.1	-63.1	-171.3	169	0	0	111.7	Q242 W243 Q248	Q242-E246 CarbonylContact C-O 3.54Å; Q242-E246 VanDerWaalsContact CA-O 3.24Å; Q242-E246 WeakPolarHBondContact CA-O 3.25Å; W243-E246 PolarHBondContact N-O 3.45Å; W243-E246 PolarHBondContact O-N 2.86Å; E246-Q248 PolarHBondContact O-NE2 2.88Å
247	D	93.3	Very high	94.1	Very high	96 Å²	96	72 Å²	72	51%	0.513	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	132.1	-178.9	-70.7	-25.6	0	0	0	112.4	Q242	Q242-D247 WeakPolarHBondContact CG-OD1 3.28Å; Q242-D247 PolarHBondContact NE2-OD1 3.08Å
248	Q	93.1	Very high	94.1	Very high	31 Å²	31	76.2 Å²	76.2	15%	0.145	40%	0.395	C	S	.	.			trans	-103.8	41.2	-176.9	-58.6	-59.9	-63.7	0	0	112.3	W241 W243 E246 Q250 D251 T252 Y281	W241-Q248 HydrophobicContact CB-CB 4.3Å; W241-Q248 PolarHBondContact O-N 3.36Å; W243-Q248 HydrophobicContact CB-CG 3.96Å; E246-Q248 PolarHBondContact O-NE2 2.88Å; Q248-Q250 VanDerWaalsContact C-N 3.33Å; Q248-Q250 PolarHBondContact O-N 3.39Å; Q248-D251 PolarHBondContact O-N 3.38Å; Q248-T252 VanDerWaalsContact O-CB 3.32Å; Q248-T252 WeakPolarHBondContact O-CB 3.15Å; Q248-T252 PolarHBondContact O-N 2.8Å; Q248-T252 VanDerWaalsContact O-N 3.12Å; Q248-T252 PolarHBondContact O-OG1 3.18Å; Q248-Y281 HydrophobicContact CG-CE1 4.41Å
249	T	86.9	Confident	94.1	Very high	105 Å²	105	78.3 Å²	78.3	64%	0.644	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-35.6	-169.1	-46.7	0	0	0	0	114
250	Q	86.8	Confident	94.1	Very high	191 Å²	191	80.4 Å²	80.4	89%	0.893	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-33.1	-178	-67.6	-173.8	5.7	0	0	112.9	Q248 T252	Q248-Q250 VanDerWaalsContact C-N 3.33Å; Q248-Q250 PolarHBondContact O-N 3.39Å; Q250-T252 VanDerWaalsContact C-N 3.34Å
251	D	85.4	Confident	93.9	Very high	111 Å²	111	82.3 Å²	82.3	59%	0.594	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	1.3	-177.7	-56.1	-55.6	0	0	0	112.5	Q248	Q248-D251 PolarHBondContact O-N 3.38Å
252	T	93.6	Very high	93.6	Very high	23 Å²	23	87.6 Å²	87.6	14%	0.141	48%	0.483	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	120.1	178.9	-64.5	0	0	0	0	110.9	Q248 Q250 L254 A269 A270	Q248-T252 VanDerWaalsContact O-CB 3.32Å; Q248-T252 WeakPolarHBondContact O-CB 3.15Å; Q248-T252 PolarHBondContact O-N 2.8Å; Q248-T252 VanDerWaalsContact O-N 3.12Å; Q248-T252 PolarHBondContact O-OG1 3.18Å; Q250-T252 VanDerWaalsContact C-N 3.34Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 3.27Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; T252-A270 CarbonylContact C-O 3.58Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.5Å
253	E	96.3	Very high	93.3	Very high	115 Å²	115	87.7 Å²	87.7	54%	0.537	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	106.7	163.1	-174.1	-173.8	-170.5	0	0	109	W268 A269 A270	E253-W268 HydrophobicContact CB-CZ3 4.25Å; E253-W268 HydrophobicContact CG-CH2 3.92Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.31Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.46Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.47Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.09Å; E253-A270 PolarHBondContact O-N 2.77Å
254	L	96.4	Very high	93.4	Very high	91 Å²	91	84.5 Å²	84.5	48%	0.476	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	119.6	178	-174.1	68.4	0	0	0	110	L239 T252 K267 A269	L239-L254 HydrophobicContact CB-CD1 4.15Å; T252-L254 HydrophobicContact CG2-CB 4.42Å; T252-L254 PolarHBondContact O-N 3.27Å; L254-K267 HydrophobicContact CD1-CD 4.47Å; L254-A269 HydrophobicContact CD1-CB 3.68Å
255	V	96.4	Very high	93.6	Very high	34 Å²	34	80.9 Å²	80.9	21%	0.206	46%	0.463	C	S	.	.	P	Polyproline II helix	trans	-84.1	153.7	175.1	-64.5	0	0	0	0	112.3	K267 W268	V255-K267 HydrophobicContact CG2-CG 4.42Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.41Å; V255-K267 WeakPolarHBondContact O-CG 3.22Å; V255-K267 PolarHBondContact O-NZ 3.21Å; V255-W268 HydrophobicContact CB-CD2 4.5Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.97Å; V255-W268 HydrophobicContact CG1-CE3 4.26Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.47Å; V255-W268 HydrophobicContact CG2-CG 3.74Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.4Å; V255-W268 PolarHBondContact N-O 3.02Å
256	E	96.4	Very high	94	Very high	172 Å²	172	80.7 Å²	80.7	80%	0.804	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-57.6	148.2	167.5	-67.8	-175.8	173.1	0	0	111.2	R258	E256-R258 PolarHBondContact O-N 3.49Å
257	T	97.7	Very high	94.3	Very high	45 Å²	45	75.5 Å²	75.5	28%	0.276	43%	0.425	S	S	.	.	P	Polyproline II helix	trans	-68.3	130.7	174.1	-56.3	0	0	0	0	108.5	F232 A235 F265 K267	F232-T257 HydrophobicContact CE2-CG2 4.08Å; F232-T257 HydrophobicContact CZ-CG2 3.92Å; A235-T257 HydrophobicContact CB-CG2 4.33Å; A235-T257 WeakPolarHBondContact O-CG2 3.49Å; T257-F265 HydrophobicContact CG2-CB 3.79Å; T257-F265 HydrophobicContact CG2-CD1 3.94Å; T257-F265 HydrophobicContact CG2-CG 4.14Å; T257-K267 WeakPolarHBondContact OG1-CD 3.17Å; T257-K267 PolarHBondContact OG1-NZ 3.39Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
258	R	97.1	Very high	94.5	Very high	97 Å²	97	72.1 Å²	72.1	37%	0.366	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.4	-175.2	68.8	-168.1	-178.7	-171.7	3.1	111.3	E256 F265 Q266	E256-R258 PolarHBondContact O-N 3.49Å; R258-F265 WeakPolarHBondContact O-CA 3.38Å; R258-Q266 HydrophobicContact CG-CG 3.59Å; R258-Q266 PolarHBondContact N-O 2.92Å; R258-Q266 WeakPolarHBondContact O-CG 3.46Å; R258-Q266 PolarHBondContact O-N 2.9Å
259	P	97	Very high	94.8	Very high	92 Å²	92	70.7 Å²	70.7	60%	0.597	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	145.1	177.6	28.5	-34.5	0	0	0	111.1	F265	P259-F265 HydrophobicContact CB-CE1 4.32Å
260	A	96.4	Very high	95.3	Very high	50 Å²	50	65.8 Å²	65.8	41%	0.413	37%	0.368	S	S	.	.			trans	-88.1	-19.4	172.9	0	0	0	0	0	112.9	D262 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.3Å; A260-T264 WeakPolarHBondContact CB-O 3.46Å; A260-T264 PolarHBondContact N-O 2.97Å
261	G	92.8	Very high	95.8	Very high	78 Å²	78	56.9 Å²	56.9	80%	0.804	33%	0.327	S	S	*	.	S	Bend	trans	98.1	-5.5	178.5	0	0	0	0	0	114.9
262	D	92.2	Very high	96.3	Very high	113 Å²	113	55.3 Å²	55.3	60%	0.604	32%	0.321	S	S	*	.	S	Bend	trans	-106.9	13.8	176.3	60.5	0	0	0	0	112.8	A260 T264	A260-D262 WeakPolarHBondContact CB-OD1 3.3Å; D262-T264 WeakPolarHBondContact OD1-CB 3.38Å; D262-T264 PolarHBondContact OD1-N 2.81Å; D262-T264 PolarHBondContact OD1-OG1 3.24Å
263	G	91.1	Very high	96.4	Very high	43 Å²	43	54.2 Å²	54.2	44%	0.443	31%	0.314	S	S	.	.	S	Bend	trans	88.8	-2.8	-173.7	0	0	0	0	0	114.3	Y233	Y233-G263 WeakPolarHBondContact CD2-O 3.23Å
264	T	96.3	Very high	96.3	Very high	7 Å²	7	51.2 Å²	51.2	4%	0.043	31%	0.305	C	S	.	.			trans	-104	172.8	175	74.5	0	0	0	0	112.5	G231 F232 A260 D262	G231-T264 WeakPolarHBondContact CA-OG1 3.41Å; F232-T264 WeakPolarHBondContact O-CA 3.33Å; A260-T264 WeakPolarHBondContact CB-O 3.46Å; A260-T264 PolarHBondContact N-O 2.97Å; D262-T264 WeakPolarHBondContact OD1-CB 3.38Å; D262-T264 PolarHBondContact OD1-N 2.81Å; D262-T264 PolarHBondContact OD1-OG1 3.24Å
265	F	97.9	Very high	96.1	Very high	27 Å²	27	49.6 Å²	49.6	12%	0.118	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	162.7	-177.5	-63.4	-86.4	0	0	0	112.5	D54 G231 F232 Y233 A235 T257 R258 P259	D54-F265 HydrophobicContact CB-CE2 3.82Å; D54-F265 HydrophobicContact CB-CZ 3.73Å; G231-F265 PolarHBondContact N-O 3.47Å; F232-F265 VanDerWaalsContact CD1-O 3.32Å; F232-F265 WeakPolarHBondContact CD1-O 3.34Å; F232-F265 HydrophobicContact CD2-CB 3.92Å; F232-F265 HydrophobicContact CE1-CB 4.3Å; F232-F265 WeakPolarHBondContact CE1-O 3.44Å; F232-F265 HydrophobicContact CE2-CB 3.47Å; F232-F265 VanDerWaalsContact CE2-CB 3.47Å; F232-F265 HydrophobicContact CE2-CG 4.48Å; F232-F265 HydrophobicContact CG-CB 4.49Å; F232-F265 HydrophobicContact CZ-CB 3.67Å; F232-F265 PolarHBondContact N-O 3.42Å; F232-F265 PolarHBondContact O-N 3.27Å; Y233-F265 HydrophobicContact CD2-CD2 4.44Å; Y233-F265 AromaticContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CD2-CE2 3.97Å; Y233-F265 HydrophobicContact CE2-CE2 4.43Å; A235-F265 HydrophobicContact CB-CD1 3.69Å; A235-F265 HydrophobicContact CB-CD2 3.68Å; A235-F265 HydrophobicContact CB-CE1 3.64Å; A235-F265 HydrophobicContact CB-CE2 3.65Å; A235-F265 HydrophobicContact CB-CG 3.72Å; A235-F265 HydrophobicContact CB-CZ 3.65Å; T257-F265 HydrophobicContact CG2-CB 3.79Å; T257-F265 HydrophobicContact CG2-CD1 3.94Å; T257-F265 HydrophobicContact CG2-CG 4.14Å; R258-F265 WeakPolarHBondContact O-CA 3.38Å; P259-F265 HydrophobicContact CB-CE1 4.32Å
266	Q	98.1	Very high	95.8	Very high	44 Å²	44	51 Å²	51	21%	0.206	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	145.8	174.6	43.1	167.5	-22.4	0	0	110.1	A229 L230 R258	A229-Q266 VanDerWaalsContact O-CA 3.31Å; A229-Q266 WeakPolarHBondContact O-CA 3.34Å; L230-Q266 HydrophobicContact CD2-CB 3.56Å; R258-Q266 HydrophobicContact CG-CG 3.59Å; R258-Q266 PolarHBondContact N-O 2.92Å; R258-Q266 WeakPolarHBondContact O-CG 3.46Å; R258-Q266 PolarHBondContact O-N 2.9Å
267	K	98.5	Very high	95.7	Very high	21 Å²	21	45.9 Å²	45.9	9%	0.091	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	155	177.4	-162.4	-175.7	-171.7	70	0	109.1	A229 F232 I237 L239 L254 V255 T257	A229-K267 PolarHBondContact N-O 2.73Å; A229-K267 PolarHBondContact O-N 2.86Å; A229-K267 VanDerWaalsContact O-O 3.07Å; F232-K267 HydrophobicContact CE1-CB 4.37Å; F232-K267 HydrophobicContact CZ-CB 4.09Å; I237-K267 HydrophobicContact CG2-CB 4.28Å; I237-K267 HydrophobicContact CG2-CD 3.59Å; L239-K267 HydrophobicContact CD1-CD 4.3Å; L239-K267 HydrophobicContact CD2-CB 4.42Å; L239-K267 HydrophobicContact CD2-CG 4.46Å; L254-K267 HydrophobicContact CD1-CD 4.47Å; V255-K267 HydrophobicContact CG2-CG 4.42Å; V255-K267 VanDerWaalsContact O-CE 3.3Å; V255-K267 WeakPolarHBondContact O-CE 3.41Å; V255-K267 WeakPolarHBondContact O-CG 3.22Å; V255-K267 PolarHBondContact O-NZ 3.21Å; T257-K267 WeakPolarHBondContact OG1-CD 3.17Å; T257-K267 PolarHBondContact OG1-NZ 3.39Å; T257-K267 VanDerWaalsContact OG1-NZ 3.16Å
268	W	98.2	Very high	95.5	Very high	25 Å²	25	44.7 Å²	44.7	10%	0.095	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	157.1	169.7	59	-98.1	0	0	0	111.7	R226 C227 W228 E253 V255 A270	R226-W268 HydrophobicContact CG-CB 4.03Å; R226-W268 HydrophobicContact CG-CD2 4.11Å; R226-W268 HydrophobicContact CG-CE3 3.87Å; R226-W268 HydrophobicContact CG-CG 4.23Å; C227-W268 CarbonylContact O-C 3.56Å; C227-W268 WeakPolarHBondContact O-CA 3.28Å; C227-W268 WeakPolarHBondContact O-CB 3.3Å; W228-W268 HydrophobicContact CD2-CB 3.95Å; W228-W268 HydrophobicContact CD2-CG 4.44Å; W228-W268 HydrophobicContact CE3-CB 3.87Å; W228-W268 AromaticContact CE3-CD1 3.85Å; W228-W268 HydrophobicContact CE3-CG 4.16Å; W228-W268 HydrophobicContact CG-CB 4.38Å; W228-W268 AromaticContact CH2-CD1 3.63Å; W228-W268 HydrophobicContact CH2-CG 4.26Å; W228-W268 HydrophobicContact CZ3-CB 4.29Å; W228-W268 AromaticContact CZ3-CD1 3.38Å; W228-W268 HydrophobicContact CZ3-CG 4.07Å; E253-W268 HydrophobicContact CB-CZ3 4.25Å; E253-W268 HydrophobicContact CG-CH2 3.92Å; E253-W268 HydrophobicContact CG-CZ3 3.85Å; E253-W268 WeakPolarHBondContact OE1-CH2 3.31Å; E253-W268 WeakPolarHBondContact OE2-CH2 3.46Å; V255-W268 HydrophobicContact CB-CD2 4.5Å; V255-W268 HydrophobicContact CB-CZ2 4.39Å; V255-W268 HydrophobicContact CG1-CD2 3.97Å; V255-W268 HydrophobicContact CG1-CE3 4.26Å; V255-W268 HydrophobicContact CG1-CH2 3.55Å; V255-W268 HydrophobicContact CG1-CZ2 3.17Å; V255-W268 HydrophobicContact CG1-CZ3 4.06Å; V255-W268 HydrophobicContact CG2-CD2 3.75Å; V255-W268 HydrophobicContact CG2-CE3 4.47Å; V255-W268 HydrophobicContact CG2-CG 3.74Å; V255-W268 HydrophobicContact CG2-CZ2 4.39Å; V255-W268 WeakPolarHBondContact CG2-O 3.4Å; V255-W268 PolarHBondContact N-O 3.02Å; W268-A270 HydrophobicContact CE3-CB 3.95Å; W268-A270 HydrophobicContact CZ3-CB 3.64Å
269	A	98.2	Very high	95.4	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	131.8	173.9	0	0	0	0	0	108.6	R226 C227 L239 W241 T252 E253 L254	R226-A269 WeakPolarHBondContact CA-O 3.46Å; C227-A269 PolarHBondContact N-O 3.07Å; C227-A269 PolarHBondContact O-N 3.22Å; L239-A269 HydrophobicContact CB-CB 4.06Å; L239-A269 HydrophobicContact CD2-CB 4.29Å; W241-A269 PolarHBondContact NE1-O 2.91Å; T252-A269 HydrophobicContact CG2-CB 3.92Å; E253-A269 CarbonylContact O-C 3.52Å; E253-A269 WeakPolarHBondContact O-CA 3.47Å; L254-A269 HydrophobicContact CD1-CB 3.68Å
270	A	97.7	Very high	95.3	Very high	3 Å²	3	43.9 Å²	43.9	3%	0.025	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.6	179.4	0	0	0	0	0	112	T224 L225 R226 T252 E253 W268	T224-A270 HydrophobicContact CG2-CB 3.95Å; L225-A270 CarbonylContact O-C 3.57Å; L225-A270 WeakPolarHBondContact O-CA 3.48Å; R226-A270 HydrophobicContact CB-CB 4.01Å; R226-A270 HydrophobicContact CG-CB 4.13Å; T252-A270 CarbonylContact C-O 3.58Å; T252-A270 VanDerWaalsContact CA-O 3.32Å; T252-A270 WeakPolarHBondContact CA-O 3.5Å; E253-A270 HydrophobicContact CB-CB 4.41Å; E253-A270 PolarHBondContact N-O 3.09Å; E253-A270 PolarHBondContact O-N 2.77Å; W268-A270 HydrophobicContact CE3-CB 3.95Å; W268-A270 HydrophobicContact CZ3-CB 3.64Å
271	V	97.3	Very high	95.3	Very high	4 Å²	4	42.4 Å²	42.4	2%	0.024	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	142.2	175.9	62.2	0	0	0	0	108.9	T224 L225 W241 V273 Y281	T224-V271 WeakPolarHBondContact CA-O 3.44Å; L225-V271 HydrophobicContact CB-CG1 4.23Å; L225-V271 PolarHBondContact N-O 3.41Å; L225-V271 PolarHBondContact O-N 3.13Å; W241-V271 HydrophobicContact CB-CG1 4.37Å; W241-V271 HydrophobicContact CD2-CG1 3.64Å; W241-V271 HydrophobicContact CE3-CG1 4.08Å; W241-V271 HydrophobicContact CG-CB 4.18Å; W241-V271 HydrophobicContact CG-CG1 3.77Å; W241-V271 HydrophobicContact CZ2-CG1 4.35Å; V271-V273 HydrophobicContact CG1-CG1 3.78Å; V271-V273 HydrophobicContact CG2-CG1 4.37Å; V271-Y281 HydrophobicContact CG1-CD1 4.08Å; V271-Y281 HydrophobicContact CG1-CE1 4.47Å; V271-Y281 HydrophobicContact CG2-CD1 4.47Å; V271-Y281 HydrophobicContact CG2-CE1 4.1Å
272	V	96.8	Very high	95.6	Very high	77 Å²	77	39.2 Å²	39.2	47%	0.467	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.8	171.5	-178.4	0	0	0	0	107.9	E222	E222-V272 HydrophobicContact CB-CG1 4.12Å; E222-V272 HydrophobicContact CG-CG1 4.34Å
273	V	95.6	Very high	95.8	Very high	1 Å²	1	33.8 Å²	33.8	1%	0.006	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	146.5	-174.7	-52.3	0	0	0	0	110.6	E222 A223 L225 V271 E278 Y281	E222-V273 WeakPolarHBondContact CA-O 3.34Å; A223-V273 HydrophobicContact CB-CG2 4.45Å; A223-V273 PolarHBondContact N-O 2.97Å; A223-V273 WeakPolarHBondContact O-CG2 3.46Å; A223-V273 PolarHBondContact O-N 3.24Å; L225-V273 HydrophobicContact CD1-CG1 4.02Å; L225-V273 HydrophobicContact CD1-CG2 4.07Å; L225-V273 HydrophobicContact CG-CG1 4.17Å; L225-V273 HydrophobicContact CG-CG2 3.85Å; V271-V273 HydrophobicContact CG1-CG1 3.78Å; V271-V273 HydrophobicContact CG2-CG1 4.37Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; V273-Y281 HydrophobicContact CB-CD2 3.94Å; V273-Y281 HydrophobicContact CB-CE2 3.6Å; V273-Y281 HydrophobicContact CG1-CD1 3.77Å; V273-Y281 HydrophobicContact CG1-CD2 3.54Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.47Å; V273-Y281 VanDerWaalsContact CG1-CE2 3.47Å; V273-Y281 HydrophobicContact CG1-CG 3.69Å
274	P	95.3	Very high	96.1	Very high	52 Å²	52	33.4 Å²	33.4	34%	0.338	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-63	139.4	170.3	-20.2	32.4	0	0	0	111.5	H221 G276 E277	H221-P274 WeakPolarHBondContact O-CA 3.49Å; P274-G276 PolarHBondContact O-N 3.16Å; P274-E277 HydrophobicContact CB-CB 4.34Å; P274-E277 HydrophobicContact CB-CG 4.18Å; P274-E277 PolarHBondContact O-N 2.83Å
275	S	91.4	Very high	96.2	Very high	56 Å²	56	33.1 Å²	33.1	39%	0.392	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	126.2	174.5	-65.7	0	0	0	0	110.8	D220 H221 E222 E278	D220-S275 PolarHBondContact O-OG 3.34Å; H221-S275 PolarHBondContact O-N 2.83Å; H221-S275 PolarHBondContact O-OG 2.9Å; E222-S275 PolarHBondContact N-OG 3.13Å; S275-E278 WeakPolarHBondContact CA-OE1 3.22Å
276	G	90.3	Very high	96.2	Very high	65 Å²	65	35 Å²	35	67%	0.67	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	92	-9.1	-178.5	0	0	0	0	0	115	P274 E278	P274-G276 PolarHBondContact O-N 3.16Å; G276-E278 WeakPolarHBondContact CA-OE2 3.49Å; G276-E278 VanDerWaalsContact N-CD 3.27Å; G276-E278 PolarHBondContact N-OE1 3.18Å; G276-E278 PolarHBondContact N-OE2 3Å
277	E	93.9	Very high	96	Very high	64 Å²	64	33.4 Å²	33.4	30%	0.299	19%	0.185	S	C	.	.			trans	-98.5	3.5	175.9	-65.2	-158	-155.6	0	0	113.6	P274 Q279 R280 Y281	P274-E277 HydrophobicContact CB-CB 4.34Å; P274-E277 HydrophobicContact CB-CG 4.18Å; P274-E277 PolarHBondContact O-N 2.83Å; E277-Q279 PolarHBondContact O-N 3.14Å; E277-R280 WeakPolarHBondContact O-CB 3.49Å; E277-R280 PolarHBondContact O-N 2.83Å; E277-R280 IonicContact OE1-NH1 2.88Å; E277-R280 IonicContact OE2-CZ 3.19Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 3.06Å; E277-Y281 HydrophobicContact CB-CE2 4.38Å; E277-Y281 WeakPolarHBondContact O-CD2 3.34Å
278	E	94	Very high	95.7	Very high	20 Å²	20	36.3 Å²	36.3	9%	0.093	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-58.7	-28.8	-170.6	-55.2	83.1	178.1	0	0	113	H215 L225 V273 S275 G276 R280 Y281 W298	H215-E278 IonicContact NE2-OE1 3.47Å; L225-E278 HydrophobicContact CD1-CB 4.1Å; L225-E278 HydrophobicContact CD2-CB 4.46Å; L225-E278 HydrophobicContact CD2-CG 4.37Å; V273-E278 HydrophobicContact CG2-CG 3.92Å; S275-E278 WeakPolarHBondContact CA-OE1 3.22Å; G276-E278 WeakPolarHBondContact CA-OE2 3.49Å; G276-E278 VanDerWaalsContact N-CD 3.27Å; G276-E278 PolarHBondContact N-OE1 3.18Å; G276-E278 PolarHBondContact N-OE2 3Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 3.4Å; E278-Y281 PolarHBondContact O-N 3.49Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.41Å; E278-W298 VanDerWaalsContact CB-CE3 3.41Å; E278-W298 HydrophobicContact CB-CZ3 3.78Å; E278-W298 HydrophobicContact CG-CE3 3.78Å; E278-W298 HydrophobicContact CG-CZ3 3.76Å
279	Q	94.3	Very high	95.4	Very high	88 Å²	88	36 Å²	36	41%	0.411	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-75.2	-15.9	-179.7	-63.6	-56.8	-52	0	0	114	E277 Y281 W298	E277-Q279 PolarHBondContact O-N 3.14Å; Q279-Y281 VanDerWaalsContact C-N 3.3Å; Q279-W298 PolarHBondContact NE2-O 3.07Å
280	R	95.6	Very high	95.1	Very high	84 Å²	84	37.2 Å²	37.2	32%	0.317	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-79	-19	174.3	-60.9	176.8	70.2	-170.2	2.2	112.1	W243 D244 E277 E278	W243-R280 VanDerWaalsContact CE2-NH2 3.3Å; W243-R280 VanDerWaalsContact CZ2-NH1 3.28Å; W243-R280 VanDerWaalsContact NE1-CZ 3.3Å; D244-R280 PolarHBondContact N-O 3.11Å; D244-R280 VanDerWaalsContact N-O 3.16Å; D244-R280 IonicContact OD1-NE 2.71Å; D244-R280 IonicContact OD2-CZ 3.42Å; D244-R280 IonicContact OD2-NE 3.26Å; D244-R280 PolarHBondContact OD2-NE 3.47Å; D244-R280 IonicContact OD2-NH2 3.14Å; D244-R280 PolarHBondContact OD2-NH2 2.76Å; E277-R280 WeakPolarHBondContact O-CB 3.49Å; E277-R280 PolarHBondContact O-N 2.83Å; E277-R280 IonicContact OE1-NH1 2.88Å; E277-R280 IonicContact OE2-CZ 3.19Å; E277-R280 IonicContact OE2-NH1 2.66Å; E277-R280 PolarHBondContact OE2-NH1 3.06Å; E278-R280 VanDerWaalsContact C-N 3.29Å; E278-R280 PolarHBondContact O-N 3.4Å
281	Y	96.8	Very high	94.8	Very high	19 Å²	19	43.5 Å²	43.5	8%	0.075	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	128.6	179.4	-69.3	-95.4	0	0	0	111.3	Q242 W243 Q248 V271 V273 E277 E278 Q279	Q242-Y281 CarbonylContact O-C 3.56Å; Q242-Y281 VanDerWaalsContact O-CA 3.27Å; Q242-Y281 WeakPolarHBondContact O-CA 3.36Å; W243-Y281 HydrophobicContact CB-CD1 4.22Å; W243-Y281 HydrophobicContact CB-CE1 3.98Å; W243-Y281 AromaticContact CD1-CE2 3.56Å; W243-Y281 AromaticContact CD1-CZ 3.58Å; W243-Y281 HydrophobicContact CG-CE1 4.28Å; Q248-Y281 HydrophobicContact CG-CE1 4.41Å; V271-Y281 HydrophobicContact CG1-CD1 4.08Å; V271-Y281 HydrophobicContact CG1-CE1 4.47Å; V271-Y281 HydrophobicContact CG2-CD1 4.47Å; V271-Y281 HydrophobicContact CG2-CE1 4.1Å; V273-Y281 HydrophobicContact CB-CD2 3.94Å; V273-Y281 HydrophobicContact CB-CE2 3.6Å; V273-Y281 HydrophobicContact CG1-CD1 3.77Å; V273-Y281 HydrophobicContact CG1-CD2 3.54Å; V273-Y281 HydrophobicContact CG1-CE1 3.69Å; V273-Y281 HydrophobicContact CG1-CE2 3.47Å; V273-Y281 VanDerWaalsContact CG1-CE2 3.47Å; V273-Y281 HydrophobicContact CG1-CG 3.69Å; E277-Y281 HydrophobicContact CB-CE2 4.38Å; E277-Y281 WeakPolarHBondContact O-CD2 3.34Å; E278-Y281 PolarHBondContact O-N 3.49Å; Q279-Y281 VanDerWaalsContact C-N 3.3Å
282	T	97.6	Very high	94.6	Very high	10 Å²	10	50.6 Å²	50.6	6%	0.061	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	132.8	174.6	46.4	0	0	0	0	110.7	W241 Q242 H284 T295 L296 R297	W241-T282 WeakPolarHBondContact CA-O 3.27Å; W241-T282 VanDerWaalsContact CE3-C 3.41Å; Q242-T282 PolarHBondContact N-O 2.98Å; Q242-T282 PolarHBondContact O-N 3.24Å; T282-H284 PolarHBondContact OG1-NE2 3.23Å; T282-H284 VanDerWaalsContact OG1-NE2 3.09Å; T282-T295 HydrophobicContact CG2-CG2 3.93Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.2Å; T282-R297 HydrophobicContact CG2-CG 3.6Å; T282-R297 VanDerWaalsContact CG2-NE 3.26Å
283	C	97.9	Very high	94.5	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	127.8	169.8	173	0	0	0	0	109.5	C227 T240 W241 T295 L296	C227-C283 HydrophobicContact CB-CB 3.53Å; C227-C283 WeakPolarHBondContact CB-SG 3.23Å; C227-C283 WeakPolarHBondContact SG-CB 3.46Å; C227-C283 CovalentContact SG-SG 2.03Å; C227-C283 PolarHBondContact SG-SG 2.96Å; T240-C283 CarbonylContact O-C 3.51Å; T240-C283 WeakPolarHBondContact O-CA 3.48Å; W241-C283 HydrophobicContact CD2-CB 4.11Å; W241-C283 HydrophobicContact CE3-CB 4.01Å; W241-C283 HydrophobicContact CH2-CB 3.94Å; W241-C283 HydrophobicContact CZ2-CB 4.04Å; W241-C283 HydrophobicContact CZ3-CB 3.92Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.34Å; C283-L296 HydrophobicContact CB-CB 4.28Å; C283-L296 PolarHBondContact N-O 3.33Å; C283-L296 PolarHBondContact O-N 2.79Å
284	H	97.6	Very high	94.6	Very high	35 Å²	35	53.2 Å²	53.2	16%	0.162	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	132.4	176.4	-65.2	-103.6	0	0	0	109.7	L239 T240 Q242 T282 L294 T295	L239-H284 WeakPolarHBondContact CA-O 3.49Å; T240-H284 PolarHBondContact N-O 3.25Å; T240-H284 PolarHBondContact O-N 3.46Å; Q242-H284 PolarHBondContact OE1-NE2 2.84Å; Q242-H284 VanDerWaalsContact OE1-NE2 3.09Å; T282-H284 PolarHBondContact OG1-NE2 3.23Å; T282-H284 VanDerWaalsContact OG1-NE2 3.09Å; H284-L294 CarbonylContact C-O 3.57Å; H284-L294 WeakPolarHBondContact CA-O 3.38Å; H284-T295 PolarHBondContact CE1-OG1 2.9Å; H284-T295 PolarHBondContact ND1-OG1 3.42Å
285	V	97.8	Very high	94.7	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	121.7	-178.8	-175.7	0	0	0	0	109	P209 T211 I237 T238 L239 L290 P293 L294 L296	P209-V285 HydrophobicContact CG-CG1 3.94Å; T211-V285 HydrophobicContact CG2-CB 4.37Å; T211-V285 HydrophobicContact CG2-CG1 4.11Å; T211-V285 HydrophobicContact CG2-CG2 4.01Å; I237-V285 HydrophobicContact CD1-CG1 4.03Å; I237-V285 HydrophobicContact CG1-CG1 4.37Å; T238-V285 WeakPolarHBondContact O-CA 3.43Å; L239-V285 HydrophobicContact CD1-CG1 4.11Å; L239-V285 HydrophobicContact CD1-CG2 4.49Å; L239-V285 HydrophobicContact CG-CG2 4.27Å; V285-L290 HydrophobicContact CG1-CD1 4.24Å; V285-P293 WeakPolarHBondContact O-CA 3.48Å; V285-L294 HydrophobicContact CB-CB 4.34Å; V285-L294 PolarHBondContact N-O 3.14Å; V285-L294 PolarHBondContact O-N 2.87Å; V285-L296 HydrophobicContact CG2-CD1 3.7Å
286	Q	96.8	Very high	94.9	Very high	66 Å²	66	53.6 Å²	53.6	31%	0.308	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	131	174.4	-56.6	178.9	13.9	0	0	109.2	I237 T238 P293	I237-Q286 VanDerWaalsContact CG1-O 3.3Å; I237-Q286 WeakPolarHBondContact CG1-O 3.47Å; T238-Q286 PolarHBondContact N-O 3.17Å; T238-Q286 PolarHBondContact O-N 3.4Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.09Å
287	H	95.3	Very high	95.2	Very high	12 Å²	12	57.5 Å²	57.5	6%	0.056	29%	0.291	C	S	.	.			trans	-157.5	146.6	-178	-173.9	-100.1	0	0	0	109	E207 P209 F232 Y233 P234 E236 I237 G289 L290	E207-H287 PolarHBondContact O-CE1 3.44Å; E207-H287 VanDerWaalsContact O-CE1 3.23Å; P209-H287 HydrophobicContact CG-CB 4.11Å; F232-H287 AromaticContact CD2-CD2 3.87Å; F232-H287 AromaticContact CD2-NE2 3.7Å; Y233-H287 PolarHBondContact O-CE1 3.41Å; P234-H287 PolarHBondContact O-NE2 2.81Å; E236-H287 PolarHBondContact O-CD2 3.01Å; I237-H287 HydrophobicContact CD1-CB 4.33Å; I237-H287 HydrophobicContact CG1-CB 4.08Å; H287-G289 PolarHBondContact ND1-N 3.44Å; H287-G289 PolarHBondContact O-N 3.1Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.2Å; H287-L290 WeakPolarHBondContact O-CB 3.46Å; H287-L290 PolarHBondContact O-N 3.05Å
288	E	91.4	Very high	95.2	Very high	81 Å²	81	56.6 Å²	56.6	38%	0.379	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-33.1	-179.8	-174.8	-177.6	173.4	0	0	113	W23 L290	W23-E288 HydrophobicContact CE3-CB 4.28Å; E288-L290 PolarHBondContact O-N 3.41Å
289	G	91.1	Very high	95	Very high	19 Å²	19	64 Å²	64	20%	0.196	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-5.2	177.8	0	0	0	0	0	114.4	H287	H287-G289 PolarHBondContact ND1-N 3.44Å; H287-G289 PolarHBondContact O-N 3.1Å
290	L	93.7	Very high	94.3	Very high	26 Å²	26	63.6 Å²	63.6	14%	0.136	32%	0.322	C	S	.	.			trans	-100.8	128	177.6	-66.2	170.8	0	0	0	110.5	H208 P209 V285 H287 E288 E292 L294	H208-L290 HydrophobicContact CB-CD2 3.94Å; P209-L290 HydrophobicContact CG-CD1 3.85Å; P209-L290 HydrophobicContact CG-CD2 4.46Å; P209-L290 HydrophobicContact CG-CG 4.21Å; V285-L290 HydrophobicContact CG1-CD1 4.24Å; H287-L290 HydrophobicContact CB-CD1 3.98Å; H287-L290 HydrophobicContact CB-CG 4.2Å; H287-L290 WeakPolarHBondContact O-CB 3.46Å; H287-L290 PolarHBondContact O-N 3.05Å; E288-L290 PolarHBondContact O-N 3.41Å; L290-E292 PolarHBondContact O-N 3.37Å; L290-L294 HydrophobicContact CD1-CD1 3.95Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CD2 4.48Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.49Å; L290-L294 HydrophobicContact CG-CG 4.49Å
291	P	91.4	Very high	92.9	Very high	135 Å²	135	64.4 Å²	64.4	88%	0.877	34%	0.34	S	S	*	.	S	Bend	trans	-66.1	-30.5	175.8	27.5	-34.2	0	0	0	112.1
292	E	92.4	Very high	90.7	Very high	153 Å²	153	68.9 Å²	68.9	72%	0.715	37%	0.374	S	S	*	.	S	Bend	trans	-141.1	148.9	174.8	-66.6	-177.1	179.1	0	0	109.5	L290 L294	L290-E292 PolarHBondContact O-N 3.37Å; E292-L294 PolarHBondContact O-N 3.17Å
293	P	95.1	Very high	88.2	Confident	70 Å²	70	75.9 Å²	75.9	46%	0.455	41%	0.406	S	S	.	.			trans	-54.2	136	174.1	-27.8	36.4	0	0	0	112.8	V285 Q286	V285-P293 WeakPolarHBondContact O-CA 3.48Å; Q286-P293 HydrophobicContact CG-CB 3.99Å; Q286-P293 HydrophobicContact CG-CG 4.09Å
294	L	96.4	Very high	85.7	Confident	62 Å²	62	81.2 Å²	81.2	33%	0.325	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	139.9	175.9	-64	177.8	0	0	0	110.6	T211 H284 V285 L290 E292	T211-L294 HydrophobicContact CG2-CD1 4.29Å; H284-L294 CarbonylContact C-O 3.57Å; H284-L294 WeakPolarHBondContact CA-O 3.38Å; V285-L294 HydrophobicContact CB-CB 4.34Å; V285-L294 PolarHBondContact N-O 3.14Å; V285-L294 PolarHBondContact O-N 2.87Å; L290-L294 HydrophobicContact CD1-CD1 3.95Å; L290-L294 HydrophobicContact CD1-CG 3.85Å; L290-L294 HydrophobicContact CD2-CD1 3.67Å; L290-L294 HydrophobicContact CD2-CD2 4.48Å; L290-L294 HydrophobicContact CD2-CG 3.92Å; L290-L294 HydrophobicContact CG-CD1 4.49Å; L290-L294 HydrophobicContact CG-CG 4.49Å; E292-L294 PolarHBondContact O-N 3.17Å
295	T	97.3	Very high	83.5	Confident	86 Å²	86	85.9 Å²	85.9	53%	0.528	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	118.5	170.8	-56.5	0	0	0	0	109.2	T282 C283 H284	T282-T295 HydrophobicContact CG2-CG2 3.93Å; C283-T295 CarbonylContact O-C 3.53Å; C283-T295 WeakPolarHBondContact O-CA 3.34Å; H284-T295 PolarHBondContact CE1-OG1 2.9Å; H284-T295 PolarHBondContact ND1-OG1 3.42Å
296	L	96.7	Very high	81.5	Confident	31 Å²	31	91 Å²	91	16%	0.162	50%	0.498	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	141.6	-175.4	-62.8	129.7	0	0	0	110.5	T211 V213 T282 C283 V285	T211-L296 HydrophobicContact CG2-CD1 4.12Å; T211-L296 WeakPolarHBondContact OG1-CD2 3.43Å; V213-L296 HydrophobicContact CG2-CB 3.84Å; T282-L296 CarbonylContact C-O 3.57Å; T282-L296 WeakPolarHBondContact CA-O 3.2Å; C283-L296 HydrophobicContact CB-CB 4.28Å; C283-L296 PolarHBondContact N-O 3.33Å; C283-L296 PolarHBondContact O-N 2.79Å; V285-L296 HydrophobicContact CG2-CD1 3.7Å
297	R	95.8	Very high	79.7	Confident	147 Å²	147	92 Å²	92	56%	0.555	51%	0.51	S	S	*	.			trans	-120.2	155.1	166.4	-69.5	-174.5	-179.2	161.3	0.1	109.2	T282 K299	T282-R297 HydrophobicContact CG2-CG 3.6Å; T282-R297 VanDerWaalsContact CG2-NE 3.26Å; R297-K299 PolarHBondContact O-N 3.08Å
298	W	95.3	Very high	78	Confident	45 Å²	45	97.2 Å²	97.2	17%	0.17	54%	0.537	C	S	.	.			trans	-63.7	127.6	168.3	171.1	60.2	0	0	0	110.2	V213 H215 L225 E278 Q279 P300	V213-W298 HydrophobicContact CB-CB 4.47Å; V213-W298 HydrophobicContact CG1-CB 3.81Å; H215-W298 HydrophobicContact CB-CD2 4.11Å; H215-W298 HydrophobicContact CB-CG 4.14Å; H215-W298 HydrophobicContact CB-CZ2 4.02Å; H215-W298 AromaticContact CG-CE2 3.74Å; H215-W298 AromaticContact CG-CZ2 3.76Å; H215-W298 AromaticContact CG-NE1 3.97Å; H215-W298 AromaticContact ND1-CZ2 3.95Å; L225-W298 HydrophobicContact CD1-CB 4.49Å; L225-W298 HydrophobicContact CD2-CB 3.85Å; L225-W298 HydrophobicContact CD2-CD2 4.42Å; L225-W298 HydrophobicContact CD2-CG 4.01Å; E278-W298 HydrophobicContact CB-CD2 4.44Å; E278-W298 HydrophobicContact CB-CE3 3.41Å; E278-W298 VanDerWaalsContact CB-CE3 3.41Å; E278-W298 HydrophobicContact CB-CZ3 3.78Å; E278-W298 HydrophobicContact CG-CE3 3.78Å; E278-W298 HydrophobicContact CG-CZ3 3.76Å; Q279-W298 PolarHBondContact NE2-O 3.07Å; W298-P300 HydrophobicContact CE3-CG 4.46Å; W298-P300 HydrophobicContact CH2-CB 4.37Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.12Å; W298-P300 HydrophobicContact CZ2-CG 4.03Å; W298-P300 HydrophobicContact CZ3-CG 4.13Å
299	K	88.9	Confident	76.6	Confident	176 Å²	176	99.2 Å²	99.2	77%	0.765	56%	0.555	S	S	*	*			trans	-108.7	120.3	171	-69.8	-177.2	-179.6	177.1	0	108.2	R297 S301	R297-K299 PolarHBondContact O-N 3.08Å; K299-S301 PolarHBondContact O-N 2.82Å
300	P	80.2	Confident	75.5	Confident	79 Å²	79	100.5 Å²	100.5	51%	0.513	57%	0.568	S	S	.	*			trans	-55.4	128.3	171.1	-21.3	30.7	0	0	0	109.1	W298 S302	W298-P300 HydrophobicContact CE3-CG 4.46Å; W298-P300 HydrophobicContact CH2-CB 4.37Å; W298-P300 HydrophobicContact CH2-CG 3.92Å; W298-P300 HydrophobicContact CZ2-CB 4.12Å; W298-P300 HydrophobicContact CZ2-CG 4.03Å; W298-P300 HydrophobicContact CZ3-CG 4.13Å; P300-S302 PolarHBondContact O-N 3.2Å
301	S	65.1	Low	74.5	Confident	100 Å²	100	103.7 Å²	103.7	70%	0.699	58%	0.584	S	S	*	*			trans	-60.2	107.1	175.9	166.7	0	0	0	0	108.9	K299 Q303	K299-S301 PolarHBondContact O-N 2.82Å; S301-Q303 PolarHBondContact O-N 2.91Å; S301-Q303 PolarHBondContact OG-N 3.39Å
302	S	50.5	Low	73.8	Confident	113 Å²	113	101.5 Å²	101.5	79%	0.79	57%	0.568	S	S	*	*			trans	-75.1	68.8	164.4	55.5	0	0	0	0	108.5	P300 P304	P300-S302 PolarHBondContact O-N 3.2Å; S302-P304 VanDerWaalsContact O-CD 3.24Å; S302-P304 WeakPolarHBondContact O-CD 3.48Å
303	Q	46.5	Very low	72.9	Confident	158 Å²	158	96.8 Å²	96.8	74%	0.738	56%	0.555	S	S	*	*			trans	-66.3	117.2	157.2	-89.1	-174.4	-16.7	0	0	105.4	S301 T305	S301-Q303 PolarHBondContact O-N 2.91Å; S301-Q303 PolarHBondContact OG-N 3.39Å; Q303-T305 PolarHBondContact O-N 2.99Å
304	P	44.3	Very low	72.3	Confident	111 Å²	111	95 Å²	95	72%	0.721	55%	0.55	S	S	*	.			trans	-60.9	114.3	168.5	24.9	-29	0	0	0	105.5	S302 I306	S302-P304 VanDerWaalsContact O-CD 3.24Å; S302-P304 WeakPolarHBondContact O-CD 3.48Å; P304-I306 PolarHBondContact O-N 2.81Å
305	T	51.7	Low	71.8	Confident	133 Å²	133	97.3 Å²	97.3	82%	0.816	56%	0.562	S	S	*	*			trans	-60.6	91.4	164.3	-38.5	0	0	0	0	104.9	Q303 P307	Q303-T305 PolarHBondContact O-N 2.99Å; T305-P307 WeakPolarHBondContact O-CD 3.48Å
306	I	56.2	Low	71.1	Confident	108 Å²	108	95.7 Å²	95.7	55%	0.554	56%	0.557	S	S	*	*			trans	-50.7	120.8	168.6	-63.5	174.5	0	0	0	103.6	P304 I308 I311	P304-I306 PolarHBondContact O-N 2.81Å; I306-I308 HydrophobicContact CG2-CG1 4.46Å; I306-I308 WeakPolarHBondContact O-CG1 3.18Å; I306-I308 PolarHBondContact O-N 3.21Å; I306-I311 HydrophobicContact CG2-CD1 3.88Å
307	P	57.6	Low	70.5	Confident	87 Å²	87	98.4 Å²	98.4	57%	0.565	58%	0.575	S	S	*	*			trans	-73.8	78.4	-174.9	29.5	-33.1	0	0	0	107.3	T305 V309 G310 I311	T305-P307 WeakPolarHBondContact O-CD 3.48Å; P307-V309 PolarHBondContact O-N 3.46Å; P307-G310 WeakPolarHBondContact O-CA 3.4Å; P307-G310 PolarHBondContact O-N 2.87Å; P307-I311 PolarHBondContact O-N 2.99Å; P307-I311 VanDerWaalsContact O-N 3.09Å
308	I	61.3	Low	70	Confident	121 Å²	121	96.9 Å²	96.9	62%	0.621	58%	0.577	S	S	*	*	H	α-helix	trans	-55.6	-35.3	178.6	-67.2	166.7	0	0	0	108.6	I306 G310 I311 V312	I306-I308 HydrophobicContact CG2-CG1 4.46Å; I306-I308 WeakPolarHBondContact O-CG1 3.18Å; I306-I308 PolarHBondContact O-N 3.21Å; I308-G310 PolarHBondContact O-N 3.42Å; I308-I311 PolarHBondContact O-N 2.82Å; I308-V312 HydrophobicContact CG2-CG2 4.28Å; I308-V312 WeakPolarHBondContact O-CB 3.43Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.25Å
309	V	62	Low	69.5	Low	124 Å²	124	97.4 Å²	97.4	75%	0.752	59%	0.591	S	S	*	*	H	α-helix	trans	-62.1	-40.5	173.5	-179.5	0	0	0	0	112.4	P307 A313	P307-V309 PolarHBondContact O-N 3.46Å; V309-A313 VanDerWaalsContact O-CB 3.25Å; V309-A313 WeakPolarHBondContact O-CB 3.45Å; V309-A313 PolarHBondContact O-N 3.15Å
310	G	66.8	Low	69.3	Low	45 Å²	45	93.2 Å²	93.2	46%	0.464	58%	0.58	S	S	.	*	H	α-helix	trans	-68.8	-38	178.4	0	0	0	0	0	112.8	P307 I308 G314	P307-G310 WeakPolarHBondContact O-CA 3.4Å; P307-G310 PolarHBondContact O-N 2.87Å; I308-G310 PolarHBondContact O-N 3.42Å; G310-G314 PolarHBondContact O-N 2.62Å
311	I	73.8	Confident	69.6	Low	94 Å²	94	94.5 Å²	94.5	48%	0.482	58%	0.582	S	S	.	*	H	α-helix	trans	-69	-44.2	176.2	-62.9	171.3	0	0	0	110.5	I306 P307 I308 G314 L315	I306-I311 HydrophobicContact CG2-CD1 3.88Å; P307-I311 PolarHBondContact O-N 2.99Å; P307-I311 VanDerWaalsContact O-N 3.09Å; I308-I311 PolarHBondContact O-N 2.82Å; I311-G314 PolarHBondContact O-N 3.33Å; I311-L315 HydrophobicContact CG2-CD1 3.99Å; I311-L315 HydrophobicContact CG2-CG 4.49Å; I311-L315 WeakPolarHBondContact O-CB 3.26Å; I311-L315 WeakPolarHBondContact O-CG 3.38Å; I311-L315 PolarHBondContact O-N 2.6Å
312	V	75.4	Confident	70.4	Confident	89 Å²	89	92.8 Å²	92.8	54%	0.539	57%	0.574	S	S	.	*	H	α-helix	trans	-65.1	-43.1	178	172.6	0	0	0	0	111.2	I308 L315 A316	I308-V312 HydrophobicContact CG2-CG2 4.28Å; I308-V312 WeakPolarHBondContact O-CB 3.43Å; I308-V312 WeakPolarHBondContact O-CG2 3.33Å; I308-V312 PolarHBondContact O-N 3.25Å; V312-L315 PolarHBondContact O-N 3.31Å; V312-A316 WeakPolarHBondContact O-CB 3.44Å; V312-A316 PolarHBondContact O-N 3.35Å
313	A	75.1	Confident	71.9	Confident	53 Å²	53	91.9 Å²	91.9	44%	0.438	56%	0.564	S	S	.	*	H	α-helix	trans	-63.2	-43.2	175.1	0	0	0	0	0	111.8	V309 A316 V317	V309-A313 VanDerWaalsContact O-CB 3.25Å; V309-A313 WeakPolarHBondContact O-CB 3.45Å; V309-A313 PolarHBondContact O-N 3.15Å; A313-A316 PolarHBondContact O-N 3.25Å; A313-V317 WeakPolarHBondContact O-CG2 3.31Å; A313-V317 PolarHBondContact O-N 3.44Å
314	G	81.6	Confident	73.6	Confident	34 Å²	34	89.2 Å²	89.2	35%	0.351	55%	0.554	S	S	.	*	H	α-helix	trans	-62	-43.5	176.9	0	0	0	0	0	113.1	G310 I311 V317 L318	G310-G314 PolarHBondContact O-N 2.62Å; I311-G314 PolarHBondContact O-N 3.33Å; G314-V317 PolarHBondContact O-N 3.36Å; G314-L318 PolarHBondContact O-N 3.12Å
315	L	85.1	Confident	75.3	Confident	109 Å²	109	85.9 Å²	85.9	57%	0.571	54%	0.54	S	S	*	.	H	α-helix	trans	-66.6	-38.5	176.5	-72.9	172.1	0	0	0	112.3	I311 V312 L318 A319	I311-L315 HydrophobicContact CG2-CD1 3.99Å; I311-L315 HydrophobicContact CG2-CG 4.49Å; I311-L315 WeakPolarHBondContact O-CB 3.26Å; I311-L315 WeakPolarHBondContact O-CG 3.38Å; I311-L315 PolarHBondContact O-N 2.6Å; V312-L315 PolarHBondContact O-N 3.31Å; L315-L318 PolarHBondContact O-N 2.68Å; L315-A319 WeakPolarHBondContact O-CB 3.33Å; L315-A319 PolarHBondContact O-N 2.77Å
316	A	83.4	Confident	76.6	Confident	53 Å²	53	82.2 Å²	82.2	44%	0.438	52%	0.523	S	S	.	.	H	α-helix	trans	-63	-43.2	175.4	0	0	0	0	0	111.7	V312 A313 A319 V320	V312-A316 WeakPolarHBondContact O-CB 3.44Å; V312-A316 PolarHBondContact O-N 3.35Å; A313-A316 PolarHBondContact O-N 3.25Å; A316-A319 PolarHBondContact O-N 2.91Å; A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 3.36Å
317	V	85	Confident	77.5	Confident	88 Å²	88	82.9 Å²	82.9	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-63.7	-44.1	176.6	172.8	0	0	0	0	111.2	A313 G314 A319 V320 L321	A313-V317 WeakPolarHBondContact O-CG2 3.31Å; A313-V317 PolarHBondContact O-N 3.44Å; G314-V317 PolarHBondContact O-N 3.36Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 2.71Å; V317-V320 PolarHBondContact O-N 2.8Å; V317-L321 HydrophobicContact CG1-CD1 4.02Å; V317-L321 HydrophobicContact CG1-CG 4.43Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.31Å
318	L	84.8	Confident	78.4	Confident	114 Å²	114	83 Å²	83	60%	0.597	52%	0.524	S	S	*	.	H	α-helix	trans	-61.4	-41.3	176.4	-84.1	164.9	0	0	0	112.5	G314 L315 L321 A322	G314-L318 PolarHBondContact O-N 3.12Å; L315-L318 PolarHBondContact O-N 2.68Å; L318-L321 PolarHBondContact O-N 3.48Å; L318-A322 WeakPolarHBondContact O-CB 3.42Å; L318-A322 PolarHBondContact O-N 3.15Å
319	A	84.4	Confident	78.9	Confident	57 Å²	57	79.7 Å²	79.7	47%	0.471	52%	0.515	S	S	.	.	H	α-helix	trans	-63	-43.6	176.1	0	0	0	0	0	111.8	L315 A316 V317 A322 V323	L315-A319 WeakPolarHBondContact O-CB 3.33Å; L315-A319 PolarHBondContact O-N 2.77Å; A316-A319 PolarHBondContact O-N 2.91Å; V317-A319 VanDerWaalsContact C-N 3.35Å; V317-A319 PolarHBondContact O-N 2.71Å; A319-A322 PolarHBondContact O-N 3.32Å; A319-V323 WeakPolarHBondContact O-CG2 3.09Å; A319-V323 PolarHBondContact O-N 3.32Å
320	V	85.4	Confident	79.5	Confident	88 Å²	88	77.4 Å²	77.4	53%	0.533	50%	0.501	S	S	.	.	H	α-helix	trans	-62.1	-44.4	176.3	171.8	0	0	0	0	111.2	A316 V317 A322 V323 L324	A316-V320 WeakPolarHBondContact O-CG2 3.39Å; A316-V320 PolarHBondContact O-N 3.36Å; V317-V320 PolarHBondContact O-N 2.8Å; V320-A322 PolarHBondContact O-N 3.36Å; V320-V323 PolarHBondContact O-N 2.94Å; V320-L324 HydrophobicContact CG1-CD1 3.98Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.95Å
321	L	84.9	Confident	79.8	Confident	105 Å²	105	79.3 Å²	79.3	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-64.5	-38.6	177.7	-71.1	173.6	0	0	0	112.3	V317 L318 L324 G325	V317-L321 HydrophobicContact CG1-CD1 4.02Å; V317-L321 HydrophobicContact CG1-CG 4.43Å; V317-L321 WeakPolarHBondContact O-CG 3.42Å; V317-L321 PolarHBondContact O-N 3.31Å; L318-L321 PolarHBondContact O-N 3.48Å; L321-L324 PolarHBondContact O-N 3.32Å; L321-G325 PolarHBondContact O-N 3.3Å
322	A	82.8	Confident	79.6	Confident	65 Å²	65	81 Å²	81	54%	0.537	51%	0.511	S	S	.	.	H	α-helix	trans	-64.3	-42	175.9	0	0	0	0	0	111.9	L318 A319 V320 G325 A326	L318-A322 WeakPolarHBondContact O-CB 3.42Å; L318-A322 PolarHBondContact O-N 3.15Å; A319-A322 PolarHBondContact O-N 3.32Å; V320-A322 PolarHBondContact O-N 3.36Å; A322-G325 PolarHBondContact O-N 3Å; A322-A326 WeakPolarHBondContact O-CB 3.3Å; A322-A326 PolarHBondContact O-N 3.07Å
323	V	82.8	Confident	79	Confident	94 Å²	94	81 Å²	81	57%	0.57	51%	0.514	S	S	*	.	H	α-helix	trans	-64.8	-44.1	176.1	173.2	0	0	0	0	111	A319 V320 A326 M327	A319-V323 WeakPolarHBondContact O-CG2 3.09Å; A319-V323 PolarHBondContact O-N 3.32Å; V320-V323 PolarHBondContact O-N 2.94Å; V323-A326 PolarHBondContact O-N 3.07Å; V323-M327 HydrophobicContact CG1-CG 4.5Å; V323-M327 VanDerWaalsContact O-CG 3.24Å; V323-M327 WeakPolarHBondContact O-CG 3.22Å; V323-M327 PolarHBondContact O-N 3.35Å
324	L	81.3	Confident	78.3	Confident	101 Å²	101	87.4 Å²	87.4	53%	0.529	53%	0.527	S	S	.	.	H	α-helix	trans	-62.5	-43.1	175.5	-72.8	169.3	0	0	0	111.7	V320 L321 A326 M327 V328	V320-L324 HydrophobicContact CG1-CD1 3.98Å; V320-L324 WeakPolarHBondContact O-CG 3.41Å; V320-L324 PolarHBondContact O-N 2.95Å; L321-L324 PolarHBondContact O-N 3.32Å; L324-A326 PolarHBondContact O-N 3.4Å; L324-M327 PolarHBondContact O-N 2.9Å; L324-V328 WeakPolarHBondContact O-CG2 3.29Å; L324-V328 PolarHBondContact O-N 2.87Å
325	G	80.8	Confident	77.2	Confident	42 Å²	42	95.8 Å²	95.8	43%	0.433	55%	0.548	S	S	.	.	H	α-helix	trans	-60.2	-43.8	175	0	0	0	0	0	112.7	L321 A322 V328 A329	L321-G325 PolarHBondContact O-N 3.3Å; A322-G325 PolarHBondContact O-N 3Å; G325-V328 PolarHBondContact O-N 2.93Å; G325-A329 WeakPolarHBondContact O-CB 3.39Å; G325-A329 PolarHBondContact O-N 3.11Å
326	A	78.4	Confident	75.5	Confident	55 Å²	55	99.5 Å²	99.5	46%	0.455	56%	0.559	S	S	.	*	H	α-helix	trans	-63.8	-41.3	175.5	0	0	0	0	0	112.1	A322 V323 L324 A329 V330	A322-A326 WeakPolarHBondContact O-CB 3.3Å; A322-A326 PolarHBondContact O-N 3.07Å; V323-A326 PolarHBondContact O-N 3.07Å; L324-A326 PolarHBondContact O-N 3.4Å; A326-A329 PolarHBondContact O-N 3.02Å; A326-V330 VanDerWaalsContact O-CG2 3.3Å; A326-V330 WeakPolarHBondContact O-CG2 3.4Å; A326-V330 PolarHBondContact O-N 3.21Å
327	M	75.7	Confident	74	Confident	122 Å²	122	101.7 Å²	101.7	60%	0.601	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-43	176.4	-72	-72	-79.5	0	0	111.8	V323 L324 V330 V331	V323-M327 HydrophobicContact CG1-CG 4.5Å; V323-M327 VanDerWaalsContact O-CG 3.24Å; V323-M327 WeakPolarHBondContact O-CG 3.22Å; V323-M327 PolarHBondContact O-N 3.35Å; L324-M327 PolarHBondContact O-N 2.9Å; M327-V330 PolarHBondContact O-N 3.23Å; M327-V331 VanDerWaalsContact O-CG2 3.28Å; M327-V331 WeakPolarHBondContact O-CG2 3.2Å; M327-V331 PolarHBondContact O-N 3Å
328	V	76.3	Confident	72.3	Confident	89 Å²	89	102.3 Å²	102.3	54%	0.539	58%	0.58	S	S	.	*	H	α-helix	trans	-63.2	-43.9	175	173.1	0	0	0	0	110.9	L324 G325 V330 V331 M332	L324-V328 WeakPolarHBondContact O-CG2 3.29Å; L324-V328 PolarHBondContact O-N 2.87Å; G325-V328 PolarHBondContact O-N 2.93Å; V328-V330 PolarHBondContact O-N 3.31Å; V328-V331 PolarHBondContact O-N 3.46Å; V328-M332 HydrophobicContact CG1-CG 4.43Å; V328-M332 HydrophobicContact CG1-SD 4.24Å; V328-M332 WeakPolarHBondContact O-CB 3.33Å; V328-M332 WeakPolarHBondContact O-CG 3.29Å; V328-M332 PolarHBondContact O-N 3.22Å
329	A	72.3	Confident	70.3	Confident	52 Å²	52	99.9 Å²	99.9	43%	0.43	58%	0.582	S	S	.	*	H	α-helix	trans	-61	-43.4	176.6	0	0	0	0	0	112.2	G325 A326 M332 C333	G325-A329 WeakPolarHBondContact O-CB 3.39Å; G325-A329 PolarHBondContact O-N 3.11Å; A326-A329 PolarHBondContact O-N 3.02Å; A329-M332 PolarHBondContact O-N 3.05Å; A329-C333 WeakPolarHBondContact O-CB 3.2Å; A329-C333 PolarHBondContact O-N 3.08Å
330	V	73.4	Confident	68	Low	77 Å²	77	101 Å²	101	47%	0.467	60%	0.599	S	S	.	*	H	α-helix	trans	-63.9	-41.7	176.1	170	0	0	0	0	111.5	A326 M327 V328 C333 R334	A326-V330 VanDerWaalsContact O-CG2 3.3Å; A326-V330 WeakPolarHBondContact O-CG2 3.4Å; A326-V330 PolarHBondContact O-N 3.21Å; M327-V330 PolarHBondContact O-N 3.23Å; V328-V330 PolarHBondContact O-N 3.31Å; V330-C333 PolarHBondContact O-N 3.12Å; V330-R334 WeakPolarHBondContact O-CB 3.35Å; V330-R334 WeakPolarHBondContact O-CG 3.47Å; V330-R334 PolarHBondContact O-N 2.74Å
331	V	72.7	Confident	65.6	Low	85 Å²	85	107.2 Å²	107.2	52%	0.515	62%	0.619	S	S	.	*	H	α-helix	trans	-66.4	-39.9	177	171	0	0	0	0	111.3	M327 V328 R334 R335	M327-V331 VanDerWaalsContact O-CG2 3.28Å; M327-V331 WeakPolarHBondContact O-CG2 3.2Å; M327-V331 PolarHBondContact O-N 3Å; V328-V331 PolarHBondContact O-N 3.46Å; V331-R334 PolarHBondContact O-N 2.88Å; V331-R335 PolarHBondContact O-N 3.17Å
332	M	70.8	Confident	63.2	Low	128 Å²	128	106.1 Å²	106.1	63%	0.631	63%	0.633	S	S	*	*	H	α-helix	trans	-66.4	-41.1	174.5	-73.5	-172.3	71	0	0	112.3	V328 A329 R334 R335 K336	V328-M332 HydrophobicContact CG1-CG 4.43Å; V328-M332 HydrophobicContact CG1-SD 4.24Å; V328-M332 WeakPolarHBondContact O-CB 3.33Å; V328-M332 WeakPolarHBondContact O-CG 3.29Å; V328-M332 PolarHBondContact O-N 3.22Å; A329-M332 PolarHBondContact O-N 3.05Å; M332-R334 VanDerWaalsContact C-N 3.34Å; M332-R334 PolarHBondContact O-N 2.73Å; M332-R335 PolarHBondContact O-N 3.48Å; M332-K336 WeakPolarHBondContact O-CB 3.17Å; M332-K336 PolarHBondContact O-N 3.01Å
333	C	61.8	Low	60.7	Low	89 Å²	89	107.2 Å²	107.2	60%	0.601	65%	0.65	S	S	*	*	H	α-helix	trans	-62.1	-40.6	173	-81.3	0	0	0	0	111.8	A329 V330 K336 S337	A329-C333 WeakPolarHBondContact O-CB 3.2Å; A329-C333 PolarHBondContact O-N 3.08Å; V330-C333 PolarHBondContact O-N 3.12Å; C333-K336 PolarHBondContact O-N 3.17Å; C333-S337 PolarHBondContact O-N 3.1Å; C333-S337 VanDerWaalsContact O-N 3.09Å; C333-S337 PolarHBondContact O-OG 3.43Å
334	R	60.8	Low	58.4	Low	189 Å²	189	108.1 Å²	108.1	71%	0.713	66%	0.661	S	S	*	*	H	α-helix	trans	-69.1	-33.4	176	-78.6	-174.2	159.9	174.9	-3.6	113.5	V330 V331 M332 K336 S337	V330-R334 WeakPolarHBondContact O-CB 3.35Å; V330-R334 WeakPolarHBondContact O-CG 3.47Å; V330-R334 PolarHBondContact O-N 2.74Å; V331-R334 PolarHBondContact O-N 2.88Å; M332-R334 VanDerWaalsContact C-N 3.34Å; M332-R334 PolarHBondContact O-N 2.73Å; R334-K336 VanDerWaalsContact C-N 3.34Å; R334-S337 PolarHBondContact O-OG 3.25Å
335	R	57.5	Low	56	Low	210 Å²	210	108.6 Å²	108.6	79%	0.792	67%	0.671	S	S	*	*	H	α-helix	trans	-68.8	-31.2	171.1	-106.3	-176.6	172.3	176	-1.5	112.6	V331 M332 S338	V331-R335 PolarHBondContact O-N 3.17Å; M332-R335 PolarHBondContact O-N 3.48Å; R335-S338 PolarHBondContact O-OG 3.3Å
336	K	50.8	Low	53.7	Low	186 Å²	186	111.3 Å²	111.3	81%	0.809	68%	0.684	S	S	*	*	H	α-helix	trans	-81.4	-21.1	179.6	-163.7	167.7	179.9	177.8	0	113.2	M332 C333 R334	M332-K336 WeakPolarHBondContact O-CB 3.17Å; M332-K336 PolarHBondContact O-N 3.01Å; C333-K336 PolarHBondContact O-N 3.17Å; R334-K336 VanDerWaalsContact C-N 3.34Å
337	S	52	Low	51.6	Low	100 Å²	100	117.8 Å²	117.8	70%	0.699	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	2.4	178.2	61	0	0	0	0	115	C333 R334	C333-S337 PolarHBondContact O-N 3.1Å; C333-S337 VanDerWaalsContact O-N 3.09Å; C333-S337 PolarHBondContact O-OG 3.43Å; R334-S337 PolarHBondContact O-OG 3.25Å
338	S	49.4	Very low	49.3	Very low	101 Å²	101	116.5 Å²	116.5	71%	0.706	71%	0.713	S	S	*	*	S	Bend	trans	-105	22.8	179.3	71.9	0	0	0	0	114.5	R335	R335-S338 PolarHBondContact O-OG 3.3Å
339	G	42.2	Very low	47.2	Very low	63 Å²	63	116.6 Å²	116.6	65%	0.649	72%	0.723	S	S	*	*	S	Bend	trans	-152.4	106.7	175.7	0	0	0	0	0	113.5
340	G	36.1	Very low	45.3	Very low	80 Å²	80	119.3 Å²	119.3	83%	0.825	74%	0.74	S	S	*	*			trans	103.2	83.8	145.4	0	0	0	0	0	119.1
341	K	34.4	Very low	43.4	Very low	219 Å²	219	121.2 Å²	121.2	95%	0.952	76%	0.756	S	S	*	*			trans	-11.2	134.2	138.9	-150.9	153.4	-178.6	170.9	0	118.3
342	G	34.3	Very low	41.7	Very low	82 Å²	82	125 Å²	125	85%	0.845	77%	0.773	S	S	*	*			trans	122.2	123.2	138.2	0	0	0	0	0	117.9
343	G	30.8	Very low	40.2	Very low	87 Å²	87	124.4 Å²	124.4	90%	0.897	78%	0.782	S	S	*	*			trans	139.3	110.2	155.4	0	0	0	0	0	115.3
344	S	35	Very low	39	Very low	114 Å²	114	124.5 Å²	124.5	80%	0.797	79%	0.789	S	S	*	*			trans	-103.3	158.3	178.4	-178.2	0	0	0	0	112.4
345	C	30.3	Very low	37.9	Very low	110 Å²	110	124.8 Å²	124.8	74%	0.743	80%	0.799	S	S	*	*			trans	93.8	114.8	145.7	-98	0	0	0	0	123.2
346	S	32.7	Very low	36.7	Very low	100 Å²	100	118 Å²	118	70%	0.699	80%	0.795	S	S	*	*				71.9	113.8	125.9	55	0	0	0	0	123.8
347	Q	33.8	Very low	36.1	Very low	191 Å²	191	114.4 Å²	114.4	89%	0.893	79%	0.792	S	S	*	*				51.6	116.4	115.8	-149.4	173.8	13	0	0	120.7
348	A	28.8	Very low	35.4	Very low	94 Å²	94	116.9 Å²	116.9	78%	0.777	80%	0.798	S	S	*	*				160.1	142.9	107	0	0	0	0	0	115.1
349	A	30.6	Very low	34.5	Very low	91 Å²	91	119.7 Å²	119.7	75%	0.752	80%	0.8	S	S	*	*			trans	76.9	104.9	139.5	0	0	0	0	0	123.3
350	S	33.2	Very low	34.1	Very low	110 Å²	110	122.3 Å²	122.3	77%	0.769	81%	0.808	S	S	*	*				44.5	127.5	121.1	69.1	0	0	0	0	123.8
351	S	33.6	Very low	33.9	Very low	116 Å²	116	125.9 Å²	125.9	81%	0.811	81%	0.808	S	S	*	*				179.4	117.9	116.7	40.3	0	0	0	0	108.3
352	N	36	Very low	33.9	Very low	164 Å²	164	122.9 Å²	122.9	88%	0.877	80%	0.801	S	S	*	*				72.7	114.1	72.4	-91.9	6.9	0	0	0	117.2
353	S	39.3	Very low	33.8	Very low	116 Å²	116	122.7 Å²	122.7	81%	0.811	79%	0.791	S	S	*	*			trans	-163.9	96.3	139.4	21.1	0	0	0	0	105.5
354	A	38.6	Very low	33.7	Very low	91 Å²	91	124.4 Å²	124.4	75%	0.752	79%	0.788	S	S	*	*				47.6	123.4	86.8	0	0	0	0	0	112
355	Q	37.1	Very low	33.6	Very low	195 Å²	195	128.8 Å²	128.8	91%	0.911	79%	0.792	S	S	*	*				-170.2	127.4	51.5	-145.4	159.2	-2.9	0	0	107.7
356	G	31.6	Very low	33.8	Very low	69 Å²	69	131.8 Å²	131.8	71%	0.711	83%	0.825	S	S	*	*				112.6	138.1	91.2	0	0	0	0	0	108.6
357	S	38.8	Very low	33.8	Very low	109 Å²	109	133.4 Å²	133.4	76%	0.762	83%	0.831	S	S	*	*			cis	-160.9	133.8	16.7	-35.8	0	0	0	0	107.3
358	D	37	Very low	33.8	Very low	153 Å²	153	130.3 Å²	130.3	82%	0.818	83%	0.828	S	S	*	*				66	137.5	107.8	-69.6	-26.8	0	0	0	115
359	E	31.4	Very low	34.1	Very low	159 Å²	159	132.3 Å²	132.3	74%	0.743	83%	0.831	S	S	*	*			cis	-169.5	149.7	28.9	-140.1	178.7	161.7	0	0	108.2
360	S	32.2	Very low	34.3	Very low	118 Å²	118	134.8 Å²	134.8	83%	0.825	84%	0.835	S	S	*	*			trans	-137.1	113.4	158.5	66.6	0	0	0	0	109.4
361	L	33.3	Very low	34.4	Very low	155 Å²	155	136.3 Å²	136.3	81%	0.812	84%	0.84	S	S	*	*			trans	-108.8	122.4	171.4	-93.2	167.8	0	0	0	111.3
362	I	33.5	Very low	34.4	Very low	157 Å²	157	137.7 Å²	137.7	81%	0.805	84%	0.841	S	S	*	*			trans	-65.7	149	152.5	-64	162.9	0	0	0	106.3
363	A	31.8	Very low	34.3	Very low	78 Å²	78	135.8 Å²	135.8	65%	0.645	84%	0.839	S	S	*	*			cis	-170.6	158	35.8	0	0	0	0	0	111.9
364	C	29.4	Very low	33.9	Very low	122 Å²	122	137.3 Å²	137.3	82%	0.824	84%	0.841	S	S	*	*			trans	54.8	115.7	135.9	-66.3	0	0	0	0	123.4
365	K	33.6	Very low	33.5	Very low	206 Å²	206	141.2 Å²	141.2	90%	0.896	85%	0.849	S	S	*	*				54.7	114.7	126.9	-95.7	-179.4	174.2	179	0	119.9
366	A	32.9	Very low	33.2	Very low	173 Å²	173	136.3 Å²	136.3	100%	1.43	84%	0.843	S	S	*	*				-125.2	0	108.1	0	0	0	0	0	108.3

Retrieved 366 of 366 residues in 109.6 ms (Link to these results)

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