A0A077ZG90_TRITR Loading...

Reprolysin 5 and Disintegrin domain containing pr otein

AlphaFold DB , UniProt , Accession A0A077ZG90, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 702 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	36.8	Very low	32.9	Very low	222 Å²	222	164.5 Å²	164.5	100%	1.094	85%	0.851	S	S	*	*				0	84.9	0	-70.2	-174.7	176.4	0	0	111
2	D	34.4	Very low	32.7	Very low	146 Å²	146	166.1 Å²	166.1	78%	0.781	85%	0.847	S	S	*	*			cis	-156.7	155.2	-38.9	-85.6	-39.7	0	0	0	107.4
3	D	36.7	Very low	32.4	Very low	145 Å²	145	164.2 Å²	164.2	78%	0.775	85%	0.847	S	S	*	*			trans	32.4	117.9	171.9	-77	-39.5	0	0	0	121.3
4	L	38.3	Very low	32.3	Very low	187 Å²	187	162.1 Å²	162.1	98%	0.979	83%	0.829	S	S	*	*			trans	-156.3	89.2	142.8	-107.8	163.2	0	0	0	108.8
5	R	34.3	Very low	32.2	Very low	226 Å²	226	153 Å²	153	85%	0.853	79%	0.791	S	S	*	*			trans	-115.8	121.2	-173.5	-152.1	179.9	-168.4	-176.8	2.9	111.9
6	S	32.8	Very low	32.4	Very low	96 Å²	96	153.7 Å²	153.7	67%	0.671	79%	0.786	S	S	*	*			trans	46.9	102.4	157.6	57	0	0	0	0	119.9	T8	S6-T8 PolarHBondContact O-N 2.83Å
7	H	30.4	Very low	32.6	Very low	201 Å²	201	147.5 Å²	147.5	93%	0.931	76%	0.76	S	S	*	*			trans	-78.8	98.6	149	-88.1	-81	0	0	0	110.5
8	T	33.3	Very low	32.4	Very low	120 Å²	120	143.6 Å²	143.6	74%	0.736	74%	0.74	S	S	*	*			trans	-161	99.3	161.8	44.9	0	0	0	0	111.2	S6	S6-T8 PolarHBondContact O-N 2.83Å
9	E	29.7	Very low	32.8	Very low	206 Å²	206	141 Å²	141	96%	0.963	73%	0.727	S	S	*	*			trans	-176.7	135.3	165	-109.7	171.2	-147.7	0	0	107.2
10	G	27.8	Very low	33.3	Very low	64 Å²	64	135.2 Å²	135.2	66%	0.66	70%	0.698	S	S	*	*			cis	-177.4	116.4	-9.8	0	0	0	0	0	108.2	K12	G10-K12 PolarHBondContact O-N 3.41Å
11	E	27.1	Very low	33.6	Very low	196 Å²	196	130.4 Å²	130.4	92%	0.916	68%	0.679	S	S	*	*			trans	-73.4	100	-173.6	-163.6	173.7	164.3	0	0	110.6	V13	E11-V13 PolarHBondContact O-N 3.07Å
12	K	30.5	Very low	33.8	Very low	184 Å²	184	121.4 Å²	121.4	80%	0.8	64%	0.639	S	S	*	*			trans	-68.7	99.1	179.8	-82	-173.5	176	178.8	0	111	G10 F14	G10-K12 PolarHBondContact O-N 3.41Å; K12-F14 PolarHBondContact O-N 3.21Å
13	V	29.1	Very low	35.1	Very low	141 Å²	141	115.4 Å²	115.4	86%	0.855	61%	0.607	S	S	*	*			trans	-61	100.9	166.4	-178.8	0	0	0	0	109.1	E11 G15	E11-V13 PolarHBondContact O-N 3.07Å; V13-G15 PolarHBondContact O-N 2.99Å
14	F	31.5	Very low	36.6	Very low	136 Å²	136	108.5 Å²	108.5	60%	0.596	57%	0.571	S	S	*	*			trans	-67.2	126.6	175.9	-109.7	-102	0	0	0	110.5	K12 D18 I19	K12-F14 PolarHBondContact O-N 3.21Å; F14-D18 HydrophobicContact CD1-CB 3.65Å; F14-D18 HydrophobicContact CE1-CB 3.93Å; F14-I19 HydrophobicContact CB-CD1 4.48Å; F14-I19 HydrophobicContact CB-CG1 4.28Å; F14-I19 HydrophobicContact CD1-CG1 4.35Å
15	G	30.7	Very low	37.9	Very low	25 Å²	25	105.6 Å²	105.6	26%	0.258	55%	0.552	S	S	.	*			trans	-66.4	149.9	177.4	0	0	0	0	0	111.7	V13 S17 D18 I19	V13-G15 PolarHBondContact O-N 2.99Å; G15-S17 PolarHBondContact O-N 2.84Å; G15-S17 VanDerWaalsContact O-N 3.16Å; G15-D18 WeakPolarHBondContact CA-OD2 3.47Å; G15-D18 PolarHBondContact N-OD2 3.09Å; G15-D18 PolarHBondContact O-N 3.08Å; G15-I19 PolarHBondContact O-N 2.75Å
16	K	35.6	Very low	39.4	Very low	164 Å²	164	100.5 Å²	100.5	71%	0.713	54%	0.536	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-23.5	176.6	-156.6	177.7	-174.6	-178.8	0	112.6	V20	K16-V20 WeakPolarHBondContact O-CG2 3.39Å
17	S	34.4	Very low	40.9	Very low	48 Å²	48	96.2 Å²	96.2	34%	0.336	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-47.7	168.4	44.6	0	0	0	0	112.6	G15 I19 V20 A21	G15-S17 PolarHBondContact O-N 2.84Å; G15-S17 VanDerWaalsContact O-N 3.16Å; S17-I19 PolarHBondContact O-N 2.72Å; S17-V20 PolarHBondContact O-N 2.88Å; S17-V20 VanDerWaalsContact O-N 3.08Å; S17-A21 PolarHBondContact O-N 2.92Å
18	D	30.5	Very low	42.8	Very low	77 Å²	77	86.9 Å²	86.9	41%	0.412	46%	0.462	S	S	.	.	H	α-helix	trans	-72.8	-37.1	-166.5	-48	-21.5	0	0	0	110.3	F14 G15 V20 A22	F14-D18 HydrophobicContact CD1-CB 3.65Å; F14-D18 HydrophobicContact CE1-CB 3.93Å; G15-D18 WeakPolarHBondContact CA-OD2 3.47Å; G15-D18 PolarHBondContact N-OD2 3.09Å; G15-D18 PolarHBondContact O-N 3.08Å; D18-V20 PolarHBondContact O-N 3.29Å; D18-A22 WeakPolarHBondContact O-CB 3.39Å; D18-A22 PolarHBondContact O-N 3Å
19	I	38.7	Very low	44.6	Very low	95 Å²	95	87.2 Å²	87.2	49%	0.487	45%	0.453	S	S	.	.	H	α-helix	trans	-58.6	-26.7	173.2	-63.8	172.2	0	0	0	111.9	F14 G15 S17	F14-I19 HydrophobicContact CB-CD1 4.48Å; F14-I19 HydrophobicContact CB-CG1 4.28Å; F14-I19 HydrophobicContact CD1-CG1 4.35Å; G15-I19 PolarHBondContact O-N 2.75Å; S17-I19 PolarHBondContact O-N 2.72Å
20	V	44	Very low	47.1	Very low	24 Å²	24	81.7 Å²	81.7	15%	0.145	43%	0.428	C	S	.	.	H	α-helix	trans	-102.9	-36.2	-170.8	178.8	0	0	0	0	112.4	K16 S17 D18 A22 N23 L24 H147 F149	K16-V20 WeakPolarHBondContact O-CG2 3.39Å; S17-V20 PolarHBondContact O-N 2.88Å; S17-V20 VanDerWaalsContact O-N 3.08Å; D18-V20 PolarHBondContact O-N 3.29Å; V20-A22 PolarHBondContact O-N 2.98Å; V20-N23 WeakPolarHBondContact O-CA 3.41Å; V20-N23 WeakPolarHBondContact O-CB 3.34Å; V20-N23 PolarHBondContact O-N 2.93Å; V20-L24 PolarHBondContact O-N 2.99Å; V20-H147 VanDerWaalsContact CG1-O 3.23Å; V20-H147 WeakPolarHBondContact CG1-O 3.32Å; V20-F149 HydrophobicContact CB-CD2 3.67Å; V20-F149 HydrophobicContact CB-CE2 3.94Å; V20-F149 HydrophobicContact CG1-CD2 3.58Å; V20-F149 HydrophobicContact CG1-CE2 3.73Å; V20-F149 HydrophobicContact CG2-CD2 3.73Å; V20-F149 HydrophobicContact CG2-CE2 3.54Å
21	A	40	Very low	49.8	Very low	36 Å²	36	81 Å²	81	30%	0.298	41%	0.405	S	S	.	.	H	α-helix	trans	-57.6	-40.7	162.8	0	0	0	0	0	110.9	S17 N23 L24 Q25	S17-A21 PolarHBondContact O-N 2.92Å; A21-N23 PolarHBondContact O-N 2.73Å; A21-N23 VanDerWaalsContact O-N 3.09Å; A21-L24 PolarHBondContact O-N 3.06Å; A21-Q25 PolarHBondContact O-N 3.28Å
22	A	40.1	Very low	52.7	Low	32 Å²	32	73.9 Å²	73.9	26%	0.264	37%	0.372	S	S	.	.	H	α-helix	trans	-68.8	1.3	171.3	0	0	0	0	0	114.6	D18 V20 K26	D18-A22 WeakPolarHBondContact O-CB 3.39Å; D18-A22 PolarHBondContact O-N 3Å; V20-A22 PolarHBondContact O-N 2.98Å; A22-K26 WeakPolarHBondContact O-CD 3.47Å; A22-K26 WeakPolarHBondContact O-CE 3.17Å; A22-K26 WeakPolarHBondContact O-CG 3.47Å
23	N	62.2	Low	55.4	Low	20 Å²	20	69.7 Å²	69.7	11%	0.107	36%	0.357	C	S	.	.	H	α-helix	trans	-97.3	-48.3	174.8	-153.4	-39.5	0	0	0	110.5	V20 A21 Q25 K26 Y364 G366	V20-N23 WeakPolarHBondContact O-CA 3.41Å; V20-N23 WeakPolarHBondContact O-CB 3.34Å; V20-N23 PolarHBondContact O-N 2.93Å; A21-N23 PolarHBondContact O-N 2.73Å; A21-N23 VanDerWaalsContact O-N 3.09Å; N23-Q25 VanDerWaalsContact C-N 3.3Å; N23-Q25 PolarHBondContact O-N 2.87Å; N23-K26 WeakPolarHBondContact O-CB 3.25Å; N23-K26 PolarHBondContact O-N 3.09Å; N23-Y364 WeakPolarHBondContact OD1-CE2 3.49Å; N23-G366 WeakPolarHBondContact ND2-CA 3.28Å; N23-G366 WeakPolarHBondContact OD1-CA 3.35Å
24	L	68	Low	58.2	Low	1 Å²	1	63.3 Å²	63.3	1%	0.005	32%	0.319	C	S	.	.	H	α-helix	trans	-61.3	-38.8	176	-165.9	59.1	0	0	0	111.9	V20 A21 K26 M27 L28 Y31 H147 L148 I157 V369	V20-L24 PolarHBondContact O-N 2.99Å; A21-L24 PolarHBondContact O-N 3.06Å; L24-K26 PolarHBondContact O-N 2.78Å; L24-M27 HydrophobicContact CD1-CE 3.93Å; L24-M27 PolarHBondContact O-N 3.28Å; L24-L28 HydrophobicContact CD1-CD1 3.59Å; L24-L28 HydrophobicContact CD1-CG 4.22Å; L24-L28 HydrophobicContact CG-CD1 4.06Å; L24-L28 PolarHBondContact O-N 2.89Å; L24-Y31 HydrophobicContact CB-CE1 4.39Å; L24-Y31 HydrophobicContact CD2-CD1 3.82Å; L24-Y31 HydrophobicContact CD2-CD2 3.95Å; L24-Y31 HydrophobicContact CD2-CE1 3.65Å; L24-Y31 HydrophobicContact CD2-CE2 3.79Å; L24-Y31 HydrophobicContact CD2-CG 3.98Å; L24-Y31 HydrophobicContact CG-CD1 4Å; L24-Y31 HydrophobicContact CG-CE1 3.9Å; L24-H147 HydrophobicContact CD1-CB 4.07Å; L24-H147 HydrophobicContact CD2-CB 4.08Å; L24-L148 HydrophobicContact CB-CD2 4.47Å; L24-L148 HydrophobicContact CD2-CD1 4.44Å; L24-L148 HydrophobicContact CD2-CD2 3.97Å; L24-L148 HydrophobicContact CD2-CG 4.19Å; L24-I157 HydrophobicContact CD1-CD1 4.24Å; L24-I157 HydrophobicContact CD2-CD1 3.97Å; L24-I157 HydrophobicContact CD2-CG2 4.42Å; L24-V369 HydrophobicContact CD1-CG1 4.33Å
25	Q	66.3	Low	60.8	Low	125 Å²	125	61.8 Å²	61.8	58%	0.584	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-11.8	173.9	-69.1	179.7	-12.9	0	0	115	A21 N23 I165	A21-Q25 PolarHBondContact O-N 3.28Å; N23-Q25 VanDerWaalsContact C-N 3.3Å; N23-Q25 PolarHBondContact O-N 2.87Å; Q25-I165 VanDerWaalsContact O-CD1 3.3Å; Q25-I165 WeakPolarHBondContact O-CD1 3.34Å
26	K	64.4	Low	63.3	Low	119 Å²	119	61.3 Å²	61.3	52%	0.517	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.1	-12	171.5	-69.1	170.3	-177	167.8	0	112.9	A22 N23 L24	A22-K26 WeakPolarHBondContact O-CD 3.47Å; A22-K26 WeakPolarHBondContact O-CE 3.17Å; A22-K26 WeakPolarHBondContact O-CG 3.47Å; N23-K26 WeakPolarHBondContact O-CB 3.25Å; N23-K26 PolarHBondContact O-N 3.09Å; L24-K26 PolarHBondContact O-N 2.78Å
27	M	65.4	Low	65.6	Low	7 Å²	7	59.5 Å²	59.5	3%	0.034	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.5	-26.4	-174.9	-55.8	-175.1	-60.4	0	0	112.1	L24 L164 I165 P367 V369	L24-M27 HydrophobicContact CD1-CE 3.93Å; L24-M27 PolarHBondContact O-N 3.28Å; M27-L164 WeakPolarHBondContact O-CA 3.49Å; M27-I165 PolarHBondContact O-N 3.35Å; M27-P367 HydrophobicContact CE-CG 4.25Å; M27-P367 VanDerWaalsContact CE-O 3.29Å; M27-P367 WeakPolarHBondContact CE-O 3.5Å; M27-V369 HydrophobicContact CB-CG1 4.48Å; M27-V369 HydrophobicContact CE-CG1 4.04Å
28	L	69.3	Low	67.7	Low	4 Å²	4	60.4 Å²	60.4	2%	0.021	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-128.1	125.6	179.9	-64.3	175.2	0	0	0	110.8	L24 H30 Y31 Y159 D163 L164 I165	L24-L28 HydrophobicContact CD1-CD1 3.59Å; L24-L28 HydrophobicContact CD1-CG 4.22Å; L24-L28 HydrophobicContact CG-CD1 4.06Å; L24-L28 PolarHBondContact O-N 2.89Å; L28-H30 PolarHBondContact O-N 2.98Å; L28-Y31 HydrophobicContact CB-CD1 4.38Å; L28-Y31 HydrophobicContact CD1-CD1 4.47Å; L28-Y31 HydrophobicContact CD1-CG 4.48Å; L28-Y159 HydrophobicContact CD1-CD1 3.94Å; L28-Y159 HydrophobicContact CD1-CD2 4.3Å; L28-Y159 HydrophobicContact CD1-CG 3.76Å; L28-Y159 HydrophobicContact CD2-CD2 3.57Å; L28-Y159 HydrophobicContact CD2-CE2 4.2Å; L28-Y159 HydrophobicContact CD2-CG 3.84Å; L28-D163 CarbonylContact C-O 3.57Å; L28-D163 WeakPolarHBondContact CA-O 3.49Å; L28-L164 HydrophobicContact CD2-CD2 3.59Å; L28-L164 HydrophobicContact CD2-CG 4.15Å; L28-I165 VanDerWaalsContact C-CD1 3.47Å
29	K	72.5	Confident	69.4	Low	127 Å²	127	59.1 Å²	59.1	55%	0.552	30%	0.301	S	S	*	.	S	Bend	trans	-61.9	-35.3	170.7	-60.8	176.8	-172.9	107.8	0	110.8	S162 D163 L164 I165	K29-S162 PolarHBondContact NZ-O 2.93Å; K29-D163 HydrophobicContact CB-CB 4.41Å; K29-D163 WeakPolarHBondContact CB-O 3.36Å; K29-D163 VanDerWaalsContact CG-O 3.32Å; K29-D163 WeakPolarHBondContact CG-O 3.4Å; K29-D163 PolarHBondContact N-O 2.75Å; K29-L164 PolarHBondContact NZ-O 3.02Å; K29-I165 HydrophobicContact CB-CG1 4.37Å; K29-I165 HydrophobicContact CG-CD1 4.27Å; K29-I165 HydrophobicContact CG-CG1 3.54Å
30	H	81.3	Confident	70.1	Confident	91 Å²	91	59.8 Å²	59.8	42%	0.421	31%	0.309	S	S	.	.			trans	-155.4	145.1	-178.5	-178.2	64.2	0	0	0	109.9	L28 E32 F65 R160 D163	L28-H30 PolarHBondContact O-N 2.98Å; H30-E32 IonicContact CE1-OE1 2.79Å; H30-E32 WeakPolarHBondContact NE2-CG 3.45Å; H30-E32 IonicContact NE2-OE1 3.05Å; H30-E32 PolarHBondContact NE2-OE1 3.04Å; H30-E32 IonicContact NE2-OE2 3.75Å; H30-F65 AromaticContact CD2-CD1 3.8Å; H30-F65 AromaticContact CD2-CE1 3.57Å; H30-F65 AromaticContact NE2-CD1 3.21Å; H30-F65 WeakPolarHBondContact NE2-CD1 3.42Å; H30-F65 AromaticContact NE2-CE1 3.36Å; H30-F65 WeakPolarHBondContact NE2-CE1 3.14Å; H30-R160 PolarHBondContact CD2-NH2 2.86Å; H30-D163 HydrophobicContact CB-CB 4.41Å; H30-D163 WeakPolarHBondContact O-CB 3.16Å
31	Y	84.6	Confident	69.9	Low	49 Å²	49	64.3 Å²	64.3	19%	0.192	32%	0.324	C	S	.	.			trans	-154.4	156.3	169.8	67.2	-88	0	0	0	108	L24 L28 I33 L148 I157 A158	L24-Y31 HydrophobicContact CB-CE1 4.39Å; L24-Y31 HydrophobicContact CD2-CD1 3.82Å; L24-Y31 HydrophobicContact CD2-CD2 3.95Å; L24-Y31 HydrophobicContact CD2-CE1 3.65Å; L24-Y31 HydrophobicContact CD2-CE2 3.79Å; L24-Y31 HydrophobicContact CD2-CG 3.98Å; L24-Y31 HydrophobicContact CG-CD1 4Å; L24-Y31 HydrophobicContact CG-CE1 3.9Å; L28-Y31 HydrophobicContact CB-CD1 4.38Å; L28-Y31 HydrophobicContact CD1-CD1 4.47Å; L28-Y31 HydrophobicContact CD1-CG 4.48Å; Y31-I33 HydrophobicContact CE2-CG1 4.24Å; Y31-L148 HydrophobicContact CE2-CD1 4.16Å; Y31-I157 HydrophobicContact CD2-CB 4.37Å; Y31-I157 HydrophobicContact CD2-CG2 3.93Å; Y31-I157 HydrophobicContact CE2-CG2 4.28Å; Y31-A158 WeakPolarHBondContact CA-O 3.18Å
32	E	88.7	Confident	69.5	Low	46 Å²	46	70.5 Å²	70.5	22%	0.215	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	138.9	176.5	-70.6	173.1	-148.2	0	0	109.2	H30 V34 A64 F65 I157 A158	H30-E32 IonicContact CE1-OE1 2.79Å; H30-E32 WeakPolarHBondContact NE2-CG 3.45Å; H30-E32 IonicContact NE2-OE1 3.05Å; H30-E32 PolarHBondContact NE2-OE1 3.04Å; H30-E32 IonicContact NE2-OE2 3.75Å; E32-V34 HydrophobicContact CB-CG1 4.24Å; E32-A64 VanDerWaalsContact OE2-CA 3.22Å; E32-A64 WeakPolarHBondContact OE2-CA 3.33Å; E32-F65 VanDerWaalsContact CD-N 3.26Å; E32-F65 HydrophobicContact CG-CD1 4.48Å; E32-F65 HydrophobicContact CG-CE1 4.17Å; E32-F65 WeakPolarHBondContact OE1-CA 3.46Å; E32-F65 WeakPolarHBondContact OE1-CD1 3.23Å; E32-F65 PolarHBondContact OE1-N 2.73Å; E32-F65 VanDerWaalsContact OE1-N 3.1Å; E32-F65 PolarHBondContact OE2-N 2.69Å; E32-I157 CarbonylContact O-C 3.59Å; E32-I157 WeakPolarHBondContact O-CA 3.46Å; E32-A158 PolarHBondContact N-O 3.18Å; E32-A158 PolarHBondContact O-N 3.33Å
33	I	87.2	Confident	69.2	Low	96 Å²	96	72.3 Å²	72.3	49%	0.492	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	121.9	169.4	-59.5	177.1	0	0	0	106.8	Y31 L148 S156 I157	Y31-I33 HydrophobicContact CE2-CG1 4.24Å; I33-L148 HydrophobicContact CD1-CD1 4.05Å; I33-L148 HydrophobicContact CG1-CD1 4.37Å; I33-S156 CarbonylContact C-O 3.52Å; I33-S156 WeakPolarHBondContact CA-O 3.06Å; I33-I157 HydrophobicContact CG1-CG2 4.44Å
34	V	88	Confident	67.7	Low	8 Å²	8	75.7 Å²	75.7	5%	0.048	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.5	-173.4	-56.8	0	0	0	0	110.9	E32 V36 F62 C63 A64 V141 S156 A158	E32-V34 HydrophobicContact CB-CG1 4.24Å; V34-V36 HydrophobicContact CG2-CG2 4.08Å; V34-F62 HydrophobicContact CB-CB 4.49Å; V34-F62 HydrophobicContact CB-CD2 4.23Å; V34-F62 HydrophobicContact CG1-CD2 4.16Å; V34-F62 HydrophobicContact CG2-CD2 4.16Å; V34-C63 WeakPolarHBondContact CG1-O 3.5Å; V34-A64 HydrophobicContact CG1-CB 4.01Å; V34-V141 HydrophobicContact CG2-CG1 4.45Å; V34-S156 PolarHBondContact N-O 2.86Å; V34-S156 PolarHBondContact O-N 3.11Å; V34-A158 HydrophobicContact CG1-CB 3.69Å; V34-A158 HydrophobicContact CG2-CB 4.05Å
35	D	84.6	Confident	66	Low	104 Å²	104	79.7 Å²	79.7	56%	0.556	38%	0.381	S	S	*	.			trans	-98.1	126.8	166.2	-171.7	31.1	0	0	0	108.5
36	V	84.6	Confident	64.7	Low	14 Å²	14	74.6 Å²	74.6	9%	0.085	36%	0.357	C	S	.	.			trans	-103.2	105.1	-172.3	-175.2	0	0	0	0	109.2	V34 L38 F60 F62 V128 V141	V34-V36 HydrophobicContact CG2-CG2 4.08Å; V36-L38 PolarHBondContact O-N 3.44Å; V36-F60 HydrophobicContact CG1-CB 3.98Å; V36-F60 HydrophobicContact CG1-CD2 3.74Å; V36-F60 HydrophobicContact CG1-CG 4.32Å; V36-F62 HydrophobicContact CG2-CB 4.3Å; V36-V128 HydrophobicContact CB-CG2 4.19Å; V36-V128 HydrophobicContact CG1-CB 4.07Å; V36-V128 HydrophobicContact CG1-CG2 3.59Å; V36-V141 HydrophobicContact CG2-CG1 4.05Å
37	Q	83.9	Confident	63.2	Low	126 Å²	126	72.7 Å²	72.7	59%	0.589	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.3	110.9	-179.6	-63.9	-173.3	-16.1	0	0	110.1	F60 S61	Q37-F60 WeakPolarHBondContact O-CA 3.37Å; Q37-S61 PolarHBondContact N-O 3.47Å; Q37-S61 PolarHBondContact O-N 2.77Å
38	L	77.3	Confident	61.5	Low	68 Å²	68	75.1 Å²	75.1	36%	0.356	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	125.8	170.6	-63.2	-178.3	0	0	0	110.6	V36 F60 I122 G126 V128	V36-L38 PolarHBondContact O-N 3.44Å; L38-F60 HydrophobicContact CD2-CB 3.63Å; L38-I122 HydrophobicContact CD1-CG2 3.55Å; L38-I122 HydrophobicContact CD2-CD1 3.86Å; L38-I122 HydrophobicContact CD2-CG2 4.27Å; L38-G126 WeakPolarHBondContact CD1-O 3.32Å; L38-V128 HydrophobicContact CD2-CG2 3.82Å
39	S	65.8	Low	59.7	Low	50 Å²	50	80.3 Å²	80.3	35%	0.35	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	95.7	168.2	-168	0	0	0	0	108.4	R41 V59	S39-R41 PolarHBondContact O-N 2.98Å; S39-V59 PolarHBondContact N-O 3.46Å; S39-V59 PolarHBondContact O-N 3.27Å
40	T	53.1	Low	57.9	Low	108 Å²	108	80.5 Å²	80.5	66%	0.663	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	93.2	166.7	40.2	0	0	0	0	108.6
41	R	41	Very low	55.7	Low	119 Å²	119	84 Å²	84	45%	0.449	43%	0.427	S	S	.	.			trans	-90.4	111.5	173.3	-80.4	-169.8	-177.9	-157.4	0.7	109	S39 H43	S39-R41 PolarHBondContact O-N 2.98Å; R41-H43 HydrophobicContact CB-CB 4.3Å; R41-H43 PolarHBondContact O-N 3.43Å
42	H	32.2	Very low	53.1	Low	167 Å²	167	85.5 Å²	85.5	77%	0.773	44%	0.444	S	S	*	.			trans	-66.9	70.1	159.1	-68.2	-80.2	0	0	0	109.4
43	H	33.7	Very low	50.4	Low	69 Å²	69	83.8 Å²	83.8	32%	0.319	44%	0.439	S	S	.	.			trans	-103.1	98.6	176.8	-104.7	-106.2	0	0	0	108.9	R41 Y45	R41-H43 HydrophobicContact CB-CB 4.3Å; R41-H43 PolarHBondContact O-N 3.43Å; H43-Y45 HydrophobicContact CB-CD2 4.33Å; H43-Y45 AromaticContact ND1-CE2 3.88Å; H43-Y45 PolarHBondContact O-N 2.53Å
44	M	30.9	Very low	47.8	Very low	92 Å²	92	81.1 Å²	81.1	45%	0.453	43%	0.429	S	S	.	.			trans	-55.6	108.3	162.4	-69.3	-169.4	-42.7	0	0	109.7	P510	M44-P510 HydrophobicContact CB-CB 3.68Å; M44-P510 HydrophobicContact CE-CB 3.84Å; M44-P510 HydrophobicContact CG-CB 3.88Å; M44-P510 VanDerWaalsContact SD-CA 3.57Å; M44-P510 HydrophobicContact SD-CB 3.4Å; M44-P510 WeakPolarHBondContact SD-CB 3.41Å
45	Y	32.3	Very low	45.6	Very low	84 Å²	84	82.4 Å²	82.4	33%	0.329	44%	0.435	S	S	.	.			trans	-122	120.9	165.6	-97.9	-75.3	0	0	0	107.9	H43 R526 Q527	H43-Y45 HydrophobicContact CB-CD2 4.33Å; H43-Y45 AromaticContact ND1-CE2 3.88Å; H43-Y45 PolarHBondContact O-N 2.53Å; Y45-R526 HydrophobicContact CD1-CG 4.42Å; Y45-Q527 PolarHBondContact OH-O 3.4Å
46	K	38.6	Very low	43.8	Very low	18 Å²	18	80.8 Å²	80.8	8%	0.078	42%	0.424	C	S	.	.	P	Polyproline II helix	trans	-98.9	161.5	170.2	-121.6	-171.4	-169.7	173.5	0	112.6	N508 S509 P510 R526 A544 D545 C546	K46-N508 WeakPolarHBondContact CE-O 3.48Å; K46-S509 PolarHBondContact NZ-OG 2.75Å; K46-P510 HydrophobicContact CB-CG 3.86Å; K46-P510 VanDerWaalsContact CD-CD 3.48Å; K46-P510 HydrophobicContact CD-CG 3.82Å; K46-P510 VanDerWaalsContact CE-CD 3.43Å; K46-P510 HydrophobicContact CG-CG 3.79Å; K46-R526 PolarHBondContact O-NE 3.17Å; K46-R526 PolarHBondContact O-NH1 2.87Å; K46-R526 VanDerWaalsContact O-NH1 3.11Å; K46-A544 PolarHBondContact NZ-O 3.32Å; K46-D545 HydrophobicContact CD-CB 4.4Å; K46-D545 WeakPolarHBondContact CD-OD1 3.33Å; K46-D545 WeakPolarHBondContact CE-OD1 3.48Å; K46-D545 IonicContact NZ-OD1 3.83Å; K46-D545 PolarHBondContact NZ-OD1 2.67Å; K46-C546 HydrophobicContact CB-CB 3.9Å; K46-C546 HydrophobicContact CD-CB 4.39Å
47	R	32.5	Very low	42.1	Very low	79 Å²	79	81.8 Å²	81.8	30%	0.298	43%	0.429	S	S	.	.	P	Polyproline II helix	trans	-58.2	131.4	-168.7	-63.8	161.5	177.7	162.1	-4.7	113.8	R526	R47-R526 PolarHBondContact O-NH1 2.85Å; R47-R526 PolarHBondContact O-NH2 3.43Å
48	D	29.9	Very low	41.2	Very low	58 Å²	58	76.3 Å²	76.3	31%	0.31	41%	0.405	S	S	.	.	P	Polyproline II helix	trans	-87.3	166.8	136.4	-64.5	-29.8	0	0	0	108.3	D50 R526 K534	D48-D50 PolarHBondContact O-N 3.39Å; D48-R526 IonicContact OD1-CZ 2.93Å; D48-R526 IonicContact OD1-NH1 2.85Å; D48-R526 PolarHBondContact OD1-NH1 3.15Å; D48-R526 IonicContact OD2-NH1 2.76Å; D48-K534 WeakPolarHBondContact OD2-CE 3.39Å; D48-K534 IonicContact OD2-NZ 3.81Å; D48-K534 PolarHBondContact OD2-NZ 2.6Å
49	A	31.3	Very low	41	Very low	114 Å²	114	73.3 Å²	73.3	94%	0.942	39%	0.389	S	S	*	.	S	Bend	trans	-73.4	28.1	-154.6	0	0	0	0	0	117.2
50	D	34.2	Very low	41.9	Very low	130 Å²	130	71 Å²	71	70%	0.695	37%	0.373	S	S	*	.	S	Bend	trans	-130.4	95.3	-174.2	-145.8	2.4	0	0	0	112	D48 S52	D48-D50 PolarHBondContact O-N 3.39Å; D50-S52 PolarHBondContact O-N 2.97Å
51	H	35.2	Very low	43.6	Very low	166 Å²	166	66.5 Å²	66.5	77%	0.769	35%	0.346	S	S	*	.	S	Bend	trans	36	1.8	163.2	-72.1	-76.3	0	0	0	123.6
52	S	30.7	Very low	45.9	Very low	80 Å²	80	61.1 Å²	61.1	56%	0.559	33%	0.326	S	S	*	.			trans	-95.6	115.3	-178.8	-170.3	0	0	0	0	111.9	D50	D50-S52 PolarHBondContact O-N 2.97Å
53	G	31.7	Very low	48.6	Very low	10 Å²	10	57.4 Å²	57.4	10%	0.103	32%	0.317	C	S	.	.			trans	-81.6	168.1	-179.8	0	0	0	0	0	114.1	N55	G53-N55 PolarHBondContact O-N 3.15Å; G53-N55 PolarHBondContact O-ND2 2.03Å
54	S	33.4	Very low	51.1	Low	40 Å²	40	54.2 Å²	54.2	28%	0.28	30%	0.303	S	S	.	.			trans	-55.3	128.9	172	-168	0	0	0	0	109.4
55	N	40.1	Very low	53.8	Low	35 Å²	35	50.5 Å²	50.5	19%	0.187	28%	0.284	C	S	.	.			trans	-128	139.9	-173.9	-88.7	-62	0	0	0	109.5	G53 L57 S74 T75	G53-N55 PolarHBondContact O-N 3.15Å; G53-N55 PolarHBondContact O-ND2 2.03Å; N55-L57 PolarHBondContact O-N 2.63Å; N55-S74 VanDerWaalsContact CG-CA 3.44Å; N55-S74 VanDerWaalsContact ND2-CB 3.33Å; N55-S74 WeakPolarHBondContact ND2-CB 3.48Å; N55-S74 WeakPolarHBondContact OD1-CA 3.46Å; N55-S74 WeakPolarHBondContact OD1-CB 3.46Å; N55-T75 PolarHBondContact OD1-N 2.99Å
56	H	47.9	Very low	56.2	Low	69 Å²	69	54 Å²	54	32%	0.319	31%	0.309	S	S	.	.			trans	-63.2	93.9	157.2	-92	-53.4	0	0	0	108.3	S58 T75 Q454	H56-S58 PolarHBondContact O-N 2.55Å; H56-T75 HydrophobicContact CB-CG2 4.25Å; H56-Q454 PolarHBondContact CD2-NE2 2.78Å; H56-Q454 PolarHBondContact CD2-OE1 3.17Å; H56-Q454 VanDerWaalsContact CD2-OE1 3.3Å; H56-Q454 PolarHBondContact NE2-NE2 2.96Å; H56-Q454 PolarHBondContact NE2-OE1 3.28Å
57	L	49.4	Very low	58.4	Low	36 Å²	36	55.1 Å²	55.1	19%	0.188	31%	0.313	C	S	.	.			trans	-75	65.9	176.8	-100.5	149.5	0	0	0	110.2	N55 V59 H72	N55-L57 PolarHBondContact O-N 2.63Å; L57-V59 PolarHBondContact O-N 2.69Å; L57-H72 HydrophobicContact CD2-CB 3.79Å; L57-H72 WeakPolarHBondContact CD2-ND1 2.95Å
58	S	64	Low	61.1	Low	11 Å²	11	57.5 Å²	57.5	8%	0.077	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	116.8	159	-68.7	0	0	0	0	107.4	H56 L73 Y106	H56-S58 PolarHBondContact O-N 2.55Å; S58-L73 WeakPolarHBondContact O-CB 3.24Å; S58-L73 PolarHBondContact O-N 3.24Å; S58-L73 VanDerWaalsContact O-N 3.15Å; S58-Y106 PolarHBondContact OG-OH 3.29Å
59	V	73.6	Confident	63.9	Low	5 Å²	5	54.8 Å²	54.8	3%	0.03	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	113.4	170.3	178	0	0	0	0	106.8	S39 L57 R70 A71	S39-V59 PolarHBondContact N-O 3.46Å; S39-V59 PolarHBondContact O-N 3.27Å; L57-V59 PolarHBondContact O-N 2.69Å; V59-R70 HydrophobicContact CG1-CG 3.59Å; V59-A71 WeakPolarHBondContact CA-O 3.01Å
60	F	84	Confident	66.7	Low	1 Å²	1	53.1 Å²	53.1	0%	0.004	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	141.9	164.8	81.5	-83.3	0	0	0	109.7	V36 Q37 L38 F62 A71 L73 V118 A120 V128 A130 I132	V36-F60 HydrophobicContact CG1-CB 3.98Å; V36-F60 HydrophobicContact CG1-CD2 3.74Å; V36-F60 HydrophobicContact CG1-CG 4.32Å; Q37-F60 WeakPolarHBondContact O-CA 3.37Å; L38-F60 HydrophobicContact CD2-CB 3.63Å; F60-F62 AromaticContact CD2-CD1 3.98Å; F60-F62 HydrophobicContact CD2-CD1 3.98Å; F60-F62 HydrophobicContact CD2-CE1 4.2Å; F60-F62 AromaticContact CE2-CD1 3.91Å; F60-F62 HydrophobicContact CE2-CD1 3.91Å; F60-F62 AromaticContact CE2-CE1 3.65Å; F60-F62 HydrophobicContact CE2-CE1 3.65Å; F60-A71 HydrophobicContact CD1-CB 3.71Å; F60-A71 HydrophobicContact CE1-CB 3.38Å; F60-A71 HydrophobicContact CG-CB 4.49Å; F60-A71 HydrophobicContact CZ-CB 3.91Å; F60-A71 PolarHBondContact N-O 2.9Å; F60-A71 PolarHBondContact O-N 2.03Å; F60-L73 HydrophobicContact CD1-CD1 3.59Å; F60-L73 HydrophobicContact CD1-CD2 4.3Å; F60-L73 HydrophobicContact CD1-CG 3.95Å; F60-L73 HydrophobicContact CE1-CD1 3.99Å; F60-L73 HydrophobicContact CE1-CD2 3.96Å; F60-L73 HydrophobicContact CE1-CG 4.13Å; F60-V118 HydrophobicContact CE1-CG1 3.84Å; F60-V118 HydrophobicContact CZ-CG1 3.98Å; F60-A120 HydrophobicContact CE1-CB 4.01Å; F60-A120 HydrophobicContact CZ-CB 4.5Å; F60-V128 HydrophobicContact CD2-CG1 4.28Å; F60-V128 HydrophobicContact CE2-CG1 4.27Å; F60-A130 HydrophobicContact CE2-CB 4.15Å; F60-A130 HydrophobicContact CZ-CB 3.73Å; F60-I132 HydrophobicContact CE2-CD1 4.18Å; F60-I132 HydrophobicContact CZ-CD1 4Å; F60-I132 HydrophobicContact CZ-CG1 4.36Å
61	S	88.8	Confident	69.1	Low	14 Å²	14	47 Å²	47	10%	0.098	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	143.2	174.8	63	0	0	0	0	111.5	Q37 F69	Q37-S61 PolarHBondContact N-O 3.47Å; Q37-S61 PolarHBondContact O-N 2.77Å; S61-F69 CarbonylContact C-O 3.59Å; S61-F69 WeakPolarHBondContact CA-O 3.17Å; S61-F69 WeakPolarHBondContact CB-O 3.32Å
62	F	89.6	Confident	71.2	Confident	5 Å²	5	42.7 Å²	42.7	2%	0.022	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	161.5	178.5	66.7	-78.9	0	0	0	108.9	V34 V36 F60 A64 F69 I132 V141 A158	V34-F62 HydrophobicContact CB-CB 4.49Å; V34-F62 HydrophobicContact CB-CD2 4.23Å; V34-F62 HydrophobicContact CG1-CD2 4.16Å; V34-F62 HydrophobicContact CG2-CD2 4.16Å; V36-F62 HydrophobicContact CG2-CB 4.3Å; F60-F62 AromaticContact CD2-CD1 3.98Å; F60-F62 HydrophobicContact CD2-CD1 3.98Å; F60-F62 HydrophobicContact CD2-CE1 4.2Å; F60-F62 AromaticContact CE2-CD1 3.91Å; F60-F62 HydrophobicContact CE2-CD1 3.91Å; F60-F62 AromaticContact CE2-CE1 3.65Å; F60-F62 HydrophobicContact CE2-CE1 3.65Å; F62-A64 HydrophobicContact CD2-CB 3.94Å; F62-A64 HydrophobicContact CE2-CB 3.73Å; F62-F69 HydrophobicContact CD1-CB 3.75Å; F62-F69 HydrophobicContact CD1-CG 4.48Å; F62-F69 HydrophobicContact CD2-CD2 4.08Å; F62-F69 HydrophobicContact CE1-CB 3.33Å; F62-F69 HydrophobicContact CE1-CD2 4.16Å; F62-F69 AromaticContact CE1-CG 3.76Å; F62-F69 HydrophobicContact CE1-CG 3.76Å; F62-F69 HydrophobicContact CE2-CB 4.2Å; F62-F69 AromaticContact CE2-CD2 3.46Å; F62-F69 HydrophobicContact CE2-CD2 3.46Å; F62-F69 VanDerWaalsContact CE2-CD2 3.46Å; F62-F69 HydrophobicContact CE2-CE2 4.06Å; F62-F69 AromaticContact CE2-CG 3.92Å; F62-F69 HydrophobicContact CE2-CG 3.92Å; F62-F69 HydrophobicContact CG-CB 4.32Å; F62-F69 HydrophobicContact CZ-CB 3.59Å; F62-F69 HydrophobicContact CZ-CD1 4.11Å; F62-F69 AromaticContact CZ-CD2 3.51Å; F62-F69 HydrophobicContact CZ-CD2 3.51Å; F62-F69 HydrophobicContact CZ-CE2 4.23Å; F62-F69 AromaticContact CZ-CG 3.44Å; F62-F69 HydrophobicContact CZ-CG 3.44Å; F62-F69 VanDerWaalsContact CZ-CG 3.44Å; F62-F69 PolarHBondContact N-O 3.48Å; F62-F69 PolarHBondContact O-N 3.33Å; F62-I132 HydrophobicContact CE1-CD1 3.72Å; F62-I132 HydrophobicContact CZ-CD1 3.79Å; F62-V141 HydrophobicContact CE1-CG2 3.85Å; F62-V141 HydrophobicContact CE2-CG2 4.01Å; F62-V141 HydrophobicContact CZ-CG2 3.52Å; F62-A158 HydrophobicContact CE2-CB 4.09Å
63	C	89.3	Confident	73.4	Confident	89 Å²	89	39 Å²	39	60%	0.601	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	130.7	171.6	-66.2	0	0	0	0	108.7	V34 R67	V34-C63 WeakPolarHBondContact CG1-O 3.5Å; C63-R67 WeakPolarHBondContact CA-O 3.17Å
64	A	86.3	Confident	74.9	Confident	2 Å²	2	40 Å²	40	2%	0.017	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153	150.1	172.3	0	0	0	0	0	110.1	E32 V34 F62 N66 R67 F69 A158	E32-A64 VanDerWaalsContact OE2-CA 3.22Å; E32-A64 WeakPolarHBondContact OE2-CA 3.33Å; V34-A64 HydrophobicContact CG1-CB 4.01Å; F62-A64 HydrophobicContact CD2-CB 3.94Å; F62-A64 HydrophobicContact CE2-CB 3.73Å; A64-N66 VanDerWaalsContact C-N 3.27Å; A64-N66 PolarHBondContact O-N 2.93Å; A64-R67 PolarHBondContact N-O 2.04Å; A64-R67 WeakPolarHBondContact O-CA 3.49Å; A64-R67 PolarHBondContact O-N 3.19Å; A64-F69 HydrophobicContact CB-CD2 4.41Å; A64-F69 HydrophobicContact CB-CE2 4.07Å; A64-A158 HydrophobicContact CB-CB 3.88Å
65	F	87.5	Confident	76.5	Confident	14 Å²	14	39.7 Å²	39.7	6%	0.061	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.5	39.1	174.5	-41.4	-62.9	0	0	0	113.5	H30 E32 R67 F69 Y139 A158 R160	H30-F65 AromaticContact CD2-CD1 3.8Å; H30-F65 AromaticContact CD2-CE1 3.57Å; H30-F65 AromaticContact NE2-CD1 3.21Å; H30-F65 WeakPolarHBondContact NE2-CD1 3.42Å; H30-F65 AromaticContact NE2-CE1 3.36Å; H30-F65 WeakPolarHBondContact NE2-CE1 3.14Å; E32-F65 VanDerWaalsContact CD-N 3.26Å; E32-F65 HydrophobicContact CG-CD1 4.48Å; E32-F65 HydrophobicContact CG-CE1 4.17Å; E32-F65 WeakPolarHBondContact OE1-CA 3.46Å; E32-F65 WeakPolarHBondContact OE1-CD1 3.23Å; E32-F65 PolarHBondContact OE1-N 2.73Å; E32-F65 VanDerWaalsContact OE1-N 3.1Å; E32-F65 PolarHBondContact OE2-N 2.69Å; F65-R67 PolarHBondContact O-N 3.38Å; F65-R67 VanDerWaalsContact O-N 3.13Å; F65-F69 HydrophobicContact CD2-CE2 4.33Å; F65-F69 HydrophobicContact CD2-CZ 4.49Å; F65-Y139 AromaticContact CD2-CD1 3.73Å; F65-Y139 HydrophobicContact CD2-CD1 3.73Å; F65-Y139 AromaticContact CD2-CE1 3.77Å; F65-Y139 HydrophobicContact CD2-CE1 3.77Å; F65-Y139 AromaticContact CE2-CD1 3.77Å; F65-Y139 HydrophobicContact CE2-CD1 3.77Å; F65-Y139 HydrophobicContact CE2-CE1 4.28Å; F65-A158 HydrophobicContact CE2-CB 4.13Å; F65-A158 HydrophobicContact CZ-CB 4.12Å; F65-A158 WeakPolarHBondContact CZ-O 3.49Å; F65-R160 HydrophobicContact CD2-CG 4.15Å; F65-R160 HydrophobicContact CE1-CG 4.47Å; F65-R160 HydrophobicContact CE2-CG 4.03Å; F65-R160 HydrophobicContact CG-CG 4.44Å; F65-R160 HydrophobicContact CZ-CG 4.21Å
66	N	82.6	Confident	77.8	Confident	159 Å²	159	38.7 Å²	38.7	85%	0.85	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.9	15.2	-171.9	-60.8	-28.7	0	0	0	115.3	A64	A64-N66 VanDerWaalsContact C-N 3.27Å; A64-N66 PolarHBondContact O-N 2.93Å
67	R	84.9	Confident	78.4	Confident	41 Å²	41	37 Å²	37	16%	0.155	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	141.1	176.8	-177.2	173.6	178.2	-162.1	-0.5	110.7	C63 A64 F65 F69 D112	C63-R67 WeakPolarHBondContact CA-O 3.17Å; A64-R67 PolarHBondContact N-O 2.04Å; A64-R67 WeakPolarHBondContact O-CA 3.49Å; A64-R67 PolarHBondContact O-N 3.19Å; F65-R67 PolarHBondContact O-N 3.38Å; F65-R67 VanDerWaalsContact O-N 3.13Å; R67-F69 HydrophobicContact CB-CE2 3.98Å; R67-F69 HydrophobicContact CB-CZ 4.3Å; R67-F69 HydrophobicContact CG-CD2 4.47Å; R67-F69 HydrophobicContact CG-CE2 4.13Å; R67-F69 HydrophobicContact CG-CZ 4.21Å; R67-D112 IonicContact CZ-OD2 3.97Å; R67-D112 IonicContact NE-OD2 3.71Å; R67-D112 PolarHBondContact NE-OD2 2.76Å; R67-D112 VanDerWaalsContact NE-OD2 3.11Å; R67-D112 IonicContact NH2-OD1 3.76Å; R67-D112 PolarHBondContact NH2-OD1 3.43Å; R67-D112 IonicContact NH2-OD2 3.81Å; R67-D112 PolarHBondContact NH2-OD2 3.29Å
68	K	89	Confident	79.1	Confident	129 Å²	129	38.3 Å²	38.3	56%	0.561	20%	0.203	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-89.7	115.5	166	-177.5	172.8	-177.3	171.9	0	108.8
69	F	89.1	Confident	80.1	Confident	1 Å²	1	38 Å²	38	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	134.6	169.4	-64.7	-92.5	0	0	0	108.8	S61 F62 A64 F65 R67 L110 I132 Y139	S61-F69 CarbonylContact C-O 3.59Å; S61-F69 WeakPolarHBondContact CA-O 3.17Å; S61-F69 WeakPolarHBondContact CB-O 3.32Å; F62-F69 HydrophobicContact CD1-CB 3.75Å; F62-F69 HydrophobicContact CD1-CG 4.48Å; F62-F69 HydrophobicContact CD2-CD2 4.08Å; F62-F69 HydrophobicContact CE1-CB 3.33Å; F62-F69 HydrophobicContact CE1-CD2 4.16Å; F62-F69 AromaticContact CE1-CG 3.76Å; F62-F69 HydrophobicContact CE1-CG 3.76Å; F62-F69 HydrophobicContact CE2-CB 4.2Å; F62-F69 AromaticContact CE2-CD2 3.46Å; F62-F69 HydrophobicContact CE2-CD2 3.46Å; F62-F69 VanDerWaalsContact CE2-CD2 3.46Å; F62-F69 HydrophobicContact CE2-CE2 4.06Å; F62-F69 AromaticContact CE2-CG 3.92Å; F62-F69 HydrophobicContact CE2-CG 3.92Å; F62-F69 HydrophobicContact CG-CB 4.32Å; F62-F69 HydrophobicContact CZ-CB 3.59Å; F62-F69 HydrophobicContact CZ-CD1 4.11Å; F62-F69 AromaticContact CZ-CD2 3.51Å; F62-F69 HydrophobicContact CZ-CD2 3.51Å; F62-F69 HydrophobicContact CZ-CE2 4.23Å; F62-F69 AromaticContact CZ-CG 3.44Å; F62-F69 HydrophobicContact CZ-CG 3.44Å; F62-F69 VanDerWaalsContact CZ-CG 3.44Å; F62-F69 PolarHBondContact N-O 3.48Å; F62-F69 PolarHBondContact O-N 3.33Å; A64-F69 HydrophobicContact CB-CD2 4.41Å; A64-F69 HydrophobicContact CB-CE2 4.07Å; F65-F69 HydrophobicContact CD2-CE2 4.33Å; F65-F69 HydrophobicContact CD2-CZ 4.49Å; R67-F69 HydrophobicContact CB-CE2 3.98Å; R67-F69 HydrophobicContact CB-CZ 4.3Å; R67-F69 HydrophobicContact CG-CD2 4.47Å; R67-F69 HydrophobicContact CG-CE2 4.13Å; R67-F69 HydrophobicContact CG-CZ 4.21Å; F69-L110 HydrophobicContact CD1-CD1 4.21Å; F69-L110 HydrophobicContact CD1-CD2 4.23Å; F69-I132 HydrophobicContact CD1-CD1 4.24Å; F69-I132 HydrophobicContact CD1-CG2 4.48Å; F69-Y139 HydrophobicContact CE1-CD1 4.12Å; F69-Y139 AromaticContact CE1-CD2 3.64Å; F69-Y139 HydrophobicContact CE1-CD2 3.64Å; F69-Y139 HydrophobicContact CE1-CE1 4.19Å; F69-Y139 AromaticContact CE1-CE2 3.73Å; F69-Y139 HydrophobicContact CE1-CE2 3.73Å; F69-Y139 AromaticContact CE1-CG 3.84Å; F69-Y139 HydrophobicContact CE1-CG 3.84Å; F69-Y139 AromaticContact CE1-CZ 3.99Å; F69-Y139 AromaticContact CZ-CD1 3.61Å; F69-Y139 HydrophobicContact CZ-CD1 3.61Å; F69-Y139 AromaticContact CZ-CD2 3.99Å; F69-Y139 HydrophobicContact CZ-CD2 3.99Å; F69-Y139 AromaticContact CZ-CE1 3.55Å; F69-Y139 HydrophobicContact CZ-CE1 3.55Å; F69-Y139 AromaticContact CZ-CE2 3.94Å; F69-Y139 HydrophobicContact CZ-CE2 3.94Å; F69-Y139 AromaticContact CZ-CG 3.82Å; F69-Y139 HydrophobicContact CZ-CG 3.82Å; F69-Y139 AromaticContact CZ-CZ 3.7Å
70	R	88.9	Confident	80.6	Confident	78 Å²	78	38.4 Å²	38.4	29%	0.294	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	123.6	170.2	-169.6	168	174.9	-120.9	-2.6	106.4	V59 L110 D111	V59-R70 HydrophobicContact CG1-CG 3.59Å; R70-L110 CarbonylContact O-C 3.29Å; R70-L110 VanDerWaalsContact O-CA 3.24Å; R70-L110 WeakPolarHBondContact O-CA 3.41Å; R70-L110 WeakPolarHBondContact O-CD2 3.33Å; R70-D111 VanDerWaalsContact C-OD1 3.29Å; R70-D111 HydrophobicContact CB-CB 4.32Å; R70-D111 WeakPolarHBondContact CD-OD2 3.24Å; R70-D111 WeakPolarHBondContact CG-OD1 3.4Å; R70-D111 WeakPolarHBondContact CG-OD2 3.47Å; R70-D111 IonicContact CZ-OD2 3.82Å; R70-D111 VanDerWaalsContact CZ-OD2 3.24Å; R70-D111 IonicContact NE-OD2 3.3Å; R70-D111 PolarHBondContact NE-OD2 3.12Å; R70-D111 IonicContact NH1-OD2 2.76Å; R70-D111 PolarHBondContact NH1-OD2 2.87Å; R70-D111 PolarHBondContact O-N 3.38Å
71	A	85	Confident	80.6	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.008	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	125.8	-173.6	0	0	0	0	0	110	V59 F60 K109 L110 V118	V59-A71 WeakPolarHBondContact CA-O 3.01Å; F60-A71 HydrophobicContact CD1-CB 3.71Å; F60-A71 HydrophobicContact CE1-CB 3.38Å; F60-A71 HydrophobicContact CG-CB 4.49Å; F60-A71 HydrophobicContact CZ-CB 3.91Å; F60-A71 PolarHBondContact N-O 2.9Å; F60-A71 PolarHBondContact O-N 2.03Å; A71-K109 CarbonylContact C-O 3.5Å; A71-K109 WeakPolarHBondContact CA-O 3.44Å; A71-L110 HydrophobicContact CB-CD2 4.05Å; A71-V118 HydrophobicContact CB-CG1 4.45Å; A71-V118 HydrophobicContact CB-CG2 4.16Å
72	H	79	Confident	79.8	Confident	77 Å²	77	41.7 Å²	41.7	36%	0.356	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.4	168.8	-80.5	-73.6	0	0	0	109.1	L57 G108 K109 D111	L57-H72 HydrophobicContact CD2-CB 3.79Å; L57-H72 WeakPolarHBondContact CD2-ND1 2.95Å; H72-G108 WeakPolarHBondContact O-CA 3.02Å; H72-K109 PolarHBondContact N-O 3.37Å; H72-K109 PolarHBondContact O-N 2.98Å; H72-K109 VanDerWaalsContact O-N 3.11Å; H72-D111 IonicContact CD2-OD1 3.54Å; H72-D111 PolarHBondContact CD2-OD1 2.86Å; H72-D111 IonicContact CG-OD1 3.62Å; H72-D111 IonicContact NE2-OD1 2.7Å; H72-D111 PolarHBondContact NE2-OD1 3.48Å; H72-D111 IonicContact NE2-OD2 3.45Å
73	L	76.9	Confident	79.3	Confident	2 Å²	2	45.6 Å²	45.6	1%	0.01	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	157.5	-179.5	-65.5	179.6	0	0	0	113.7	S58 F60 Y106 H107 V118 A120 I122	S58-L73 WeakPolarHBondContact O-CB 3.24Å; S58-L73 PolarHBondContact O-N 3.24Å; S58-L73 VanDerWaalsContact O-N 3.15Å; F60-L73 HydrophobicContact CD1-CD1 3.59Å; F60-L73 HydrophobicContact CD1-CD2 4.3Å; F60-L73 HydrophobicContact CD1-CG 3.95Å; F60-L73 HydrophobicContact CE1-CD1 3.99Å; F60-L73 HydrophobicContact CE1-CD2 3.96Å; F60-L73 HydrophobicContact CE1-CG 4.13Å; L73-Y106 HydrophobicContact CB-CD1 3.75Å; L73-Y106 HydrophobicContact CB-CG 3.96Å; L73-Y106 HydrophobicContact CD1-CD1 4.26Å; L73-Y106 HydrophobicContact CD1-CD2 4.06Å; L73-Y106 HydrophobicContact CD1-CG 3.8Å; L73-Y106 HydrophobicContact CG-CG 4.37Å; L73-H107 CarbonylContact C-O 3.51Å; L73-H107 VanDerWaalsContact CA-O 3.32Å; L73-H107 WeakPolarHBondContact CA-O 3.06Å; L73-H107 WeakPolarHBondContact CD2-O 3.06Å; L73-V118 HydrophobicContact CD2-CB 4.44Å; L73-V118 HydrophobicContact CD2-CG1 3.93Å; L73-A120 HydrophobicContact CD1-CB 3.98Å; L73-A120 HydrophobicContact CD2-CB 3.95Å; L73-I122 HydrophobicContact CD1-CD1 3.75Å
74	S	64.6	Low	79.1	Confident	31 Å²	31	43.2 Å²	43.2	22%	0.217	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	134.9	-178.6	49.1	0	0	0	0	108.4	N55 Y106 H107	N55-S74 VanDerWaalsContact CG-CA 3.44Å; N55-S74 VanDerWaalsContact ND2-CB 3.33Å; N55-S74 WeakPolarHBondContact ND2-CB 3.48Å; N55-S74 WeakPolarHBondContact OD1-CA 3.46Å; N55-S74 WeakPolarHBondContact OD1-CB 3.46Å; S74-Y106 CarbonylContact O-C 3.55Å; S74-Y106 WeakPolarHBondContact O-CA 3.04Å; S74-Y106 WeakPolarHBondContact O-CB 3.45Å; S74-H107 PolarHBondContact N-O 3.47Å; S74-H107 PolarHBondContact O-N 2.89Å; S74-H107 VanDerWaalsContact O-O 3.1Å; S74-H107 PolarHBondContact OG-O 2.78Å
75	T	66.8	Low	79.1	Confident	34 Å²	34	47 Å²	47	21%	0.209	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	137.4	-177.1	38	0	0	0	0	111	N55 H56 F105 Y106	N55-T75 PolarHBondContact OD1-N 2.99Å; H56-T75 HydrophobicContact CB-CG2 4.25Å; T75-F105 WeakPolarHBondContact CA-O 2.97Å; T75-Y106 HydrophobicContact CG2-CD1 4.25Å; T75-Y106 HydrophobicContact CG2-CE1 3.99Å
76	A	65.8	Low	79	Confident	14 Å²	14	46.5 Å²	46.5	12%	0.116	24%	0.241	C	C	.	.			trans	-132.6	123.1	-173.6	0	0	0	0	0	111.6	F105 H107	A76-F105 PolarHBondContact N-O 3.32Å; A76-F105 WeakPolarHBondContact O-CB 3.35Å; A76-H107 HydrophobicContact CB-CB 4.29Å; A76-H107 WeakPolarHBondContact CB-CD2 3.34Å
77	R	61.6	Low	79.3	Confident	34 Å²	34	40 Å²	40	13%	0.128	21%	0.206	C	C	.	.			trans	-130.5	17.9	175.1	-64.5	-168.9	-178	153.6	9.5	113.7	V79 L80 L102 G452	R77-V79 PolarHBondContact O-N 2.8Å; R77-L80 PolarHBondContact O-N 3.11Å; R77-L80 VanDerWaalsContact O-N 3.17Å; R77-L102 PolarHBondContact NE-O 3.37Å; R77-G452 PolarHBondContact NH1-O 2.95Å; R77-G452 PolarHBondContact NH2-O 2.7Å
78	S	64.9	Low	79.5	Confident	62 Å²	62	38.3 Å²	38.3	43%	0.434	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-25.9	-172.4	52.4	0	0	0	0	115.9
79	V	83	Confident	79.9	Confident	4 Å²	4	32.5 Å²	32.5	2%	0.024	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	8.5	-176.7	-62.7	0	0	0	0	114.9	R77 I235 D239 N242 I266	R77-V79 PolarHBondContact O-N 2.8Å; V79-I235 HydrophobicContact CG2-CG2 4.14Å; V79-D239 HydrophobicContact CG1-CB 4.42Å; V79-D239 HydrophobicContact CG2-CB 4.16Å; V79-N242 HydrophobicContact CG1-CB 3.88Å; V79-N242 WeakPolarHBondContact CG1-ND2 3.11Å; V79-I266 HydrophobicContact CG2-CD1 4.17Å; V79-I266 WeakPolarHBondContact O-CB 3.27Å; V79-I266 WeakPolarHBondContact O-CG1 3.38Å; V79-I266 PolarHBondContact O-N 2.87Å
80	L	84.7	Confident	80.1	Confident	14 Å²	14	33.5 Å²	33.5	7%	0.073	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	134.3	179.9	-60.3	-178.9	0	0	0	111.8	R77 F84 L102 I235 V265 I266	R77-L80 PolarHBondContact O-N 3.11Å; R77-L80 VanDerWaalsContact O-N 3.17Å; L80-F84 HydrophobicContact CD2-CD2 4.24Å; L80-F84 HydrophobicContact CD2-CE2 4.38Å; L80-F84 HydrophobicContact CD2-CG 4.43Å; L80-L102 HydrophobicContact CD1-CD1 3.56Å; L80-L102 HydrophobicContact CD1-CD2 3.87Å; L80-L102 HydrophobicContact CD1-CG 4.18Å; L80-I235 HydrophobicContact CD2-CD1 4.04Å; L80-I235 HydrophobicContact CD2-CG1 4.04Å; L80-I235 HydrophobicContact CD2-CG2 4.13Å; L80-V265 VanDerWaalsContact C-CG2 3.49Å; L80-I266 HydrophobicContact CD2-CB 4.09Å; L80-I266 HydrophobicContact CD2-CD1 4.06Å
81	F	84.1	Confident	80.2	Confident	28 Å²	28	30.1 Å²	30.1	12%	0.123	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	145.8	172.1	-159.7	-107.6	0	0	0	108.9	T83 F84 V265 I266 K267 V444	F81-T83 VanDerWaalsContact C-N 3.28Å; F81-T83 WeakPolarHBondContact CD1-OG1 3.22Å; F81-T83 HydrophobicContact CE1-CG2 4.48Å; F81-T83 WeakPolarHBondContact CE1-OG1 2.96Å; F81-T83 PolarHBondContact O-N 2.74Å; F81-F84 WeakPolarHBondContact O-CA 3.32Å; F81-F84 WeakPolarHBondContact O-CB 3.43Å; F81-F84 PolarHBondContact O-N 3.34Å; F81-V265 HydrophobicContact CB-CG2 3.86Å; F81-V265 HydrophobicContact CD2-CG1 3.89Å; F81-V265 HydrophobicContact CD2-CG2 3.96Å; F81-V265 HydrophobicContact CG-CG2 4.43Å; F81-V265 VanDerWaalsContact N-CG2 3.33Å; F81-I266 WeakPolarHBondContact CB-O 3.14Å; F81-I266 PolarHBondContact N-O 2.88Å; F81-K267 HydrophobicContact CB-CB 4.16Å; F81-K267 HydrophobicContact CB-CG 4.48Å; F81-K267 HydrophobicContact CD1-CD 4.5Å; F81-K267 HydrophobicContact CD1-CG 4Å; F81-K267 HydrophobicContact CG-CB 4.34Å; F81-K267 HydrophobicContact CG-CG 4.27Å; F81-V444 HydrophobicContact CD2-CG2 4.46Å; F81-V444 HydrophobicContact CE2-CB 4.47Å; F81-V444 HydrophobicContact CE2-CG2 3.93Å
82	P	72.8	Confident	80.7	Confident	57 Å²	57	36.6 Å²	36.6	37%	0.37	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	-37.1	-176.3	-9.6	13.9	0	0	0	112.5	F84 E447	P82-F84 PolarHBondContact O-N 3.3Å; P82-E447 WeakPolarHBondContact CD-OE1 3.37Å; P82-E447 HydrophobicContact CG-CB 4.33Å; P82-E447 HydrophobicContact CG-CG 4.26Å; P82-E447 VanDerWaalsContact CG-OE1 3.24Å; P82-E447 WeakPolarHBondContact CG-OE1 3.41Å; P82-E447 WeakPolarHBondContact CG-OE2 3.35Å
83	T	79.4	Confident	81.3	Confident	86 Å²	86	34.9 Å²	34.9	53%	0.528	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	35.1	172.6	79.8	0	0	0	0	112.4	F81 Q85	F81-T83 VanDerWaalsContact C-N 3.28Å; F81-T83 WeakPolarHBondContact CD1-OG1 3.22Å; F81-T83 HydrophobicContact CE1-CG2 4.48Å; F81-T83 WeakPolarHBondContact CE1-OG1 2.96Å; F81-T83 PolarHBondContact O-N 2.74Å; T83-Q85 PolarHBondContact O-N 3.08Å
84	F	84.3	Confident	82	Confident	39 Å²	39	42.3 Å²	42.3	17%	0.171	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.5	135.8	178.6	165.8	-105.8	0	0	0	111.2	L80 F81 P82 A86 L102 I231 I235 I266 I269	L80-F84 HydrophobicContact CD2-CD2 4.24Å; L80-F84 HydrophobicContact CD2-CE2 4.38Å; L80-F84 HydrophobicContact CD2-CG 4.43Å; F81-F84 WeakPolarHBondContact O-CA 3.32Å; F81-F84 WeakPolarHBondContact O-CB 3.43Å; F81-F84 PolarHBondContact O-N 3.34Å; P82-F84 PolarHBondContact O-N 3.3Å; F84-A86 HydrophobicContact CE1-CB 4Å; F84-A86 HydrophobicContact CZ-CB 4Å; F84-L102 HydrophobicContact CD1-CD1 4.48Å; F84-I231 HydrophobicContact CZ-CG2 4.34Å; F84-I235 HydrophobicContact CZ-CD1 4.4Å; F84-I266 HydrophobicContact CD2-CG2 3.97Å; F84-I266 HydrophobicContact CE2-CG2 3.74Å; F84-I269 HydrophobicContact CE2-CB 4.23Å; F84-I269 HydrophobicContact CE2-CD1 3.86Å; F84-I269 HydrophobicContact CE2-CG1 3.87Å; F84-I269 HydrophobicContact CZ-CB 4.39Å; F84-I269 HydrophobicContact CZ-CD1 3.99Å; F84-I269 HydrophobicContact CZ-CG1 4.29Å
85	Q	85.6	Confident	83.4	Confident	81 Å²	81	48.3 Å²	48.3	38%	0.379	25%	0.247	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	121.7	179.9	-71.2	173.8	13.8	0	0	110.9	T83 K267 K268 I269	T83-Q85 PolarHBondContact O-N 3.08Å; Q85-K267 PolarHBondContact N-O 3.03Å; Q85-K268 HydrophobicContact CB-CG 4.49Å; Q85-K268 CarbonylContact O-C 3.56Å; Q85-K268 WeakPolarHBondContact O-CA 3.42Å; Q85-I269 PolarHBondContact O-N 3.02Å
86	A	85	Confident	84.2	Confident	5 Å²	5	50.9 Å²	50.9	4%	0.041	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	131.3	168.9	0	0	0	0	0	110.3	F84 E98 V100 I231	F84-A86 HydrophobicContact CE1-CB 4Å; F84-A86 HydrophobicContact CZ-CB 4Å; A86-E98 HydrophobicContact CB-CB 3.96Å; A86-E98 PolarHBondContact O-N 2.92Å; A86-V100 HydrophobicContact CB-CG2 4.03Å; A86-I231 HydrophobicContact CB-CD1 3.88Å
87	L	90.2	Very high	84.9	Confident	22 Å²	22	57.6 Å²	57.6	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	135.6	-178.1	-63	169.2	0	0	0	110.9	N96 Q97 K268 I269 I270 V271	L87-N96 CarbonylContact C-O 3.49Å; L87-N96 VanDerWaalsContact CA-O 3.26Å; L87-N96 WeakPolarHBondContact CA-O 3.47Å; L87-Q97 HydrophobicContact CD2-CB 4.44Å; L87-K268 HydrophobicContact CD1-CD 4.19Å; L87-I269 PolarHBondContact N-O 2.96Å; L87-I270 HydrophobicContact CD1-CG1 4.42Å; L87-I270 CarbonylContact O-C 3.33Å; L87-I270 WeakPolarHBondContact O-CA 3.42Å; L87-V271 PolarHBondContact O-N 2.62Å
88	S	89.5	Confident	85.6	Confident	5 Å²	5	58.4 Å²	58.4	4%	0.035	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	150.6	160.8	68.1	0	0	0	0	110.9	R95 N96 E98 V271	S88-R95 VanDerWaalsContact O-CA 3.31Å; S88-R95 WeakPolarHBondContact O-CA 3.44Å; S88-N96 PolarHBondContact N-O 2.91Å; S88-N96 PolarHBondContact O-N 3.45Å; S88-N96 PolarHBondContact OG-ND2 3.09Å; S88-E98 WeakPolarHBondContact CB-OE1 3.43Å; S88-E98 PolarHBondContact OG-OE1 3.5Å; S88-V271 CarbonylContact C-O 3.44Å; S88-V271 VanDerWaalsContact CA-O 3.3Å; S88-V271 WeakPolarHBondContact CA-O 3.28Å
89	V	96	Very high	85.7	Confident	8 Å²	8	63.4 Å²	63.4	5%	0.048	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	124.9	178.4	-170.9	0	0	0	0	109.6	R94 R95 I270 V271 H272 T273	V89-R94 WeakPolarHBondContact CA-O 3.41Å; V89-R95 HydrophobicContact CG2-CG 4.13Å; V89-I270 HydrophobicContact CG2-CG2 3.44Å; V89-I270 VanDerWaalsContact CG2-CG2 3.44Å; V89-V271 PolarHBondContact N-O 2.77Å; V89-H272 CarbonylContact O-C 3.55Å; V89-H272 VanDerWaalsContact O-CA 3.31Å; V89-H272 WeakPolarHBondContact O-CA 3.16Å; V89-T273 PolarHBondContact O-N 2.71Å; V89-T273 PolarHBondContact O-OG1 3.11Å
90	D	93.1	Very high	84.8	Confident	22 Å²	22	64.4 Å²	64.4	12%	0.118	32%	0.321	C	S	.	.			trans	-86.6	176.8	177.6	79.3	2.1	0	0	0	113.2	F92 G93 R94	D90-F92 PolarHBondContact O-N 3.02Å; D90-F92 VanDerWaalsContact O-N 3.09Å; D90-F92 WeakPolarHBondContact OD1-CA 3.26Å; D90-F92 WeakPolarHBondContact OD1-CB 3.33Å; D90-F92 PolarHBondContact OD1-N 3Å; D90-G93 PolarHBondContact O-N 2.03Å; D90-G93 PolarHBondContact OD1-N 3.37Å; D90-G93 VanDerWaalsContact OD1-N 3.12Å; D90-R94 PolarHBondContact N-O 2.86Å; D90-R94 VanDerWaalsContact N-O 3.09Å; D90-R94 WeakPolarHBondContact OD1-CB 3.48Å; D90-R94 PolarHBondContact OD1-N 3.36Å; D90-R94 IonicContact OD1-NE 3.64Å; D90-R94 IonicContact OD2-CZ 2.75Å; D90-R94 IonicContact OD2-NE 3.72Å; D90-R94 PolarHBondContact OD2-NE 2.87Å; D90-R94 IonicContact OD2-NH2 3.88Å; D90-R94 PolarHBondContact OD2-NH2 3.29Å
91	G	92.5	Very high	83.8	Confident	6 Å²	6	65.6 Å²	65.6	6%	0.062	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.9	-178.7	0	0	0	0	0	114.9	P275 S276 Q277	G91-P275 WeakPolarHBondContact CA-O 3.32Å; G91-S276 WeakPolarHBondContact O-CA 3.18Å; G91-Q277 PolarHBondContact O-N 2.83Å
92	F	94.5	Very high	83	Confident	138 Å²	138	65.4 Å²	65.4	61%	0.605	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-1.4	174.1	-57.7	-83.4	0	0	0	112.4	D90 R94	D90-F92 PolarHBondContact O-N 3.02Å; D90-F92 VanDerWaalsContact O-N 3.09Å; D90-F92 WeakPolarHBondContact OD1-CA 3.26Å; D90-F92 WeakPolarHBondContact OD1-CB 3.33Å; D90-F92 PolarHBondContact OD1-N 3Å; F92-R94 HydrophobicContact CB-CG 4.37Å
93	G	91.5	Very high	82.6	Confident	41 Å²	41	64 Å²	64	42%	0.423	32%	0.319	S	S	.	.			trans	81.6	9.5	-177.4	0	0	0	0	0	114.5	D90	D90-G93 PolarHBondContact O-N 2.03Å; D90-G93 PolarHBondContact OD1-N 3.37Å; D90-G93 VanDerWaalsContact OD1-N 3.12Å
94	R	93	Very high	82.3	Confident	157 Å²	157	60 Å²	60	59%	0.592	30%	0.295	S	S	*	.			trans	-71.6	132.3	175.9	-60.5	-178.5	-64.7	-177	2.5	108.9	V89 D90 F92	V89-R94 WeakPolarHBondContact CA-O 3.41Å; D90-R94 PolarHBondContact N-O 2.86Å; D90-R94 VanDerWaalsContact N-O 3.09Å; D90-R94 WeakPolarHBondContact OD1-CB 3.48Å; D90-R94 PolarHBondContact OD1-N 3.36Å; D90-R94 IonicContact OD1-NE 3.64Å; D90-R94 IonicContact OD2-CZ 2.75Å; D90-R94 IonicContact OD2-NE 3.72Å; D90-R94 PolarHBondContact OD2-NE 2.87Å; D90-R94 IonicContact OD2-NH2 3.88Å; D90-R94 PolarHBondContact OD2-NH2 3.29Å; F92-R94 HydrophobicContact CB-CG 4.37Å
95	R	93.2	Very high	81.9	Confident	157 Å²	157	58.8 Å²	58.8	59%	0.592	29%	0.29	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.6	128.7	-175.7	-56.1	-172.3	170.6	174.3	-5	110.2	S88 V89	S88-R95 VanDerWaalsContact O-CA 3.31Å; S88-R95 WeakPolarHBondContact O-CA 3.44Å; V89-R95 HydrophobicContact CG2-CG 4.13Å
96	N	82.5	Confident	81.6	Confident	88 Å²	88	56 Å²	56	47%	0.471	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	146.5	170.1	-45.2	-64.1	0	0	0	109.5	L87 S88	L87-N96 CarbonylContact C-O 3.49Å; L87-N96 VanDerWaalsContact CA-O 3.26Å; L87-N96 WeakPolarHBondContact CA-O 3.47Å; S88-N96 PolarHBondContact N-O 2.91Å; S88-N96 PolarHBondContact O-N 3.45Å; S88-N96 PolarHBondContact OG-ND2 3.09Å
97	Q	81.9	Confident	81.4	Confident	155 Å²	155	59 Å²	59	72%	0.724	29%	0.289	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	130.1	172.8	-176.4	171.6	-11.7	0	0	109.6	L87	L87-Q97 HydrophobicContact CD2-CB 4.44Å
98	E	76.5	Confident	81	Confident	51 Å²	51	58.6 Å²	58.6	24%	0.238	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-102.3	128.3	-176.1	-60	-67.1	140.6	0	0	109.7	A86 S88 V100 V227 I231	A86-E98 HydrophobicContact CB-CB 3.96Å; A86-E98 PolarHBondContact O-N 2.92Å; S88-E98 WeakPolarHBondContact CB-OE1 3.43Å; S88-E98 PolarHBondContact OG-OE1 3.5Å; E98-V100 HydrophobicContact CB-CG2 4.25Å; E98-V227 HydrophobicContact CG-CG1 3.75Å; E98-I231 HydrophobicContact CB-CD1 4.28Å
99	L	65.8	Low	80.5	Confident	167 Å²	167	63.7 Å²	63.7	87%	0.874	31%	0.311	S	S	*	.	P	Polyproline II helix	trans	-88.1	116.4	166.4	-64	174.7	0	0	0	107.3
100	V	63.9	Low	79.9	Confident	25 Å²	25	63.6 Å²	63.6	15%	0.152	31%	0.311	C	S	.	.			trans	-116.4	129.5	-178.8	-178	0	0	0	0	108.3	A86 E98 L102 I231 R232	A86-V100 HydrophobicContact CB-CG2 4.03Å; E98-V100 HydrophobicContact CB-CG2 4.25Å; V100-L102 HydrophobicContact CG1-CD2 4.19Å; V100-L102 PolarHBondContact O-N 2.72Å; V100-I231 HydrophobicContact CG1-CG2 4.18Å; V100-I231 HydrophobicContact CG2-CB 4.36Å; V100-I231 HydrophobicContact CG2-CD1 3.56Å; V100-I231 HydrophobicContact CG2-CG2 4.13Å; V100-R232 HydrophobicContact CG1-CG 4.06Å
101	D	63.7	Low	79.4	Confident	39 Å²	39	63.9 Å²	63.9	21%	0.209	31%	0.312	C	S	.	.			trans	-71.3	120.3	170.6	178.5	30.4	0	0	0	111	S103 R232 L467	D101-S103 VanDerWaalsContact CG-OG 3.3Å; D101-S103 WeakPolarHBondContact OD1-CB 3.22Å; D101-S103 PolarHBondContact OD1-N 2.88Å; D101-S103 PolarHBondContact OD1-OG 3.21Å; D101-S103 PolarHBondContact OD2-OG 3.12Å; D101-R232 PolarHBondContact O-NH1 2.77Å; D101-R232 VanDerWaalsContact O-NH1 3.13Å; D101-L467 HydrophobicContact CB-CD2 4.33Å
102	L	67.1	Low	78.7	Confident	24 Å²	24	67.4 Å²	67.4	13%	0.126	33%	0.329	C	S	.	.			trans	-105.1	13.8	179.5	-56.2	173.1	0	0	0	112.1	R77 L80 F84 V100 F105 I235	R77-L102 PolarHBondContact NE-O 3.37Å; L80-L102 HydrophobicContact CD1-CD1 3.56Å; L80-L102 HydrophobicContact CD1-CD2 3.87Å; L80-L102 HydrophobicContact CD1-CG 4.18Å; F84-L102 HydrophobicContact CD1-CD1 4.48Å; V100-L102 HydrophobicContact CG1-CD2 4.19Å; V100-L102 PolarHBondContact O-N 2.72Å; L102-F105 HydrophobicContact CD2-CD2 4.5Å; L102-F105 HydrophobicContact CD2-CE2 3.9Å; L102-I235 HydrophobicContact CD2-CD1 3.71Å
103	S	65.9	Low	77.9	Confident	28 Å²	28	62.2 Å²	62.2	20%	0.196	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-28.2	173.5	81.4	0	0	0	0	112.9	D101 F105	D101-S103 VanDerWaalsContact CG-OG 3.3Å; D101-S103 WeakPolarHBondContact OD1-CB 3.22Å; D101-S103 PolarHBondContact OD1-N 2.88Å; D101-S103 PolarHBondContact OD1-OG 3.21Å; D101-S103 PolarHBondContact OD2-OG 3.12Å; S103-F105 VanDerWaalsContact C-N 3.27Å; S103-F105 PolarHBondContact O-N 2.73Å
104	G	71.7	Confident	77.1	Confident	3 Å²	3	63.3 Å²	63.3	3%	0.031	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	13.5	-171.3	0	0	0	0	0	116.5	Y106 E121 I122	G104-Y106 VanDerWaalsContact C-CE2 3.4Å; G104-Y106 WeakPolarHBondContact O-CD2 3.02Å; G104-Y106 WeakPolarHBondContact O-CE2 3.41Å; G104-E121 CarbonylContact O-C 3.44Å; G104-E121 WeakPolarHBondContact O-CA 3.43Å; G104-I122 PolarHBondContact O-N 2.95Å
105	F	76.8	Confident	76.3	Confident	13 Å²	13	62.1 Å²	62.1	6%	0.057	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	133.3	179	-66.1	-81.9	0	0	0	111.4	T75 A76 L102 S103 E121 R232 I235	T75-F105 WeakPolarHBondContact CA-O 2.97Å; A76-F105 PolarHBondContact N-O 3.32Å; A76-F105 WeakPolarHBondContact O-CB 3.35Å; L102-F105 HydrophobicContact CD2-CD2 4.5Å; L102-F105 HydrophobicContact CD2-CE2 3.9Å; S103-F105 VanDerWaalsContact C-N 3.27Å; S103-F105 PolarHBondContact O-N 2.73Å; F105-E121 HydrophobicContact CD1-CB 4.33Å; F105-E121 HydrophobicContact CD1-CG 4.07Å; F105-E121 HydrophobicContact CE1-CB 4.32Å; F105-E121 HydrophobicContact CE1-CG 3.66Å; F105-E121 HydrophobicContact CZ-CG 4.28Å; F105-R232 HydrophobicContact CE2-CG 4.29Å; F105-R232 HydrophobicContact CZ-CB 3.9Å; F105-R232 HydrophobicContact CZ-CG 3.9Å; F105-I235 HydrophobicContact CD1-CG2 3.97Å; F105-I235 HydrophobicContact CE1-CB 3.74Å; F105-I235 HydrophobicContact CE1-CG2 3.54Å; F105-I235 HydrophobicContact CE2-CD1 4.2Å; F105-I235 HydrophobicContact CE2-CG2 4.21Å; F105-I235 HydrophobicContact CG-CG2 4.46Å; F105-I235 HydrophobicContact CZ-CB 3.69Å; F105-I235 HydrophobicContact CZ-CD1 3.96Å; F105-I235 HydrophobicContact CZ-CG1 4.42Å; F105-I235 HydrophobicContact CZ-CG2 3.67Å
106	Y	78.9	Confident	75.8	Confident	23 Å²	23	54.7 Å²	54.7	9%	0.09	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.4	143.4	-172.1	-55.4	-94.3	0	0	0	113.3	S58 L73 S74 T75 G104 S119 A120 I122	S58-Y106 PolarHBondContact OG-OH 3.29Å; L73-Y106 HydrophobicContact CB-CD1 3.75Å; L73-Y106 HydrophobicContact CB-CG 3.96Å; L73-Y106 HydrophobicContact CD1-CD1 4.26Å; L73-Y106 HydrophobicContact CD1-CD2 4.06Å; L73-Y106 HydrophobicContact CD1-CG 3.8Å; L73-Y106 HydrophobicContact CG-CG 4.37Å; S74-Y106 CarbonylContact O-C 3.55Å; S74-Y106 WeakPolarHBondContact O-CA 3.04Å; S74-Y106 WeakPolarHBondContact O-CB 3.45Å; T75-Y106 HydrophobicContact CG2-CD1 4.25Å; T75-Y106 HydrophobicContact CG2-CE1 3.99Å; G104-Y106 VanDerWaalsContact C-CE2 3.4Å; G104-Y106 WeakPolarHBondContact O-CD2 3.02Å; G104-Y106 WeakPolarHBondContact O-CE2 3.41Å; Y106-S119 CarbonylContact O-C 3.19Å; Y106-S119 WeakPolarHBondContact O-CA 3.05Å; Y106-A120 PolarHBondContact N-O 3.35Å; Y106-A120 PolarHBondContact O-N 2.8Å; Y106-I122 HydrophobicContact CD2-CD1 3.99Å; Y106-I122 HydrophobicContact CD2-CG1 4.04Å; Y106-I122 HydrophobicContact CE2-CB 4.08Å; Y106-I122 HydrophobicContact CE2-CD1 3.7Å; Y106-I122 HydrophobicContact CE2-CG1 3.89Å
107	H	81.4	Confident	75.9	Confident	68 Å²	68	55.3 Å²	55.3	32%	0.315	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	169.5	155.3	-66.4	-41	0	0	0	109.9	L73 S74 A76 V118 D239	L73-H107 CarbonylContact C-O 3.51Å; L73-H107 VanDerWaalsContact CA-O 3.32Å; L73-H107 WeakPolarHBondContact CA-O 3.06Å; L73-H107 WeakPolarHBondContact CD2-O 3.06Å; S74-H107 PolarHBondContact N-O 3.47Å; S74-H107 PolarHBondContact O-N 2.89Å; S74-H107 VanDerWaalsContact O-O 3.1Å; S74-H107 PolarHBondContact OG-O 2.78Å; A76-H107 HydrophobicContact CB-CB 4.29Å; A76-H107 WeakPolarHBondContact CB-CD2 3.34Å; H107-V118 CarbonylContact C-O 3.59Å; H107-V118 WeakPolarHBondContact CA-O 3Å; H107-D239 IonicContact CE1-OD1 2.84Å; H107-D239 PolarHBondContact CE1-OD1 3.39Å; H107-D239 IonicContact CE1-OD2 2.66Å; H107-D239 PolarHBondContact CE1-OD2 2.94Å; H107-D239 IonicContact ND1-OD2 3.76Å; H107-D239 IonicContact NE2-OD1 3.09Å
108	G	80.6	Confident	76.1	Confident	12 Å²	12	48.1 Å²	48.1	12%	0.124	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.6	-169.1	175	0	0	0	0	0	114.4	H72 V118	H72-G108 WeakPolarHBondContact O-CA 3.02Å; G108-V118 PolarHBondContact N-O 3.22Å; G108-V118 PolarHBondContact O-N 3.37Å
109	K	80.6	Confident	76.6	Confident	113 Å²	113	46.5 Å²	46.5	49%	0.491	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	154.3	176.7	-60.5	-170	166.4	-167	0	110	A71 H72 P114	A71-K109 CarbonylContact C-O 3.5Å; A71-K109 WeakPolarHBondContact CA-O 3.44Å; H72-K109 PolarHBondContact N-O 3.37Å; H72-K109 PolarHBondContact O-N 2.98Å; H72-K109 VanDerWaalsContact O-N 3.11Å; K109-P114 WeakPolarHBondContact CD-O 3.4Å; K109-P114 WeakPolarHBondContact CE-O 3.4Å; K109-P114 PolarHBondContact NZ-O 2.92Å
110	L	83.6	Confident	77.6	Confident	6 Å²	6	38.6 Å²	38.6	3%	0.031	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	145.6	170.2	-59.7	177.8	0	0	0	111.5	F69 R70 A71 D112 D113 S116 V118 I132 T134	F69-L110 HydrophobicContact CD1-CD1 4.21Å; F69-L110 HydrophobicContact CD1-CD2 4.23Å; R70-L110 CarbonylContact O-C 3.29Å; R70-L110 VanDerWaalsContact O-CA 3.24Å; R70-L110 WeakPolarHBondContact O-CA 3.41Å; R70-L110 WeakPolarHBondContact O-CD2 3.33Å; A71-L110 HydrophobicContact CB-CD2 4.05Å; L110-D112 VanDerWaalsContact CB-OD1 3.31Å; L110-D112 WeakPolarHBondContact CB-OD1 3.45Å; L110-D112 PolarHBondContact O-N 3.08Å; L110-D113 HydrophobicContact CB-CB 4.36Å; L110-D113 CarbonylContact O-C 3.54Å; L110-D113 PolarHBondContact O-N 3.15Å; L110-S116 WeakPolarHBondContact CB-OG 3.4Å; L110-S116 PolarHBondContact N-OG 3.31Å; L110-V118 HydrophobicContact CD2-CG2 4.24Å; L110-V118 HydrophobicContact CG-CG2 4.41Å; L110-I132 HydrophobicContact CD1-CG2 3.73Å; L110-I132 HydrophobicContact CD2-CG2 3.89Å; L110-I132 HydrophobicContact CG-CG2 3.97Å; L110-T134 HydrophobicContact CD1-CG2 3.67Å
111	D	81.1	Confident	78.5	Confident	28 Å²	28	37.9 Å²	37.9	15%	0.15	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.9	-29.3	174.3	-67.6	36.5	0	0	0	113.4	R70 H72 M559	R70-D111 VanDerWaalsContact C-OD1 3.29Å; R70-D111 HydrophobicContact CB-CB 4.32Å; R70-D111 WeakPolarHBondContact CD-OD2 3.24Å; R70-D111 WeakPolarHBondContact CG-OD1 3.4Å; R70-D111 WeakPolarHBondContact CG-OD2 3.47Å; R70-D111 IonicContact CZ-OD2 3.82Å; R70-D111 VanDerWaalsContact CZ-OD2 3.24Å; R70-D111 IonicContact NE-OD2 3.3Å; R70-D111 PolarHBondContact NE-OD2 3.12Å; R70-D111 IonicContact NH1-OD2 2.76Å; R70-D111 PolarHBondContact NH1-OD2 2.87Å; R70-D111 PolarHBondContact O-N 3.38Å; H72-D111 IonicContact CD2-OD1 3.54Å; H72-D111 PolarHBondContact CD2-OD1 2.86Å; H72-D111 IonicContact CG-OD1 3.62Å; H72-D111 IonicContact NE2-OD1 2.7Å; H72-D111 PolarHBondContact NE2-OD1 3.48Å; H72-D111 IonicContact NE2-OD2 3.45Å; D111-M559 WeakPolarHBondContact O-CE 3.18Å
112	D	78.9	Confident	79.3	Confident	79 Å²	79	36.8 Å²	36.8	42%	0.422	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	-5.8	-173.8	68.4	-26.8	0	0	0	113.9	R67 L110	R67-D112 IonicContact CZ-OD2 3.97Å; R67-D112 IonicContact NE-OD2 3.71Å; R67-D112 PolarHBondContact NE-OD2 2.76Å; R67-D112 VanDerWaalsContact NE-OD2 3.11Å; R67-D112 IonicContact NH2-OD1 3.76Å; R67-D112 PolarHBondContact NH2-OD1 3.43Å; R67-D112 IonicContact NH2-OD2 3.81Å; R67-D112 PolarHBondContact NH2-OD2 3.29Å; L110-D112 VanDerWaalsContact CB-OD1 3.31Å; L110-D112 WeakPolarHBondContact CB-OD1 3.45Å; L110-D112 PolarHBondContact O-N 3.08Å
113	D	77.8	Confident	79.5	Confident	29 Å²	29	36.8 Å²	36.8	16%	0.155	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	92.8	179.6	-178.3	-5.4	0	0	0	110.7	L110 L115 S116 T134	L110-D113 HydrophobicContact CB-CB 4.36Å; L110-D113 CarbonylContact O-C 3.54Å; L110-D113 PolarHBondContact O-N 3.15Å; D113-L115 PolarHBondContact O-N 3.13Å; D113-L115 VanDerWaalsContact O-N 3.14Å; D113-L115 WeakPolarHBondContact OD1-CA 3.27Å; D113-L115 WeakPolarHBondContact OD1-CB 3Å; D113-L115 PolarHBondContact OD1-N 2.99Å; D113-S116 VanDerWaalsContact O-CB 3.29Å; D113-S116 WeakPolarHBondContact O-CB 3.04Å; D113-S116 PolarHBondContact O-N 3.12Å; D113-S116 PolarHBondContact O-OG 2.02Å; D113-S116 PolarHBondContact OD1-N 2.04Å; D113-T134 VanDerWaalsContact OD2-CB 3.31Å; D113-T134 WeakPolarHBondContact OD2-CB 3.35Å
114	P	73.9	Confident	79.5	Confident	65 Å²	65	42.2 Å²	42.2	42%	0.422	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	-9.9	178.7	-22.5	34.9	0	0	0	114.9	K109 M559	K109-P114 WeakPolarHBondContact CD-O 3.4Å; K109-P114 WeakPolarHBondContact CE-O 3.4Å; K109-P114 PolarHBondContact NZ-O 2.92Å; P114-M559 VanDerWaalsContact CD-SD 3.53Å; P114-M559 HydrophobicContact CG-CE 3.87Å; P114-M559 HydrophobicContact CG-SD 3.4Å; P114-M559 WeakPolarHBondContact CG-SD 3.27Å
115	L	76.1	Confident	79.3	Confident	132 Å²	132	46.5 Å²	46.5	69%	0.691	24%	0.236	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-95.8	-13.1	174.8	-61.4	179.9	0	0	0	112.2	D113	D113-L115 PolarHBondContact O-N 3.13Å; D113-L115 VanDerWaalsContact O-N 3.14Å; D113-L115 WeakPolarHBondContact OD1-CA 3.27Å; D113-L115 WeakPolarHBondContact OD1-CB 3Å; D113-L115 PolarHBondContact OD1-N 2.99Å
116	S	82.7	Confident	79	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	154.3	172.6	68.4	0	0	0	0	112.2	L110 D113 W133	L110-S116 WeakPolarHBondContact CB-OG 3.4Å; L110-S116 PolarHBondContact N-OG 3.31Å; D113-S116 VanDerWaalsContact O-CB 3.29Å; D113-S116 WeakPolarHBondContact O-CB 3.04Å; D113-S116 PolarHBondContact O-N 3.12Å; D113-S116 PolarHBondContact O-OG 2.02Å; D113-S116 PolarHBondContact OD1-N 2.04Å; S116-W133 CarbonylContact C-O 3.51Å; S116-W133 WeakPolarHBondContact CA-O 3.36Å; S116-W133 WeakPolarHBondContact CB-O 3.39Å
117	K	84	Confident	79	Confident	101 Å²	101	46.3 Å²	46.3	44%	0.439	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	124.7	172.4	-64.5	179.2	-180	179.3	0	108.5	W133 Q247	K117-W133 HydrophobicContact CB-CB 4.4Å; K117-W133 HydrophobicContact CG-CE3 4.47Å; K117-W133 PolarHBondContact N-O 3.02Å; K117-W133 PolarHBondContact O-N 2.8Å; K117-Q247 VanDerWaalsContact NZ-CD 3.32Å
118	V	87	Confident	79.1	Confident	5 Å²	5	43 Å²	43	3%	0.03	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	133.5	173.7	-174.7	0	0	0	0	108.6	F60 A71 L73 H107 G108 L110 A120 S131 I132	F60-V118 HydrophobicContact CE1-CG1 3.84Å; F60-V118 HydrophobicContact CZ-CG1 3.98Å; A71-V118 HydrophobicContact CB-CG1 4.45Å; A71-V118 HydrophobicContact CB-CG2 4.16Å; L73-V118 HydrophobicContact CD2-CB 4.44Å; L73-V118 HydrophobicContact CD2-CG1 3.93Å; H107-V118 CarbonylContact C-O 3.59Å; H107-V118 WeakPolarHBondContact CA-O 3Å; G108-V118 PolarHBondContact N-O 3.22Å; G108-V118 PolarHBondContact O-N 3.37Å; L110-V118 HydrophobicContact CD2-CG2 4.24Å; L110-V118 HydrophobicContact CG-CG2 4.41Å; V118-A120 HydrophobicContact CG1-CB 4.24Å; V118-S131 WeakPolarHBondContact CA-O 3.4Å; V118-I132 HydrophobicContact CG1-CG1 4.12Å; V118-I132 HydrophobicContact CG2-CG1 4.24Å; V118-I132 HydrophobicContact CG2-CG2 4.28Å
119	S	87.3	Confident	79.3	Confident	16 Å²	16	42.6 Å²	42.6	11%	0.112	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	129.1	157.7	173.2	0	0	0	0	107.1	Y106 A130 S131 D239	Y106-S119 CarbonylContact O-C 3.19Å; Y106-S119 WeakPolarHBondContact O-CA 3.05Å; S119-A130 CarbonylContact O-C 3.41Å; S119-A130 WeakPolarHBondContact O-CA 2.99Å; S119-S131 PolarHBondContact N-O 3.43Å; S119-S131 PolarHBondContact O-N 2.99Å; S119-D239 WeakPolarHBondContact CB-OD2 3.32Å; S119-D239 PolarHBondContact OG-OD2 3.08Å
120	A	86.7	Confident	79.7	Confident	2 Å²	2	37.4 Å²	37.4	2%	0.017	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	140.8	-173.5	0	0	0	0	0	111.4	F60 L73 Y106 V118 T129 A130	F60-A120 HydrophobicContact CE1-CB 4.01Å; F60-A120 HydrophobicContact CZ-CB 4.5Å; L73-A120 HydrophobicContact CD1-CB 3.98Å; L73-A120 HydrophobicContact CD2-CB 3.95Å; Y106-A120 PolarHBondContact N-O 3.35Å; Y106-A120 PolarHBondContact O-N 2.8Å; V118-A120 HydrophobicContact CG1-CB 4.24Å; A120-T129 CarbonylContact C-O 2.92Å; A120-T129 WeakPolarHBondContact CA-O 3.38Å; A120-A130 HydrophobicContact CB-CB 3.97Å
121	E	83.6	Confident	80	Confident	9 Å²	9	37.5 Å²	37.5	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	120.2	174.9	-178.6	-92	144.3	0	0	106.8	G104 F105 V128 T129 R232	G104-E121 CarbonylContact O-C 3.44Å; G104-E121 WeakPolarHBondContact O-CA 3.43Å; F105-E121 HydrophobicContact CD1-CB 4.33Å; F105-E121 HydrophobicContact CD1-CG 4.07Å; F105-E121 HydrophobicContact CE1-CB 4.32Å; F105-E121 HydrophobicContact CE1-CG 3.66Å; F105-E121 HydrophobicContact CZ-CG 4.28Å; E121-V128 WeakPolarHBondContact O-CA 3.1Å; E121-T129 PolarHBondContact N-O 3.44Å; E121-T129 PolarHBondContact O-N 3.25Å; E121-T129 WeakPolarHBondContact OE2-CB 2.98Å; E121-T129 PolarHBondContact OE2-OG1 2.9Å; E121-R232 HydrophobicContact CG-CB 4.47Å; E121-R232 IonicContact OE1-CZ 2.68Å; E121-R232 VanDerWaalsContact OE1-CZ 3.28Å; E121-R232 IonicContact OE1-NE 3.69Å; E121-R232 PolarHBondContact OE1-NE 3.31Å; E121-R232 IonicContact OE1-NH2 2.66Å; E121-R232 PolarHBondContact OE1-NH2 2.76Å
122	I	80.2	Confident	80.4	Confident	16 Å²	16	36.1 Å²	36.1	8%	0.082	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	109.9	-176.9	-53	179.7	0	0	0	107.8	L38 L73 G104 Y106 T127 V128 R232	L38-I122 HydrophobicContact CD1-CG2 3.55Å; L38-I122 HydrophobicContact CD2-CD1 3.86Å; L38-I122 HydrophobicContact CD2-CG2 4.27Å; L73-I122 HydrophobicContact CD1-CD1 3.75Å; G104-I122 PolarHBondContact O-N 2.95Å; Y106-I122 HydrophobicContact CD2-CD1 3.99Å; Y106-I122 HydrophobicContact CD2-CG1 4.04Å; Y106-I122 HydrophobicContact CE2-CB 4.08Å; Y106-I122 HydrophobicContact CE2-CD1 3.7Å; Y106-I122 HydrophobicContact CE2-CG1 3.89Å; I122-T127 WeakPolarHBondContact CA-O 3.35Å; I122-V128 HydrophobicContact CG1-CG2 4.16Å; I122-V128 HydrophobicContact CG2-CG2 4.4Å; I122-R232 PolarHBondContact O-NH2 3.48Å
123	D	70.9	Confident	80.8	Confident	25 Å²	25	36.9 Å²	36.9	13%	0.134	19%	0.192	C	C	.	.			trans	-75.3	172.6	-176.6	94	-15.7	0	0	0	113.3	N125 G126 T127	D123-N125 PolarHBondContact O-N 3Å; D123-N125 VanDerWaalsContact O-N 3.12Å; D123-N125 VanDerWaalsContact OD1-CA 3.31Å; D123-N125 WeakPolarHBondContact OD1-CA 3.29Å; D123-N125 WeakPolarHBondContact OD1-CB 3.02Å; D123-N125 PolarHBondContact OD1-N 3.25Å; D123-N125 PolarHBondContact OD2-ND2 2.97Å; D123-G126 PolarHBondContact O-N 3.06Å; D123-G126 PolarHBondContact OD1-N 3.34Å; D123-T127 PolarHBondContact N-O 3.12Å; D123-T127 WeakPolarHBondContact OD1-CB 3.49Å; D123-T127 PolarHBondContact OD1-N 2.97Å; D123-T127 PolarHBondContact OD1-OG1 3.22Å
124	E	65.9	Low	81.1	Confident	142 Å²	142	35.5 Å²	35.5	66%	0.664	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	-20.3	-180	-65.3	161.3	-148.7	0	0	113.7
125	N	66.5	Low	81.1	Confident	93 Å²	93	38 Å²	38	50%	0.497	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.9	1.6	178.1	-45.7	-81.7	0	0	0	112	D123 T127	D123-N125 PolarHBondContact O-N 3Å; D123-N125 VanDerWaalsContact O-N 3.12Å; D123-N125 VanDerWaalsContact OD1-CA 3.31Å; D123-N125 WeakPolarHBondContact OD1-CA 3.29Å; D123-N125 WeakPolarHBondContact OD1-CB 3.02Å; D123-N125 PolarHBondContact OD1-N 3.25Å; D123-N125 PolarHBondContact OD2-ND2 2.97Å; N125-T127 VanDerWaalsContact C-N 3.3Å
126	G	72	Confident	81.1	Confident	26 Å²	26	32.8 Å²	32.8	27%	0.268	16%	0.164	S	C	.	.			trans	77.8	9.8	-173.4	0	0	0	0	0	114.1	L38 D123	L38-G126 WeakPolarHBondContact CD1-O 3.32Å; D123-G126 PolarHBondContact O-N 3.06Å; D123-G126 PolarHBondContact OD1-N 3.34Å
127	T	77.2	Confident	81	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.031	17%	0.168	C	C	.	.			trans	-74.8	132.7	178.2	-40.6	0	0	0	0	109.8	I122 D123 N125 P143 S153	I122-T127 WeakPolarHBondContact CA-O 3.35Å; D123-T127 PolarHBondContact N-O 3.12Å; D123-T127 WeakPolarHBondContact OD1-CB 3.49Å; D123-T127 PolarHBondContact OD1-N 2.97Å; D123-T127 PolarHBondContact OD1-OG1 3.22Å; N125-T127 VanDerWaalsContact C-N 3.3Å; T127-P143 HydrophobicContact CG2-CB 3.73Å; T127-P143 HydrophobicContact CG2-CG 3.65Å; T127-S153 PolarHBondContact OG1-O 3.48Å
128	V	83.8	Confident	80.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	122.9	-174.3	-176.8	0	0	0	0	111.3	V36 L38 F60 E121 I122 A130	V36-V128 HydrophobicContact CB-CG2 4.19Å; V36-V128 HydrophobicContact CG1-CB 4.07Å; V36-V128 HydrophobicContact CG1-CG2 3.59Å; L38-V128 HydrophobicContact CD2-CG2 3.82Å; F60-V128 HydrophobicContact CD2-CG1 4.28Å; F60-V128 HydrophobicContact CE2-CG1 4.27Å; E121-V128 WeakPolarHBondContact O-CA 3.1Å; I122-V128 HydrophobicContact CG1-CG2 4.16Å; I122-V128 HydrophobicContact CG2-CG2 4.4Å; V128-A130 HydrophobicContact CG1-CB 3.87Å
129	T	85.8	Confident	81	Confident	3 Å²	3	30.6 Å²	30.6	2%	0.018	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.3	159.3	-44.2	0	0	0	0	107.6	A120 E121 V141 R146	A120-T129 CarbonylContact C-O 2.92Å; A120-T129 WeakPolarHBondContact CA-O 3.38Å; E121-T129 PolarHBondContact N-O 3.44Å; E121-T129 PolarHBondContact O-N 3.25Å; E121-T129 WeakPolarHBondContact OE2-CB 2.98Å; E121-T129 PolarHBondContact OE2-OG1 2.9Å; T129-V141 CarbonylContact C-O 3.15Å; T129-V141 WeakPolarHBondContact CA-O 3.45Å; T129-R146 PolarHBondContact OG1-NH2 3.33Å
130	A	89.3	Confident	81.1	Confident	3 Å²	3	29.8 Å²	29.8	3%	0.025	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	149.6	-179.2	0	0	0	0	0	114.2	F60 S119 A120 V128 F140 V141	F60-A130 HydrophobicContact CE2-CB 4.15Å; F60-A130 HydrophobicContact CZ-CB 3.73Å; S119-A130 CarbonylContact O-C 3.41Å; S119-A130 WeakPolarHBondContact O-CA 2.99Å; A120-A130 HydrophobicContact CB-CB 3.97Å; V128-A130 HydrophobicContact CG1-CB 3.87Å; A130-F140 CarbonylContact O-C 3.51Å; A130-F140 WeakPolarHBondContact O-CA 3.47Å; A130-V141 HydrophobicContact CB-CB 4.17Å; A130-V141 HydrophobicContact CB-CG2 4.48Å; A130-V141 PolarHBondContact N-O 2.82Å; A130-V141 PolarHBondContact O-N 2.93Å
131	S	89.5	Confident	81.4	Confident	8 Å²	8	29.8 Å²	29.8	6%	0.056	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	117.6	173	147.2	0	0	0	0	107.4	V118 S119 H138 R240	V118-S131 WeakPolarHBondContact CA-O 3.4Å; S119-S131 PolarHBondContact N-O 3.43Å; S119-S131 PolarHBondContact O-N 2.99Å; S131-H138 VanDerWaalsContact C-NE2 3.32Å; S131-H138 VanDerWaalsContact CA-NE2 3.27Å; S131-H138 WeakPolarHBondContact CA-NE2 3.14Å; S131-H138 WeakPolarHBondContact CB-NE2 3.24Å; S131-H138 PolarHBondContact OG-NE2 3.11Å; S131-R240 VanDerWaalsContact CB-CD 3.45Å
132	I	90.3	Very high	81.6	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	98.7	-174.7	-58.7	168.8	0	0	0	107.6	F60 F62 F69 L110 V118 T134 H138 Y139 V141	F60-I132 HydrophobicContact CE2-CD1 4.18Å; F60-I132 HydrophobicContact CZ-CD1 4Å; F60-I132 HydrophobicContact CZ-CG1 4.36Å; F62-I132 HydrophobicContact CE1-CD1 3.72Å; F62-I132 HydrophobicContact CZ-CD1 3.79Å; F69-I132 HydrophobicContact CD1-CD1 4.24Å; F69-I132 HydrophobicContact CD1-CG2 4.48Å; L110-I132 HydrophobicContact CD1-CG2 3.73Å; L110-I132 HydrophobicContact CD2-CG2 3.89Å; L110-I132 HydrophobicContact CG-CG2 3.97Å; V118-I132 HydrophobicContact CG1-CG1 4.12Å; V118-I132 HydrophobicContact CG2-CG1 4.24Å; V118-I132 HydrophobicContact CG2-CG2 4.28Å; I132-T134 HydrophobicContact CG2-CG2 4.35Å; I132-H138 PolarHBondContact N-NE2 2.69Å; I132-H138 WeakPolarHBondContact O-CA 3.2Å; I132-H138 PolarHBondContact O-CD2 3.06Å; I132-Y139 HydrophobicContact CG2-CD2 4.34Å; I132-Y139 PolarHBondContact N-O 3.05Å; I132-Y139 PolarHBondContact O-N 3.25Å; I132-V141 HydrophobicContact CD1-CG2 4.5Å
133	W	86.2	Confident	81.8	Confident	94 Å²	94	28.9 Å²	28.9	36%	0.356	14%	0.144	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	122	171.9	-175.7	88.6	0	0	0	109.2	S116 K117	S116-W133 CarbonylContact C-O 3.51Å; S116-W133 WeakPolarHBondContact CA-O 3.36Å; S116-W133 WeakPolarHBondContact CB-O 3.39Å; K117-W133 HydrophobicContact CB-CB 4.4Å; K117-W133 HydrophobicContact CG-CE3 4.47Å; K117-W133 PolarHBondContact N-O 3.02Å; K117-W133 PolarHBondContact O-N 2.8Å
134	T	83.5	Confident	82.4	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.006	14%	0.138	C	C	.	.			trans	-109.1	173.7	163.7	69.5	0	0	0	0	109	L110 D113 I132 S136 E137 Y139	L110-T134 HydrophobicContact CD1-CG2 3.67Å; D113-T134 VanDerWaalsContact OD2-CB 3.31Å; D113-T134 WeakPolarHBondContact OD2-CB 3.35Å; I132-T134 HydrophobicContact CG2-CG2 4.35Å; T134-S136 VanDerWaalsContact C-N 3.29Å; T134-S136 PolarHBondContact O-N 3.26Å; T134-S136 PolarHBondContact OG1-N 2.9Å; T134-S136 PolarHBondContact OG1-OG 3.25Å; T134-E137 PolarHBondContact N-O 3.5Å; T134-E137 PolarHBondContact OG1-N 3.24Å; T134-E137 VanDerWaalsContact OG1-N 3.12Å; T134-E137 PolarHBondContact OG1-O 2.77Å; T134-Y139 HydrophobicContact CG2-CD2 4.37Å; T134-Y139 HydrophobicContact CG2-CE2 3.99Å
135	F	75.4	Confident	83.1	Confident	118 Å²	118	25 Å²	25	52%	0.518	12%	0.122	S	C	.	.	S	Bend	trans	-57.2	-46.1	173.6	-175.9	-126.9	0	0	0	111.2	R624	F135-R624 HydrophobicContact CD1-CG 3.86Å; F135-R624 HydrophobicContact CE1-CG 4.05Å; F135-R624 PolarHBondContact O-NE 2.81Å; F135-R624 PolarHBondContact O-NH1 2.98Å; F135-R624 PolarHBondContact O-NH2 3.13Å
136	S	74.7	Confident	83.5	Confident	21 Å²	21	21.9 Å²	21.9	15%	0.147	10%	0.103	C	C	.	.	S	Bend	trans	-79.2	-38.3	-175	46.8	0	0	0	0	115.6	T134 G622	T134-S136 VanDerWaalsContact C-N 3.29Å; T134-S136 PolarHBondContact O-N 3.26Å; T134-S136 PolarHBondContact OG1-N 2.9Å; T134-S136 PolarHBondContact OG1-OG 3.25Å; S136-G622 WeakPolarHBondContact CB-O 3.4Å; S136-G622 PolarHBondContact OG-O 2.85Å
137	E	80.2	Confident	83.7	Confident	19 Å²	19	20.9 Å²	20.9	9%	0.089	9%	0.092	C	C	.	.			trans	-148.3	156.5	-164.2	179.2	59.4	-89.9	0	0	110.7	T134 Y139 R160 A161 S162	T134-E137 PolarHBondContact N-O 3.5Å; T134-E137 PolarHBondContact OG1-N 3.24Å; T134-E137 VanDerWaalsContact OG1-N 3.12Å; T134-E137 PolarHBondContact OG1-O 2.77Å; E137-Y139 HydrophobicContact CB-CD2 4.44Å; E137-Y139 HydrophobicContact CB-CE1 4.39Å; E137-Y139 HydrophobicContact CB-CE2 3.73Å; E137-Y139 HydrophobicContact CG-CD1 4.09Å; E137-Y139 HydrophobicContact CG-CD2 4.16Å; E137-Y139 HydrophobicContact CG-CE1 3.68Å; E137-Y139 HydrophobicContact CG-CE2 3.76Å; E137-Y139 HydrophobicContact CG-CG 4.32Å; E137-R160 HydrophobicContact CG-CB 4.08Å; E137-R160 HydrophobicContact CG-CG 3.82Å; E137-R160 WeakPolarHBondContact OE2-CB 3.44Å; E137-A161 PolarHBondContact OE1-N 3.09Å; E137-S162 PolarHBondContact OE1-N 3.04Å; E137-S162 WeakPolarHBondContact OE2-CB 3.46Å; E137-S162 PolarHBondContact OE2-OG 3.26Å
138	H	82.8	Confident	83.6	Confident	33 Å²	33	21.3 Å²	21.3	15%	0.153	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	108.9	173.1	-163.7	166.3	0	0	0	109.2	S131 I132 F140 A161 R371	S131-H138 VanDerWaalsContact C-NE2 3.32Å; S131-H138 VanDerWaalsContact CA-NE2 3.27Å; S131-H138 WeakPolarHBondContact CA-NE2 3.14Å; S131-H138 WeakPolarHBondContact CB-NE2 3.24Å; S131-H138 PolarHBondContact OG-NE2 3.11Å; I132-H138 PolarHBondContact N-NE2 2.69Å; I132-H138 WeakPolarHBondContact O-CA 3.2Å; I132-H138 PolarHBondContact O-CD2 3.06Å; H138-F140 HydrophobicContact CB-CE2 4.07Å; H138-F140 AromaticContact CD2-CE2 3.31Å; H138-F140 WeakPolarHBondContact CD2-CE2 3.27Å; H138-F140 AromaticContact CD2-CZ 3.52Å; H138-F140 AromaticContact CE1-CZ 3.87Å; H138-F140 AromaticContact CG-CE2 3.49Å; H138-F140 VanDerWaalsContact CG-CE2 3.49Å; H138-F140 AromaticContact CG-CZ 3.81Å; H138-F140 AromaticContact ND1-CE2 3.92Å; H138-F140 AromaticContact ND1-CZ 3.79Å; H138-F140 AromaticContact NE2-CE1 3.89Å; H138-F140 AromaticContact NE2-CZ 3.47Å; H138-F140 WeakPolarHBondContact NE2-CZ 3.33Å; H138-A161 HydrophobicContact CB-CB 4.05Å; H138-A161 WeakPolarHBondContact O-CB 3.36Å; H138-A161 PolarHBondContact O-N 2.68Å; H138-R371 PolarHBondContact ND1-NH1 2.86Å
139	Y	89.9	Confident	82.8	Confident	8 Å²	8	26.8 Å²	26.8	3%	0.031	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	145.9	179.4	-49.1	-94.9	0	0	0	111	F65 F69 I132 T134 E137 Y159 R160	F65-Y139 AromaticContact CD2-CD1 3.73Å; F65-Y139 HydrophobicContact CD2-CD1 3.73Å; F65-Y139 AromaticContact CD2-CE1 3.77Å; F65-Y139 HydrophobicContact CD2-CE1 3.77Å; F65-Y139 AromaticContact CE2-CD1 3.77Å; F65-Y139 HydrophobicContact CE2-CD1 3.77Å; F65-Y139 HydrophobicContact CE2-CE1 4.28Å; F69-Y139 HydrophobicContact CE1-CD1 4.12Å; F69-Y139 AromaticContact CE1-CD2 3.64Å; F69-Y139 HydrophobicContact CE1-CD2 3.64Å; F69-Y139 HydrophobicContact CE1-CE1 4.19Å; F69-Y139 AromaticContact CE1-CE2 3.73Å; F69-Y139 HydrophobicContact CE1-CE2 3.73Å; F69-Y139 AromaticContact CE1-CG 3.84Å; F69-Y139 HydrophobicContact CE1-CG 3.84Å; F69-Y139 AromaticContact CE1-CZ 3.99Å; F69-Y139 AromaticContact CZ-CD1 3.61Å; F69-Y139 HydrophobicContact CZ-CD1 3.61Å; F69-Y139 AromaticContact CZ-CD2 3.99Å; F69-Y139 HydrophobicContact CZ-CD2 3.99Å; F69-Y139 AromaticContact CZ-CE1 3.55Å; F69-Y139 HydrophobicContact CZ-CE1 3.55Å; F69-Y139 AromaticContact CZ-CE2 3.94Å; F69-Y139 HydrophobicContact CZ-CE2 3.94Å; F69-Y139 AromaticContact CZ-CG 3.82Å; F69-Y139 HydrophobicContact CZ-CG 3.82Å; F69-Y139 AromaticContact CZ-CZ 3.7Å; I132-Y139 HydrophobicContact CG2-CD2 4.34Å; I132-Y139 PolarHBondContact N-O 3.05Å; I132-Y139 PolarHBondContact O-N 3.25Å; T134-Y139 HydrophobicContact CG2-CD2 4.37Å; T134-Y139 HydrophobicContact CG2-CE2 3.99Å; E137-Y139 HydrophobicContact CB-CD2 4.44Å; E137-Y139 HydrophobicContact CB-CE1 4.39Å; E137-Y139 HydrophobicContact CB-CE2 3.73Å; E137-Y139 HydrophobicContact CG-CD1 4.09Å; E137-Y139 HydrophobicContact CG-CD2 4.16Å; E137-Y139 HydrophobicContact CG-CE1 3.68Å; E137-Y139 HydrophobicContact CG-CE2 3.76Å; E137-Y139 HydrophobicContact CG-CG 4.32Å; Y139-Y159 WeakPolarHBondContact CA-O 3.19Å; Y139-R160 HydrophobicContact CD1-CG 3.6Å; Y139-R160 HydrophobicContact CE1-CG 3.63Å
140	F	89.7	Confident	81.8	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	138.3	178.2	-70.7	-97	0	0	0	109.1	A130 H138 A158 Y159 T370 R371	A130-F140 CarbonylContact O-C 3.51Å; A130-F140 WeakPolarHBondContact O-CA 3.47Å; H138-F140 HydrophobicContact CB-CE2 4.07Å; H138-F140 AromaticContact CD2-CE2 3.31Å; H138-F140 WeakPolarHBondContact CD2-CE2 3.27Å; H138-F140 AromaticContact CD2-CZ 3.52Å; H138-F140 AromaticContact CE1-CZ 3.87Å; H138-F140 AromaticContact CG-CE2 3.49Å; H138-F140 VanDerWaalsContact CG-CE2 3.49Å; H138-F140 AromaticContact CG-CZ 3.81Å; H138-F140 AromaticContact ND1-CE2 3.92Å; H138-F140 AromaticContact ND1-CZ 3.79Å; H138-F140 AromaticContact NE2-CE1 3.89Å; H138-F140 AromaticContact NE2-CZ 3.47Å; H138-F140 WeakPolarHBondContact NE2-CZ 3.33Å; F140-A158 CarbonylContact O-C 3.49Å; F140-A158 VanDerWaalsContact O-CA 3.26Å; F140-A158 WeakPolarHBondContact O-CA 3.1Å; F140-Y159 HydrophobicContact CB-CD1 4.01Å; F140-Y159 HydrophobicContact CB-CD2 4.11Å; F140-Y159 HydrophobicContact CB-CE1 3.53Å; F140-Y159 HydrophobicContact CB-CE2 3.64Å; F140-Y159 HydrophobicContact CB-CG 4.27Å; F140-Y159 AromaticContact CD2-CE2 3.98Å; F140-Y159 HydrophobicContact CD2-CE2 3.98Å; F140-Y159 HydrophobicContact CG-CE1 4.46Å; F140-Y159 AromaticContact CG-CE2 3.84Å; F140-Y159 HydrophobicContact CG-CE2 3.84Å; F140-Y159 AromaticContact CG-CZ 3.77Å; F140-Y159 PolarHBondContact N-O 2.79Å; F140-Y159 PolarHBondContact O-N 2.92Å; F140-T370 HydrophobicContact CD1-CG2 3.98Å; F140-T370 HydrophobicContact CE1-CG2 4.17Å; F140-R371 HydrophobicContact CD1-CB 4.25Å; F140-R371 HydrophobicContact CD2-CB 4.3Å; F140-R371 HydrophobicContact CE1-CB 3.88Å; F140-R371 HydrophobicContact CE2-CB 4Å; F140-R371 VanDerWaalsContact CE2-CD 3.47Å; F140-R371 HydrophobicContact CE2-CG 4.17Å; F140-R371 HydrophobicContact CG-CB 4.46Å; F140-R371 HydrophobicContact CZ-CB 3.77Å; F140-R371 HydrophobicContact CZ-CG 3.98Å
141	V	91.5	Very high	80.8	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	125	172.6	-175	0	0	0	0	107	V34 V36 F62 T129 A130 I132 I157	V34-V141 HydrophobicContact CG2-CG1 4.45Å; V36-V141 HydrophobicContact CG2-CG1 4.05Å; F62-V141 HydrophobicContact CE1-CG2 3.85Å; F62-V141 HydrophobicContact CE2-CG2 4.01Å; F62-V141 HydrophobicContact CZ-CG2 3.52Å; T129-V141 CarbonylContact C-O 3.15Å; T129-V141 WeakPolarHBondContact CA-O 3.45Å; A130-V141 HydrophobicContact CB-CB 4.17Å; A130-V141 HydrophobicContact CB-CG2 4.48Å; A130-V141 PolarHBondContact N-O 2.82Å; A130-V141 PolarHBondContact O-N 2.93Å; I132-V141 HydrophobicContact CD1-CG2 4.5Å; V141-I157 WeakPolarHBondContact CA-O 3.48Å
142	E	87.9	Confident	79.9	Confident	2 Å²	2	38.8 Å²	38.8	1%	0.009	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	146.8	179.8	-67.2	-174	-128.5	0	0	111.1	A144 H147 S156 I157 Y159 T370	E142-A144 PolarHBondContact O-N 3.47Å; E142-H147 IonicContact OE1-NE2 2.85Å; E142-H147 IonicContact OE2-CD2 3.19Å; E142-H147 IonicContact OE2-CE1 2.98Å; E142-H147 IonicContact OE2-NE2 3.82Å; E142-H147 PolarHBondContact OE2-NE2 2.78Å; E142-S156 CarbonylContact O-C 3.59Å; E142-S156 WeakPolarHBondContact O-CA 3.27Å; E142-S156 VanDerWaalsContact O-CB 3.29Å; E142-S156 WeakPolarHBondContact O-CB 3.35Å; E142-I157 HydrophobicContact CB-CG1 4.1Å; E142-I157 PolarHBondContact N-O 3.34Å; E142-I157 PolarHBondContact O-N 3.06Å; E142-Y159 HydrophobicContact CG-CE1 4.26Å; E142-Y159 WeakPolarHBondContact OE1-CE1 3.2Å; E142-Y159 VanDerWaalsContact OE1-CZ 3.29Å; E142-Y159 PolarHBondContact OE1-OH 3.3Å; E142-T370 VanDerWaalsContact CD-CB 3.46Å; E142-T370 WeakPolarHBondContact OE1-CB 3.37Å; E142-T370 PolarHBondContact OE1-N 2.89Å; E142-T370 PolarHBondContact OE1-OG1 3.02Å; E142-T370 PolarHBondContact OE2-OG1 3.07Å
143	P	84.6	Confident	78.8	Confident	4 Å²	4	42.7 Å²	42.7	3%	0.026	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	123.3	170.9	-23.5	31.6	0	0	0	112.5	T127 W145 R146	T127-P143 HydrophobicContact CG2-CB 3.73Å; T127-P143 HydrophobicContact CG2-CG 3.65Å; P143-W145 HydrophobicContact CB-CG 4.4Å; P143-W145 VanDerWaalsContact CB-NE1 3.31Å; P143-W145 PolarHBondContact O-N 2.71Å; P143-R146 PolarHBondContact O-N 2.9Å
144	A	84.6	Confident	78	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-63	-32.1	-173.3	0	0	0	0	0	112.6	E142 R146 H147 L148 V151 S155 I157	E142-A144 PolarHBondContact O-N 3.47Å; A144-R146 PolarHBondContact O-N 3.32Å; A144-R146 VanDerWaalsContact O-N 3.14Å; A144-H147 PolarHBondContact O-N 3Å; A144-L148 HydrophobicContact CB-CD1 4.5Å; A144-L148 WeakPolarHBondContact O-CB 3.35Å; A144-L148 PolarHBondContact O-N 3.03Å; A144-V151 HydrophobicContact CB-CB 4.25Å; A144-V151 HydrophobicContact CB-CG1 3.8Å; A144-S155 VanDerWaalsContact CB-O 3.29Å; A144-S155 WeakPolarHBondContact CB-O 3.46Å; A144-S155 PolarHBondContact N-O 3.23Å; A144-I157 HydrophobicContact CB-CG2 4.04Å
145	W	79.3	Confident	77.9	Confident	85 Å²	85	41.9 Å²	41.9	32%	0.322	22%	0.223	S	C	.	.	G	3₁₀ helix	trans	-60.6	-21.3	-179.6	69.6	-101.2	0	0	0	114.3	P143 H147 V222	P143-W145 HydrophobicContact CB-CG 4.4Å; P143-W145 VanDerWaalsContact CB-NE1 3.31Å; P143-W145 PolarHBondContact O-N 2.71Å; W145-H147 VanDerWaalsContact C-N 3.28Å; W145-H147 PolarHBondContact O-N 2.84Å; W145-V222 WeakPolarHBondContact CH2-O 3.09Å
146	R	75.5	Confident	78.5	Confident	28 Å²	28	36.3 Å²	36.3	11%	0.106	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-69.2	-28	174.8	-72.4	-157.9	-92.7	-107.8	10.7	112.7	T129 P143 A144	T129-R146 PolarHBondContact OG1-NH2 3.33Å; P143-R146 PolarHBondContact O-N 2.9Å; A144-R146 PolarHBondContact O-N 3.32Å; A144-R146 VanDerWaalsContact O-N 3.14Å
147	H	76.4	Confident	79.1	Confident	5 Å²	5	35.3 Å²	35.3	2%	0.023	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-18.5	-171.1	-60.7	-70	0	0	0	113.8	V20 L24 E142 A144 W145 I157	V20-H147 VanDerWaalsContact CG1-O 3.23Å; V20-H147 WeakPolarHBondContact CG1-O 3.32Å; L24-H147 HydrophobicContact CD1-CB 4.07Å; L24-H147 HydrophobicContact CD2-CB 4.08Å; E142-H147 IonicContact OE1-NE2 2.85Å; E142-H147 IonicContact OE2-CD2 3.19Å; E142-H147 IonicContact OE2-CE1 2.98Å; E142-H147 IonicContact OE2-NE2 3.82Å; E142-H147 PolarHBondContact OE2-NE2 2.78Å; A144-H147 PolarHBondContact O-N 3Å; W145-H147 VanDerWaalsContact C-N 3.28Å; W145-H147 PolarHBondContact O-N 2.84Å; H147-I157 HydrophobicContact CB-CD1 4.22Å; H147-I157 VanDerWaalsContact CD2-CD1 3.47Å; H147-I157 WeakPolarHBondContact CD2-CD1 3.42Å
148	L	74.1	Confident	79.6	Confident	14 Å²	14	34.4 Å²	34.4	7%	0.073	19%	0.188	C	C	.	.			trans	-134.3	138.7	-173.2	-59.4	174.6	0	0	0	110.8	L24 Y31 I33 A144 V151 I157	L24-L148 HydrophobicContact CB-CD2 4.47Å; L24-L148 HydrophobicContact CD2-CD1 4.44Å; L24-L148 HydrophobicContact CD2-CD2 3.97Å; L24-L148 HydrophobicContact CD2-CG 4.19Å; Y31-L148 HydrophobicContact CE2-CD1 4.16Å; I33-L148 HydrophobicContact CD1-CD1 4.05Å; I33-L148 HydrophobicContact CG1-CD1 4.37Å; A144-L148 HydrophobicContact CB-CD1 4.5Å; A144-L148 WeakPolarHBondContact O-CB 3.35Å; A144-L148 PolarHBondContact O-N 3.03Å; L148-V151 HydrophobicContact CB-CG2 3.55Å; L148-V151 HydrophobicContact CD1-CG2 4.13Å; L148-I157 HydrophobicContact CD1-CG2 3.96Å
149	F	67.5	Low	79.8	Confident	115 Å²	115	32.9 Å²	32.9	50%	0.504	18%	0.18	S	C	.	.	S	Bend	trans	-87.7	153.4	172.3	-76.1	-100.3	0	0	0	110.9	V20 V151	V20-F149 HydrophobicContact CB-CD2 3.67Å; V20-F149 HydrophobicContact CB-CE2 3.94Å; V20-F149 HydrophobicContact CG1-CD2 3.58Å; V20-F149 HydrophobicContact CG1-CE2 3.73Å; V20-F149 HydrophobicContact CG2-CD2 3.73Å; V20-F149 HydrophobicContact CG2-CE2 3.54Å; F149-V151 VanDerWaalsContact C-N 3.31Å; F149-V151 PolarHBondContact O-N 3.23Å
150	N	64.4	Low	79.6	Confident	161 Å²	161	34.5 Å²	34.5	86%	0.861	19%	0.187	S	C	*	.	S	Bend	trans	60.1	29.3	177.3	-59.3	-7.6	0	0	0	115.7
151	V	69	Low	79	Confident	43 Å²	43	34.6 Å²	34.6	26%	0.261	19%	0.187	S	C	.	.			trans	-100.8	151	171.5	-167.8	0	0	0	0	109.8	A144 L148 F149	A144-V151 HydrophobicContact CB-CB 4.25Å; A144-V151 HydrophobicContact CB-CG1 3.8Å; L148-V151 HydrophobicContact CB-CG2 3.55Å; L148-V151 HydrophobicContact CD1-CG2 4.13Å; F149-V151 VanDerWaalsContact C-N 3.31Å; F149-V151 PolarHBondContact O-N 3.23Å
152	S	70.5	Confident	78.1	Confident	63 Å²	63	34.9 Å²	34.9	44%	0.441	19%	0.189	S	C	.	.			trans	-55	142.5	172.5	-179.3	0	0	0	0	111.2	S154 S155	S152-S154 PolarHBondContact O-N 3.27Å; S152-S154 PolarHBondContact OG-N 3.12Å; S152-S154 PolarHBondContact OG-OG 2.7Å; S152-S155 PolarHBondContact O-N 2.73Å; S152-S155 VanDerWaalsContact O-N 3.13Å
153	S	66.9	Low	77.5	Confident	82 Å²	82	35.3 Å²	35.3	57%	0.573	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.4	175.5	52.6	0	0	0	0	113.6	T127	T127-S153 PolarHBondContact OG1-O 3.48Å
154	S	70.5	Confident	76.6	Confident	56 Å²	56	35.5 Å²	35.5	39%	0.392	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-22.7	175.8	61.8	0	0	0	0	113.9	S152	S152-S154 PolarHBondContact O-N 3.27Å; S152-S154 PolarHBondContact OG-N 3.12Å; S152-S154 PolarHBondContact OG-OG 2.7Å
155	S	81	Confident	75.4	Confident	22 Å²	22	38.3 Å²	38.3	15%	0.154	21%	0.207	C	C	.	.			trans	-73.8	141.7	-175.8	-58.7	0	0	0	0	111.5	A144 S152	A144-S155 VanDerWaalsContact CB-O 3.29Å; A144-S155 WeakPolarHBondContact CB-O 3.46Å; A144-S155 PolarHBondContact N-O 3.23Å; S152-S155 PolarHBondContact O-N 2.73Å; S152-S155 VanDerWaalsContact O-N 3.13Å
156	S	87.5	Confident	73.9	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	158	172.3	-58	0	0	0	0	110.4	I33 V34 E142	I33-S156 CarbonylContact C-O 3.52Å; I33-S156 WeakPolarHBondContact CA-O 3.06Å; V34-S156 PolarHBondContact N-O 2.86Å; V34-S156 PolarHBondContact O-N 3.11Å; E142-S156 CarbonylContact O-C 3.59Å; E142-S156 WeakPolarHBondContact O-CA 3.27Å; E142-S156 VanDerWaalsContact O-CB 3.29Å; E142-S156 WeakPolarHBondContact O-CB 3.35Å
157	I	88.2	Confident	72.2	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	139.6	158.4	58.4	169.7	0	0	0	108.6	L24 Y31 E32 I33 V141 E142 A144 H147 L148 Y159	L24-I157 HydrophobicContact CD1-CD1 4.24Å; L24-I157 HydrophobicContact CD2-CD1 3.97Å; L24-I157 HydrophobicContact CD2-CG2 4.42Å; Y31-I157 HydrophobicContact CD2-CB 4.37Å; Y31-I157 HydrophobicContact CD2-CG2 3.93Å; Y31-I157 HydrophobicContact CE2-CG2 4.28Å; E32-I157 CarbonylContact O-C 3.59Å; E32-I157 WeakPolarHBondContact O-CA 3.46Å; I33-I157 HydrophobicContact CG1-CG2 4.44Å; V141-I157 WeakPolarHBondContact CA-O 3.48Å; E142-I157 HydrophobicContact CB-CG1 4.1Å; E142-I157 PolarHBondContact N-O 3.34Å; E142-I157 PolarHBondContact O-N 3.06Å; A144-I157 HydrophobicContact CB-CG2 4.04Å; H147-I157 HydrophobicContact CB-CD1 4.22Å; H147-I157 VanDerWaalsContact CD2-CD1 3.47Å; H147-I157 WeakPolarHBondContact CD2-CD1 3.42Å; L148-I157 HydrophobicContact CD1-CG2 3.96Å; I157-Y159 HydrophobicContact CD1-CD1 4.28Å; I157-Y159 HydrophobicContact CD1-CE1 4.48Å
158	A	90.7	Very high	69.9	Low	1 Å²	1	43.5 Å²	43.5	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	136.8	164	0	0	0	0	0	109.1	Y31 E32 V34 F62 A64 F65 F140	Y31-A158 WeakPolarHBondContact CA-O 3.18Å; E32-A158 PolarHBondContact N-O 3.18Å; E32-A158 PolarHBondContact O-N 3.33Å; V34-A158 HydrophobicContact CG1-CB 3.69Å; V34-A158 HydrophobicContact CG2-CB 4.05Å; F62-A158 HydrophobicContact CE2-CB 4.09Å; A64-A158 HydrophobicContact CB-CB 3.88Å; F65-A158 HydrophobicContact CE2-CB 4.13Å; F65-A158 HydrophobicContact CZ-CB 4.12Å; F65-A158 WeakPolarHBondContact CZ-O 3.49Å; F140-A158 CarbonylContact O-C 3.49Å; F140-A158 VanDerWaalsContact O-CA 3.26Å; F140-A158 WeakPolarHBondContact O-CA 3.1Å
159	Y	86.7	Confident	67.6	Low	0 Å²	0	44.8 Å²	44.8	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	157.7	171.9	64.8	-87.1	0	0	0	111.1	L28 Y139 F140 E142 I157 L164 T370 R371	L28-Y159 HydrophobicContact CD1-CD1 3.94Å; L28-Y159 HydrophobicContact CD1-CD2 4.3Å; L28-Y159 HydrophobicContact CD1-CG 3.76Å; L28-Y159 HydrophobicContact CD2-CD2 3.57Å; L28-Y159 HydrophobicContact CD2-CE2 4.2Å; L28-Y159 HydrophobicContact CD2-CG 3.84Å; Y139-Y159 WeakPolarHBondContact CA-O 3.19Å; F140-Y159 HydrophobicContact CB-CD1 4.01Å; F140-Y159 HydrophobicContact CB-CD2 4.11Å; F140-Y159 HydrophobicContact CB-CE1 3.53Å; F140-Y159 HydrophobicContact CB-CE2 3.64Å; F140-Y159 HydrophobicContact CB-CG 4.27Å; F140-Y159 AromaticContact CD2-CE2 3.98Å; F140-Y159 HydrophobicContact CD2-CE2 3.98Å; F140-Y159 HydrophobicContact CG-CE1 4.46Å; F140-Y159 AromaticContact CG-CE2 3.84Å; F140-Y159 HydrophobicContact CG-CE2 3.84Å; F140-Y159 AromaticContact CG-CZ 3.77Å; F140-Y159 PolarHBondContact N-O 2.79Å; F140-Y159 PolarHBondContact O-N 2.92Å; E142-Y159 HydrophobicContact CG-CE1 4.26Å; E142-Y159 WeakPolarHBondContact OE1-CE1 3.2Å; E142-Y159 VanDerWaalsContact OE1-CZ 3.29Å; E142-Y159 PolarHBondContact OE1-OH 3.3Å; I157-Y159 HydrophobicContact CD1-CD1 4.28Å; I157-Y159 HydrophobicContact CD1-CE1 4.48Å; Y159-L164 HydrophobicContact CE2-CD2 4.34Å; Y159-T370 PolarHBondContact OH-N 2.88Å; Y159-R371 HydrophobicContact CE2-CB 4.38Å; Y159-R371 PolarHBondContact OH-N 2.98Å
160	R	85.4	Confident	65.7	Low	43 Å²	43	45 Å²	45	16%	0.162	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	152.7	172	-67.5	172.8	-65.2	-134.6	-2.9	110.5	H30 F65 E137 Y139 S162 D163	H30-R160 PolarHBondContact CD2-NH2 2.86Å; F65-R160 HydrophobicContact CD2-CG 4.15Å; F65-R160 HydrophobicContact CE1-CG 4.47Å; F65-R160 HydrophobicContact CE2-CG 4.03Å; F65-R160 HydrophobicContact CG-CG 4.44Å; F65-R160 HydrophobicContact CZ-CG 4.21Å; E137-R160 HydrophobicContact CG-CB 4.08Å; E137-R160 HydrophobicContact CG-CG 3.82Å; E137-R160 WeakPolarHBondContact OE2-CB 3.44Å; Y139-R160 HydrophobicContact CD1-CG 3.6Å; Y139-R160 HydrophobicContact CE1-CG 3.63Å; R160-S162 VanDerWaalsContact CB-OG 3.27Å; R160-S162 WeakPolarHBondContact CB-OG 3.3Å; R160-S162 PolarHBondContact O-N 3.22Å; R160-D163 HydrophobicContact CB-CB 4.49Å; R160-D163 WeakPolarHBondContact CB-OD2 3.38Å; R160-D163 IonicContact CZ-OD1 3.96Å; R160-D163 IonicContact CZ-OD2 3.75Å; R160-D163 IonicContact NE-OD1 3.76Å; R160-D163 IonicContact NE-OD2 3.33Å; R160-D163 PolarHBondContact NE-OD2 2.92Å; R160-D163 VanDerWaalsContact NH2-CG 3.33Å; R160-D163 IonicContact NH2-OD1 1.93Å; R160-D163 PolarHBondContact NH2-OD1 3.31Å; R160-D163 IonicContact NH2-OD2 2.8Å; R160-D163 PolarHBondContact NH2-OD2 3.47Å; R160-D163 PolarHBondContact O-N 2.77Å
161	A	75.8	Confident	64	Low	1 Å²	1	46.9 Å²	46.9	1%	0.008	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-58.1	-32.2	166.1	0	0	0	0	0	111.5	E137 H138 D163 L164	E137-A161 PolarHBondContact OE1-N 3.09Å; H138-A161 HydrophobicContact CB-CB 4.05Å; H138-A161 WeakPolarHBondContact O-CB 3.36Å; H138-A161 PolarHBondContact O-N 2.68Å; A161-D163 PolarHBondContact O-N 2.86Å; A161-L164 PolarHBondContact O-N 3.34Å
162	S	73.2	Confident	62	Low	7 Å²	7	49.4 Å²	49.4	5%	0.049	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-62.5	-25.5	174.2	58.8	0	0	0	0	115	K29 E137 R160	K29-S162 PolarHBondContact NZ-O 2.93Å; E137-S162 PolarHBondContact OE1-N 3.04Å; E137-S162 WeakPolarHBondContact OE2-CB 3.46Å; E137-S162 PolarHBondContact OE2-OG 3.26Å; R160-S162 VanDerWaalsContact CB-OG 3.27Å; R160-S162 WeakPolarHBondContact CB-OG 3.3Å; R160-S162 PolarHBondContact O-N 3.22Å
163	D	75.3	Confident	60.4	Low	11 Å²	11	51.2 Å²	51.2	6%	0.059	30%	0.297	C	S	.	.	G	3₁₀ helix	trans	-85	-4	-178.3	-66.6	-47.9	0	0	0	113.3	L28 K29 H30 R160 A161 I165	L28-D163 CarbonylContact C-O 3.57Å; L28-D163 WeakPolarHBondContact CA-O 3.49Å; K29-D163 HydrophobicContact CB-CB 4.41Å; K29-D163 WeakPolarHBondContact CB-O 3.36Å; K29-D163 VanDerWaalsContact CG-O 3.32Å; K29-D163 WeakPolarHBondContact CG-O 3.4Å; K29-D163 PolarHBondContact N-O 2.75Å; H30-D163 HydrophobicContact CB-CB 4.41Å; H30-D163 WeakPolarHBondContact O-CB 3.16Å; R160-D163 HydrophobicContact CB-CB 4.49Å; R160-D163 WeakPolarHBondContact CB-OD2 3.38Å; R160-D163 IonicContact CZ-OD1 3.96Å; R160-D163 IonicContact CZ-OD2 3.75Å; R160-D163 IonicContact NE-OD1 3.76Å; R160-D163 IonicContact NE-OD2 3.33Å; R160-D163 PolarHBondContact NE-OD2 2.92Å; R160-D163 VanDerWaalsContact NH2-CG 3.33Å; R160-D163 IonicContact NH2-OD1 1.93Å; R160-D163 PolarHBondContact NH2-OD1 3.31Å; R160-D163 IonicContact NH2-OD2 2.8Å; R160-D163 PolarHBondContact NH2-OD2 3.47Å; R160-D163 PolarHBondContact O-N 2.77Å; A161-D163 PolarHBondContact O-N 2.86Å; D163-I165 PolarHBondContact O-N 3.25Å
164	L	66	Low	58.7	Low	9 Å²	9	51.8 Å²	51.8	5%	0.047	29%	0.291	C	S	.	.	B	Isolated β-bridge	trans	-63.7	134.1	176.8	-70.5	162.6	0	0	0	111.6	M27 L28 K29 Y159 A161 V369 R371 S414	M27-L164 WeakPolarHBondContact O-CA 3.49Å; L28-L164 HydrophobicContact CD2-CD2 3.59Å; L28-L164 HydrophobicContact CD2-CG 4.15Å; K29-L164 PolarHBondContact NZ-O 3.02Å; Y159-L164 HydrophobicContact CE2-CD2 4.34Å; A161-L164 PolarHBondContact O-N 3.34Å; L164-V369 HydrophobicContact CD2-CG2 3.52Å; L164-R371 HydrophobicContact CD1-CB 4.03Å; L164-R371 HydrophobicContact CD1-CG 3.77Å; L164-S414 VanDerWaalsContact CD1-O 3.28Å; L164-S414 WeakPolarHBondContact CD1-O 3.37Å
165	I	58.8	Low	57.2	Low	58 Å²	58	49.3 Å²	49.3	30%	0.297	27%	0.273	S	S	.	.			trans	-91.6	109.4	174.4	-63.8	173.9	0	0	0	107.6	Q25 M27 L28 K29 D163 N167	Q25-I165 VanDerWaalsContact O-CD1 3.3Å; Q25-I165 WeakPolarHBondContact O-CD1 3.34Å; M27-I165 PolarHBondContact O-N 3.35Å; L28-I165 VanDerWaalsContact C-CD1 3.47Å; K29-I165 HydrophobicContact CB-CG1 4.37Å; K29-I165 HydrophobicContact CG-CD1 4.27Å; K29-I165 HydrophobicContact CG-CG1 3.54Å; D163-I165 PolarHBondContact O-N 3.25Å; I165-N167 PolarHBondContact O-N 3.39Å
166	A	49.1	Very low	54.9	Low	60 Å²	60	48.3 Å²	48.3	50%	0.496	27%	0.266	S	S	.	.			trans	-57.9	128.4	162.4	0	0	0	0	0	108.6	A168	A166-A168 PolarHBondContact O-N 2.91Å
167	N	38.6	Very low	52.3	Low	73 Å²	73	49.5 Å²	49.5	39%	0.39	28%	0.276	S	S	.	.			trans	-71.7	67.6	177.4	-113.4	-63.2	0	0	0	110.3	I165 S169 R173	I165-N167 PolarHBondContact O-N 3.39Å; N167-S169 PolarHBondContact O-N 3.37Å; N167-R173 PolarHBondContact OD1-NH1 3.47Å
168	A	28.1	Very low	49.8	Very low	94 Å²	94	52.7 Å²	52.7	78%	0.777	30%	0.295	S	S	*	.			trans	-71.2	68.8	-178.5	0	0	0	0	0	111.5	A166	A166-A168 PolarHBondContact O-N 2.91Å
169	S	27.3	Very low	47.1	Very low	41 Å²	41	56.2 Å²	56.2	29%	0.287	31%	0.314	S	S	.	.			trans	-64.4	148.2	156.4	-138.2	0	0	0	0	108.5	N167 W171 R173	N167-S169 PolarHBondContact O-N 3.37Å; S169-W171 PolarHBondContact O-N 2.66Å; S169-R173 VanDerWaalsContact CB-NH2 3.28Å; S169-R173 PolarHBondContact OG-NE 3.08Å; S169-R173 PolarHBondContact OG-NH2 2.76Å
170	P	27.6	Very low	44.5	Very low	121 Å²	121	61.2 Å²	61.2	79%	0.786	35%	0.349	S	S	*	.	S	Bend	trans	-65.8	13.5	172.8	-22.3	34.3	0	0	0	115.4
171	W	26.9	Very low	41.9	Very low	199 Å²	199	63.5 Å²	63.5	75%	0.754	37%	0.372	S	S	*	.	S	Bend	trans	-138.4	131.1	-172	-62.6	94.5	0	0	0	108.4	S169 R173	S169-W171 PolarHBondContact O-N 2.66Å; W171-R173 PolarHBondContact O-N 3.2Å; W171-R173 VanDerWaalsContact O-N 3.13Å
172	P	28.1	Very low	39.7	Very low	97 Å²	97	70 Å²	70	63%	0.63	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-59.8	117	177.6	-19.9	31.2	0	0	0	110.3	Y411	P172-Y411 HydrophobicContact CB-CD1 3.84Å; P172-Y411 HydrophobicContact CB-CE1 3.39Å; P172-Y411 HydrophobicContact CB-CE2 4.32Å; P172-Y411 HydrophobicContact CB-CG 4.47Å
173	R	36.1	Very low	37.8	Very low	100 Å²	100	78.9 Å²	78.9	38%	0.377	44%	0.44	S	S	.	.	P	Polyproline II helix	trans	-91.8	127.5	177	-66.5	-173.5	-176.9	161.7	7.6	109.5	N167 S169 W171 F175	N167-R173 PolarHBondContact OD1-NH1 3.47Å; S169-R173 VanDerWaalsContact CB-NH2 3.28Å; S169-R173 PolarHBondContact OG-NE 3.08Å; S169-R173 PolarHBondContact OG-NH2 2.76Å; W171-R173 PolarHBondContact O-N 3.2Å; W171-R173 VanDerWaalsContact O-N 3.13Å; R173-F175 PolarHBondContact O-N 3.17Å
174	Q	31.5	Very low	35.5	Very low	95 Å²	95	83 Å²	83	44%	0.444	47%	0.47	S	S	.	.	B	Isolated β-bridge	trans	-78.9	119	-178.2	-175.8	165.3	5.4	0	0	109.9	C176 G321 V322	Q174-C176 WeakPolarHBondContact CG-O 3.33Å; Q174-C176 PolarHBondContact NE2-O 3.45Å; Q174-G321 CarbonylContact O-C 3.54Å; Q174-G321 WeakPolarHBondContact O-CA 3.29Å; Q174-V322 PolarHBondContact O-N 3.01Å
175	F	38.2	Very low	33.7	Very low	4 Å²	4	89.6 Å²	89.6	2%	0.018	51%	0.505	C	S	.	.	S	Bend	trans	-81.1	-34.3	-175	-176.2	-117.7	0	0	0	112.2	R173 V322 L323 V376 H379 S412	R173-F175 PolarHBondContact O-N 3.17Å; F175-V322 CarbonylContact O-C 3.54Å; F175-V322 VanDerWaalsContact O-CA 3.31Å; F175-V322 WeakPolarHBondContact O-CA 3.19Å; F175-L323 HydrophobicContact CD2-CD1 4.17Å; F175-L323 HydrophobicContact CE2-CD1 3.8Å; F175-L323 PolarHBondContact O-N 2.89Å; F175-V376 HydrophobicContact CE1-CG2 4.17Å; F175-V376 HydrophobicContact CE2-CG2 3.63Å; F175-V376 HydrophobicContact CZ-CB 4.04Å; F175-V376 HydrophobicContact CZ-CG1 4.47Å; F175-V376 HydrophobicContact CZ-CG2 3.3Å; F175-H379 HydrophobicContact CE1-CB 4.34Å; F175-S412 VanDerWaalsContact CD2-CB 3.42Å; F175-S412 WeakPolarHBondContact CD2-OG 3.23Å
176	C	33.6	Very low	32.3	Very low	0 Å²	0	93.8 Å²	93.8	0%	0	53%	0.528	C	S	.	.	B	Isolated β-bridge	trans	-136.4	133.8	-179	-56.8	0	0	0	0	108.9	Q174 H379 E380	Q174-C176 WeakPolarHBondContact CG-O 3.33Å; Q174-C176 PolarHBondContact NE2-O 3.45Å; C176-H379 PolarHBondContact SG-CD2 2.89Å; C176-H379 PolarHBondContact SG-NE2 3.44Å; C176-E380 PolarHBondContact SG-OE1 3.35Å
177	A	33.7	Very low	31.3	Very low	25 Å²	25	95.3 Å²	95.3	21%	0.207	53%	0.531	C	S	.	.			trans	-80.4	165.3	163	0	0	0	0	0	109.2	V291 V322 L325	A177-V291 HydrophobicContact CB-CG1 4.41Å; A177-V322 HydrophobicContact CB-CG2 4.45Å; A177-L325 VanDerWaalsContact C-CD1 3.43Å; A177-L325 HydrophobicContact CB-CD1 4.03Å; A177-L325 WeakPolarHBondContact O-CD1 3.41Å
178	V	34.5	Very low	30.8	Very low	67 Å²	67	98.4 Å²	98.4	41%	0.406	55%	0.547	S	S	.	.			trans	-134.6	119.3	161.9	177.3	0	0	0	0	106.3	I328	V178-I328 HydrophobicContact CG1-CD1 4.03Å; V178-I328 HydrophobicContact CG2-CD1 4.31Å
179	D	34.5	Very low	30.7	Very low	75 Å²	75	101.8 Å²	101.8	40%	0.401	55%	0.547	S	S	.	.			trans	-92.1	103.8	177.4	-172.2	7.9	0	0	0	110.5	S181	D179-S181 WeakPolarHBondContact OD1-CA 3.41Å; D179-S181 VanDerWaalsContact OD1-CB 3.24Å; D179-S181 WeakPolarHBondContact OD1-CB 3.12Å; D179-S181 PolarHBondContact OD1-N 2.86Å; D179-S181 PolarHBondContact OD1-OG 3.36Å
180	S	32.1	Very low	30.8	Very low	106 Å²	106	106.2 Å²	106.2	74%	0.741	57%	0.572	S	S	*	*			trans	-93.2	0.8	172.3	56.8	0	0	0	0	113.1	N182	S180-N182 PolarHBondContact O-N 2.8Å
181	S	29.9	Very low	30.8	Very low	91 Å²	91	106.4 Å²	106.4	64%	0.636	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	45.1	-165.9	73.9	0	0	0	0	115.4	D179	D179-S181 WeakPolarHBondContact OD1-CA 3.41Å; D179-S181 VanDerWaalsContact OD1-CB 3.24Å; D179-S181 WeakPolarHBondContact OD1-CB 3.12Å; D179-S181 PolarHBondContact OD1-N 2.86Å; D179-S181 PolarHBondContact OD1-OG 3.36Å
182	N	30.3	Very low	30.8	Very low	137 Å²	137	102.3 Å²	102.3	73%	0.733	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.8	20	159	-129.5	-14.4	0	0	0	117.3	S180	S180-N182 PolarHBondContact O-N 2.8Å
183	Y	33	Very low	30.8	Very low	193 Å²	193	106 Å²	106	76%	0.757	57%	0.573	S	S	*	*			trans	-122.2	73.6	170.7	-113	-86.1	0	0	0	112.3
184	S	28.1	Very low	30.3	Very low	98 Å²	98	112.8 Å²	112.8	69%	0.685	60%	0.598	S	S	*	*			trans	-81.2	137.1	160.7	44.3	0	0	0	0	110.4
185	N	27.5	Very low	30.2	Very low	148 Å²	148	116.4 Å²	116.4	79%	0.791	62%	0.615	S	S	*	*			trans	66.9	82.1	169.5	-53.9	-27.2	0	0	0	118.1
186	L	30.4	Very low	29.6	Very low	146 Å²	146	122.5 Å²	122.5	76%	0.764	65%	0.653	S	S	*	*			trans	-147.4	82.7	131.5	-144.2	86.2	0	0	0	111.4	D188	L186-D188 PolarHBondContact O-N 2.67Å
187	T	26.8	Very low	29.6	Very low	91 Å²	91	127.7 Å²	127.7	56%	0.558	68%	0.684	S	S	*	*			trans	-65.6	118	162.5	47.1	0	0	0	0	109.1	N656	T187-N656 HydrophobicContact CG2-CB 4.15Å
188	D	28.3	Very low	29.5	Very low	139 Å²	139	134.4 Å²	134.4	74%	0.743	71%	0.712	S	S	*	*			trans	-159	140.6	149.1	-110.6	-31	0	0	0	113.2	L186 V190	L186-D188 PolarHBondContact O-N 2.67Å; D188-V190 PolarHBondContact O-N 3.46Å
189	H	27.2	Very low	29.4	Very low	164 Å²	164	136.7 Å²	136.7	76%	0.759	73%	0.731	S	S	*	*			trans	-56.8	112.1	-167.5	-62.7	-86.6	0	0	0	114.6	I191	H189-I191 HydrophobicContact CB-CG1 4.28Å; H189-I191 PolarHBondContact O-N 3.43Å
190	V	28.7	Very low	29.6	Very low	134 Å²	134	139.1 Å²	139.1	81%	0.812	75%	0.748	S	S	*	*			trans	-78.7	84.4	155.7	-176.5	0	0	0	0	108.2	D188 S192	D188-V190 PolarHBondContact O-N 3.46Å; V190-S192 PolarHBondContact O-N 3.12Å
191	I	27.6	Very low	30	Very low	125 Å²	125	138.9 Å²	138.9	64%	0.641	75%	0.746	S	S	*	*			trans	-55.5	126.2	163.9	-66.2	171.9	0	0	0	107.6	H189 K193	H189-I191 HydrophobicContact CB-CG1 4.28Å; H189-I191 PolarHBondContact O-N 3.43Å; I191-K193 HydrophobicContact CG2-CG 4.31Å; I191-K193 PolarHBondContact O-N 3.22Å
192	S	27.1	Very low	31	Very low	114 Å²	114	138.7 Å²	138.7	80%	0.797	73%	0.732	S	S	*	*			trans	-65.2	80.8	167.4	-177.1	0	0	0	0	110	V190	V190-S192 PolarHBondContact O-N 3.12Å
193	K	26.7	Very low	32.1	Very low	175 Å²	175	137.7 Å²	137.7	76%	0.761	73%	0.725	S	S	*	*			trans	-81.3	113.6	157.1	-86.8	-175.6	173.3	178.6	0	106.5	I191 Q195	I191-K193 HydrophobicContact CG2-CG 4.31Å; I191-K193 PolarHBondContact O-N 3.22Å; K193-Q195 PolarHBondContact O-N 3.12Å
194	R	26.6	Very low	33.8	Very low	241 Å²	241	130.3 Å²	130.3	91%	0.909	71%	0.708	S	S	*	*			trans	-54.4	87.9	158.3	-77.3	175.9	166.3	166.7	-5.8	108.7	T196	R194-T196 PolarHBondContact O-N 3.16Å
195	Q	28.4	Very low	36.6	Very low	171 Å²	171	129 Å²	129	80%	0.799	69%	0.69	S	S	*	*			trans	-72.4	118.4	153.6	-81.3	-176.9	-43.5	0	0	106	K193 V197	K193-Q195 PolarHBondContact O-N 3.12Å; Q195-V197 PolarHBondContact O-N 2.95Å
196	T	26.3	Very low	39.6	Very low	133 Å²	133	123 Å²	123	82%	0.816	66%	0.658	S	S	*	*			trans	-60.5	100.4	170	43.7	0	0	0	0	108.1	R194 Q198	R194-T196 PolarHBondContact O-N 3.16Å; T196-Q198 VanDerWaalsContact C-N 3.33Å; T196-Q198 PolarHBondContact O-N 2.03Å
197	V	34.5	Very low	42.6	Very low	108 Å²	108	116.5 Å²	116.5	66%	0.655	62%	0.623	S	S	*	*			trans	-69.2	94.4	175.5	-179	0	0	0	0	107.6	Q195	Q195-V197 PolarHBondContact O-N 2.95Å
198	Q	30.9	Very low	45.9	Very low	166 Å²	166	112.1 Å²	112.1	78%	0.776	60%	0.596	S	S	*	*			trans	-59.2	135.9	160.3	-82.4	179.1	-38.2	0	0	108	T196 V200	T196-Q198 VanDerWaalsContact C-N 3.33Å; T196-Q198 PolarHBondContact O-N 2.03Å; Q198-V200 PolarHBondContact O-N 3.17Å
199	S	33.4	Very low	49.2	Very low	116 Å²	116	105.7 Å²	105.7	81%	0.811	56%	0.562	S	S	*	*			trans	-63.6	97.3	175	53.4	0	0	0	0	109.9	S201	S199-S201 PolarHBondContact O-N 2.04Å; S199-S201 VanDerWaalsContact O-N 3.09Å
200	V	38.7	Very low	52.5	Low	126 Å²	126	97.9 Å²	97.9	76%	0.764	53%	0.526	S	S	*	.			trans	-69.8	104.6	170.2	-179.3	0	0	0	0	107.4	Q198	Q198-V200 PolarHBondContact O-N 3.17Å
201	S	38.6	Very low	55.8	Low	101 Å²	101	92.3 Å²	92.3	71%	0.706	49%	0.491	S	S	*	.			trans	-62.1	134.3	169.2	55.8	0	0	0	0	109.5	S199 I203	S199-S201 PolarHBondContact O-N 2.04Å; S199-S201 VanDerWaalsContact O-N 3.09Å; S201-I203 PolarHBondContact O-N 2.8Å
202	W	51.2	Low	59.2	Low	86 Å²	86	86.3 Å²	86.3	33%	0.326	46%	0.46	S	S	.	.			trans	-47.4	135.7	-179.7	-84.7	105.9	0	0	0	114.5	K205 N206 F259 V262	W202-K205 WeakPolarHBondContact CZ3-O 3.13Å; W202-N206 HydrophobicContact CH2-CB 4.5Å; W202-F259 HydrophobicContact CD2-CD1 4.47Å; W202-F259 AromaticContact CE2-CD1 3.47Å; W202-F259 VanDerWaalsContact CE2-CD1 3.47Å; W202-F259 HydrophobicContact CH2-CD1 4.14Å; W202-F259 HydrophobicContact CZ2-CB 3.95Å; W202-F259 AromaticContact CZ2-CD1 3.29Å; W202-F259 HydrophobicContact CZ2-CD1 3.29Å; W202-F259 HydrophobicContact CZ2-CE1 4Å; W202-F259 AromaticContact CZ2-CG 3.92Å; W202-F259 HydrophobicContact CZ2-CG 3.92Å; W202-F259 AromaticContact NE1-CD1 3.56Å; W202-V262 HydrophobicContact CH2-CG2 4.16Å; W202-V262 HydrophobicContact CZ2-CG2 3.66Å
203	I	54.9	Low	62.6	Low	116 Å²	116	80.9 Å²	80.9	60%	0.595	42%	0.422	S	S	*	.			trans	-100.6	87.8	154.9	-54	174.3	0	0	0	106.9	S201 K205	S201-I203 PolarHBondContact O-N 2.8Å; I203-K205 PolarHBondContact O-N 3.21Å
204	G	67.1	Low	65.9	Low	39 Å²	39	72.6 Å²	72.6	40%	0.402	39%	0.386	S	S	.	.	S	Bend	trans	58.1	-29.9	161	0	0	0	0	0	121.7	N206	G204-N206 PolarHBondContact O-N 3Å; G204-N206 VanDerWaalsContact O-N 3.11Å
205	K	87	Confident	69.3	Low	71 Å²	71	61.2 Å²	61.2	31%	0.309	34%	0.343	S	S	.	.			trans	-91.8	71.2	-154.7	-68.7	172.7	168.7	-171.2	0	114.6	W202 I203 F443 V444 E445	W202-K205 WeakPolarHBondContact CZ3-O 3.13Å; I203-K205 PolarHBondContact O-N 3.21Å; K205-F443 HydrophobicContact CB-CB 4Å; K205-F443 WeakPolarHBondContact CD-O 3.24Å; K205-F443 WeakPolarHBondContact O-CB 3.33Å; K205-V444 CarbonylContact C-O 3.57Å; K205-V444 VanDerWaalsContact C-O 3.26Å; K205-V444 VanDerWaalsContact CA-O 3.27Å; K205-V444 WeakPolarHBondContact CA-O 3.43Å; K205-E445 HydrophobicContact CG-CG 3.84Å
206	N	91	Very high	72.4	Confident	20 Å²	20	54 Å²	54	11%	0.107	31%	0.309	C	S	.	.			trans	-94.9	8.5	-175.2	68	-21.6	0	0	0	115.5	W202 G204 N261 V262 G263 V444 E446	W202-N206 HydrophobicContact CH2-CB 4.5Å; G204-N206 PolarHBondContact O-N 3Å; G204-N206 VanDerWaalsContact O-N 3.11Å; N206-N261 WeakPolarHBondContact CB-O 3.22Å; N206-N261 PolarHBondContact ND2-ND2 2.77Å; N206-N261 PolarHBondContact ND2-O 3.27Å; N206-V262 WeakPolarHBondContact O-CA 3.27Å; N206-G263 PolarHBondContact O-N 3.17Å; N206-V444 PolarHBondContact N-O 3.06Å; N206-E446 PolarHBondContact ND2-OE2 2.02Å; N206-E446 WeakPolarHBondContact OD1-CB 3.19Å; N206-E446 PolarHBondContact OD1-N 3.46Å
207	R	93.7	Very high	75.6	Confident	10 Å²	10	48.2 Å²	48.2	4%	0.038	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122	-178.1	-62.6	-72.4	167.7	-100	13	113.3	N261 V265 F443 V444 E446	R207-N261 PolarHBondContact NH1-O 3.35Å; R207-N261 PolarHBondContact NH2-OD1 2.91Å; R207-V265 HydrophobicContact CB-CB 4.22Å; R207-V265 HydrophobicContact CB-CG1 3.87Å; R207-F443 WeakPolarHBondContact O-CA 3.44Å; R207-V444 HydrophobicContact CB-CG2 3.92Å; R207-V444 PolarHBondContact N-O 2.79Å; R207-V444 PolarHBondContact O-N 3.17Å; R207-E446 HydrophobicContact CG-CB 3.95Å; R207-E446 IonicContact CZ-OE1 3.72Å; R207-E446 IonicContact CZ-OE2 3.84Å; R207-E446 IonicContact NE-OE1 3.92Å; R207-E446 IonicContact NH2-OE1 2.7Å; R207-E446 PolarHBondContact NH2-OE1 2.84Å; R207-E446 IonicContact NH2-OE2 3.14Å; R207-E446 PolarHBondContact NH2-OE2 3.24Å
208	C	96.6	Very high	78.4	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	110.8	170	178.5	0	0	0	0	109.7	L210 G263 F264 V265 C308 W385 F443	C208-L210 PolarHBondContact O-N 2.86Å; C208-G263 WeakPolarHBondContact CB-O 3.35Å; C208-G263 PolarHBondContact N-O 3.36Å; C208-F264 HydrophobicContact CB-CD1 3.75Å; C208-F264 HydrophobicContact CB-CE1 4.05Å; C208-F264 WeakPolarHBondContact O-CA 3.47Å; C208-V265 PolarHBondContact O-N 3.29Å; C208-C308 VanDerWaalsContact CA-SG 3.56Å; C208-C308 HydrophobicContact CB-CB 3.87Å; C208-C308 WeakPolarHBondContact CB-SG 3.39Å; C208-C308 WeakPolarHBondContact SG-CB 3.44Å; C208-C308 CovalentContact SG-SG 2.04Å; C208-C308 PolarHBondContact SG-SG 3.46Å; C208-W385 HydrophobicContact CB-CZ2 4.09Å; C208-F443 HydrophobicContact CB-CD1 4.3Å; C208-F443 HydrophobicContact CB-CE1 3.77Å; C208-F443 HydrophobicContact CB-CE2 4.15Å; C208-F443 HydrophobicContact CB-CZ 3.69Å
209	S	96.2	Very high	81.3	Confident	4 Å²	4	35.6 Å²	35.6	3%	0.028	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	126.1	-180	59.6	0	0	0	0	112.9	V265 C308 L309	S209-V265 CarbonylContact C-O 3.6Å; S209-V265 WeakPolarHBondContact CA-O 3.06Å; S209-C308 VanDerWaalsContact N-CB 3.33Å; S209-C308 WeakPolarHBondContact O-CA 3.31Å; S209-C308 WeakPolarHBondContact O-CB 3.47Å; S209-C308 PolarHBondContact O-N 2.8Å; S209-C308 PolarHBondContact OG-N 2.99Å; S209-L309 PolarHBondContact O-N 2.89Å
210	L	98	Very high	83.9	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	141.6	-176	-62.8	-175.6	0	0	0	112.8	C208 L212 I238 F264 V265 K267 K268 L309 F381	C208-L210 PolarHBondContact O-N 2.86Å; L210-L212 HydrophobicContact CB-CD2 3.85Å; L210-L212 HydrophobicContact CD1-CD2 3.97Å; L210-L212 HydrophobicContact CG-CD2 4.5Å; L210-I238 HydrophobicContact CD1-CD1 4.04Å; L210-I238 HydrophobicContact CD1-CG1 4.42Å; L210-I238 HydrophobicContact CD1-CG2 3.91Å; L210-F264 HydrophobicContact CD1-CB 3.75Å; L210-F264 HydrophobicContact CD1-CD1 3.79Å; L210-F264 HydrophobicContact CD1-CG 3.89Å; L210-F264 HydrophobicContact CD2-CD1 3.62Å; L210-F264 HydrophobicContact CD2-CE1 4.09Å; L210-F264 HydrophobicContact CG-CB 4.1Å; L210-F264 HydrophobicContact CG-CD1 3.8Å; L210-F264 HydrophobicContact CG-CG 4.29Å; L210-V265 PolarHBondContact N-O 3.16Å; L210-K267 PolarHBondContact O-N 2.88Å; L210-K268 PolarHBondContact O-N 2.96Å; L210-L309 HydrophobicContact CD2-CB 3.75Å; L210-L309 HydrophobicContact CD2-CD1 4.39Å; L210-F381 HydrophobicContact CD1-CE2 4.03Å; L210-F381 HydrophobicContact CD1-CZ 3.9Å; L210-F381 HydrophobicContact CD2-CZ 4.37Å
211	K	98	Very high	85.7	Confident	16 Å²	16	31.7 Å²	31.7	7%	0.07	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	117.4	157.4	171.9	-178	162.2	-169	0	108.7	V213 K268 E302 F307 L309 V310 H311	K211-V213 HydrophobicContact CG-CG2 4.39Å; K211-K268 CarbonylContact C-O 3.47Å; K211-K268 WeakPolarHBondContact CA-O 3.36Å; K211-K268 HydrophobicContact CB-CB 4.42Å; K211-K268 HydrophobicContact CG-CB 4.31Å; K211-K268 HydrophobicContact CG-CG 4.49Å; K211-E302 VanDerWaalsContact CE-OE2 3.28Å; K211-E302 WeakPolarHBondContact CE-OE2 3.44Å; K211-E302 PolarHBondContact NZ-O 3.47Å; K211-E302 IonicContact NZ-OE2 3.34Å; K211-E302 PolarHBondContact NZ-OE2 2.71Å; K211-F307 HydrophobicContact CB-CB 4.34Å; K211-F307 HydrophobicContact CB-CD1 3.59Å; K211-F307 HydrophobicContact CB-CD2 3.86Å; K211-F307 HydrophobicContact CB-CE1 3.76Å; K211-F307 HydrophobicContact CB-CE2 4.05Å; K211-F307 HydrophobicContact CB-CG 3.64Å; K211-F307 HydrophobicContact CB-CZ 4Å; K211-F307 HydrophobicContact CD-CD2 3.92Å; K211-F307 HydrophobicContact CD-CE2 3.67Å; K211-F307 HydrophobicContact CD-CZ 4.07Å; K211-F307 HydrophobicContact CG-CE2 4.36Å; K211-F307 HydrophobicContact CG-CZ 4.35Å; K211-L309 PolarHBondContact N-O 3.04Å; K211-V310 HydrophobicContact CB-CB 4.41Å; K211-V310 HydrophobicContact CB-CG1 4.08Å; K211-V310 HydrophobicContact CB-CG2 4.15Å; K211-V310 HydrophobicContact CD-CG1 3.69Å; K211-V310 HydrophobicContact CD-CG2 4.18Å; K211-V310 HydrophobicContact CG-CG1 3.9Å; K211-V310 CarbonylContact O-C 3.49Å; K211-V310 VanDerWaalsContact O-CA 3.28Å; K211-V310 WeakPolarHBondContact O-CA 3.39Å; K211-H311 PolarHBondContact O-N 2.81Å
212	L	98.3	Very high	87.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	142.4	175.6	-36.2	176.8	0	0	0	109.3	L210 L234 I238 I266 K268 I269 I270 H311 F313	L210-L212 HydrophobicContact CB-CD2 3.85Å; L210-L212 HydrophobicContact CD1-CD2 3.97Å; L210-L212 HydrophobicContact CG-CD2 4.5Å; L212-L234 HydrophobicContact CB-CD1 4.41Å; L212-L234 HydrophobicContact CD1-CB 4.01Å; L212-I238 HydrophobicContact CD1-CD1 4.4Å; L212-I238 HydrophobicContact CD1-CG1 3.59Å; L212-I238 HydrophobicContact CD2-CD1 4.13Å; L212-I238 HydrophobicContact CD2-CG1 4.13Å; L212-I266 HydrophobicContact CD1-CD1 4.16Å; L212-I266 HydrophobicContact CD1-CG1 4.34Å; L212-I266 HydrophobicContact CD1-CG2 4.22Å; L212-I266 HydrophobicContact CG-CG2 4.35Å; L212-K268 PolarHBondContact N-O 2.97Å; L212-I269 HydrophobicContact CB-CG1 4.09Å; L212-I269 HydrophobicContact CD1-CD1 4Å; L212-I269 HydrophobicContact CD1-CG1 3.91Å; L212-I269 HydrophobicContact CG-CG1 4.11Å; L212-I269 CarbonylContact O-C 3.49Å; L212-I269 WeakPolarHBondContact O-CA 3.36Å; L212-I270 PolarHBondContact O-N 3.33Å; L212-H311 HydrophobicContact CD2-CB 4.47Å; L212-F313 HydrophobicContact CB-CD2 4.46Å; L212-F313 HydrophobicContact CB-CE2 4.29Å; L212-F313 HydrophobicContact CD1-CE2 4.49Å; L212-F313 HydrophobicContact CD2-CE2 4.26Å
213	V	98.4	Very high	88.8	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	122.1	176.4	-175.8	0	0	0	0	108.3	K211 I270 Y282 F298 H311 L312 F313	K211-V213 HydrophobicContact CG-CG2 4.39Å; V213-I270 CarbonylContact C-O 3.6Å; V213-I270 VanDerWaalsContact CA-O 3.31Å; V213-I270 WeakPolarHBondContact CA-O 3.5Å; V213-I270 HydrophobicContact CG1-CB 4.42Å; V213-I270 HydrophobicContact CG2-CB 4.3Å; V213-Y282 HydrophobicContact CG1-CE2 3.98Å; V213-F298 HydrophobicContact CB-CE2 3.8Å; V213-F298 HydrophobicContact CB-CZ 4.09Å; V213-F298 HydrophobicContact CG1-CE2 4.15Å; V213-F298 HydrophobicContact CG2-CE2 3.8Å; V213-F298 HydrophobicContact CG2-CZ 3.95Å; V213-H311 PolarHBondContact N-O 2.83Å; V213-L312 HydrophobicContact CB-CD1 4.3Å; V213-L312 HydrophobicContact CG1-CD1 4.14Å; V213-L312 CarbonylContact O-C 3.39Å; V213-L312 WeakPolarHBondContact O-CA 3.42Å; V213-F313 PolarHBondContact O-N 3.42Å
214	A	97.1	Very high	89.6	Confident	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	129.8	167.8	0	0	0	0	0	109.9	F218 T230 L234 I270 V271 H272 F313	A214-F218 HydrophobicContact CB-CB 4.25Å; A214-F218 HydrophobicContact CB-CD1 3.6Å; A214-F218 HydrophobicContact CB-CE1 4.3Å; A214-F218 HydrophobicContact CB-CG 4.19Å; A214-T230 HydrophobicContact CB-CG2 3.83Å; A214-L234 HydrophobicContact CB-CD1 4.19Å; A214-I270 PolarHBondContact N-O 3.02Å; A214-V271 HydrophobicContact CB-CG2 4.38Å; A214-H272 PolarHBondContact O-CD2 2.73Å; A214-H272 PolarHBondContact O-N 2.82Å; A214-F313 WeakPolarHBondContact CA-O 3.24Å
215	D	96.4	Very high	90.1	Very high	2 Å²	2	20.9 Å²	20.9	1%	0.011	11%	0.109	C	C	.	.			trans	-75.5	168.9	170.3	87.1	-8.8	0	0	0	112.2	R217 F218 H219 N283 L312 F313 T314	D215-R217 PolarHBondContact O-N 3Å; D215-R217 VanDerWaalsContact O-N 3.11Å; D215-R217 WeakPolarHBondContact OD1-CA 3.43Å; D215-R217 VanDerWaalsContact OD1-CB 3.3Å; D215-R217 WeakPolarHBondContact OD1-CB 3.16Å; D215-R217 PolarHBondContact OD1-N 2.79Å; D215-R217 IonicContact OD2-NH1 2.75Å; D215-F218 PolarHBondContact O-N 3.49Å; D215-F218 PolarHBondContact OD1-N 2.7Å; D215-H219 PolarHBondContact O-N 2.78Å; D215-N283 WeakPolarHBondContact CA-OD1 3.38Å; D215-N283 WeakPolarHBondContact CB-OD1 3.39Å; D215-L312 HydrophobicContact CB-CD1 4.33Å; D215-F313 PolarHBondContact N-O 3.25Å; D215-T314 VanDerWaalsContact CG-OG1 3.29Å; D215-T314 WeakPolarHBondContact OD2-CB 3.39Å; D215-T314 PolarHBondContact OD2-OG1 3.03Å
216	Y	95	Very high	89.6	Confident	21 Å²	21	24.2 Å²	24.2	8%	0.082	12%	0.12	C	C	.	.	H	α-helix	trans	-61	-21.5	-179.1	83.7	-84.5	0	0	0	113.4	R220 H272 P275 N283	Y216-R220 VanDerWaalsContact O-CB 3.26Å; Y216-R220 WeakPolarHBondContact O-CB 3.21Å; Y216-R220 PolarHBondContact O-N 3.04Å; Y216-R220 VanDerWaalsContact O-N 3.17Å; Y216-H272 WeakPolarHBondContact CA-O 3.43Å; Y216-P275 HydrophobicContact CD1-CB 3.74Å; Y216-P275 HydrophobicContact CD1-CG 4.5Å; Y216-P275 HydrophobicContact CD2-CB 4.28Å; Y216-P275 HydrophobicContact CD2-CG 4.17Å; Y216-P275 HydrophobicContact CE1-CB 3.8Å; Y216-P275 HydrophobicContact CE2-CB 4.31Å; Y216-P275 HydrophobicContact CE2-CG 4.22Å; Y216-P275 HydrophobicContact CG-CB 4Å; Y216-P275 HydrophobicContact CG-CG 4.31Å; Y216-N283 WeakPolarHBondContact CD1-OD1 3.34Å; Y216-N283 PolarHBondContact N-OD1 2.83Å
217	R	92.8	Very high	89.1	Confident	11 Å²	11	24.4 Å²	24.4	4%	0.042	12%	0.121	C	C	.	.	H	α-helix	trans	-81.5	-44.2	179.7	-51.4	175.1	-177.6	140.8	-7.7	109.7	D215 R220 D221 S284 Y285 A286 A315	D215-R217 PolarHBondContact O-N 3Å; D215-R217 VanDerWaalsContact O-N 3.11Å; D215-R217 WeakPolarHBondContact OD1-CA 3.43Å; D215-R217 VanDerWaalsContact OD1-CB 3.3Å; D215-R217 WeakPolarHBondContact OD1-CB 3.16Å; D215-R217 PolarHBondContact OD1-N 2.79Å; D215-R217 IonicContact OD2-NH1 2.75Å; R217-R220 PolarHBondContact O-N 2.77Å; R217-D221 WeakPolarHBondContact O-CB 3.06Å; R217-D221 PolarHBondContact O-N 2.94Å; R217-S284 PolarHBondContact NH2-O 3.24Å; R217-Y285 PolarHBondContact NH2-O 2.8Å; R217-A286 PolarHBondContact NH2-O 2.03Å; R217-A315 HydrophobicContact CB-CB 3.89Å
218	F	93.8	Very high	88.1	Confident	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-61	-46.5	173	-171.1	-83.6	0	0	0	111.1	A214 D215 R220 D221 V222 G223 T230 Y233 L234 F313 V360	A214-F218 HydrophobicContact CB-CB 4.25Å; A214-F218 HydrophobicContact CB-CD1 3.6Å; A214-F218 HydrophobicContact CB-CE1 4.3Å; A214-F218 HydrophobicContact CB-CG 4.19Å; D215-F218 PolarHBondContact O-N 3.49Å; D215-F218 PolarHBondContact OD1-N 2.7Å; F218-R220 VanDerWaalsContact C-N 3.34Å; F218-R220 PolarHBondContact O-N 3.3Å; F218-D221 PolarHBondContact O-N 2.89Å; F218-V222 HydrophobicContact CD1-CB 4.27Å; F218-V222 HydrophobicContact CD2-CB 4.44Å; F218-V222 HydrophobicContact CD2-CG2 3.9Å; F218-V222 HydrophobicContact CE1-CB 4.12Å; F218-V222 HydrophobicContact CE1-CG1 4.19Å; F218-V222 HydrophobicContact CE2-CB 4.3Å; F218-V222 HydrophobicContact CE2-CG1 4.4Å; F218-V222 HydrophobicContact CE2-CG2 3.89Å; F218-V222 HydrophobicContact CG-CB 4.43Å; F218-V222 HydrophobicContact CG-CG2 4.26Å; F218-V222 HydrophobicContact CZ-CB 4.15Å; F218-V222 HydrophobicContact CZ-CG1 3.98Å; F218-V222 HydrophobicContact CZ-CG2 4.24Å; F218-V222 WeakPolarHBondContact O-CA 3.38Å; F218-V222 WeakPolarHBondContact O-CB 3.06Å; F218-V222 PolarHBondContact O-N 3.18Å; F218-G223 PolarHBondContact O-N 2.9Å; F218-T230 HydrophobicContact CD1-CG2 3.76Å; F218-T230 HydrophobicContact CE1-CG2 3.92Å; F218-Y233 HydrophobicContact CE1-CD1 4.2Å; F218-Y233 HydrophobicContact CE2-CE1 4.32Å; F218-Y233 AromaticContact CZ-CD1 3.59Å; F218-Y233 HydrophobicContact CZ-CD1 3.59Å; F218-Y233 AromaticContact CZ-CE1 3.71Å; F218-Y233 HydrophobicContact CZ-CE1 3.71Å; F218-L234 HydrophobicContact CE1-CD2 3.77Å; F218-L234 HydrophobicContact CE1-CG 4.06Å; F218-L234 HydrophobicContact CZ-CD2 3.68Å; F218-L234 HydrophobicContact CZ-CG 4.39Å; F218-F313 HydrophobicContact CD1-CB 4.45Å; F218-F313 HydrophobicContact CD2-CB 3.67Å; F218-F313 HydrophobicContact CE1-CB 4.43Å; F218-F313 HydrophobicContact CE2-CB 3.64Å; F218-F313 HydrophobicContact CE2-CD1 4.18Å; F218-F313 HydrophobicContact CE2-CG 4.25Å; F218-F313 HydrophobicContact CG-CB 4.08Å; F218-F313 HydrophobicContact CZ-CB 4.03Å; F218-F313 HydrophobicContact CZ-CG 4.44Å; F218-V360 HydrophobicContact CD2-CG1 4.31Å; F218-V360 HydrophobicContact CD2-CG2 3.81Å; F218-V360 HydrophobicContact CE2-CB 4.48Å; F218-V360 HydrophobicContact CE2-CG1 3.71Å; F218-V360 HydrophobicContact CE2-CG2 3.98Å
219	H	90.6	Very high	87	Confident	9 Å²	9	26.2 Å²	26.2	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-55.7	-46.5	174.6	173.6	57.8	0	0	0	112.5	D215 G223 G224 S225 T230 V271 H272	D215-H219 PolarHBondContact O-N 2.78Å; H219-G223 CarbonylContact O-C 3.37Å; H219-G223 VanDerWaalsContact O-C 3.25Å; H219-G223 WeakPolarHBondContact O-CA 3.38Å; H219-G223 PolarHBondContact O-N 2.74Å; H219-G224 PolarHBondContact O-N 3.23Å; H219-S225 PolarHBondContact CE1-O 3.08Å; H219-S225 WeakPolarHBondContact O-CA 3.41Å; H219-S225 PolarHBondContact O-N 3.25Å; H219-T230 HydrophobicContact CB-CG2 4.47Å; H219-T230 PolarHBondContact ND1-OG1 3.17Å; H219-V271 HydrophobicContact CB-CG1 3.88Å; H219-H272 WeakPolarHBondContact CB-O 3.22Å
220	R	87.5	Confident	86.4	Confident	123 Å²	123	26 Å²	26	46%	0.464	14%	0.135	S	C	.	.	H	α-helix	trans	-68.1	-49.2	177.9	-173.5	-167.5	69.6	-158.2	-7.3	112.7	Y216 R217 F218 G224 S225	Y216-R220 VanDerWaalsContact O-CB 3.26Å; Y216-R220 WeakPolarHBondContact O-CB 3.21Å; Y216-R220 PolarHBondContact O-N 3.04Å; Y216-R220 VanDerWaalsContact O-N 3.17Å; R217-R220 PolarHBondContact O-N 2.77Å; F218-R220 VanDerWaalsContact C-N 3.34Å; F218-R220 PolarHBondContact O-N 3.3Å; R220-G224 WeakPolarHBondContact O-CA 3.33Å; R220-G224 PolarHBondContact O-N 2.91Å; R220-S225 PolarHBondContact O-N 3.1Å
221	D	78.4	Confident	85.8	Confident	36 Å²	36	26 Å²	26	19%	0.193	14%	0.135	C	C	.	.	H	α-helix	trans	-89.7	-29.7	-165.6	-67.6	-10.7	0	0	0	114.1	R217 F218 A315 R361	R217-D221 WeakPolarHBondContact O-CB 3.06Å; R217-D221 PolarHBondContact O-N 2.94Å; F218-D221 PolarHBondContact O-N 2.89Å; D221-A315 HydrophobicContact CB-CB 3.91Å; D221-R361 IonicContact OD2-NE 3.8Å; D221-R361 IonicContact OD2-NH2 3.94Å
222	V	80.5	Confident	84.9	Confident	10 Å²	10	25.4 Å²	25.4	6%	0.061	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-41.4	178	-175.5	0	0	0	0	111.1	W145 F218 G224 Y233 V360	W145-V222 WeakPolarHBondContact CH2-O 3.09Å; F218-V222 HydrophobicContact CD1-CB 4.27Å; F218-V222 HydrophobicContact CD2-CB 4.44Å; F218-V222 HydrophobicContact CD2-CG2 3.9Å; F218-V222 HydrophobicContact CE1-CB 4.12Å; F218-V222 HydrophobicContact CE1-CG1 4.19Å; F218-V222 HydrophobicContact CE2-CB 4.3Å; F218-V222 HydrophobicContact CE2-CG1 4.4Å; F218-V222 HydrophobicContact CE2-CG2 3.89Å; F218-V222 HydrophobicContact CG-CB 4.43Å; F218-V222 HydrophobicContact CG-CG2 4.26Å; F218-V222 HydrophobicContact CZ-CB 4.15Å; F218-V222 HydrophobicContact CZ-CG1 3.98Å; F218-V222 HydrophobicContact CZ-CG2 4.24Å; F218-V222 WeakPolarHBondContact O-CA 3.38Å; F218-V222 WeakPolarHBondContact O-CB 3.06Å; F218-V222 PolarHBondContact O-N 3.18Å; V222-G224 VanDerWaalsContact C-N 3.32Å; V222-Y233 HydrophobicContact CG1-CD1 3.72Å; V222-Y233 HydrophobicContact CG1-CD2 3.67Å; V222-Y233 HydrophobicContact CG1-CE1 3.78Å; V222-Y233 HydrophobicContact CG1-CE2 3.73Å; V222-Y233 HydrophobicContact CG1-CG 3.65Å; V222-V360 HydrophobicContact CG2-CB 4.26Å; V222-V360 HydrophobicContact CG2-CG2 3.29Å
223	G	72.6	Confident	84.2	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	-81.5	-5.3	178	0	0	0	0	0	114.7	F218 H219 S225 R226 T230	F218-G223 PolarHBondContact O-N 2.9Å; H219-G223 CarbonylContact O-C 3.37Å; H219-G223 VanDerWaalsContact O-C 3.25Å; H219-G223 WeakPolarHBondContact O-CA 3.38Å; H219-G223 PolarHBondContact O-N 2.74Å; G223-S225 PolarHBondContact O-N 2.94Å; G223-R226 WeakPolarHBondContact O-CB 3Å; G223-R226 PolarHBondContact O-N 2.86Å; G223-T230 WeakPolarHBondContact CA-OG1 3.46Å
224	G	71.8	Confident	83.9	Confident	32 Å²	32	25.7 Å²	25.7	33%	0.33	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.1	29.4	-176.6	0	0	0	0	0	113.4	H219 R220 V222 R226	H219-G224 PolarHBondContact O-N 3.23Å; R220-G224 WeakPolarHBondContact O-CA 3.33Å; R220-G224 PolarHBondContact O-N 2.91Å; V222-G224 VanDerWaalsContact C-N 3.32Å; G224-R226 PolarHBondContact O-N 3.02Å
225	S	77.9	Confident	83.4	Confident	74 Å²	74	25.9 Å²	25.9	52%	0.517	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.2	24.5	-170.2	-51.1	0	0	0	0	114.5	H219 R220 G223	H219-S225 PolarHBondContact CE1-O 3.08Å; H219-S225 WeakPolarHBondContact O-CA 3.41Å; H219-S225 PolarHBondContact O-N 3.25Å; R220-S225 PolarHBondContact O-N 3.1Å; G223-S225 PolarHBondContact O-N 2.94Å
226	R	77.9	Confident	82.9	Confident	141 Å²	141	25.9 Å²	25.9	53%	0.532	14%	0.135	S	C	.	.			trans	-112.2	125	173.9	-63.8	179.8	179	-173.3	-2.2	110.4	G223 G224 T229 T230	G223-R226 WeakPolarHBondContact O-CB 3Å; G223-R226 PolarHBondContact O-N 2.86Å; G224-R226 PolarHBondContact O-N 3.02Å; R226-T229 WeakPolarHBondContact CB-OG1 3.45Å; R226-T229 PolarHBondContact O-N 2.85Å; R226-T230 PolarHBondContact O-N 2.81Å; R226-T230 PolarHBondContact O-OG1 3.1Å
227	V	79.6	Confident	82.6	Confident	23 Å²	23	24.9 Å²	24.9	14%	0.139	13%	0.131	C	C	.	.	H	α-helix	trans	-66.7	-46.9	-175	178	0	0	0	0	110.8	E98 T229 T230 I231 V271 T273	E98-V227 HydrophobicContact CG-CG1 3.75Å; V227-T229 PolarHBondContact O-N 2.78Å; V227-T230 WeakPolarHBondContact O-CB 3.43Å; V227-T230 PolarHBondContact O-N 3.37Å; V227-T230 VanDerWaalsContact O-N 3.11Å; V227-I231 HydrophobicContact CG1-CD1 3.63Å; V227-I231 HydrophobicContact CG1-CG1 4.32Å; V227-I231 WeakPolarHBondContact O-CG1 3.5Å; V227-I231 PolarHBondContact O-N 2.87Å; V227-V271 HydrophobicContact CG1-CB 4.23Å; V227-V271 HydrophobicContact CG1-CG1 4.48Å; V227-V271 HydrophobicContact CG1-CG2 4.34Å; V227-T273 HydrophobicContact CG2-CG2 3.61Å
228	A	72.7	Confident	82.7	Confident	27 Å²	27	24.4 Å²	24.4	22%	0.223	13%	0.129	C	C	.	.	H	α-helix	trans	-53.7	-52.5	174.4	0	0	0	0	0	112.3	T230 I231 R232	A228-T230 VanDerWaalsContact C-N 3.29Å; A228-T230 PolarHBondContact O-N 2.82Å; A228-I231 PolarHBondContact O-N 2.84Å; A228-R232 WeakPolarHBondContact O-CB 3.35Å; A228-R232 VanDerWaalsContact O-CG 3.23Å; A228-R232 WeakPolarHBondContact O-CG 3.36Å; A228-R232 PolarHBondContact O-N 3.45Å
229	T	74.6	Confident	82.4	Confident	21 Å²	21	25.2 Å²	25.2	13%	0.129	13%	0.133	C	C	.	.	H	α-helix	trans	-58.5	-38.8	176.4	-49.2	0	0	0	0	112.5	R226 V227 Y233	R226-T229 WeakPolarHBondContact CB-OG1 3.45Å; R226-T229 PolarHBondContact O-N 2.85Å; V227-T229 PolarHBondContact O-N 2.78Å; T229-Y233 WeakPolarHBondContact O-CB 3.46Å; T229-Y233 PolarHBondContact O-N 2.65Å
230	T	82.9	Confident	82.3	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.5	-49.7	176.2	-48.8	0	0	0	0	111.2	A214 F218 H219 G223 R226 V227 A228 R232 L234 V271	A214-T230 HydrophobicContact CB-CG2 3.83Å; F218-T230 HydrophobicContact CD1-CG2 3.76Å; F218-T230 HydrophobicContact CE1-CG2 3.92Å; H219-T230 HydrophobicContact CB-CG2 4.47Å; H219-T230 PolarHBondContact ND1-OG1 3.17Å; G223-T230 WeakPolarHBondContact CA-OG1 3.46Å; R226-T230 PolarHBondContact O-N 2.81Å; R226-T230 PolarHBondContact O-OG1 3.1Å; V227-T230 WeakPolarHBondContact O-CB 3.43Å; V227-T230 PolarHBondContact O-N 3.37Å; V227-T230 VanDerWaalsContact O-N 3.11Å; A228-T230 VanDerWaalsContact C-N 3.29Å; A228-T230 PolarHBondContact O-N 2.82Å; T230-R232 VanDerWaalsContact C-N 3.32Å; T230-R232 PolarHBondContact O-N 3.25Å; T230-L234 WeakPolarHBondContact O-CG 3.36Å; T230-L234 PolarHBondContact O-N 3.02Å; T230-V271 HydrophobicContact CG2-CG1 3.89Å; T230-V271 HydrophobicContact CG2-CG2 3.9Å
231	I	84.6	Confident	82.5	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-64	-42	-179	-66.1	167.8	0	0	0	110.1	F84 A86 E98 V100 V227 A228 L234 I235 I269 V271	F84-I231 HydrophobicContact CZ-CG2 4.34Å; A86-I231 HydrophobicContact CB-CD1 3.88Å; E98-I231 HydrophobicContact CB-CD1 4.28Å; V100-I231 HydrophobicContact CG1-CG2 4.18Å; V100-I231 HydrophobicContact CG2-CB 4.36Å; V100-I231 HydrophobicContact CG2-CD1 3.56Å; V100-I231 HydrophobicContact CG2-CG2 4.13Å; V227-I231 HydrophobicContact CG1-CD1 3.63Å; V227-I231 HydrophobicContact CG1-CG1 4.32Å; V227-I231 WeakPolarHBondContact O-CG1 3.5Å; V227-I231 PolarHBondContact O-N 2.87Å; A228-I231 PolarHBondContact O-N 2.84Å; I231-L234 WeakPolarHBondContact O-CB 3.24Å; I231-L234 PolarHBondContact O-N 3.25Å; I231-I235 HydrophobicContact CG2-CD1 3.82Å; I231-I235 HydrophobicContact CG2-CG1 4.41Å; I231-I235 WeakPolarHBondContact O-CG1 3.42Å; I231-I235 PolarHBondContact O-N 2.81Å; I231-I269 HydrophobicContact CG1-CG2 3.9Å; I231-I269 HydrophobicContact CG2-CD1 3.87Å; I231-I269 HydrophobicContact CG2-CG2 4.45Å; I231-V271 HydrophobicContact CD1-CG2 4.26Å; I231-V271 HydrophobicContact CG1-CG2 3.64Å
232	R	79.6	Confident	83.2	Confident	4 Å²	4	18.4 Å²	18.4	2%	0.015	11%	0.105	C	C	.	.	H	α-helix	trans	-67.4	-40.2	-177.3	-69.4	171.9	57.3	105.8	8.7	113	V100 D101 F105 E121 I122 A228 T230 L234 I235 S236	V100-R232 HydrophobicContact CG1-CG 4.06Å; D101-R232 PolarHBondContact O-NH1 2.77Å; D101-R232 VanDerWaalsContact O-NH1 3.13Å; F105-R232 HydrophobicContact CE2-CG 4.29Å; F105-R232 HydrophobicContact CZ-CB 3.9Å; F105-R232 HydrophobicContact CZ-CG 3.9Å; E121-R232 HydrophobicContact CG-CB 4.47Å; E121-R232 IonicContact OE1-CZ 2.68Å; E121-R232 VanDerWaalsContact OE1-CZ 3.28Å; E121-R232 IonicContact OE1-NE 3.69Å; E121-R232 PolarHBondContact OE1-NE 3.31Å; E121-R232 IonicContact OE1-NH2 2.66Å; E121-R232 PolarHBondContact OE1-NH2 2.76Å; I122-R232 PolarHBondContact O-NH2 3.48Å; A228-R232 WeakPolarHBondContact O-CB 3.35Å; A228-R232 VanDerWaalsContact O-CG 3.23Å; A228-R232 WeakPolarHBondContact O-CG 3.36Å; A228-R232 PolarHBondContact O-N 3.45Å; T230-R232 VanDerWaalsContact C-N 3.32Å; T230-R232 PolarHBondContact O-N 3.25Å; R232-L234 VanDerWaalsContact C-N 3.32Å; R232-L234 PolarHBondContact O-N 3.36Å; R232-I235 PolarHBondContact O-N 3.32Å; R232-S236 WeakPolarHBondContact O-CB 3.48Å; R232-S236 PolarHBondContact O-N 3.16Å
233	Y	83.7	Confident	83.7	Confident	6 Å²	6	20.2 Å²	20.2	2%	0.024	12%	0.118	C	C	.	.	H	α-helix	trans	-57.7	-44.7	170.9	-177.6	-82.6	0	0	0	111.7	F218 V222 T229 S236 L237	F218-Y233 HydrophobicContact CE1-CD1 4.2Å; F218-Y233 HydrophobicContact CE2-CE1 4.32Å; F218-Y233 AromaticContact CZ-CD1 3.59Å; F218-Y233 HydrophobicContact CZ-CD1 3.59Å; F218-Y233 AromaticContact CZ-CE1 3.71Å; F218-Y233 HydrophobicContact CZ-CE1 3.71Å; V222-Y233 HydrophobicContact CG1-CD1 3.72Å; V222-Y233 HydrophobicContact CG1-CD2 3.67Å; V222-Y233 HydrophobicContact CG1-CE1 3.78Å; V222-Y233 HydrophobicContact CG1-CE2 3.73Å; V222-Y233 HydrophobicContact CG1-CG 3.65Å; T229-Y233 WeakPolarHBondContact O-CB 3.46Å; T229-Y233 PolarHBondContact O-N 2.65Å; Y233-S236 PolarHBondContact O-N 3.1Å; Y233-L237 HydrophobicContact CE1-CB 4.48Å; Y233-L237 HydrophobicContact CE1-CD1 3.73Å; Y233-L237 WeakPolarHBondContact O-CB 3.33Å; Y233-L237 PolarHBondContact O-N 2.79Å
234	L	91	Very high	84.6	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.3	-43.4	178.8	-69.8	176.4	0	0	0	112.8	L212 A214 F218 T230 I231 R232 L237 I238 I269 F313	L212-L234 HydrophobicContact CB-CD1 4.41Å; L212-L234 HydrophobicContact CD1-CB 4.01Å; A214-L234 HydrophobicContact CB-CD1 4.19Å; F218-L234 HydrophobicContact CE1-CD2 3.77Å; F218-L234 HydrophobicContact CE1-CG 4.06Å; F218-L234 HydrophobicContact CZ-CD2 3.68Å; F218-L234 HydrophobicContact CZ-CG 4.39Å; T230-L234 WeakPolarHBondContact O-CG 3.36Å; T230-L234 PolarHBondContact O-N 3.02Å; I231-L234 WeakPolarHBondContact O-CB 3.24Å; I231-L234 PolarHBondContact O-N 3.25Å; R232-L234 VanDerWaalsContact C-N 3.32Å; R232-L234 PolarHBondContact O-N 3.36Å; L234-L237 PolarHBondContact O-N 2.99Å; L234-I238 WeakPolarHBondContact O-CG1 3.08Å; L234-I238 PolarHBondContact O-N 2.84Å; L234-I269 HydrophobicContact CB-CD1 4.2Å; L234-I269 HydrophobicContact CD1-CG2 3.75Å; L234-F313 HydrophobicContact CD2-CB 4.01Å; L234-F313 HydrophobicContact CD2-CD1 4.12Å; L234-F313 HydrophobicContact CD2-CD2 3.33Å; L234-F313 HydrophobicContact CD2-CE1 4.45Å; L234-F313 HydrophobicContact CD2-CE2 3.71Å; L234-F313 HydrophobicContact CD2-CG 3.55Å; L234-F313 HydrophobicContact CD2-CZ 4.26Å
235	I	88.1	Confident	85.7	Confident	3 Å²	3	20.1 Å²	20.1	2%	0.015	11%	0.11	C	C	.	.	H	α-helix	trans	-61.9	-47.1	176.3	-64.6	167.8	0	0	0	110.1	V79 L80 F84 L102 F105 I231 R232 L237 I238 D239 I266 I269	V79-I235 HydrophobicContact CG2-CG2 4.14Å; L80-I235 HydrophobicContact CD2-CD1 4.04Å; L80-I235 HydrophobicContact CD2-CG1 4.04Å; L80-I235 HydrophobicContact CD2-CG2 4.13Å; F84-I235 HydrophobicContact CZ-CD1 4.4Å; L102-I235 HydrophobicContact CD2-CD1 3.71Å; F105-I235 HydrophobicContact CD1-CG2 3.97Å; F105-I235 HydrophobicContact CE1-CB 3.74Å; F105-I235 HydrophobicContact CE1-CG2 3.54Å; F105-I235 HydrophobicContact CE2-CD1 4.2Å; F105-I235 HydrophobicContact CE2-CG2 4.21Å; F105-I235 HydrophobicContact CG-CG2 4.46Å; F105-I235 HydrophobicContact CZ-CB 3.69Å; F105-I235 HydrophobicContact CZ-CD1 3.96Å; F105-I235 HydrophobicContact CZ-CG1 4.42Å; F105-I235 HydrophobicContact CZ-CG2 3.67Å; I231-I235 HydrophobicContact CG2-CD1 3.82Å; I231-I235 HydrophobicContact CG2-CG1 4.41Å; I231-I235 WeakPolarHBondContact O-CG1 3.42Å; I231-I235 PolarHBondContact O-N 2.81Å; R232-I235 PolarHBondContact O-N 3.32Å; I235-L237 VanDerWaalsContact C-N 3.33Å; I235-L237 PolarHBondContact O-N 2.85Å; I235-I238 PolarHBondContact O-N 2.87Å; I235-D239 WeakPolarHBondContact O-CB 3.1Å; I235-D239 PolarHBondContact O-N 3.34Å; I235-I266 HydrophobicContact CB-CD1 4.3Å; I235-I266 HydrophobicContact CG1-CD1 4Å; I235-I266 HydrophobicContact CG2-CD1 4.42Å; I235-I269 HydrophobicContact CD1-CD1 4.34Å; I235-I269 HydrophobicContact CG1-CD1 3.74Å
236	S	84.8	Confident	86.3	Confident	3 Å²	3	18.1 Å²	18.1	2%	0.021	9%	0.094	C	C	.	.	H	α-helix	trans	-61	-38.6	178.3	-173.1	0	0	0	0	112.7	R232 Y233 R240	R232-S236 WeakPolarHBondContact O-CB 3.48Å; R232-S236 PolarHBondContact O-N 3.16Å; Y233-S236 PolarHBondContact O-N 3.1Å; S236-R240 PolarHBondContact O-N 3.26Å; S236-R240 PolarHBondContact O-NH1 2.97Å; S236-R240 PolarHBondContact OG-NH1 3.39Å
237	L	90.1	Very high	86.9	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-66.8	-49.3	175.6	-175.2	158.5	0	0	0	111.8	Y233 L234 I235 D239 R240 V241 F313 A373 T377	Y233-L237 HydrophobicContact CE1-CB 4.48Å; Y233-L237 HydrophobicContact CE1-CD1 3.73Å; Y233-L237 WeakPolarHBondContact O-CB 3.33Å; Y233-L237 PolarHBondContact O-N 2.79Å; L234-L237 PolarHBondContact O-N 2.99Å; I235-L237 VanDerWaalsContact C-N 3.33Å; I235-L237 PolarHBondContact O-N 2.85Å; L237-D239 VanDerWaalsContact C-N 3.28Å; L237-D239 PolarHBondContact O-N 3.02Å; L237-R240 VanDerWaalsContact CA-NH2 3.32Å; L237-R240 PolarHBondContact O-N 3.4Å; L237-V241 HydrophobicContact CD2-CG2 3.95Å; L237-V241 WeakPolarHBondContact O-CG2 3.31Å; L237-V241 PolarHBondContact O-N 3.32Å; L237-F313 HydrophobicContact CD1-CE1 3.97Å; L237-F313 HydrophobicContact CD2-CE1 3.9Å; L237-F313 HydrophobicContact CD2-CZ 3.85Å; L237-A373 HydrophobicContact CD1-CB 4.41Å; L237-T377 HydrophobicContact CD2-CG2 3.8Å
238	I	93.6	Very high	87.4	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-65.3	-32.1	178.9	-65.5	-58.2	0	0	0	111.9	L210 L212 L234 I235 V241 N242 F264 I266 F313 T377 F381	L210-I238 HydrophobicContact CD1-CD1 4.04Å; L210-I238 HydrophobicContact CD1-CG1 4.42Å; L210-I238 HydrophobicContact CD1-CG2 3.91Å; L212-I238 HydrophobicContact CD1-CD1 4.4Å; L212-I238 HydrophobicContact CD1-CG1 3.59Å; L212-I238 HydrophobicContact CD2-CD1 4.13Å; L212-I238 HydrophobicContact CD2-CG1 4.13Å; L234-I238 WeakPolarHBondContact O-CG1 3.08Å; L234-I238 PolarHBondContact O-N 2.84Å; I235-I238 PolarHBondContact O-N 2.87Å; I238-V241 PolarHBondContact O-N 3.06Å; I238-N242 WeakPolarHBondContact O-CB 3.48Å; I238-N242 PolarHBondContact O-N 3.32Å; I238-F264 HydrophobicContact CG2-CB 4.49Å; I238-I266 HydrophobicContact CB-CD1 3.88Å; I238-I266 HydrophobicContact CB-CG1 4.27Å; I238-I266 HydrophobicContact CG1-CD1 4.28Å; I238-I266 HydrophobicContact CG2-CD1 3.89Å; I238-I266 HydrophobicContact CG2-CG1 3.77Å; I238-F313 HydrophobicContact CD1-CZ 4.25Å; I238-T377 HydrophobicContact CD1-CG2 4.46Å; I238-F381 HydrophobicContact CD1-CE2 3.7Å; I238-F381 HydrophobicContact CD1-CZ 3.65Å
239	D	87.9	Confident	88.4	Confident	17 Å²	17	17.2 Å²	17.2	9%	0.091	9%	0.092	C	C	.	.	H	α-helix	trans	-57.5	-51.8	171.1	178.4	62.8	0	0	0	112.3	V79 H107 S119 I235 L237 V241 N242 S243	V79-D239 HydrophobicContact CG1-CB 4.42Å; V79-D239 HydrophobicContact CG2-CB 4.16Å; H107-D239 IonicContact CE1-OD1 2.84Å; H107-D239 PolarHBondContact CE1-OD1 3.39Å; H107-D239 IonicContact CE1-OD2 2.66Å; H107-D239 PolarHBondContact CE1-OD2 2.94Å; H107-D239 IonicContact ND1-OD2 3.76Å; H107-D239 IonicContact NE2-OD1 3.09Å; S119-D239 WeakPolarHBondContact CB-OD2 3.32Å; S119-D239 PolarHBondContact OG-OD2 3.08Å; I235-D239 WeakPolarHBondContact O-CB 3.1Å; I235-D239 PolarHBondContact O-N 3.34Å; L237-D239 VanDerWaalsContact C-N 3.28Å; L237-D239 PolarHBondContact O-N 3.02Å; D239-V241 PolarHBondContact O-N 3.45Å; D239-N242 PolarHBondContact O-N 3.38Å; D239-S243 PolarHBondContact O-N 2.9Å
240	R	87.8	Confident	89.3	Confident	15 Å²	15	16.2 Å²	16.2	6%	0.057	9%	0.086	C	C	.	.	H	α-helix	trans	-63	-41.6	178.1	-66.9	-172	-55.3	-80.5	-9.1	112.3	S131 S236 L237 S243 T370 D374	S131-R240 VanDerWaalsContact CB-CD 3.45Å; S236-R240 PolarHBondContact O-N 3.26Å; S236-R240 PolarHBondContact O-NH1 2.97Å; S236-R240 PolarHBondContact OG-NH1 3.39Å; L237-R240 VanDerWaalsContact CA-NH2 3.32Å; L237-R240 PolarHBondContact O-N 3.4Å; R240-S243 VanDerWaalsContact O-CB 3.25Å; R240-S243 WeakPolarHBondContact O-CB 3.27Å; R240-S243 PolarHBondContact O-N 2.97Å; R240-T370 VanDerWaalsContact CZ-CG2 3.44Å; R240-D374 WeakPolarHBondContact CD-OD2 3.4Å; R240-D374 IonicContact CZ-OD1 2.77Å; R240-D374 VanDerWaalsContact CZ-OD1 3.3Å; R240-D374 IonicContact CZ-OD2 2.78Å; R240-D374 VanDerWaalsContact NE-CG 3.27Å; R240-D374 IonicContact NE-OD1 3.71Å; R240-D374 PolarHBondContact NE-OD1 2.76Å; R240-D374 IonicContact NE-OD2 2.96Å; R240-D374 PolarHBondContact NE-OD2 2.85Å; R240-D374 IonicContact NH2-OD1 3.75Å; R240-D374 PolarHBondContact NH2-OD1 2.68Å; R240-D374 IonicContact NH2-OD2 3.85Å
241	V	93.1	Very high	89.6	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-65.9	-43.9	176	174.4	0	0	0	0	111.4	L237 I238 D239 S243 I244 Y245 D374 T377 A378 F381	L237-V241 HydrophobicContact CD2-CG2 3.95Å; L237-V241 WeakPolarHBondContact O-CG2 3.31Å; L237-V241 PolarHBondContact O-N 3.32Å; I238-V241 PolarHBondContact O-N 3.06Å; D239-V241 PolarHBondContact O-N 3.45Å; V241-S243 PolarHBondContact O-N 3.2Å; V241-I244 WeakPolarHBondContact O-CB 2.98Å; V241-I244 PolarHBondContact O-N 3.43Å; V241-Y245 HydrophobicContact CG1-CD2 4.26Å; V241-Y245 HydrophobicContact CG1-CE2 4.14Å; V241-Y245 WeakPolarHBondContact O-CD2 3.5Å; V241-Y245 PolarHBondContact O-N 2.91Å; V241-D374 HydrophobicContact CG2-CB 4.45Å; V241-D374 WeakPolarHBondContact CG2-O 3.42Å; V241-T377 HydrophobicContact CG2-CG2 4.18Å; V241-A378 HydrophobicContact CG1-CB 4.16Å; V241-F381 HydrophobicContact CG1-CD2 3.7Å; V241-F381 HydrophobicContact CG1-CE2 3.98Å
242	N	93.4	Very high	89.7	Confident	10 Å²	10	21.3 Å²	21.3	5%	0.053	11%	0.11	C	C	.	.	H	α-helix	trans	-60.1	-33.5	177.2	-178.4	56.4	0	0	0	112.1	V79 I238 D239 I244 Y245 T246 G263 F264	V79-N242 HydrophobicContact CG1-CB 3.88Å; V79-N242 WeakPolarHBondContact CG1-ND2 3.11Å; I238-N242 WeakPolarHBondContact O-CB 3.48Å; I238-N242 PolarHBondContact O-N 3.32Å; D239-N242 PolarHBondContact O-N 3.38Å; N242-I244 VanDerWaalsContact C-N 3.27Å; N242-I244 PolarHBondContact O-N 3.42Å; N242-Y245 PolarHBondContact O-N 2.84Å; N242-T246 WeakPolarHBondContact O-CB 3.46Å; N242-T246 WeakPolarHBondContact O-CG2 3.23Å; N242-T246 PolarHBondContact O-N 2.99Å; N242-T246 PolarHBondContact O-OG1 3.25Å; N242-G263 VanDerWaalsContact OD1-CA 3.24Å; N242-G263 WeakPolarHBondContact OD1-CA 3.38Å; N242-F264 HydrophobicContact CB-CD2 4.36Å; N242-F264 PolarHBondContact OD1-N 2.89Å
243	S	89	Confident	89.8	Confident	48 Å²	48	23.2 Å²	23.2	34%	0.336	12%	0.124	S	C	.	.	H	α-helix	trans	-59.3	-34.9	174	-153.1	0	0	0	0	113	D239 R240 V241 Q247	D239-S243 PolarHBondContact O-N 2.9Å; R240-S243 VanDerWaalsContact O-CB 3.25Å; R240-S243 WeakPolarHBondContact O-CB 3.27Å; R240-S243 PolarHBondContact O-N 2.97Å; V241-S243 PolarHBondContact O-N 3.2Å; S243-Q247 VanDerWaalsContact O-CB 3.29Å; S243-Q247 WeakPolarHBondContact O-CB 3.35Å; S243-Q247 WeakPolarHBondContact O-CG 2.98Å; S243-Q247 PolarHBondContact O-N 3.18Å; S243-Q247 PolarHBondContact O-NE2 2.83Å; S243-Q247 VanDerWaalsContact O-NE2 3.17Å; S243-Q247 PolarHBondContact OG-NE2 3.47Å
244	I	91.6	Very high	89.5	Confident	31 Å²	31	28.5 Å²	28.5	16%	0.159	15%	0.149	C	C	.	.	H	α-helix	trans	-68.5	-44.5	176.2	-57.4	171.4	0	0	0	110.3	V241 N242 T248 A378 I407 F423	V241-I244 WeakPolarHBondContact O-CB 2.98Å; V241-I244 PolarHBondContact O-N 3.43Å; N242-I244 VanDerWaalsContact C-N 3.27Å; N242-I244 PolarHBondContact O-N 3.42Å; I244-T248 PolarHBondContact O-N 3.45Å; I244-T248 PolarHBondContact O-OG1 3.2Å; I244-A378 HydrophobicContact CD1-CB 3.94Å; I244-I407 HydrophobicContact CD1-CD1 4.46Å; I244-I407 HydrophobicContact CG2-CD1 3.6Å; I244-F423 HydrophobicContact CG2-CD2 4.34Å; I244-F423 HydrophobicContact CG2-CE2 3.9Å
245	Y	95.7	Very high	88.6	Confident	0 Å²	0	35 Å²	35	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-72	-46.7	-175.9	-81.5	-108.5	0	0	0	112.6	V241 N242 Q247 T248 W250 V262 F264 A378 F381 G382 W385 F423	V241-Y245 HydrophobicContact CG1-CD2 4.26Å; V241-Y245 HydrophobicContact CG1-CE2 4.14Å; V241-Y245 WeakPolarHBondContact O-CD2 3.5Å; V241-Y245 PolarHBondContact O-N 2.91Å; N242-Y245 PolarHBondContact O-N 2.84Å; Y245-Q247 VanDerWaalsContact C-N 3.29Å; Y245-Q247 PolarHBondContact O-N 2.85Å; Y245-T248 WeakPolarHBondContact O-CB 3.31Å; Y245-T248 PolarHBondContact O-N 3.26Å; Y245-W250 HydrophobicContact CD1-CH2 4.1Å; Y245-W250 AromaticContact CD1-CZ2 3.65Å; Y245-W250 HydrophobicContact CD1-CZ2 3.65Å; Y245-W250 HydrophobicContact CE1-CH2 4.17Å; Y245-W250 HydrophobicContact CE1-CZ2 4.17Å; Y245-W250 HydrophobicContact CG-CZ2 4.25Å; Y245-V262 CarbonylContact C-O 3.6Å; Y245-F264 AromaticContact CD1-CE2 3.65Å; Y245-F264 HydrophobicContact CD1-CE2 3.65Å; Y245-F264 AromaticContact CD1-CZ 3.84Å; Y245-F264 HydrophobicContact CD1-CZ 3.84Å; Y245-F264 AromaticContact CD2-CE2 3.67Å; Y245-F264 HydrophobicContact CD2-CE2 3.67Å; Y245-F264 HydrophobicContact CD2-CZ 4.43Å; Y245-F264 AromaticContact CE1-CE2 3.96Å; Y245-F264 HydrophobicContact CE1-CE2 3.96Å; Y245-F264 AromaticContact CE1-CZ 3.8Å; Y245-F264 HydrophobicContact CE1-CZ 3.8Å; Y245-F264 AromaticContact CE2-CE2 3.98Å; Y245-F264 HydrophobicContact CE2-CE2 3.98Å; Y245-F264 HydrophobicContact CE2-CZ 4.4Å; Y245-F264 HydrophobicContact CG-CD2 4.39Å; Y245-F264 AromaticContact CG-CE2 3.49Å; Y245-F264 HydrophobicContact CG-CE2 3.49Å; Y245-F264 VanDerWaalsContact CG-CE2 3.49Å; Y245-F264 HydrophobicContact CG-CZ 4.17Å; Y245-A378 HydrophobicContact CE2-CB 4.24Å; Y245-A378 PolarHBondContact OH-O 3.44Å; Y245-F381 HydrophobicContact CE1-CB 4.49Å; Y245-F381 HydrophobicContact CE2-CB 4.27Å; Y245-F381 WeakPolarHBondContact OH-CB 3.34Å; Y245-G382 VanDerWaalsContact OH-CA 3.27Å; Y245-G382 WeakPolarHBondContact OH-CA 3.46Å; Y245-G382 PolarHBondContact OH-N 2.96Å; Y245-W385 HydrophobicContact CD1-CD2 4.04Å; Y245-W385 AromaticContact CD1-CE2 3.95Å; Y245-W385 AromaticContact CD1-CE3 3.93Å; Y245-W385 HydrophobicContact CD1-CE3 3.93Å; Y245-W385 AromaticContact CD1-CH2 3.63Å; Y245-W385 HydrophobicContact CD1-CH2 3.63Å; Y245-W385 AromaticContact CD1-CZ2 3.77Å; Y245-W385 HydrophobicContact CD1-CZ2 3.77Å; Y245-W385 AromaticContact CD1-CZ3 3.73Å; Y245-W385 HydrophobicContact CD1-CZ3 3.73Å; Y245-W385 AromaticContact CE1-CD2 3.73Å; Y245-W385 HydrophobicContact CE1-CD2 3.73Å; Y245-W385 AromaticContact CE1-CE2 3.84Å; Y245-W385 AromaticContact CE1-CE3 3.94Å; Y245-W385 HydrophobicContact CE1-CE3 3.94Å; Y245-W385 HydrophobicContact CE1-CG 4.11Å; Y245-W385 HydrophobicContact CE1-CH2 4.31Å; Y245-W385 HydrophobicContact CE1-CZ2 4.15Å; Y245-W385 HydrophobicContact CE1-CZ3 4.23Å; Y245-F423 HydrophobicContact CD2-CE2 4.16Å; Y245-F423 HydrophobicContact CE1-CE2 4.34Å; Y245-F423 HydrophobicContact CE1-CZ 4.24Å; Y245-F423 AromaticContact CE2-CE2 3.79Å; Y245-F423 HydrophobicContact CE2-CE2 3.79Å; Y245-F423 AromaticContact CE2-CZ 3.72Å; Y245-F423 HydrophobicContact CE2-CZ 3.72Å; Y245-F423 AromaticContact CZ-CE2 3.87Å; Y245-F423 AromaticContact CZ-CZ 3.54Å; Y245-F423 WeakPolarHBondContact OH-CZ 3.31Å
246	T	91.2	Very high	88	Confident	31 Å²	31	39.1 Å²	39.1	19%	0.19	21%	0.208	C	C	.	.	H	α-helix	trans	-67	-28.4	-179.4	50.4	0	0	0	0	113.1	N242 V262	N242-T246 WeakPolarHBondContact O-CB 3.46Å; N242-T246 WeakPolarHBondContact O-CG2 3.23Å; N242-T246 PolarHBondContact O-N 2.99Å; N242-T246 PolarHBondContact O-OG1 3.25Å; T246-V262 WeakPolarHBondContact CA-O 3.42Å; T246-V262 PolarHBondContact N-O 3.42Å
247	Q	88.9	Confident	87.6	Confident	110 Å²	110	42.2 Å²	42.2	51%	0.514	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-9.1	173.1	-67	177.2	61.2	0	0	113.4	K117 S243 Y245	K117-Q247 VanDerWaalsContact NZ-CD 3.32Å; S243-Q247 VanDerWaalsContact O-CB 3.29Å; S243-Q247 WeakPolarHBondContact O-CB 3.35Å; S243-Q247 WeakPolarHBondContact O-CG 2.98Å; S243-Q247 PolarHBondContact O-N 3.18Å; S243-Q247 PolarHBondContact O-NE2 2.83Å; S243-Q247 VanDerWaalsContact O-NE2 3.17Å; S243-Q247 PolarHBondContact OG-NE2 3.47Å; Y245-Q247 VanDerWaalsContact C-N 3.29Å; Y245-Q247 PolarHBondContact O-N 2.85Å
248	T	91.9	Very high	87.3	Confident	13 Å²	13	43.4 Å²	43.4	8%	0.08	25%	0.252	C	S	.	.			trans	-88.3	126.1	178.5	-63.3	0	0	0	0	110.9	I244 Y245 W250 F423 R428	I244-T248 PolarHBondContact O-N 3.45Å; I244-T248 PolarHBondContact O-OG1 3.2Å; Y245-T248 WeakPolarHBondContact O-CB 3.31Å; Y245-T248 PolarHBondContact O-N 3.26Å; T248-W250 HydrophobicContact CG2-CD2 3.8Å; T248-W250 HydrophobicContact CG2-CE3 3.77Å; T248-W250 HydrophobicContact CG2-CH2 3.77Å; T248-W250 HydrophobicContact CG2-CZ2 3.77Å; T248-W250 HydrophobicContact CG2-CZ3 3.74Å; T248-W250 PolarHBondContact O-NE1 2.87Å; T248-F423 HydrophobicContact CG2-CB 4.39Å; T248-F423 HydrophobicContact CG2-CD2 4.28Å; T248-R428 HydrophobicContact CG2-CG 4.15Å
249	I	92.3	Very high	87.1	Confident	50 Å²	50	44.6 Å²	44.6	26%	0.256	26%	0.258	S	S	.	.			trans	-90.1	109.9	171.8	-54.8	-179.3	0	0	0	108.9	R251 E260 R428	I249-R251 HydrophobicContact CG2-CB 4.48Å; I249-R251 HydrophobicContact CG2-CG 4.03Å; I249-R251 PolarHBondContact O-N 3.48Å; I249-E260 HydrophobicContact CB-CG 4.44Å; I249-E260 HydrophobicContact CG1-CG 4.11Å; I249-E260 HydrophobicContact CG2-CG 3.9Å; I249-R428 VanDerWaalsContact O-CZ 3.32Å; I249-R428 PolarHBondContact O-NE 3.03Å; I249-R428 PolarHBondContact O-NH2 2.82Å
250	W	94.1	Very high	87.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	28%	0.279	C	S	.	.	B	Isolated β-bridge	trans	-84.1	88.1	-177.4	-47.7	96.6	0	0	0	110.6	Y245 T248 G258 F259 W385 F423 R428 I431 L435	Y245-W250 HydrophobicContact CD1-CH2 4.1Å; Y245-W250 AromaticContact CD1-CZ2 3.65Å; Y245-W250 HydrophobicContact CD1-CZ2 3.65Å; Y245-W250 HydrophobicContact CE1-CH2 4.17Å; Y245-W250 HydrophobicContact CE1-CZ2 4.17Å; Y245-W250 HydrophobicContact CG-CZ2 4.25Å; T248-W250 HydrophobicContact CG2-CD2 3.8Å; T248-W250 HydrophobicContact CG2-CE3 3.77Å; T248-W250 HydrophobicContact CG2-CH2 3.77Å; T248-W250 HydrophobicContact CG2-CZ2 3.77Å; T248-W250 HydrophobicContact CG2-CZ3 3.74Å; T248-W250 PolarHBondContact O-NE1 2.87Å; W250-G258 CarbonylContact O-C 3.23Å; W250-G258 WeakPolarHBondContact O-CA 3.28Å; W250-F259 HydrophobicContact CB-CB 4.07Å; W250-F259 HydrophobicContact CB-CD2 4.28Å; W250-F259 HydrophobicContact CG-CB 4.42Å; W250-F259 PolarHBondContact N-O 3.31Å; W250-F259 PolarHBondContact O-N 2.66Å; W250-W385 AromaticContact CE2-CZ3 3.98Å; W250-W385 HydrophobicContact CZ2-CE3 4.21Å; W250-W385 AromaticContact CZ2-CZ3 3.96Å; W250-W385 HydrophobicContact CZ2-CZ3 3.96Å; W250-F423 HydrophobicContact CH2-CD1 4.49Å; W250-F423 AromaticContact CH2-CD2 3.47Å; W250-F423 HydrophobicContact CH2-CD2 3.47Å; W250-F423 VanDerWaalsContact CH2-CD2 3.47Å; W250-F423 AromaticContact CH2-CE2 3.7Å; W250-F423 HydrophobicContact CH2-CE2 3.7Å; W250-F423 AromaticContact CH2-CG 3.92Å; W250-F423 HydrophobicContact CH2-CG 3.92Å; W250-F423 HydrophobicContact CH2-CZ 4.31Å; W250-F423 HydrophobicContact CZ2-CD2 4.41Å; W250-F423 HydrophobicContact CZ3-CB 4.23Å; W250-F423 HydrophobicContact CZ3-CD1 4.5Å; W250-F423 AromaticContact CZ3-CD2 3.98Å; W250-F423 HydrophobicContact CZ3-CD2 3.98Å; W250-F423 AromaticContact CZ3-CG 3.96Å; W250-F423 HydrophobicContact CZ3-CG 3.96Å; W250-R428 HydrophobicContact CE3-CG 4.35Å; W250-I431 HydrophobicContact CD2-CG2 3.77Å; W250-I431 HydrophobicContact CE3-CB 3.75Å; W250-I431 HydrophobicContact CE3-CD1 4.31Å; W250-I431 HydrophobicContact CE3-CG2 3.35Å; W250-I431 HydrophobicContact CG-CG2 4.46Å; W250-I431 HydrophobicContact CH2-CD1 3.92Å; W250-I431 HydrophobicContact CH2-CG2 4.15Å; W250-I431 HydrophobicContact CZ3-CB 3.84Å; W250-I431 HydrophobicContact CZ3-CD1 3.48Å; W250-I431 VanDerWaalsContact CZ3-CD1 3.48Å; W250-I431 HydrophobicContact CZ3-CG1 4.23Å; W250-I431 HydrophobicContact CZ3-CG2 3.59Å; W250-L435 HydrophobicContact CB-CD1 4.14Å; W250-L435 HydrophobicContact CD2-CD1 4.3Å; W250-L435 HydrophobicContact CG-CD1 3.83Å
251	R	89.9	Confident	87.2	Confident	45 Å²	45	51.7 Å²	51.7	17%	0.17	29%	0.293	C	S	.	.			trans	-137.5	159	180	61.2	-172.8	174.8	-154.4	-4.3	111.6	I249 S253 E254 E256	I249-R251 HydrophobicContact CG2-CB 4.48Å; I249-R251 HydrophobicContact CG2-CG 4.03Å; I249-R251 PolarHBondContact O-N 3.48Å; R251-S253 WeakPolarHBondContact CD-O 3.22Å; R251-S253 WeakPolarHBondContact CG-O 3.05Å; R251-E254 IonicContact CZ-OE1 2.82Å; R251-E254 IonicContact CZ-OE2 2.77Å; R251-E254 IonicContact NE-OE1 2.63Å; R251-E254 PolarHBondContact NE-OE1 2.77Å; R251-E254 IonicContact NE-OE2 2.76Å; R251-E254 IonicContact NH2-OE1 3.71Å; R251-E254 PolarHBondContact NH2-OE1 2.68Å; R251-E254 IonicContact NH2-OE2 3.71Å; R251-E254 PolarHBondContact NH2-OE2 3.37Å; R251-E256 WeakPolarHBondContact CD-O 3.34Å
252	D	85.4	Confident	87.2	Confident	62 Å²	62	51.7 Å²	51.7	33%	0.332	29%	0.293	S	S	.	.	S	Bend	trans	-82.6	-33.9	-178.8	-63.9	-24.2	0	0	0	112.7	R429 K432	D252-R429 HydrophobicContact CB-CG 4.1Å; D252-R429 WeakPolarHBondContact OD1-CG 3.45Å; D252-K432 HydrophobicContact CB-CD 4.44Å; D252-K432 VanDerWaalsContact CG-CD 3.42Å; D252-K432 WeakPolarHBondContact OD1-CD 3.39Å; D252-K432 IonicContact OD1-NZ 3.52Å; D252-K432 WeakPolarHBondContact OD2-CD 3.41Å; D252-K432 IonicContact OD2-NZ 3.05Å; D252-K432 PolarHBondContact OD2-NZ 2.94Å
253	S	83.1	Confident	87.3	Confident	43 Å²	43	51.2 Å²	51.2	30%	0.301	29%	0.291	S	S	.	.	S	Bend	trans	-144.9	160.9	174.8	74.1	0	0	0	0	110.1	R251 T255 E256	R251-S253 WeakPolarHBondContact CD-O 3.22Å; R251-S253 WeakPolarHBondContact CG-O 3.05Å; S253-T255 PolarHBondContact O-N 3.04Å; S253-T255 VanDerWaalsContact O-N 3.16Å; S253-T255 PolarHBondContact OG-OG1 3Å; S253-T255 VanDerWaalsContact OG-OG1 3.08Å; S253-E256 PolarHBondContact O-N 2.88Å; S253-E256 VanDerWaalsContact O-N 3.12Å
254	E	76.4	Confident	87.6	Confident	118 Å²	118	49 Å²	49	55%	0.551	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.6	-178.7	-61.2	-67.4	102.7	0	0	113.7	R251 R428	R251-E254 IonicContact CZ-OE1 2.82Å; R251-E254 IonicContact CZ-OE2 2.77Å; R251-E254 IonicContact NE-OE1 2.63Å; R251-E254 PolarHBondContact NE-OE1 2.77Å; R251-E254 IonicContact NE-OE2 2.76Å; R251-E254 IonicContact NH2-OE1 3.71Å; R251-E254 PolarHBondContact NH2-OE1 2.68Å; R251-E254 IonicContact NH2-OE2 3.71Å; R251-E254 PolarHBondContact NH2-OE2 3.37Å; E254-R428 IonicContact OE1-CZ 2.73Å; E254-R428 IonicContact OE1-NH1 3.24Å; E254-R428 PolarHBondContact OE1-NH1 2.96Å; E254-R428 IonicContact OE1-NH2 3.42Å; E254-R428 PolarHBondContact OE1-NH2 3.33Å
255	T	72.6	Confident	87.7	Confident	137 Å²	137	48 Å²	48	84%	0.84	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.1	-8.6	175.6	55.3	0	0	0	0	113.9	S253	S253-T255 PolarHBondContact O-N 3.04Å; S253-T255 VanDerWaalsContact O-N 3.16Å; S253-T255 PolarHBondContact OG-OG1 3Å; S253-T255 VanDerWaalsContact OG-OG1 3.08Å
256	E	75.8	Confident	87.5	Confident	88 Å²	88	48 Å²	48	41%	0.411	27%	0.27	S	S	.	.	S	Bend	trans	-98.7	148.7	-179.7	-76.6	-174.6	-158.5	0	0	112.9	R251 S253 K432	R251-E256 WeakPolarHBondContact CD-O 3.34Å; S253-E256 PolarHBondContact O-N 2.88Å; S253-E256 VanDerWaalsContact O-N 3.12Å; E256-K432 IonicContact OE2-NZ 3.54Å; E256-K432 PolarHBondContact OE2-NZ 3.14Å
257	G	76.6	Confident	87.6	Confident	68 Å²	68	49.3 Å²	49.3	70%	0.701	27%	0.273	S	S	*	.			trans	-60.6	140.7	164.1	0	0	0	0	0	111.1
258	G	83.6	Confident	87.9	Confident	25 Å²	25	46.1 Å²	46.1	26%	0.258	26%	0.258	S	S	.	.			trans	-132.4	-173.2	177.9	0	0	0	0	0	112.2	W250	W250-G258 CarbonylContact O-C 3.23Å; W250-G258 WeakPolarHBondContact O-CA 3.28Å
259	F	89.6	Confident	88	Confident	26 Å²	26	45.5 Å²	45.5	11%	0.114	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-90.6	133.7	166.2	-54.7	-66.2	0	0	0	110.4	W202 W250 V262 K432 L435 Q436	W202-F259 HydrophobicContact CD2-CD1 4.47Å; W202-F259 AromaticContact CE2-CD1 3.47Å; W202-F259 VanDerWaalsContact CE2-CD1 3.47Å; W202-F259 HydrophobicContact CH2-CD1 4.14Å; W202-F259 HydrophobicContact CZ2-CB 3.95Å; W202-F259 AromaticContact CZ2-CD1 3.29Å; W202-F259 HydrophobicContact CZ2-CD1 3.29Å; W202-F259 HydrophobicContact CZ2-CE1 4Å; W202-F259 AromaticContact CZ2-CG 3.92Å; W202-F259 HydrophobicContact CZ2-CG 3.92Å; W202-F259 AromaticContact NE1-CD1 3.56Å; W250-F259 HydrophobicContact CB-CB 4.07Å; W250-F259 HydrophobicContact CB-CD2 4.28Å; W250-F259 HydrophobicContact CG-CB 4.42Å; W250-F259 PolarHBondContact N-O 3.31Å; W250-F259 PolarHBondContact O-N 2.66Å; F259-V262 HydrophobicContact CB-CG2 3.61Å; F259-K432 HydrophobicContact CD2-CG 4.33Å; F259-K432 HydrophobicContact CE2-CG 4.22Å; F259-K432 WeakPolarHBondContact CE2-O 3.44Å; F259-L435 HydrophobicContact CB-CD1 4.35Å; F259-L435 HydrophobicContact CD2-CB 3.54Å; F259-L435 HydrophobicContact CD2-CD1 3.72Å; F259-L435 HydrophobicContact CD2-CG 4.3Å; F259-L435 HydrophobicContact CE2-CB 3.31Å; F259-L435 HydrophobicContact CE2-CD1 4.38Å; F259-L435 HydrophobicContact CE2-CG 4.5Å; F259-L435 HydrophobicContact CG-CB 4.45Å; F259-L435 HydrophobicContact CG-CD1 4.31Å; F259-L435 HydrophobicContact CZ-CB 4.08Å; F259-Q436 HydrophobicContact CE2-CB 4.41Å; F259-Q436 HydrophobicContact CE2-CG 3.66Å; F259-Q436 HydrophobicContact CZ-CB 4.26Å; F259-Q436 HydrophobicContact CZ-CG 3.54Å
260	E	89.4	Confident	88.3	Confident	113 Å²	113	43.3 Å²	43.3	53%	0.528	24%	0.243	S	C	.	.			trans	-126.4	154.5	-179.3	-63.2	-174.9	-175.8	0	0	109.5	I249 V262	I249-E260 HydrophobicContact CB-CG 4.44Å; I249-E260 HydrophobicContact CG1-CG 4.11Å; I249-E260 HydrophobicContact CG2-CG 3.9Å; E260-V262 PolarHBondContact O-N 3.22Å; E260-V262 VanDerWaalsContact O-N 3.16Å
261	N	88.3	Confident	88.3	Confident	68 Å²	68	43.3 Å²	43.3	36%	0.364	24%	0.243	S	C	.	.	S	Bend	trans	48.4	41.5	-177.7	-175.9	29.5	0	0	0	113	N206 R207 E446	N206-N261 WeakPolarHBondContact CB-O 3.22Å; N206-N261 PolarHBondContact ND2-ND2 2.77Å; N206-N261 PolarHBondContact ND2-O 3.27Å; R207-N261 PolarHBondContact NH1-O 3.35Å; R207-N261 PolarHBondContact NH2-OD1 2.91Å; N261-E446 PolarHBondContact ND2-OE2 2.83Å
262	V	92.6	Very high	88.7	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.236	C	C	.	.			trans	-95.8	131.6	173.3	-161.4	0	0	0	0	108.9	W202 N206 Y245 T246 F259 E260 W385 L435 F443	W202-V262 HydrophobicContact CH2-CG2 4.16Å; W202-V262 HydrophobicContact CZ2-CG2 3.66Å; N206-V262 WeakPolarHBondContact O-CA 3.27Å; Y245-V262 CarbonylContact C-O 3.6Å; T246-V262 WeakPolarHBondContact CA-O 3.42Å; T246-V262 PolarHBondContact N-O 3.42Å; F259-V262 HydrophobicContact CB-CG2 3.61Å; E260-V262 PolarHBondContact O-N 3.22Å; E260-V262 VanDerWaalsContact O-N 3.16Å; V262-W385 HydrophobicContact CB-CH2 4.08Å; V262-W385 HydrophobicContact CB-CZ3 4.19Å; V262-W385 HydrophobicContact CG1-CH2 3.56Å; V262-W385 HydrophobicContact CG1-CZ3 3.86Å; V262-L435 HydrophobicContact CG1-CD2 4.37Å; V262-F443 HydrophobicContact CG1-CD1 4.24Å; V262-F443 HydrophobicContact CG1-CE1 3.63Å
263	G	94.7	Very high	89	Confident	0 Å²	0	41 Å²	41	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.9	-154.5	-172.2	0	0	0	0	0	113.1	N206 C208 N242	N206-G263 PolarHBondContact O-N 3.17Å; C208-G263 WeakPolarHBondContact CB-O 3.35Å; C208-G263 PolarHBondContact N-O 3.36Å; N242-G263 VanDerWaalsContact OD1-CA 3.24Å; N242-G263 WeakPolarHBondContact OD1-CA 3.38Å
264	F	95.5	Very high	89.6	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	157.9	-172.5	-61.1	-75.5	0	0	0	112.3	C208 L210 I238 N242 Y245 L309 F381 W385	C208-F264 HydrophobicContact CB-CD1 3.75Å; C208-F264 HydrophobicContact CB-CE1 4.05Å; C208-F264 WeakPolarHBondContact O-CA 3.47Å; L210-F264 HydrophobicContact CD1-CB 3.75Å; L210-F264 HydrophobicContact CD1-CD1 3.79Å; L210-F264 HydrophobicContact CD1-CG 3.89Å; L210-F264 HydrophobicContact CD2-CD1 3.62Å; L210-F264 HydrophobicContact CD2-CE1 4.09Å; L210-F264 HydrophobicContact CG-CB 4.1Å; L210-F264 HydrophobicContact CG-CD1 3.8Å; L210-F264 HydrophobicContact CG-CG 4.29Å; I238-F264 HydrophobicContact CG2-CB 4.49Å; N242-F264 HydrophobicContact CB-CD2 4.36Å; N242-F264 PolarHBondContact OD1-N 2.89Å; Y245-F264 AromaticContact CD1-CE2 3.65Å; Y245-F264 HydrophobicContact CD1-CE2 3.65Å; Y245-F264 AromaticContact CD1-CZ 3.84Å; Y245-F264 HydrophobicContact CD1-CZ 3.84Å; Y245-F264 AromaticContact CD2-CE2 3.67Å; Y245-F264 HydrophobicContact CD2-CE2 3.67Å; Y245-F264 HydrophobicContact CD2-CZ 4.43Å; Y245-F264 AromaticContact CE1-CE2 3.96Å; Y245-F264 HydrophobicContact CE1-CE2 3.96Å; Y245-F264 AromaticContact CE1-CZ 3.8Å; Y245-F264 HydrophobicContact CE1-CZ 3.8Å; Y245-F264 AromaticContact CE2-CE2 3.98Å; Y245-F264 HydrophobicContact CE2-CE2 3.98Å; Y245-F264 HydrophobicContact CE2-CZ 4.4Å; Y245-F264 HydrophobicContact CG-CD2 4.39Å; Y245-F264 AromaticContact CG-CE2 3.49Å; Y245-F264 HydrophobicContact CG-CE2 3.49Å; Y245-F264 VanDerWaalsContact CG-CE2 3.49Å; Y245-F264 HydrophobicContact CG-CZ 4.17Å; F264-L309 HydrophobicContact CE1-CD1 4.27Å; F264-F381 HydrophobicContact CD1-CE2 4.47Å; F264-F381 HydrophobicContact CD2-CD2 4.28Å; F264-F381 HydrophobicContact CD2-CE2 4.35Å; F264-F381 AromaticContact CE1-CD2 3.89Å; F264-F381 HydrophobicContact CE1-CD2 3.89Å; F264-F381 HydrophobicContact CE1-CE2 4.18Å; F264-F381 HydrophobicContact CE1-CG 4.36Å; F264-F381 AromaticContact CE2-CD2 3.56Å; F264-F381 HydrophobicContact CE2-CD2 3.56Å; F264-F381 HydrophobicContact CE2-CE2 4.07Å; F264-F381 HydrophobicContact CE2-CG 4.49Å; F264-F381 HydrophobicContact CZ-CB 3.99Å; F264-F381 AromaticContact CZ-CD2 3.34Å; F264-F381 HydrophobicContact CZ-CD2 3.34Å; F264-F381 AromaticContact CZ-CE2 3.99Å; F264-F381 HydrophobicContact CZ-CE2 3.99Å; F264-F381 AromaticContact CZ-CG 3.89Å; F264-F381 HydrophobicContact CZ-CG 3.89Å; F264-W385 HydrophobicContact CD1-CZ2 4.34Å; F264-W385 AromaticContact CE1-CE2 3.76Å; F264-W385 AromaticContact CE1-CZ2 3.67Å; F264-W385 HydrophobicContact CE1-CZ2 3.67Å; F264-W385 AromaticContact CE1-NE1 3.3Å; F264-W385 VanDerWaalsContact CE1-NE1 3.3Å; F264-W385 HydrophobicContact CE2-CZ2 4.18Å; F264-W385 AromaticContact CZ-CE2 3.61Å; F264-W385 AromaticContact CZ-CZ2 3.56Å; F264-W385 HydrophobicContact CZ-CZ2 3.56Å; F264-W385 AromaticContact CZ-NE1 3.37Å
265	V	93.3	Very high	90.5	Very high	11 Å²	11	35.6 Å²	35.6	7%	0.067	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	127.1	168.2	68.2	0	0	0	0	110	L80 F81 R207 C208 S209 L210 K267 V444	L80-V265 VanDerWaalsContact C-CG2 3.49Å; F81-V265 HydrophobicContact CB-CG2 3.86Å; F81-V265 HydrophobicContact CD2-CG1 3.89Å; F81-V265 HydrophobicContact CD2-CG2 3.96Å; F81-V265 HydrophobicContact CG-CG2 4.43Å; F81-V265 VanDerWaalsContact N-CG2 3.33Å; R207-V265 HydrophobicContact CB-CB 4.22Å; R207-V265 HydrophobicContact CB-CG1 3.87Å; C208-V265 PolarHBondContact O-N 3.29Å; S209-V265 CarbonylContact C-O 3.6Å; S209-V265 WeakPolarHBondContact CA-O 3.06Å; L210-V265 PolarHBondContact N-O 3.16Å; V265-K267 PolarHBondContact O-N 3.37Å; V265-V444 HydrophobicContact CG1-CG2 3.87Å
266	I	93.2	Very high	91.5	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	110.6	-177.6	-53.5	171	0	0	0	108.7	V79 L80 F81 F84 L212 I235 I238 I269	V79-I266 HydrophobicContact CG2-CD1 4.17Å; V79-I266 WeakPolarHBondContact O-CB 3.27Å; V79-I266 WeakPolarHBondContact O-CG1 3.38Å; V79-I266 PolarHBondContact O-N 2.87Å; L80-I266 HydrophobicContact CD2-CB 4.09Å; L80-I266 HydrophobicContact CD2-CD1 4.06Å; F81-I266 WeakPolarHBondContact CB-O 3.14Å; F81-I266 PolarHBondContact N-O 2.88Å; F84-I266 HydrophobicContact CD2-CG2 3.97Å; F84-I266 HydrophobicContact CE2-CG2 3.74Å; L212-I266 HydrophobicContact CD1-CD1 4.16Å; L212-I266 HydrophobicContact CD1-CG1 4.34Å; L212-I266 HydrophobicContact CD1-CG2 4.22Å; L212-I266 HydrophobicContact CG-CG2 4.35Å; I235-I266 HydrophobicContact CB-CD1 4.3Å; I235-I266 HydrophobicContact CG1-CD1 4Å; I235-I266 HydrophobicContact CG2-CD1 4.42Å; I238-I266 HydrophobicContact CB-CD1 3.88Å; I238-I266 HydrophobicContact CB-CG1 4.27Å; I238-I266 HydrophobicContact CG1-CD1 4.28Å; I238-I266 HydrophobicContact CG2-CD1 3.89Å; I238-I266 HydrophobicContact CG2-CG1 3.77Å; I266-I269 HydrophobicContact CG2-CD1 3.88Å; I266-I269 HydrophobicContact CG2-CG1 3.7Å
267	K	93	Very high	92.3	Very high	58 Å²	58	31.6 Å²	31.6	25%	0.252	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	-27.9	178.3	-174.7	176.1	176.4	-175	0	112.1	F81 Q85 L210 V265 D306 F307	F81-K267 HydrophobicContact CB-CB 4.16Å; F81-K267 HydrophobicContact CB-CG 4.48Å; F81-K267 HydrophobicContact CD1-CD 4.5Å; F81-K267 HydrophobicContact CD1-CG 4Å; F81-K267 HydrophobicContact CG-CB 4.34Å; F81-K267 HydrophobicContact CG-CG 4.27Å; Q85-K267 PolarHBondContact N-O 3.03Å; L210-K267 PolarHBondContact O-N 2.88Å; V265-K267 PolarHBondContact O-N 3.37Å; K267-D306 PolarHBondContact NZ-O 3.21Å; K267-F307 HydrophobicContact CB-CD1 4.04Å; K267-F307 HydrophobicContact CB-CE1 3.86Å; K267-F307 HydrophobicContact CD-CD1 3.92Å; K267-F307 HydrophobicContact CD-CE1 3.8Å; K267-F307 HydrophobicContact CG-CD1 4.26Å; K267-F307 HydrophobicContact CG-CE1 3.8Å
268	K	93.8	Very high	92.9	Very high	43 Å²	43	31.7 Å²	31.7	19%	0.187	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	139.2	179.2	-173.6	157.6	-71.2	-174.1	0	112.6	Q85 L87 L210 K211 L212 I270 F307	Q85-K268 HydrophobicContact CB-CG 4.49Å; Q85-K268 CarbonylContact O-C 3.56Å; Q85-K268 WeakPolarHBondContact O-CA 3.42Å; L87-K268 HydrophobicContact CD1-CD 4.19Å; L210-K268 PolarHBondContact O-N 2.96Å; K211-K268 CarbonylContact C-O 3.47Å; K211-K268 WeakPolarHBondContact CA-O 3.36Å; K211-K268 HydrophobicContact CB-CB 4.42Å; K211-K268 HydrophobicContact CG-CB 4.31Å; K211-K268 HydrophobicContact CG-CG 4.49Å; L212-K268 PolarHBondContact N-O 2.97Å; K268-I270 HydrophobicContact CD-CD1 4.4Å; K268-I270 HydrophobicContact CD-CG1 4.39Å; K268-I270 HydrophobicContact CG-CG1 4.11Å; K268-F307 HydrophobicContact CB-CE1 3.73Å; K268-F307 HydrophobicContact CB-CZ 3.91Å; K268-F307 HydrophobicContact CD-CZ 4.09Å
269	I	95.5	Very high	93	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	134.2	165.1	-67.3	172.5	0	0	0	109.1	F84 Q85 L87 L212 I231 L234 I235 I266 V271	F84-I269 HydrophobicContact CE2-CB 4.23Å; F84-I269 HydrophobicContact CE2-CD1 3.86Å; F84-I269 HydrophobicContact CE2-CG1 3.87Å; F84-I269 HydrophobicContact CZ-CB 4.39Å; F84-I269 HydrophobicContact CZ-CD1 3.99Å; F84-I269 HydrophobicContact CZ-CG1 4.29Å; Q85-I269 PolarHBondContact O-N 3.02Å; L87-I269 PolarHBondContact N-O 2.96Å; L212-I269 HydrophobicContact CB-CG1 4.09Å; L212-I269 HydrophobicContact CD1-CD1 4Å; L212-I269 HydrophobicContact CD1-CG1 3.91Å; L212-I269 HydrophobicContact CG-CG1 4.11Å; L212-I269 CarbonylContact O-C 3.49Å; L212-I269 WeakPolarHBondContact O-CA 3.36Å; I231-I269 HydrophobicContact CG1-CG2 3.9Å; I231-I269 HydrophobicContact CG2-CD1 3.87Å; I231-I269 HydrophobicContact CG2-CG2 4.45Å; L234-I269 HydrophobicContact CB-CD1 4.2Å; L234-I269 HydrophobicContact CD1-CG2 3.75Å; I235-I269 HydrophobicContact CD1-CD1 4.34Å; I235-I269 HydrophobicContact CG1-CD1 3.74Å; I266-I269 HydrophobicContact CG2-CD1 3.88Å; I266-I269 HydrophobicContact CG2-CG1 3.7Å; I269-V271 HydrophobicContact CG2-CG2 4.11Å
270	I	97.1	Very high	92.8	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	126.4	173.7	-56.5	-174.1	0	0	0	108.2	L87 V89 L212 V213 A214 K268	L87-I270 HydrophobicContact CD1-CG1 4.42Å; L87-I270 CarbonylContact O-C 3.33Å; L87-I270 WeakPolarHBondContact O-CA 3.42Å; V89-I270 HydrophobicContact CG2-CG2 3.44Å; V89-I270 VanDerWaalsContact CG2-CG2 3.44Å; L212-I270 PolarHBondContact O-N 3.33Å; V213-I270 CarbonylContact C-O 3.6Å; V213-I270 VanDerWaalsContact CA-O 3.31Å; V213-I270 WeakPolarHBondContact CA-O 3.5Å; V213-I270 HydrophobicContact CG1-CB 4.42Å; V213-I270 HydrophobicContact CG2-CB 4.3Å; A214-I270 PolarHBondContact N-O 3.02Å; K268-I270 HydrophobicContact CD-CD1 4.4Å; K268-I270 HydrophobicContact CD-CG1 4.39Å; K268-I270 HydrophobicContact CG-CG1 4.11Å
271	V	94.9	Very high	93	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.3	175.1	-179.8	0	0	0	0	109.4	L87 S88 V89 A214 H219 V227 T230 I231 I269 T273	L87-V271 PolarHBondContact O-N 2.62Å; S88-V271 CarbonylContact C-O 3.44Å; S88-V271 VanDerWaalsContact CA-O 3.3Å; S88-V271 WeakPolarHBondContact CA-O 3.28Å; V89-V271 PolarHBondContact N-O 2.77Å; A214-V271 HydrophobicContact CB-CG2 4.38Å; H219-V271 HydrophobicContact CB-CG1 3.88Å; V227-V271 HydrophobicContact CG1-CB 4.23Å; V227-V271 HydrophobicContact CG1-CG1 4.48Å; V227-V271 HydrophobicContact CG1-CG2 4.34Å; T230-V271 HydrophobicContact CG2-CG1 3.89Å; T230-V271 HydrophobicContact CG2-CG2 3.9Å; I231-V271 HydrophobicContact CD1-CG2 4.26Å; I231-V271 HydrophobicContact CG1-CG2 3.64Å; I269-V271 HydrophobicContact CG2-CG2 4.11Å; V271-T273 PolarHBondContact O-N 2.86Å
272	H	97.6	Very high	93.3	Very high	6 Å²	6	32.7 Å²	32.7	3%	0.028	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	121	169.2	-70.2	-94.6	0	0	0	109.9	V89 A214 Y216 H219 H281 Y282 N283	V89-H272 CarbonylContact O-C 3.55Å; V89-H272 VanDerWaalsContact O-CA 3.31Å; V89-H272 WeakPolarHBondContact O-CA 3.16Å; A214-H272 PolarHBondContact O-CD2 2.73Å; A214-H272 PolarHBondContact O-N 2.82Å; Y216-H272 WeakPolarHBondContact CA-O 3.43Å; H219-H272 WeakPolarHBondContact CB-O 3.22Å; H272-H281 AromaticContact CE1-CE1 3.89Å; H272-Y282 AromaticContact NE2-CE2 3.93Å; H272-Y282 AromaticContact NE2-CZ 3.64Å; H272-Y282 PolarHBondContact NE2-OH 2.63Å; H272-N283 VanDerWaalsContact CB-CG 3.46Å; H272-N283 WeakPolarHBondContact CB-ND2 3.25Å; H272-N283 WeakPolarHBondContact CB-OD1 3.48Å; H272-N283 VanDerWaalsContact CG-CG 3.4Å; H272-N283 PolarHBondContact ND1-ND2 3.46Å
273	T	92.8	Very high	93.4	Very high	53 Å²	53	32.7 Å²	32.7	33%	0.325	19%	0.186	S	C	.	.	S	Bend	trans	-86.7	-21.6	-179.3	56.3	0	0	0	0	112.8	V89 V227 V271	V89-T273 PolarHBondContact O-N 2.71Å; V89-T273 PolarHBondContact O-OG1 3.11Å; V227-T273 HydrophobicContact CG2-CG2 3.61Å; V271-T273 PolarHBondContact O-N 2.86Å
274	A	94.8	Very high	93.3	Very high	33 Å²	33	33.9 Å²	33.9	27%	0.273	19%	0.194	S	C	.	.	S	Bend	trans	-143.3	157.8	178.1	0	0	0	0	0	110.3	N283	A274-N283 PolarHBondContact O-ND2 2.77Å
275	P	95.2	Very high	92.7	Very high	15 Å²	15	41.9 Å²	41.9	10%	0.097	23%	0.225	C	C	.	.			trans	-64.4	138.1	173.8	22.8	-29.5	0	0	0	111.1	G91 Y216 N283 Y285	G91-P275 WeakPolarHBondContact CA-O 3.32Å; Y216-P275 HydrophobicContact CD1-CB 3.74Å; Y216-P275 HydrophobicContact CD1-CG 4.5Å; Y216-P275 HydrophobicContact CD2-CB 4.28Å; Y216-P275 HydrophobicContact CD2-CG 4.17Å; Y216-P275 HydrophobicContact CE1-CB 3.8Å; Y216-P275 HydrophobicContact CE2-CB 4.31Å; Y216-P275 HydrophobicContact CE2-CG 4.22Å; Y216-P275 HydrophobicContact CG-CB 4Å; Y216-P275 HydrophobicContact CG-CG 4.31Å; P275-N283 CarbonylContact C-O 3.58Å; P275-N283 VanDerWaalsContact CA-O 3.28Å; P275-N283 WeakPolarHBondContact CA-O 3.38Å; P275-Y285 HydrophobicContact CB-CD1 4.44Å; P275-Y285 HydrophobicContact CB-CD2 3.86Å; P275-Y285 HydrophobicContact CB-CE2 4.04Å; P275-Y285 HydrophobicContact CB-CG 4.07Å; P275-Y285 HydrophobicContact CG-CD1 4.08Å; P275-Y285 HydrophobicContact CG-CD2 3.59Å; P275-Y285 HydrophobicContact CG-CE1 3.76Å; P275-Y285 HydrophobicContact CG-CE2 3.24Å; P275-Y285 HydrophobicContact CG-CG 4Å
276	S	94.5	Very high	91.8	Very high	12 Å²	12	44 Å²	44	8%	0.084	24%	0.244	C	C	.	.			trans	-65.2	134.3	176.7	-173.5	0	0	0	0	111.5	G91 S278 N283	G91-S276 WeakPolarHBondContact O-CA 3.18Å; S276-S278 PolarHBondContact O-N 3.19Å; S276-S278 WeakPolarHBondContact OG-CB 3.21Å; S276-S278 PolarHBondContact OG-N 2.84Å; S276-N283 PolarHBondContact N-ND2 2.82Å; S276-N283 PolarHBondContact N-O 2.85Å
277	Q	91.5	Very high	90.2	Very high	128 Å²	128	49 Å²	49	60%	0.598	28%	0.275	S	S	*	.			trans	-78.1	-7.6	171.1	-63.6	177.6	18.8	0	0	112.7	G91 I279	G91-Q277 PolarHBondContact O-N 2.83Å; Q277-I279 PolarHBondContact O-N 3.13Å
278	S	89.2	Confident	88.7	Confident	71 Å²	71	55.5 Å²	55.5	50%	0.497	30%	0.303	S	S	.	.	S	Bend	trans	-72.4	123.1	177.4	-68.5	0	0	0	0	111.2	S276 G280 H281	S276-S278 PolarHBondContact O-N 3.19Å; S276-S278 WeakPolarHBondContact OG-CB 3.21Å; S276-S278 PolarHBondContact OG-N 2.84Å; S278-G280 PolarHBondContact O-N 3.33Å; S278-H281 WeakPolarHBondContact O-CB 3.42Å; S278-H281 PolarHBondContact O-N 3.05Å; S278-H281 VanDerWaalsContact O-N 3.17Å
279	I	86	Confident	87.5	Confident	180 Å²	180	54.6 Å²	54.6	92%	0.923	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	128.1	179.4	-59.9	171.4	0	0	0	109.9	Q277 H281	Q277-I279 PolarHBondContact O-N 3.13Å; I279-H281 VanDerWaalsContact C-N 3.3Å; I279-H281 PolarHBondContact O-N 2.57Å
280	G	86.1	Confident	87	Confident	39 Å²	39	59.7 Å²	59.7	40%	0.402	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	77.9	5	178.6	0	0	0	0	0	115.6	S278	S278-G280 PolarHBondContact O-N 3.33Å
281	H	93.3	Very high	86.4	Confident	28 Å²	28	60 Å²	60	13%	0.13	33%	0.331	C	S	.	.			trans	-67.6	143.6	175.2	-166.7	-81.9	0	0	0	111.6	H272 S278 I279 N283 S284	H272-H281 AromaticContact CE1-CE1 3.89Å; S278-H281 WeakPolarHBondContact O-CB 3.42Å; S278-H281 PolarHBondContact O-N 3.05Å; S278-H281 VanDerWaalsContact O-N 3.17Å; I279-H281 VanDerWaalsContact C-N 3.3Å; I279-H281 PolarHBondContact O-N 2.57Å; H281-N283 WeakPolarHBondContact ND1-CB 3.38Å; H281-N283 PolarHBondContact ND1-N 3.19Å; H281-N283 PolarHBondContact O-N 3.15Å; H281-S284 WeakPolarHBondContact O-CB 3.49Å; H281-S284 PolarHBondContact O-N 2.82Å; H281-S284 VanDerWaalsContact O-N 3.15Å; H281-S284 PolarHBondContact O-OG 3.48Å
282	Y	93.8	Very high	86	Confident	6 Å²	6	60.4 Å²	60.4	2%	0.024	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-44.7	-179.2	64.3	-89.4	0	0	0	111.9	V213 H272 S284 F298 I301 E302 L312	V213-Y282 HydrophobicContact CG1-CE2 3.98Å; H272-Y282 AromaticContact NE2-CE2 3.93Å; H272-Y282 AromaticContact NE2-CZ 3.64Å; H272-Y282 PolarHBondContact NE2-OH 2.63Å; Y282-S284 PolarHBondContact O-N 3.25Å; Y282-F298 HydrophobicContact CD1-CD2 4.17Å; Y282-F298 AromaticContact CD2-CD2 3.92Å; Y282-F298 HydrophobicContact CD2-CD2 3.92Å; Y282-F298 HydrophobicContact CE1-CD2 4.17Å; Y282-F298 AromaticContact CE2-CD2 3.92Å; Y282-F298 HydrophobicContact CE2-CD2 3.92Å; Y282-F298 HydrophobicContact CE2-CE2 4.25Å; Y282-F298 HydrophobicContact CG-CB 4.35Å; Y282-F298 HydrophobicContact CG-CD2 4.07Å; Y282-I301 HydrophobicContact CD1-CB 4.18Å; Y282-I301 HydrophobicContact CD1-CD1 4.03Å; Y282-I301 HydrophobicContact CD1-CG2 4.28Å; Y282-I301 HydrophobicContact CE1-CB 4.12Å; Y282-I301 HydrophobicContact CE1-CG2 3.8Å; Y282-E302 HydrophobicContact CD1-CG 4.45Å; Y282-E302 HydrophobicContact CE1-CG 3.44Å; Y282-E302 VanDerWaalsContact CE1-CG 3.44Å; Y282-E302 VanDerWaalsContact OH-CD 3.23Å; Y282-E302 VanDerWaalsContact OH-CG 3.28Å; Y282-E302 WeakPolarHBondContact OH-CG 3.33Å; Y282-E302 PolarHBondContact OH-OE1 3.18Å; Y282-L312 HydrophobicContact CD2-CD1 3.99Å; Y282-L312 HydrophobicContact CD2-CD2 4.17Å; Y282-L312 HydrophobicContact CE2-CD1 3.95Å
283	N	95.1	Very high	85.5	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.352	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	32.2	173.1	-176.3	60.7	0	0	0	114.1	D215 Y216 H272 A274 P275 S276 H281	D215-N283 WeakPolarHBondContact CA-OD1 3.38Å; D215-N283 WeakPolarHBondContact CB-OD1 3.39Å; Y216-N283 WeakPolarHBondContact CD1-OD1 3.34Å; Y216-N283 PolarHBondContact N-OD1 2.83Å; H272-N283 VanDerWaalsContact CB-CG 3.46Å; H272-N283 WeakPolarHBondContact CB-ND2 3.25Å; H272-N283 WeakPolarHBondContact CB-OD1 3.48Å; H272-N283 VanDerWaalsContact CG-CG 3.4Å; H272-N283 PolarHBondContact ND1-ND2 3.46Å; A274-N283 PolarHBondContact O-ND2 2.77Å; P275-N283 CarbonylContact C-O 3.58Å; P275-N283 VanDerWaalsContact CA-O 3.28Å; P275-N283 WeakPolarHBondContact CA-O 3.38Å; S276-N283 PolarHBondContact N-ND2 2.82Å; S276-N283 PolarHBondContact N-O 2.85Å; H281-N283 WeakPolarHBondContact ND1-CB 3.38Å; H281-N283 PolarHBondContact ND1-N 3.19Å; H281-N283 PolarHBondContact O-N 3.15Å
284	S	92.6	Very high	85.4	Confident	24 Å²	24	61.6 Å²	61.6	17%	0.168	34%	0.337	C	S	.	.	S	Bend	trans	-90.5	167.8	178.4	61.7	0	0	0	0	112.5	R217 H281 Y282 A286	R217-S284 PolarHBondContact NH2-O 3.24Å; H281-S284 WeakPolarHBondContact O-CB 3.49Å; H281-S284 PolarHBondContact O-N 2.82Å; H281-S284 VanDerWaalsContact O-N 3.15Å; H281-S284 PolarHBondContact O-OG 3.48Å; Y282-S284 PolarHBondContact O-N 3.25Å; S284-A286 PolarHBondContact O-N 2.91Å; S284-A286 VanDerWaalsContact O-N 3.07Å
285	Y	84.4	Confident	85.2	Confident	168 Å²	168	60.1 Å²	60.1	66%	0.659	33%	0.325	S	S	*	.	S	Bend	trans	-59.4	-17.8	177.6	-93	-69.4	0	0	0	114.6	R217 P275 T287	R217-Y285 PolarHBondContact NH2-O 2.8Å; P275-Y285 HydrophobicContact CB-CD1 4.44Å; P275-Y285 HydrophobicContact CB-CD2 3.86Å; P275-Y285 HydrophobicContact CB-CE2 4.04Å; P275-Y285 HydrophobicContact CB-CG 4.07Å; P275-Y285 HydrophobicContact CG-CD1 4.08Å; P275-Y285 HydrophobicContact CG-CD2 3.59Å; P275-Y285 HydrophobicContact CG-CE1 3.76Å; P275-Y285 HydrophobicContact CG-CE2 3.24Å; P275-Y285 HydrophobicContact CG-CG 4Å; Y285-T287 WeakPolarHBondContact O-CG2 3.48Å; Y285-T287 PolarHBondContact O-N 3.33Å
286	A	73.7	Confident	85	Confident	55 Å²	55	62.6 Å²	62.6	46%	0.455	34%	0.335	S	S	.	.			trans	-54.4	109	-171.6	0	0	0	0	0	112.6	R217 S284 K288	R217-A286 PolarHBondContact NH2-O 2.03Å; S284-A286 PolarHBondContact O-N 2.91Å; S284-A286 VanDerWaalsContact O-N 3.07Å; A286-K288 PolarHBondContact O-N 3.31Å
287	T	59.7	Low	84.9	Confident	105 Å²	105	65.1 Å²	65.1	64%	0.644	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.9	-167.5	51	0	0	0	0	115.1	Y285	Y285-T287 WeakPolarHBondContact O-CG2 3.48Å; Y285-T287 PolarHBondContact O-N 3.33Å
288	K	62	Low	85.1	Confident	195 Å²	195	59 Å²	59	85%	0.848	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-140.1	39.4	-172	-63.2	-173.1	177.4	-176.4	0	112.7	A286	A286-K288 PolarHBondContact O-N 3.31Å
289	S	68.5	Low	85.2	Confident	25 Å²	25	55.7 Å²	55.7	18%	0.175	29%	0.291	C	S	.	.			trans	-64.1	134.3	163.4	39.5	0	0	0	0	109.4	Q316	S289-Q316 PolarHBondContact O-NE2 3.4Å; S289-Q316 PolarHBondContact OG-NE2 2.81Å; S289-Q316 PolarHBondContact OG-OE1 2.62Å; S289-Q316 VanDerWaalsContact OG-OE1 3.12Å
290	D	83.1	Confident	85.5	Confident	107 Å²	107	48.9 Å²	48.9	57%	0.572	26%	0.255	S	S	*	.			trans	-58.2	148.7	160.4	172.8	66	0	0	0	110.2	G292 H293 L294	D290-G292 VanDerWaalsContact C-N 3.35Å; D290-G292 PolarHBondContact O-N 3.32Å; D290-G292 WeakPolarHBondContact OD2-CA 3.38Å; D290-G292 PolarHBondContact OD2-N 3.45Å; D290-H293 HydrophobicContact CB-CB 4.43Å; D290-H293 PolarHBondContact O-N 3Å; D290-H293 PolarHBondContact OD2-N 3.26Å; D290-L294 PolarHBondContact O-N 2.81Å
291	V	85.4	Confident	85.9	Confident	10 Å²	10	50.3 Å²	50.3	6%	0.061	25%	0.253	C	S	.	.	H	α-helix	trans	-64.4	-37.7	-175.9	65	0	0	0	0	112.2	A177 L294 L295 F318 V322 L325 L357	A177-V291 HydrophobicContact CB-CG1 4.41Å; V291-L294 PolarHBondContact O-N 3.38Å; V291-L295 PolarHBondContact O-N 3.36Å; V291-F318 HydrophobicContact CB-CD1 3.79Å; V291-F318 HydrophobicContact CB-CD2 4.41Å; V291-F318 HydrophobicContact CB-CE1 4.03Å; V291-F318 HydrophobicContact CB-CG 4.01Å; V291-F318 HydrophobicContact CB-CZ 4.45Å; V291-F318 HydrophobicContact CG2-CD1 4.15Å; V291-F318 HydrophobicContact CG2-CD2 4.01Å; V291-F318 HydrophobicContact CG2-CE1 4.09Å; V291-F318 HydrophobicContact CG2-CE2 3.93Å; V291-F318 HydrophobicContact CG2-CG 4.13Å; V291-F318 HydrophobicContact CG2-CZ 4Å; V291-V322 HydrophobicContact CG1-CG1 4.24Å; V291-V322 HydrophobicContact CG2-CG1 4.15Å; V291-L325 HydrophobicContact CG1-CD2 4.3Å; V291-L325 HydrophobicContact CG2-CB 3.82Å; V291-L325 HydrophobicContact CG2-CD2 4.17Å; V291-L357 HydrophobicContact CG2-CD1 3.99Å; V291-L357 HydrophobicContact CG2-CD2 4.34Å
292	G	86.6	Confident	86	Confident	8 Å²	8	49.6 Å²	49.6	8%	0.082	25%	0.25	C	C	.	.	H	α-helix	trans	-66	-46	175.1	0	0	0	0	0	112	D290 L294 L295 Q296	D290-G292 VanDerWaalsContact C-N 3.35Å; D290-G292 PolarHBondContact O-N 3.32Å; D290-G292 WeakPolarHBondContact OD2-CA 3.38Å; D290-G292 PolarHBondContact OD2-N 3.45Å; G292-L294 VanDerWaalsContact C-N 3.32Å; G292-L294 PolarHBondContact O-N 2.03Å; G292-L295 PolarHBondContact O-N 3.44Å; G292-Q296 WeakPolarHBondContact O-CB 3.5Å; G292-Q296 PolarHBondContact O-N 2.7Å
293	H	87.6	Confident	86.1	Confident	80 Å²	80	50 Å²	50	37%	0.37	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-38	174.3	-178.2	-99.8	0	0	0	111.9	D290 Q296 R297	D290-H293 HydrophobicContact CB-CB 4.43Å; D290-H293 PolarHBondContact O-N 3Å; D290-H293 PolarHBondContact OD2-N 3.26Å; H293-Q296 PolarHBondContact O-N 2.92Å; H293-R297 PolarHBondContact NE2-NE 3.24Å; H293-R297 PolarHBondContact NE2-NH2 3.44Å; H293-R297 VanDerWaalsContact O-CG 3.31Å; H293-R297 WeakPolarHBondContact O-CG 3.28Å; H293-R297 PolarHBondContact O-N 3.07Å
294	L	90.9	Very high	86.1	Confident	4 Å²	4	50.9 Å²	50.9	2%	0.021	26%	0.262	C	S	.	.	H	α-helix	trans	-63.4	-47.6	175.6	-176.6	66	0	0	0	111.7	D290 V291 G292 Q296 R297 F298 L312 F318 L357	D290-L294 PolarHBondContact O-N 2.81Å; V291-L294 PolarHBondContact O-N 3.38Å; G292-L294 VanDerWaalsContact C-N 3.32Å; G292-L294 PolarHBondContact O-N 2.03Å; L294-Q296 VanDerWaalsContact C-N 3.35Å; L294-Q296 PolarHBondContact O-N 3.35Å; L294-R297 PolarHBondContact O-N 3.41Å; L294-F298 WeakPolarHBondContact O-CB 3.28Å; L294-F298 PolarHBondContact O-N 3.15Å; L294-L312 HydrophobicContact CD1-CD2 4.45Å; L294-L312 HydrophobicContact CD2-CD2 4.2Å; L294-L312 HydrophobicContact CG-CD2 4.18Å; L294-F318 HydrophobicContact CD2-CE1 3.86Å; L294-F318 HydrophobicContact CD2-CZ 3.64Å; L294-L357 HydrophobicContact CB-CD2 4.32Å; L294-L357 HydrophobicContact CD2-CD2 4.02Å; L294-L357 HydrophobicContact CG-CD2 4.1Å
295	L	90.9	Very high	86.2	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-61.7	-42.5	177.3	-179.7	60.7	0	0	0	111.7	V291 G292 R297 F298 S299 L325 Y327 L357	V291-L295 PolarHBondContact O-N 3.36Å; G292-L295 PolarHBondContact O-N 3.44Å; L295-R297 PolarHBondContact O-N 3.05Å; L295-F298 HydrophobicContact CD1-CD1 4.37Å; L295-F298 PolarHBondContact O-N 2.79Å; L295-S299 WeakPolarHBondContact O-CB 3.34Å; L295-S299 PolarHBondContact O-N 3.44Å; L295-S299 PolarHBondContact O-OG 2.9Å; L295-L325 HydrophobicContact CB-CD2 3.94Å; L295-L325 HydrophobicContact CD2-CB 4.26Å; L295-L325 HydrophobicContact CD2-CD2 3.78Å; L295-L325 HydrophobicContact CD2-CG 3.58Å; L295-Y327 HydrophobicContact CD1-CE2 4.18Å; L295-Y327 HydrophobicContact CD2-CD2 3.89Å; L295-Y327 HydrophobicContact CD2-CE2 3.54Å; L295-Y327 HydrophobicContact CG-CD2 4.3Å; L295-Y327 HydrophobicContact CG-CE2 3.6Å; L295-L357 HydrophobicContact CB-CD2 3.8Å; L295-L357 HydrophobicContact CD1-CD2 4.38Å
296	Q	90	Very high	86.7	Confident	67 Å²	67	52.9 Å²	52.9	31%	0.313	28%	0.275	S	S	.	.	H	α-helix	trans	-59.4	-47.1	176.9	-175.5	177.3	59.8	0	0	111.1	G292 H293 L294 F298 S299 E300	G292-Q296 WeakPolarHBondContact O-CB 3.5Å; G292-Q296 PolarHBondContact O-N 2.7Å; H293-Q296 PolarHBondContact O-N 2.92Å; L294-Q296 VanDerWaalsContact C-N 3.35Å; L294-Q296 PolarHBondContact O-N 3.35Å; Q296-F298 PolarHBondContact O-N 3.45Å; Q296-S299 WeakPolarHBondContact O-CB 3.29Å; Q296-S299 PolarHBondContact O-N 3.13Å; Q296-E300 WeakPolarHBondContact O-CG 3.47Å; Q296-E300 PolarHBondContact O-N 2.81Å
297	R	92.2	Very high	87.7	Confident	65 Å²	65	51 Å²	51	25%	0.245	26%	0.257	C	S	.	.	H	α-helix	trans	-66.1	-35.3	177.3	-66.1	-50.4	-178.7	168.4	7.7	113.5	H293 L294 L295 E300 I301	H293-R297 PolarHBondContact NE2-NE 3.24Å; H293-R297 PolarHBondContact NE2-NH2 3.44Å; H293-R297 VanDerWaalsContact O-CG 3.31Å; H293-R297 WeakPolarHBondContact O-CG 3.28Å; H293-R297 PolarHBondContact O-N 3.07Å; L294-R297 PolarHBondContact O-N 3.41Å; L295-R297 PolarHBondContact O-N 3.05Å; R297-E300 VanDerWaalsContact CD-OE2 3.26Å; R297-E300 WeakPolarHBondContact CD-OE2 3.17Å; R297-E300 IonicContact CZ-OE2 3.36Å; R297-E300 IonicContact NE-OE2 2.79Å; R297-E300 IonicContact NH1-OE1 3.06Å; R297-E300 IonicContact NH1-OE2 3.11Å; R297-E300 PolarHBondContact NH1-OE2 3.08Å; R297-I301 WeakPolarHBondContact O-CD1 3.39Å; R297-I301 WeakPolarHBondContact O-CG1 3.07Å; R297-I301 PolarHBondContact O-N 3.16Å
298	F	95	Very high	89.5	Confident	0 Å²	0	46 Å²	46	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-63.9	-43.2	173	179.9	-116.6	0	0	0	111.2	V213 Y282 L294 L295 Q296 I301 E302 V310 L312 T355	V213-F298 HydrophobicContact CB-CE2 3.8Å; V213-F298 HydrophobicContact CB-CZ 4.09Å; V213-F298 HydrophobicContact CG1-CE2 4.15Å; V213-F298 HydrophobicContact CG2-CE2 3.8Å; V213-F298 HydrophobicContact CG2-CZ 3.95Å; Y282-F298 HydrophobicContact CD1-CD2 4.17Å; Y282-F298 AromaticContact CD2-CD2 3.92Å; Y282-F298 HydrophobicContact CD2-CD2 3.92Å; Y282-F298 HydrophobicContact CE1-CD2 4.17Å; Y282-F298 AromaticContact CE2-CD2 3.92Å; Y282-F298 HydrophobicContact CE2-CD2 3.92Å; Y282-F298 HydrophobicContact CE2-CE2 4.25Å; Y282-F298 HydrophobicContact CG-CB 4.35Å; Y282-F298 HydrophobicContact CG-CD2 4.07Å; L294-F298 WeakPolarHBondContact O-CB 3.28Å; L294-F298 PolarHBondContact O-N 3.15Å; L295-F298 HydrophobicContact CD1-CD1 4.37Å; L295-F298 PolarHBondContact O-N 2.79Å; Q296-F298 PolarHBondContact O-N 3.45Å; F298-I301 PolarHBondContact O-N 3.27Å; F298-E302 HydrophobicContact CD2-CB 3.96Å; F298-E302 HydrophobicContact CD2-CG 3.86Å; F298-E302 HydrophobicContact CE2-CB 3.65Å; F298-E302 HydrophobicContact CE2-CG 3.67Å; F298-E302 HydrophobicContact CZ-CB 4.14Å; F298-E302 PolarHBondContact O-N 2.83Å; F298-V310 HydrophobicContact CE1-CG1 4.13Å; F298-V310 WeakPolarHBondContact CE1-O 3.21Å; F298-V310 HydrophobicContact CZ-CG1 3.74Å; F298-L312 HydrophobicContact CB-CD2 4.24Å; F298-L312 HydrophobicContact CD1-CB 3.83Å; F298-L312 HydrophobicContact CD2-CB 3.91Å; F298-L312 HydrophobicContact CD2-CD1 4.16Å; F298-L312 HydrophobicContact CD2-CD2 4.07Å; F298-L312 HydrophobicContact CD2-CG 4.28Å; F298-L312 HydrophobicContact CE1-CB 3.64Å; F298-L312 HydrophobicContact CE2-CB 3.72Å; F298-L312 HydrophobicContact CE2-CD1 4.02Å; F298-L312 HydrophobicContact CE2-CG 4.33Å; F298-L312 HydrophobicContact CG-CB 3.96Å; F298-L312 HydrophobicContact CG-CD2 4.09Å; F298-L312 HydrophobicContact CZ-CB 3.57Å; F298-T355 HydrophobicContact CD1-CG2 4.32Å; F298-T355 HydrophobicContact CE1-CG2 4.3Å
299	S	92.8	Very high	91.2	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.007	19%	0.186	C	C	.	.	H	α-helix	trans	-64.9	-43.4	177.8	-49.7	0	0	0	0	112.8	L295 Q296 I301 G303 Y327 T355	L295-S299 WeakPolarHBondContact O-CB 3.34Å; L295-S299 PolarHBondContact O-N 3.44Å; L295-S299 PolarHBondContact O-OG 2.9Å; Q296-S299 WeakPolarHBondContact O-CB 3.29Å; Q296-S299 PolarHBondContact O-N 3.13Å; S299-I301 PolarHBondContact O-N 3.21Å; S299-G303 PolarHBondContact O-N 2.89Å; S299-Y327 WeakPolarHBondContact OG-CE2 3.18Å; S299-T355 PolarHBondContact OG-OG1 3.47Å
300	E	92.2	Very high	92.6	Very high	38 Å²	38	35.5 Å²	35.5	18%	0.178	18%	0.177	C	C	.	.	H	α-helix	trans	-60.5	-21.6	176.2	-77	-175.4	157.2	0	0	113.9	Q296 R297 V351	Q296-E300 WeakPolarHBondContact O-CG 3.47Å; Q296-E300 PolarHBondContact O-N 2.81Å; R297-E300 VanDerWaalsContact CD-OE2 3.26Å; R297-E300 WeakPolarHBondContact CD-OE2 3.17Å; R297-E300 IonicContact CZ-OE2 3.36Å; R297-E300 IonicContact NE-OE2 2.79Å; R297-E300 IonicContact NH1-OE1 3.06Å; R297-E300 IonicContact NH1-OE2 3.11Å; R297-E300 PolarHBondContact NH1-OE2 3.08Å; E300-V351 HydrophobicContact CG-CG2 4.32Å
301	I	94	Very high	93.3	Very high	68 Å²	68	30.4 Å²	30.4	35%	0.349	15%	0.15	S	C	.	.	H	α-helix	trans	-115.1	-40.5	-171.1	-63	171	0	0	0	112.6	Y282 R297 F298 S299	Y282-I301 HydrophobicContact CD1-CB 4.18Å; Y282-I301 HydrophobicContact CD1-CD1 4.03Å; Y282-I301 HydrophobicContact CD1-CG2 4.28Å; Y282-I301 HydrophobicContact CE1-CB 4.12Å; Y282-I301 HydrophobicContact CE1-CG2 3.8Å; R297-I301 WeakPolarHBondContact O-CD1 3.39Å; R297-I301 WeakPolarHBondContact O-CG1 3.07Å; R297-I301 PolarHBondContact O-N 3.16Å; F298-I301 PolarHBondContact O-N 3.27Å; S299-I301 PolarHBondContact O-N 3.21Å
302	E	96.1	Very high	93.9	Very high	13 Å²	13	30 Å²	30	6%	0.061	15%	0.148	C	C	.	.	H	α-helix	trans	-114.2	-18	-170.6	-61.9	-65.3	169.4	0	0	114.8	K211 Y282 F298 S304 V310	K211-E302 VanDerWaalsContact CE-OE2 3.28Å; K211-E302 WeakPolarHBondContact CE-OE2 3.44Å; K211-E302 PolarHBondContact NZ-O 3.47Å; K211-E302 IonicContact NZ-OE2 3.34Å; K211-E302 PolarHBondContact NZ-OE2 2.71Å; Y282-E302 HydrophobicContact CD1-CG 4.45Å; Y282-E302 HydrophobicContact CE1-CG 3.44Å; Y282-E302 VanDerWaalsContact CE1-CG 3.44Å; Y282-E302 VanDerWaalsContact OH-CD 3.23Å; Y282-E302 VanDerWaalsContact OH-CG 3.28Å; Y282-E302 WeakPolarHBondContact OH-CG 3.33Å; Y282-E302 PolarHBondContact OH-OE1 3.18Å; F298-E302 HydrophobicContact CD2-CB 3.96Å; F298-E302 HydrophobicContact CD2-CG 3.86Å; F298-E302 HydrophobicContact CE2-CB 3.65Å; F298-E302 HydrophobicContact CE2-CG 3.67Å; F298-E302 HydrophobicContact CZ-CB 4.14Å; F298-E302 PolarHBondContact O-N 2.83Å; E302-S304 PolarHBondContact O-N 3.11Å; E302-V310 HydrophobicContact CB-CG1 4.17Å
303	G	95.6	Very high	94.4	Very high	14 Å²	14	29.7 Å²	29.7	14%	0.144	14%	0.144	C	C	.	.			trans	-58.7	133.7	176.7	0	0	0	0	0	111.2	S299	S299-G303 PolarHBondContact O-N 2.89Å
304	S	94.9	Very high	94.8	Very high	19 Å²	19	25.9 Å²	25.9	13%	0.133	13%	0.126	C	C	.	.			trans	-154.7	145	-178.2	176.8	0	0	0	0	112.4	E302 D306 N354	E302-S304 PolarHBondContact O-N 3.11Å; S304-D306 PolarHBondContact O-N 3.19Å; S304-D306 PolarHBondContact OG-N 3.33Å; S304-D306 PolarHBondContact OG-OD2 2.93Å; S304-N354 PolarHBondContact N-OD1 3.21Å; S304-N354 PolarHBondContact O-ND2 2.7Å
305	K	94.1	Very high	94.7	Very high	143 Å²	143	25.9 Å²	25.9	62%	0.622	13%	0.127	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-16.1	167.7	61.4	168.8	-172.8	173.1	0	115.2	F307 Y352	K305-F307 PolarHBondContact O-N 2.88Å; K305-Y352 HydrophobicContact CB-CD1 4.24Å; K305-Y352 HydrophobicContact CB-CE1 3.62Å; K305-Y352 HydrophobicContact CG-CE1 4.26Å
306	D	94.6	Very high	94.6	Very high	91 Å²	91	26 Å²	26	49%	0.487	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-5	-174	-50	-44.2	0	0	0	113.2	K267 S304	K267-D306 PolarHBondContact NZ-O 3.21Å; S304-D306 PolarHBondContact O-N 3.19Å; S304-D306 PolarHBondContact OG-N 3.33Å; S304-D306 PolarHBondContact OG-OD2 2.93Å
307	F	95.8	Very high	94.2	Very high	16 Å²	16	25.6 Å²	25.6	7%	0.07	13%	0.131	C	C	.	.	S	Bend	trans	-135.5	149.2	-177.7	-54.8	-85.6	0	0	0	109.2	K211 K267 K268 K305 V310 N354	K211-F307 HydrophobicContact CB-CB 4.34Å; K211-F307 HydrophobicContact CB-CD1 3.59Å; K211-F307 HydrophobicContact CB-CD2 3.86Å; K211-F307 HydrophobicContact CB-CE1 3.76Å; K211-F307 HydrophobicContact CB-CE2 4.05Å; K211-F307 HydrophobicContact CB-CG 3.64Å; K211-F307 HydrophobicContact CB-CZ 4Å; K211-F307 HydrophobicContact CD-CD2 3.92Å; K211-F307 HydrophobicContact CD-CE2 3.67Å; K211-F307 HydrophobicContact CD-CZ 4.07Å; K211-F307 HydrophobicContact CG-CE2 4.36Å; K211-F307 HydrophobicContact CG-CZ 4.35Å; K267-F307 HydrophobicContact CB-CD1 4.04Å; K267-F307 HydrophobicContact CB-CE1 3.86Å; K267-F307 HydrophobicContact CD-CD1 3.92Å; K267-F307 HydrophobicContact CD-CE1 3.8Å; K267-F307 HydrophobicContact CG-CD1 4.26Å; K267-F307 HydrophobicContact CG-CE1 3.8Å; K268-F307 HydrophobicContact CB-CE1 3.73Å; K268-F307 HydrophobicContact CB-CZ 3.91Å; K268-F307 HydrophobicContact CD-CZ 4.09Å; K305-F307 PolarHBondContact O-N 2.88Å; F307-V310 HydrophobicContact CB-CG2 4.2Å; F307-V310 HydrophobicContact CD2-CG2 4.37Å; F307-N354 PolarHBondContact O-ND2 3.29Å
308	C	97.1	Very high	93.5	Very high	0 Å²	0	23 Å²	23	0%	0	12%	0.121	C	C	.	.	S	Bend	trans	-64.4	-45.1	170.7	170.6	0	0	0	0	111.1	C208 S209 C340 N354 C442 F443	C208-C308 VanDerWaalsContact CA-SG 3.56Å; C208-C308 HydrophobicContact CB-CB 3.87Å; C208-C308 WeakPolarHBondContact CB-SG 3.39Å; C208-C308 WeakPolarHBondContact SG-CB 3.44Å; C208-C308 CovalentContact SG-SG 2.04Å; C208-C308 PolarHBondContact SG-SG 3.46Å; S209-C308 VanDerWaalsContact N-CB 3.33Å; S209-C308 WeakPolarHBondContact O-CA 3.31Å; S209-C308 WeakPolarHBondContact O-CB 3.47Å; S209-C308 PolarHBondContact O-N 2.8Å; S209-C308 PolarHBondContact OG-N 2.99Å; C308-C340 PolarHBondContact O-N 2.99Å; C308-N354 PolarHBondContact O-ND2 3.44Å; C308-C442 VanDerWaalsContact CA-SG 3.56Å; C308-F443 VanDerWaalsContact SG-CE2 3.53Å
309	L	97.2	Very high	92.5	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	156	172.8	-63.8	174.4	0	0	0	112.7	S209 L210 K211 F264 I339 N354 F381 N384	S209-L309 PolarHBondContact O-N 2.89Å; L210-L309 HydrophobicContact CD2-CB 3.75Å; L210-L309 HydrophobicContact CD2-CD1 4.39Å; K211-L309 PolarHBondContact N-O 3.04Å; F264-L309 HydrophobicContact CE1-CD1 4.27Å; L309-I339 HydrophobicContact CD1-CG2 3.86Å; L309-I339 HydrophobicContact CD2-CB 4.39Å; L309-I339 HydrophobicContact CD2-CG2 3.75Å; L309-I339 HydrophobicContact CG-CG2 3.79Å; L309-N354 CarbonylContact C-O 3.56Å; L309-N354 WeakPolarHBondContact CA-O 3.43Å; L309-N354 HydrophobicContact CD2-CB 4.22Å; L309-F381 HydrophobicContact CD1-CD1 4.42Å; L309-N384 HydrophobicContact CD1-CB 3.67Å; L309-N384 HydrophobicContact CD2-CB 3.69Å; L309-N384 WeakPolarHBondContact CD2-OD1 3.26Å; L309-N384 HydrophobicContact CG-CB 4.35Å
310	V	98.2	Very high	91.2	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	118	174.5	-173.2	0	0	0	0	109.3	K211 F298 E302 F307 N354 T355 A356	K211-V310 HydrophobicContact CB-CB 4.41Å; K211-V310 HydrophobicContact CB-CG1 4.08Å; K211-V310 HydrophobicContact CB-CG2 4.15Å; K211-V310 HydrophobicContact CD-CG1 3.69Å; K211-V310 HydrophobicContact CD-CG2 4.18Å; K211-V310 HydrophobicContact CG-CG1 3.9Å; K211-V310 CarbonylContact O-C 3.49Å; K211-V310 VanDerWaalsContact O-CA 3.28Å; K211-V310 WeakPolarHBondContact O-CA 3.39Å; F298-V310 HydrophobicContact CE1-CG1 4.13Å; F298-V310 WeakPolarHBondContact CE1-O 3.21Å; F298-V310 HydrophobicContact CZ-CG1 3.74Å; E302-V310 HydrophobicContact CB-CG1 4.17Å; F307-V310 HydrophobicContact CB-CG2 4.2Å; F307-V310 HydrophobicContact CD2-CG2 4.37Å; V310-N354 PolarHBondContact N-O 3.2Å; V310-T355 HydrophobicContact CB-CG2 4.2Å; V310-T355 VanDerWaalsContact O-CA 3.27Å; V310-T355 WeakPolarHBondContact O-CA 3.41Å; V310-A356 PolarHBondContact O-N 2.84Å
311	H	98.4	Very high	89.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	135.7	-172.2	-157	79.6	0	0	0	113.2	K211 L212 V213 F313 A356 T358 F381	K211-H311 PolarHBondContact O-N 2.81Å; L212-H311 HydrophobicContact CD2-CB 4.47Å; V213-H311 PolarHBondContact N-O 2.83Å; H311-F313 HydrophobicContact CB-CE2 4.39Å; H311-F313 AromaticContact CD2-CD2 3.87Å; H311-F313 AromaticContact CD2-CE1 3.95Å; H311-F313 AromaticContact CD2-CE2 3.51Å; H311-F313 AromaticContact CD2-CZ 3.55Å; H311-A356 WeakPolarHBondContact CA-O 3.2Å; H311-A356 WeakPolarHBondContact ND1-CB 3.49Å; H311-A356 PolarHBondContact ND1-O 2.55Å; H311-T358 PolarHBondContact CE1-OG1 2.92Å; H311-T358 PolarHBondContact NE2-N 2.75Å; H311-T358 PolarHBondContact NE2-OG1 2.84Å; H311-F381 HydrophobicContact CB-CE1 4.06Å; H311-F381 AromaticContact CE1-CE1 3.98Å; H311-F381 AromaticContact CG-CE1 3.77Å; H311-F381 AromaticContact ND1-CD1 4Å; H311-F381 AromaticContact ND1-CE1 3.49Å; H311-F381 WeakPolarHBondContact ND1-CE1 3.41Å
312	L	98.1	Very high	88.8	Confident	1 Å²	1	27.3 Å²	27.3	1%	0.005	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	121.8	174.3	178.8	64	0	0	0	111	V213 D215 Y282 L294 F298 A356 L357 T358	V213-L312 HydrophobicContact CB-CD1 4.3Å; V213-L312 HydrophobicContact CG1-CD1 4.14Å; V213-L312 CarbonylContact O-C 3.39Å; V213-L312 WeakPolarHBondContact O-CA 3.42Å; D215-L312 HydrophobicContact CB-CD1 4.33Å; Y282-L312 HydrophobicContact CD2-CD1 3.99Å; Y282-L312 HydrophobicContact CD2-CD2 4.17Å; Y282-L312 HydrophobicContact CE2-CD1 3.95Å; L294-L312 HydrophobicContact CD1-CD2 4.45Å; L294-L312 HydrophobicContact CD2-CD2 4.2Å; L294-L312 HydrophobicContact CG-CD2 4.18Å; F298-L312 HydrophobicContact CB-CD2 4.24Å; F298-L312 HydrophobicContact CD1-CB 3.83Å; F298-L312 HydrophobicContact CD2-CB 3.91Å; F298-L312 HydrophobicContact CD2-CD1 4.16Å; F298-L312 HydrophobicContact CD2-CD2 4.07Å; F298-L312 HydrophobicContact CD2-CG 4.28Å; F298-L312 HydrophobicContact CE1-CB 3.64Å; F298-L312 HydrophobicContact CE2-CB 3.72Å; F298-L312 HydrophobicContact CE2-CD1 4.02Å; F298-L312 HydrophobicContact CE2-CG 4.33Å; F298-L312 HydrophobicContact CG-CB 3.96Å; F298-L312 HydrophobicContact CG-CD2 4.09Å; F298-L312 HydrophobicContact CZ-CB 3.57Å; L312-A356 PolarHBondContact N-O 3.33Å; L312-L357 HydrophobicContact CB-CB 3.75Å; L312-L357 HydrophobicContact CD2-CB 4.29Å; L312-L357 HydrophobicContact CG-CB 4.31Å; L312-L357 CarbonylContact O-C 3.6Å; L312-L357 WeakPolarHBondContact O-CA 3.41Å; L312-L357 WeakPolarHBondContact O-CB 3.34Å; L312-T358 PolarHBondContact O-N 3.02Å
313	F	97.1	Very high	88.1	Confident	1 Å²	1	27 Å²	27	0%	0.004	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127	166.2	-68.7	-85.1	0	0	0	109.8	L212 V213 A214 D215 F218 L234 L237 I238 H311 T358 T377	L212-F313 HydrophobicContact CB-CD2 4.46Å; L212-F313 HydrophobicContact CB-CE2 4.29Å; L212-F313 HydrophobicContact CD1-CE2 4.49Å; L212-F313 HydrophobicContact CD2-CE2 4.26Å; V213-F313 PolarHBondContact O-N 3.42Å; A214-F313 WeakPolarHBondContact CA-O 3.24Å; D215-F313 PolarHBondContact N-O 3.25Å; F218-F313 HydrophobicContact CD1-CB 4.45Å; F218-F313 HydrophobicContact CD2-CB 3.67Å; F218-F313 HydrophobicContact CE1-CB 4.43Å; F218-F313 HydrophobicContact CE2-CB 3.64Å; F218-F313 HydrophobicContact CE2-CD1 4.18Å; F218-F313 HydrophobicContact CE2-CG 4.25Å; F218-F313 HydrophobicContact CG-CB 4.08Å; F218-F313 HydrophobicContact CZ-CB 4.03Å; F218-F313 HydrophobicContact CZ-CG 4.44Å; L234-F313 HydrophobicContact CD2-CB 4.01Å; L234-F313 HydrophobicContact CD2-CD1 4.12Å; L234-F313 HydrophobicContact CD2-CD2 3.33Å; L234-F313 HydrophobicContact CD2-CE1 4.45Å; L234-F313 HydrophobicContact CD2-CE2 3.71Å; L234-F313 HydrophobicContact CD2-CG 3.55Å; L234-F313 HydrophobicContact CD2-CZ 4.26Å; L237-F313 HydrophobicContact CD1-CE1 3.97Å; L237-F313 HydrophobicContact CD2-CE1 3.9Å; L237-F313 HydrophobicContact CD2-CZ 3.85Å; I238-F313 HydrophobicContact CD1-CZ 4.25Å; H311-F313 HydrophobicContact CB-CE2 4.39Å; H311-F313 AromaticContact CD2-CD2 3.87Å; H311-F313 AromaticContact CD2-CE1 3.95Å; H311-F313 AromaticContact CD2-CE2 3.51Å; H311-F313 AromaticContact CD2-CZ 3.55Å; F313-T358 WeakPolarHBondContact CA-O 3.27Å; F313-T377 HydrophobicContact CE1-CG2 4.14Å; F313-T377 HydrophobicContact CZ-CG2 3.94Å
314	T	94.5	Very high	87.7	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	161.3	-179.9	-176	0	0	0	0	111.5	D215 Q316 F318 T358 S359 V360	D215-T314 VanDerWaalsContact CG-OG1 3.29Å; D215-T314 WeakPolarHBondContact OD2-CB 3.39Å; D215-T314 PolarHBondContact OD2-OG1 3.03Å; T314-Q316 HydrophobicContact CG2-CB 4.09Å; T314-Q316 WeakPolarHBondContact OG1-CB 3.37Å; T314-Q316 PolarHBondContact OG1-N 2.98Å; T314-F318 HydrophobicContact CG2-CE2 4.21Å; T314-F318 HydrophobicContact CG2-CZ 4.06Å; T314-T358 PolarHBondContact N-O 2.8Å; T314-S359 WeakPolarHBondContact O-CA 3.35Å; T314-V360 WeakPolarHBondContact O-CG2 3.43Å; T314-V360 PolarHBondContact O-N 2.98Å
315	A	89.2	Confident	87.4	Confident	5 Å²	5	25.6 Å²	25.6	4%	0.041	16%	0.16	C	C	.	.			trans	-111	35.8	162.1	0	0	0	0	0	111.2	R217 D221 V360 R361	R217-A315 HydrophobicContact CB-CB 3.89Å; D221-A315 HydrophobicContact CB-CB 3.91Å; A315-V360 HydrophobicContact CB-CG2 4.08Å; A315-R361 HydrophobicContact CB-CG 3.75Å; A315-R361 WeakPolarHBondContact O-CG 3.44Å
316	Q	89.2	Confident	87.2	Confident	3 Å²	3	19 Å²	19	1%	0.014	13%	0.132	C	C	.	.	P	Polyproline II helix	trans	-86.1	120.3	172.1	-178.6	171.1	-25.7	0	0	110.8	S289 T314 F318 S359	S289-Q316 PolarHBondContact O-NE2 3.4Å; S289-Q316 PolarHBondContact OG-NE2 2.81Å; S289-Q316 PolarHBondContact OG-OE1 2.62Å; S289-Q316 VanDerWaalsContact OG-OE1 3.12Å; T314-Q316 HydrophobicContact CG2-CB 4.09Å; T314-Q316 WeakPolarHBondContact OG1-CB 3.37Å; T314-Q316 PolarHBondContact OG1-N 2.98Å; Q316-F318 HydrophobicContact CB-CE1 4.2Å; Q316-F318 HydrophobicContact CB-CZ 4.16Å; Q316-F318 HydrophobicContact CG-CD1 4.17Å; Q316-F318 HydrophobicContact CG-CE1 3.77Å; Q316-F318 HydrophobicContact CG-CZ 4.24Å; Q316-F318 PolarHBondContact O-N 3.27Å; Q316-S359 WeakPolarHBondContact O-CB 3.5Å; Q316-S359 PolarHBondContact O-OG 2.63Å
317	P	81	Confident	87.1	Confident	59 Å²	59	16.8 Å²	16.8	38%	0.383	12%	0.118	S	C	.	.	P	Polyproline II helix	trans	-69.9	129.6	168.7	30.4	-33.9	0	0	0	109.8	R361 S362	P317-R361 HydrophobicContact CB-CB 4.37Å; P317-S362 WeakPolarHBondContact CB-O 3.35Å
318	F	79.1	Confident	86.8	Confident	10 Å²	10	18.7 Å²	18.7	4%	0.044	13%	0.128	C	C	.	.	P	Polyproline II helix	trans	-103.4	153.9	172.1	-55.6	-66.5	0	0	0	111.4	V291 L294 T314 Q316 V322 L357 S363	V291-F318 HydrophobicContact CB-CD1 3.79Å; V291-F318 HydrophobicContact CB-CD2 4.41Å; V291-F318 HydrophobicContact CB-CE1 4.03Å; V291-F318 HydrophobicContact CB-CG 4.01Å; V291-F318 HydrophobicContact CB-CZ 4.45Å; V291-F318 HydrophobicContact CG2-CD1 4.15Å; V291-F318 HydrophobicContact CG2-CD2 4.01Å; V291-F318 HydrophobicContact CG2-CE1 4.09Å; V291-F318 HydrophobicContact CG2-CE2 3.93Å; V291-F318 HydrophobicContact CG2-CG 4.13Å; V291-F318 HydrophobicContact CG2-CZ 4Å; L294-F318 HydrophobicContact CD2-CE1 3.86Å; L294-F318 HydrophobicContact CD2-CZ 3.64Å; T314-F318 HydrophobicContact CG2-CE2 4.21Å; T314-F318 HydrophobicContact CG2-CZ 4.06Å; Q316-F318 HydrophobicContact CB-CE1 4.2Å; Q316-F318 HydrophobicContact CB-CZ 4.16Å; Q316-F318 HydrophobicContact CG-CD1 4.17Å; Q316-F318 HydrophobicContact CG-CE1 3.77Å; Q316-F318 HydrophobicContact CG-CZ 4.24Å; Q316-F318 PolarHBondContact O-N 3.27Å; F318-V322 HydrophobicContact CB-CB 4.15Å; F318-L357 HydrophobicContact CE2-CD1 3.61Å; F318-L357 HydrophobicContact CZ-CD1 3.82Å; F318-S363 VanDerWaalsContact O-CA 3.23Å; F318-S363 WeakPolarHBondContact O-CA 3.08Å; F318-S363 WeakPolarHBondContact O-CB 3.44Å; F318-S363 PolarHBondContact O-OG 3.42Å
319	S	73.2	Confident	86.6	Confident	110 Å²	110	18.9 Å²	18.9	77%	0.769	13%	0.129	S	C	*	.	G	3₁₀ helix	trans	-68.6	163.5	174.8	-60.4	0	0	0	0	112.1	G321 V322	S319-G321 VanDerWaalsContact C-N 3.31Å; S319-G321 PolarHBondContact O-N 2.76Å; S319-V322 PolarHBondContact O-N 2.83Å
320	G	65	Low	86.3	Confident	60 Å²	60	21.1 Å²	21.1	62%	0.619	15%	0.145	S	C	*	.	G	3₁₀ helix	trans	80.4	-4.1	168.7	0	0	0	0	0	117.1
321	G	65.4	Low	85.9	Confident	19 Å²	19	24 Å²	24	20%	0.196	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	98.5	-1.7	-172	0	0	0	0	0	113.9	Q174 S319 L323 S363	Q174-G321 CarbonylContact O-C 3.54Å; Q174-G321 WeakPolarHBondContact O-CA 3.29Å; S319-G321 VanDerWaalsContact C-N 3.31Å; S319-G321 PolarHBondContact O-N 2.76Å; G321-L323 PolarHBondContact O-N 2.6Å; G321-S363 WeakPolarHBondContact CA-OG 3.32Å; G321-S363 PolarHBondContact N-OG 2.74Å
322	V	71.7	Confident	85.4	Confident	10 Å²	10	29.8 Å²	29.8	6%	0.061	19%	0.189	C	C	.	.			trans	-67.7	125.1	-171.9	-178.1	0	0	0	0	111.4	Q174 F175 A177 V291 F318 S319 G324	Q174-V322 PolarHBondContact O-N 3.01Å; F175-V322 CarbonylContact O-C 3.54Å; F175-V322 VanDerWaalsContact O-CA 3.31Å; F175-V322 WeakPolarHBondContact O-CA 3.19Å; A177-V322 HydrophobicContact CB-CG2 4.45Å; V291-V322 HydrophobicContact CG1-CG1 4.24Å; V291-V322 HydrophobicContact CG2-CG1 4.15Å; F318-V322 HydrophobicContact CB-CB 4.15Å; S319-V322 PolarHBondContact O-N 2.83Å; V322-G324 WeakPolarHBondContact CG1-O 3.21Å
323	L	80.8	Confident	84.9	Confident	5 Å²	5	34.8 Å²	34.8	3%	0.026	22%	0.216	C	C	.	.			trans	-109.6	-14.7	172.7	-66.7	-176.8	0	0	0	113	F175 G321 T358 S359 V368 E372 V376	F175-L323 HydrophobicContact CD2-CD1 4.17Å; F175-L323 HydrophobicContact CE2-CD1 3.8Å; F175-L323 PolarHBondContact O-N 2.89Å; G321-L323 PolarHBondContact O-N 2.6Å; L323-T358 CarbonylContact O-C 3.57Å; L323-T358 WeakPolarHBondContact O-CA 3.43Å; L323-S359 PolarHBondContact O-N 2.8Å; L323-V368 HydrophobicContact CD1-CG2 4.26Å; L323-V368 HydrophobicContact CD2-CG2 3.98Å; L323-E372 HydrophobicContact CD1-CG 4.29Å; L323-E372 WeakPolarHBondContact CD1-OE1 3.12Å; L323-V376 HydrophobicContact CB-CG1 3.84Å; L323-V376 HydrophobicContact CB-CG2 3.78Å; L323-V376 HydrophobicContact CD1-CG2 3.65Å; L323-V376 HydrophobicContact CG-CG2 4.38Å
324	G	87.4	Confident	84	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156	169.5	177.5	0	0	0	0	0	114.3	V322 L357 E380	V322-G324 WeakPolarHBondContact CG1-O 3.21Å; G324-L357 WeakPolarHBondContact CA-O 3.17Å; G324-E380 VanDerWaalsContact C-CD 3.48Å; G324-E380 WeakPolarHBondContact CA-OE1 3.41Å
325	L	89	Confident	83.4	Confident	4 Å²	4	38.9 Å²	38.9	2%	0.021	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.1	135.7	171.9	-178.1	65.3	0	0	0	110.1	A177 V291 L295 A356 L357 E380	A177-L325 VanDerWaalsContact C-CD1 3.43Å; A177-L325 HydrophobicContact CB-CD1 4.03Å; A177-L325 WeakPolarHBondContact O-CD1 3.41Å; V291-L325 HydrophobicContact CG1-CD2 4.3Å; V291-L325 HydrophobicContact CG2-CB 3.82Å; V291-L325 HydrophobicContact CG2-CD2 4.17Å; L295-L325 HydrophobicContact CB-CD2 3.94Å; L295-L325 HydrophobicContact CD2-CB 4.26Å; L295-L325 HydrophobicContact CD2-CD2 3.78Å; L295-L325 HydrophobicContact CD2-CG 3.58Å; L325-A356 CarbonylContact O-C 3.25Å; L325-A356 VanDerWaalsContact O-CA 3.25Å; L325-A356 WeakPolarHBondContact O-CA 3.42Å; L325-L357 HydrophobicContact CB-CG 4.43Å; L325-L357 PolarHBondContact N-O 3.02Å; L325-L357 VanDerWaalsContact N-O 3.12Å; L325-L357 PolarHBondContact O-N 2.69Å; L325-E380 VanDerWaalsContact CA-OE2 3.28Å; L325-E380 WeakPolarHBondContact CA-OE2 3.47Å; L325-E380 VanDerWaalsContact N-CD 3.27Å; L325-E380 PolarHBondContact N-OE1 2.88Å; L325-E380 PolarHBondContact N-OE2 3.01Å
326	G	90.3	Very high	83.2	Confident	4 Å²	4	40.3 Å²	40.3	4%	0.041	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	153.1	178.1	0	0	0	0	0	113.5	E380	G326-E380 PolarHBondContact N-OE2 2.63Å
327	Y	90.7	Very high	83.2	Confident	45 Å²	45	40.2 Å²	40.2	18%	0.176	26%	0.26	C	S	.	.	P	Polyproline II helix	trans	-77.5	132.2	172.8	-66.4	-76.8	0	0	0	111.1	L295 S299 G338 F353 T355 N384	L295-Y327 HydrophobicContact CD1-CE2 4.18Å; L295-Y327 HydrophobicContact CD2-CD2 3.89Å; L295-Y327 HydrophobicContact CD2-CE2 3.54Å; L295-Y327 HydrophobicContact CG-CD2 4.3Å; L295-Y327 HydrophobicContact CG-CE2 3.6Å; S299-Y327 WeakPolarHBondContact OG-CE2 3.18Å; Y327-G338 WeakPolarHBondContact O-CA 3.34Å; Y327-G338 PolarHBondContact O-N 2.94Å; Y327-F353 WeakPolarHBondContact CB-O 3.27Å; Y327-F353 HydrophobicContact CD1-CD1 4.38Å; Y327-F353 HydrophobicContact CD2-CB 4.03Å; Y327-F353 AromaticContact CD2-CD1 4Å; Y327-F353 HydrophobicContact CD2-CD1 4Å; Y327-F353 AromaticContact CE1-CD1 3.95Å; Y327-F353 HydrophobicContact CE1-CD1 3.95Å; Y327-F353 HydrophobicContact CE1-CE1 4.39Å; Y327-F353 HydrophobicContact CE2-CB 4.42Å; Y327-F353 AromaticContact CE2-CD1 3.52Å; Y327-F353 HydrophobicContact CE2-CD1 3.52Å; Y327-F353 HydrophobicContact CE2-CE1 4.26Å; Y327-F353 HydrophobicContact CE2-CG 4.44Å; Y327-F353 HydrophobicContact CG-CB 4.09Å; Y327-F353 HydrophobicContact CG-CD1 4.4Å; Y327-F353 AromaticContact CZ-CD1 3.5Å; Y327-F353 VanDerWaalsContact CZ-CD1 3.5Å; Y327-F353 AromaticContact CZ-CE1 3.88Å; Y327-T355 VanDerWaalsContact CD2-OG1 3.27Å; Y327-T355 WeakPolarHBondContact CD2-OG1 3.45Å; Y327-T355 WeakPolarHBondContact CE2-OG1 3.5Å; Y327-T355 PolarHBondContact N-O 3.32Å; Y327-N384 PolarHBondContact N-ND2 2.77Å; Y327-N384 WeakPolarHBondContact O-CA 3.17Å; Y327-N384 PolarHBondContact O-ND2 3.27Å
328	I	91.3	Very high	83.7	Confident	57 Å²	57	37.4 Å²	37.4	29%	0.292	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-82	130.9	-179.1	-57.9	170.4	0	0	0	110.3	V178 H383	V178-I328 HydrophobicContact CG1-CD1 4.03Å; V178-I328 HydrophobicContact CG2-CD1 4.31Å; I328-H383 VanDerWaalsContact CA-O 3.26Å; I328-H383 WeakPolarHBondContact CA-O 3.36Å; I328-H383 HydrophobicContact CG1-CB 3.89Å
329	A	91.9	Very high	84.5	Confident	3 Å²	3	37 Å²	37	3%	0.025	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-77	131	173.2	0	0	0	0	0	112.1	G337 I339 H383 N384 G386 V434	A329-G337 WeakPolarHBondContact CA-O 3.41Å; A329-I339 HydrophobicContact CB-CG1 4.24Å; A329-H383 PolarHBondContact N-O 3.11Å; A329-N384 WeakPolarHBondContact CB-O 3.35Å; A329-G386 WeakPolarHBondContact O-CA 3.38Å; A329-V434 HydrophobicContact CB-CG1 3.7Å
330	S	90.3	Very high	85.5	Confident	48 Å²	48	32.5 Å²	32.5	34%	0.336	21%	0.208	S	C	.	.	P	Polyproline II helix	trans	-87.6	148.2	164.8	-173.4	0	0	0	0	111.1	K332 T335 K438	S330-K332 PolarHBondContact O-N 2.84Å; S330-K332 PolarHBondContact OG-N 3.09Å; S330-T335 WeakPolarHBondContact CB-OG1 3.05Å; S330-K438 WeakPolarHBondContact O-CE 3.49Å; S330-K438 PolarHBondContact O-NZ 2.82Å
331	P	90.4	Very high	86.6	Confident	61 Å²	61	30 Å²	30	40%	0.396	18%	0.181	S	C	.	.	S	Bend	trans	-71.1	-9.8	167.7	30.4	-36.4	0	0	0	113.1	L333 A433 V434 A437	P331-L333 PolarHBondContact O-N 2.83Å; P331-A433 HydrophobicContact CB-CB 4.11Å; P331-A433 HydrophobicContact CG-CB 4.41Å; P331-V434 HydrophobicContact CB-CG2 4.07Å; P331-V434 HydrophobicContact CG-CG2 4.43Å; P331-A437 HydrophobicContact CB-CB 4.38Å; P331-A437 WeakPolarHBondContact O-CB 3.16Å
332	K	88.9	Confident	87.6	Confident	121 Å²	121	34.2 Å²	34.2	53%	0.526	20%	0.196	S	C	.	.	S	Bend	trans	-70.9	126.8	173.7	-171.6	175.7	176.6	179.3	0	109.9	S330 T335	S330-K332 PolarHBondContact O-N 2.84Å; S330-K332 PolarHBondContact OG-N 3.09Å; K332-T335 HydrophobicContact CB-CG2 3.86Å; K332-T335 HydrophobicContact CD-CG2 3.9Å; K332-T335 HydrophobicContact CG-CG2 3.92Å; K332-T335 PolarHBondContact O-OG1 3.23Å
333	L	86.3	Confident	88.3	Confident	106 Å²	106	35 Å²	35	56%	0.555	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.7	152.6	172	-63.1	177.3	0	0	0	110.8	P331 T335 A437 K438 L441	P331-L333 PolarHBondContact O-N 2.83Å; L333-T335 PolarHBondContact O-N 3.12Å; L333-A437 HydrophobicContact CD2-CB 4.46Å; L333-K438 HydrophobicContact CD2-CG 4.38Å; L333-L441 HydrophobicContact CD2-CD1 4.08Å
334	G	78.7	Confident	88.6	Confident	49 Å²	49	37.1 Å²	37.1	51%	0.505	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	75	0.9	-176.1	0	0	0	0	0	115.8	E342	G334-E342 WeakPolarHBondContact CA-OE1 3.04Å; G334-E342 PolarHBondContact N-OE1 2.94Å
335	T	81.5	Confident	88.7	Confident	38 Å²	38	42 Å²	42	23%	0.233	25%	0.246	C	C	.	.			trans	-97.6	132.2	171.7	66.5	0	0	0	0	111.1	S330 K332 L333 K438	S330-T335 WeakPolarHBondContact CB-OG1 3.05Å; K332-T335 HydrophobicContact CB-CG2 3.86Å; K332-T335 HydrophobicContact CD-CG2 3.9Å; K332-T335 HydrophobicContact CG-CG2 3.92Å; K332-T335 PolarHBondContact O-OG1 3.23Å; L333-T335 PolarHBondContact O-N 3.12Å; T335-K438 PolarHBondContact O-NZ 2.98Å
336	S	86.5	Confident	88.4	Confident	34 Å²	34	44.4 Å²	44.4	24%	0.238	26%	0.259	C	S	.	.			trans	-77.5	157.1	172.1	-58.6	0	0	0	0	112.8	S341 E342 I344	S336-S341 VanDerWaalsContact CA-OG 3.28Å; S336-S341 WeakPolarHBondContact CA-OG 3.02Å; S336-S341 WeakPolarHBondContact CB-OG 3.43Å; S336-E342 PolarHBondContact OG-O 2.91Å; S336-I344 WeakPolarHBondContact OG-CD1 3.31Å; S336-I344 WeakPolarHBondContact OG-CG1 3.46Å
337	G	88.3	Confident	88.2	Confident	2 Å²	2	53.5 Å²	53.5	2%	0.021	29%	0.292	C	S	.	.	S	Bend	trans	119	132.3	-175.5	0	0	0	0	0	111.9	A329 S341 F353	A329-G337 WeakPolarHBondContact CA-O 3.41Å; G337-S341 PolarHBondContact N-OG 2.92Å; G337-F353 CarbonylContact C-O 3.49Å; G337-F353 WeakPolarHBondContact CA-O 3.2Å
338	G	92.2	Very high	87.9	Confident	0 Å²	0	61.3 Å²	61.3	0%	0	33%	0.327	C	S	.	.	S	Bend	trans	61.4	-151.5	174.1	0	0	0	0	0	114.9	Y327 C340 S341 F353 N354 N384	Y327-G338 WeakPolarHBondContact O-CA 3.34Å; Y327-G338 PolarHBondContact O-N 2.94Å; G338-C340 PolarHBondContact O-N 3.24Å; G338-S341 WeakPolarHBondContact O-CB 3.32Å; G338-S341 PolarHBondContact O-N 3.29Å; G338-F353 PolarHBondContact N-O 3.45Å; G338-N354 WeakPolarHBondContact O-CA 3.49Å; G338-N354 WeakPolarHBondContact O-CB 3.48Å; G338-N384 CarbonylContact C-O 3.3Å; G338-N384 VanDerWaalsContact CA-O 3.25Å; G338-N384 WeakPolarHBondContact CA-O 3.36Å
339	I	95.3	Very high	87.6	Confident	0 Å²	0	66.8 Å²	66.8	0%	0	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55	137	-171.9	58.7	174.7	0	0	0	112.1	L309 A329 S341 N384 W385 V434 L435 K438 F443	L309-I339 HydrophobicContact CD1-CG2 3.86Å; L309-I339 HydrophobicContact CD2-CB 4.39Å; L309-I339 HydrophobicContact CD2-CG2 3.75Å; L309-I339 HydrophobicContact CG-CG2 3.79Å; A329-I339 HydrophobicContact CB-CG1 4.24Å; I339-S341 PolarHBondContact O-N 3.46Å; I339-S341 VanDerWaalsContact O-N 3.12Å; I339-N384 PolarHBondContact N-O 3.29Å; I339-W385 HydrophobicContact CD1-CG 4.43Å; I339-W385 VanDerWaalsContact CG2-CD1 3.43Å; I339-W385 HydrophobicContact CG2-CG 4.13Å; I339-V434 HydrophobicContact CD1-CG1 3.92Å; I339-V434 HydrophobicContact CG1-CG1 3.98Å; I339-L435 HydrophobicContact CD1-CD2 4.16Å; I339-K438 WeakPolarHBondContact O-CD 3.44Å; I339-F443 HydrophobicContact CB-CE2 4.47Å; I339-F443 HydrophobicContact CD1-CE2 4.02Å; I339-F443 HydrophobicContact CD1-CZ 4.15Å
340	C	93.8	Very high	87.6	Confident	16 Å²	16	71.2 Å²	71.2	11%	0.108	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	31	179.4	-44.7	0	0	0	0	114.3	C308 G338 E342 K438 L441 C442	C308-C340 PolarHBondContact O-N 2.99Å; G338-C340 PolarHBondContact O-N 3.24Å; C340-E342 PolarHBondContact O-N 3.37Å; C340-K438 HydrophobicContact CB-CB 4.35Å; C340-K438 PolarHBondContact SG-O 2.84Å; C340-L441 HydrophobicContact CB-CB 4.07Å; C340-L441 HydrophobicContact CB-CD1 4.41Å; C340-C442 WeakPolarHBondContact CA-SG 3.22Å; C340-C442 HydrophobicContact CB-CB 3.75Å; C340-C442 WeakPolarHBondContact CB-SG 3.45Å; C340-C442 WeakPolarHBondContact SG-CB 3.46Å; C340-C442 CovalentContact SG-SG 2.03Å; C340-C442 PolarHBondContact SG-SG 3.13Å
341	S	88.5	Confident	87.5	Confident	7 Å²	7	69.1 Å²	69.1	5%	0.049	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-54.7	131.1	178.1	-178.7	0	0	0	0	112	S336 G337 G338 I339	S336-S341 VanDerWaalsContact CA-OG 3.28Å; S336-S341 WeakPolarHBondContact CA-OG 3.02Å; S336-S341 WeakPolarHBondContact CB-OG 3.43Å; G337-S341 PolarHBondContact N-OG 2.92Å; G338-S341 WeakPolarHBondContact O-CB 3.32Å; G338-S341 PolarHBondContact O-N 3.29Å; I339-S341 PolarHBondContact O-N 3.46Å; I339-S341 VanDerWaalsContact O-N 3.12Å
342	E	86	Confident	87.7	Confident	108 Å²	108	67.7 Å²	67.7	51%	0.505	34%	0.338	S	S	.	.	P	Polyproline II helix	trans	-66.8	153.7	162.5	-70.1	177	-145	0	0	110.5	G334 S336 C340	G334-E342 WeakPolarHBondContact CA-OE1 3.04Å; G334-E342 PolarHBondContact N-OE1 2.94Å; S336-E342 PolarHBondContact OG-O 2.91Å; C340-E342 PolarHBondContact O-N 3.37Å
343	G	87.1	Confident	87.9	Confident	26 Å²	26	63.1 Å²	63.1	27%	0.268	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.6	-177.7	0	0	0	0	0	112.6	L350 V351	G343-L350 VanDerWaalsContact C-CD1 3.49Å; G343-L350 WeakPolarHBondContact O-CD1 3.42Å; G343-V351 CarbonylContact C-O 3.38Å; G343-V351 VanDerWaalsContact CA-O 3.24Å; G343-V351 WeakPolarHBondContact CA-O 3.48Å
344	I	87	Confident	88.3	Confident	51 Å²	51	58.1 Å²	58.1	26%	0.262	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	139.8	176.9	-59.2	-178.3	0	0	0	109.7	S336 I346 V351 F353	S336-I344 WeakPolarHBondContact OG-CD1 3.31Å; S336-I344 WeakPolarHBondContact OG-CG1 3.46Å; I344-I346 HydrophobicContact CB-CG1 4.49Å; I344-I346 HydrophobicContact CG2-CD1 4.49Å; I344-I346 HydrophobicContact CG2-CG1 3.97Å; I344-I346 PolarHBondContact O-N 3.34Å; I344-V351 PolarHBondContact N-O 3Å; I344-V351 PolarHBondContact O-N 3.06Å; I344-F353 HydrophobicContact CB-CE2 4.35Å; I344-F353 HydrophobicContact CD1-CD2 4.33Å; I344-F353 HydrophobicContact CD1-CE2 4.15Å; I344-F353 HydrophobicContact CG1-CE2 4.48Å
345	V	88.5	Confident	89.1	Confident	102 Å²	102	55.8 Å²	55.8	62%	0.618	27%	0.268	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	105.4	172.6	-177.9	0	0	0	0	110.2	R349 L350	V345-R349 CarbonylContact C-O 3.57Å; V345-R349 VanDerWaalsContact CA-O 3.31Å; V345-R349 WeakPolarHBondContact CA-O 3.26Å; V345-L350 HydrophobicContact CG2-CD1 4.12Å
346	I	83.3	Confident	89.8	Confident	54 Å²	54	54 Å²	54	28%	0.277	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	125.1	175.6	-62	177.1	0	0	0	108.4	I344 K348 R349 V351 F353	I344-I346 HydrophobicContact CB-CG1 4.49Å; I344-I346 HydrophobicContact CG2-CD1 4.49Å; I344-I346 HydrophobicContact CG2-CG1 3.97Å; I344-I346 PolarHBondContact O-N 3.34Å; I346-K348 PolarHBondContact O-N 2.89Å; I346-K348 VanDerWaalsContact O-N 3.16Å; I346-R349 PolarHBondContact N-O 2.99Å; I346-R349 PolarHBondContact O-N 3.41Å; I346-R349 VanDerWaalsContact O-O 3.1Å; I346-V351 HydrophobicContact CB-CG2 4.13Å; I346-V351 HydrophobicContact CD1-CB 4.37Å; I346-V351 HydrophobicContact CD1-CG2 4.5Å; I346-F353 HydrophobicContact CD1-CE2 3.83Å; I346-F353 HydrophobicContact CD1-CZ 3.5Å
347	R	84.9	Confident	90.1	Very high	196 Å²	196	52.4 Å²	52.4	74%	0.74	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.3	42.4	179.7	-63.4	175.3	171.7	152.5	-3.8	113.5	R349	R347-R349 PolarHBondContact O-N 3.38Å
348	K	85.8	Confident	90.4	Very high	208 Å²	208	52.3 Å²	52.3	90%	0.904	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	15.9	-175.8	-51.7	179.9	178.6	-179.5	0	115.4	I346	I346-K348 PolarHBondContact O-N 2.89Å; I346-K348 VanDerWaalsContact O-N 3.16Å
349	R	85.1	Confident	90.2	Very high	173 Å²	173	52.3 Å²	52.3	65%	0.653	25%	0.245	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-114.7	142.8	171.4	-63.8	-174.7	177.3	-167.5	-1.4	110.1	V345 I346 R347	V345-R349 CarbonylContact C-O 3.57Å; V345-R349 VanDerWaalsContact CA-O 3.31Å; V345-R349 WeakPolarHBondContact CA-O 3.26Å; I346-R349 PolarHBondContact N-O 2.99Å; I346-R349 PolarHBondContact O-N 3.41Å; I346-R349 VanDerWaalsContact O-O 3.1Å; R347-R349 PolarHBondContact O-N 3.38Å
350	L	90.6	Very high	89.6	Confident	96 Å²	96	52.5 Å²	52.5	50%	0.503	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	118.5	174.3	-172.4	61.7	0	0	0	108.8	G343 V345 Y352	G343-L350 VanDerWaalsContact C-CD1 3.49Å; G343-L350 WeakPolarHBondContact O-CD1 3.42Å; V345-L350 HydrophobicContact CG2-CD1 4.12Å; L350-Y352 HydrophobicContact CD2-CE2 4.05Å; L350-Y352 VanDerWaalsContact CD2-OH 3.22Å; L350-Y352 WeakPolarHBondContact CD2-OH 3.43Å; L350-Y352 HydrophobicContact CG-CE2 3.93Å
351	V	90	Very high	88.9	Confident	3 Å²	3	54.3 Å²	54.3	2%	0.018	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	132.1	-174.8	179.6	0	0	0	0	109.1	E300 G343 I344 I346 F353	E300-V351 HydrophobicContact CG-CG2 4.32Å; G343-V351 CarbonylContact C-O 3.38Å; G343-V351 VanDerWaalsContact CA-O 3.24Å; G343-V351 WeakPolarHBondContact CA-O 3.48Å; I344-V351 PolarHBondContact N-O 3Å; I344-V351 PolarHBondContact O-N 3.06Å; I346-V351 HydrophobicContact CB-CG2 4.13Å; I346-V351 HydrophobicContact CD1-CB 4.37Å; I346-V351 HydrophobicContact CD1-CG2 4.5Å; V351-F353 HydrophobicContact CG1-CD1 4.48Å; V351-F353 HydrophobicContact CG1-CE1 3.97Å; V351-F353 HydrophobicContact CG1-CE2 4.13Å; V351-F353 HydrophobicContact CG1-CZ 3.79Å
352	Y	92.5	Very high	87.9	Confident	31 Å²	31	54.6 Å²	54.6	12%	0.122	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	131.4	177	-61.4	-92.7	0	0	0	109.8	K305 L350 N354	K305-Y352 HydrophobicContact CB-CD1 4.24Å; K305-Y352 HydrophobicContact CB-CE1 3.62Å; K305-Y352 HydrophobicContact CG-CE1 4.26Å; L350-Y352 HydrophobicContact CD2-CE2 4.05Å; L350-Y352 VanDerWaalsContact CD2-OH 3.22Å; L350-Y352 WeakPolarHBondContact CD2-OH 3.43Å; L350-Y352 HydrophobicContact CG-CE2 3.93Å; Y352-N354 VanDerWaalsContact C-N 3.33Å; Y352-N354 WeakPolarHBondContact CB-OD1 3.38Å
353	F	93.2	Very high	86.9	Confident	26 Å²	26	51.9 Å²	51.9	11%	0.114	25%	0.246	C	C	.	.			trans	-99.6	30.1	-178.1	-65.9	-70	0	0	0	112.2	Y327 G337 G338 I344 I346 V351 T355	Y327-F353 WeakPolarHBondContact CB-O 3.27Å; Y327-F353 HydrophobicContact CD1-CD1 4.38Å; Y327-F353 HydrophobicContact CD2-CB 4.03Å; Y327-F353 AromaticContact CD2-CD1 4Å; Y327-F353 HydrophobicContact CD2-CD1 4Å; Y327-F353 AromaticContact CE1-CD1 3.95Å; Y327-F353 HydrophobicContact CE1-CD1 3.95Å; Y327-F353 HydrophobicContact CE1-CE1 4.39Å; Y327-F353 HydrophobicContact CE2-CB 4.42Å; Y327-F353 AromaticContact CE2-CD1 3.52Å; Y327-F353 HydrophobicContact CE2-CD1 3.52Å; Y327-F353 HydrophobicContact CE2-CE1 4.26Å; Y327-F353 HydrophobicContact CE2-CG 4.44Å; Y327-F353 HydrophobicContact CG-CB 4.09Å; Y327-F353 HydrophobicContact CG-CD1 4.4Å; Y327-F353 AromaticContact CZ-CD1 3.5Å; Y327-F353 VanDerWaalsContact CZ-CD1 3.5Å; Y327-F353 AromaticContact CZ-CE1 3.88Å; G337-F353 CarbonylContact C-O 3.49Å; G337-F353 WeakPolarHBondContact CA-O 3.2Å; G338-F353 PolarHBondContact N-O 3.45Å; I344-F353 HydrophobicContact CB-CE2 4.35Å; I344-F353 HydrophobicContact CD1-CD2 4.33Å; I344-F353 HydrophobicContact CD1-CE2 4.15Å; I344-F353 HydrophobicContact CG1-CE2 4.48Å; I346-F353 HydrophobicContact CD1-CE2 3.83Å; I346-F353 HydrophobicContact CD1-CZ 3.5Å; V351-F353 HydrophobicContact CG1-CD1 4.48Å; V351-F353 HydrophobicContact CG1-CE1 3.97Å; V351-F353 HydrophobicContact CG1-CE2 4.13Å; V351-F353 HydrophobicContact CG1-CZ 3.79Å; F353-T355 PolarHBondContact O-N 3.36Å; F353-T355 VanDerWaalsContact O-N 3.11Å
354	N	95.2	Very high	85.8	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	25%	0.252	C	S	.	.			trans	-83.6	44.5	172.3	65.5	-31.6	0	0	0	111.8	S304 F307 C308 L309 V310 G338 Y352	S304-N354 PolarHBondContact N-OD1 3.21Å; S304-N354 PolarHBondContact O-ND2 2.7Å; F307-N354 PolarHBondContact O-ND2 3.29Å; C308-N354 PolarHBondContact O-ND2 3.44Å; L309-N354 CarbonylContact C-O 3.56Å; L309-N354 WeakPolarHBondContact CA-O 3.43Å; L309-N354 HydrophobicContact CD2-CB 4.22Å; V310-N354 PolarHBondContact N-O 3.2Å; G338-N354 WeakPolarHBondContact O-CA 3.49Å; G338-N354 WeakPolarHBondContact O-CB 3.48Å; Y352-N354 VanDerWaalsContact C-N 3.33Å; Y352-N354 WeakPolarHBondContact CB-OD1 3.38Å
355	T	96	Very high	84.8	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	150.9	-165.2	56.6	0	0	0	0	113.2	F298 S299 V310 Y327 F353 N384	F298-T355 HydrophobicContact CD1-CG2 4.32Å; F298-T355 HydrophobicContact CE1-CG2 4.3Å; S299-T355 PolarHBondContact OG-OG1 3.47Å; V310-T355 HydrophobicContact CB-CG2 4.2Å; V310-T355 VanDerWaalsContact O-CA 3.27Å; V310-T355 WeakPolarHBondContact O-CA 3.41Å; Y327-T355 VanDerWaalsContact CD2-OG1 3.27Å; Y327-T355 WeakPolarHBondContact CD2-OG1 3.45Å; Y327-T355 WeakPolarHBondContact CE2-OG1 3.5Å; Y327-T355 PolarHBondContact N-O 3.32Å; F353-T355 PolarHBondContact O-N 3.36Å; F353-T355 VanDerWaalsContact O-N 3.11Å; T355-N384 PolarHBondContact O-ND2 3.41Å
356	A	95.3	Very high	83.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	172.5	167.2	0	0	0	0	0	110.3	V310 H311 L312 L325 E380 N384	V310-A356 PolarHBondContact O-N 2.84Å; H311-A356 WeakPolarHBondContact CA-O 3.2Å; H311-A356 WeakPolarHBondContact ND1-CB 3.49Å; H311-A356 PolarHBondContact ND1-O 2.55Å; L312-A356 PolarHBondContact N-O 3.33Å; L325-A356 CarbonylContact O-C 3.25Å; L325-A356 VanDerWaalsContact O-CA 3.25Å; L325-A356 WeakPolarHBondContact O-CA 3.42Å; A356-E380 HydrophobicContact CB-CB 4.14Å; A356-N384 WeakPolarHBondContact CB-OD1 3.49Å
357	L	94.5	Very high	82.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140	151.7	174	72.2	86.2	0	0	0	112.2	V291 L294 L295 L312 F318 G324 L325	V291-L357 HydrophobicContact CG2-CD1 3.99Å; V291-L357 HydrophobicContact CG2-CD2 4.34Å; L294-L357 HydrophobicContact CB-CD2 4.32Å; L294-L357 HydrophobicContact CD2-CD2 4.02Å; L294-L357 HydrophobicContact CG-CD2 4.1Å; L295-L357 HydrophobicContact CB-CD2 3.8Å; L295-L357 HydrophobicContact CD1-CD2 4.38Å; L312-L357 HydrophobicContact CB-CB 3.75Å; L312-L357 HydrophobicContact CD2-CB 4.29Å; L312-L357 HydrophobicContact CG-CB 4.31Å; L312-L357 CarbonylContact O-C 3.6Å; L312-L357 WeakPolarHBondContact O-CA 3.41Å; L312-L357 WeakPolarHBondContact O-CB 3.34Å; F318-L357 HydrophobicContact CE2-CD1 3.61Å; F318-L357 HydrophobicContact CZ-CD1 3.82Å; G324-L357 WeakPolarHBondContact CA-O 3.17Å; L325-L357 HydrophobicContact CB-CG 4.43Å; L325-L357 PolarHBondContact N-O 3.02Å; L325-L357 VanDerWaalsContact N-O 3.12Å; L325-L357 PolarHBondContact O-N 2.69Å
358	T	92.7	Very high	82.1	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	135.2	172.5	-59.9	0	0	0	0	109.9	H311 L312 F313 T314 L323 V376	H311-T358 PolarHBondContact CE1-OG1 2.92Å; H311-T358 PolarHBondContact NE2-N 2.75Å; H311-T358 PolarHBondContact NE2-OG1 2.84Å; L312-T358 PolarHBondContact O-N 3.02Å; F313-T358 WeakPolarHBondContact CA-O 3.27Å; T314-T358 PolarHBondContact N-O 2.8Å; L323-T358 CarbonylContact O-C 3.57Å; L323-T358 WeakPolarHBondContact O-CA 3.43Å; T358-V376 HydrophobicContact CG2-CB 3.98Å; T358-V376 HydrophobicContact CG2-CG1 3.64Å
359	S	89.5	Confident	81.5	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	134.1	169.1	-171.9	0	0	0	0	111.5	T314 Q316 L323 R361	T314-S359 WeakPolarHBondContact O-CA 3.35Å; Q316-S359 WeakPolarHBondContact O-CB 3.5Å; Q316-S359 PolarHBondContact O-OG 2.63Å; L323-S359 PolarHBondContact O-N 2.8Å; S359-R361 VanDerWaalsContact C-N 3.26Å; S359-R361 PolarHBondContact OG-N 2.82Å; S359-R361 PolarHBondContact OG-O 2.88Å
360	V	82.7	Confident	81.2	Confident	4 Å²	4	20.6 Å²	20.6	2%	0.024	11%	0.108	C	C	.	.	S	Bend	trans	-92.5	20.3	167.7	-61.1	0	0	0	0	112.4	F218 V222 T314 A315 V368 A373	F218-V360 HydrophobicContact CD2-CG1 4.31Å; F218-V360 HydrophobicContact CD2-CG2 3.81Å; F218-V360 HydrophobicContact CE2-CB 4.48Å; F218-V360 HydrophobicContact CE2-CG1 3.71Å; F218-V360 HydrophobicContact CE2-CG2 3.98Å; V222-V360 HydrophobicContact CG2-CB 4.26Å; V222-V360 HydrophobicContact CG2-CG2 3.29Å; T314-V360 WeakPolarHBondContact O-CG2 3.43Å; T314-V360 PolarHBondContact O-N 2.98Å; A315-V360 HydrophobicContact CB-CG2 4.08Å; V360-V368 VanDerWaalsContact C-CG2 3.49Å; V360-V368 HydrophobicContact CB-CB 4.49Å; V360-V368 PolarHBondContact O-N 3.07Å; V360-A373 HydrophobicContact CG1-CB 4.4Å
361	R	77.9	Confident	80.6	Confident	55 Å²	55	16.5 Å²	16.5	21%	0.208	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-126.3	123.8	172.7	-70.9	-67.6	-175.1	162.9	-11.3	110.8	D221 A315 P317 S359 G365 G366	D221-R361 IonicContact OD2-NE 3.8Å; D221-R361 IonicContact OD2-NH2 3.94Å; A315-R361 HydrophobicContact CB-CG 3.75Å; A315-R361 WeakPolarHBondContact O-CG 3.44Å; P317-R361 HydrophobicContact CB-CB 4.37Å; S359-R361 VanDerWaalsContact C-N 3.26Å; S359-R361 PolarHBondContact OG-N 2.82Å; S359-R361 PolarHBondContact OG-O 2.88Å; R361-G365 PolarHBondContact NH1-O 3.12Å; R361-G366 CarbonylContact C-O 3.53Å; R361-G366 VanDerWaalsContact CA-O 3.27Å; R361-G366 WeakPolarHBondContact CA-O 3.27Å; R361-G366 VanDerWaalsContact CD-O 3.32Å; R361-G366 WeakPolarHBondContact CD-O 3.48Å
362	S	67.1	Low	80	Confident	12 Å²	12	18.3 Å²	18.3	8%	0.084	10%	0.095	C	C	.	.			trans	-65.4	163.2	172.8	67.3	0	0	0	0	111.9	P317 Y364 G365 G366	P317-S362 WeakPolarHBondContact CB-O 3.35Å; S362-Y364 PolarHBondContact O-N 3.44Å; S362-Y364 WeakPolarHBondContact OG-CD1 3.14Å; S362-Y364 WeakPolarHBondContact OG-CD2 3.42Å; S362-Y364 WeakPolarHBondContact OG-CE1 3.43Å; S362-Y364 VanDerWaalsContact OG-CE2 3.27Å; S362-Y364 WeakPolarHBondContact OG-CE2 3.37Å; S362-G365 WeakPolarHBondContact O-CA 3.37Å; S362-G365 PolarHBondContact O-N 2.93Å; S362-G366 PolarHBondContact N-O 3.21Å; S362-G366 PolarHBondContact OG-N 3.32Å; S362-G366 VanDerWaalsContact OG-N 3.15Å; S362-G366 PolarHBondContact OG-O 3.11Å
363	S	66.8	Low	79.6	Confident	52 Å²	52	16.9 Å²	16.9	36%	0.364	9%	0.089	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-20.3	-179.3	-54.2	0	0	0	0	115.3	F318 G321	F318-S363 VanDerWaalsContact O-CA 3.23Å; F318-S363 WeakPolarHBondContact O-CA 3.08Å; F318-S363 WeakPolarHBondContact O-CB 3.44Å; F318-S363 PolarHBondContact O-OG 3.42Å; G321-S363 WeakPolarHBondContact CA-OG 3.32Å; G321-S363 PolarHBondContact N-OG 2.74Å
364	Y	64	Low	79.3	Confident	100 Å²	100	16 Å²	16	39%	0.392	9%	0.085	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	9	175.2	59.3	-94.4	0	0	0	113.3	N23 S362	N23-Y364 WeakPolarHBondContact OD1-CE2 3.49Å; S362-Y364 PolarHBondContact O-N 3.44Å; S362-Y364 WeakPolarHBondContact OG-CD1 3.14Å; S362-Y364 WeakPolarHBondContact OG-CD2 3.42Å; S362-Y364 WeakPolarHBondContact OG-CE1 3.43Å; S362-Y364 VanDerWaalsContact OG-CE2 3.27Å; S362-Y364 WeakPolarHBondContact OG-CE2 3.37Å
365	G	64.1	Low	78.9	Confident	27 Å²	27	16.1 Å²	16.1	28%	0.278	9%	0.086	S	C	.	.	S	Bend	trans	82.6	6.6	176.2	0	0	0	0	0	115.6	R361 S362	R361-G365 PolarHBondContact NH1-O 3.12Å; S362-G365 WeakPolarHBondContact O-CA 3.37Å; S362-G365 PolarHBondContact O-N 2.93Å
366	G	62	Low	78.5	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-71.2	149.4	173.6	0	0	0	0	0	112.5	N23 R361 S362	N23-G366 WeakPolarHBondContact ND2-CA 3.28Å; N23-G366 WeakPolarHBondContact OD1-CA 3.35Å; R361-G366 CarbonylContact C-O 3.53Å; R361-G366 VanDerWaalsContact CA-O 3.27Å; R361-G366 WeakPolarHBondContact CA-O 3.27Å; R361-G366 VanDerWaalsContact CD-O 3.32Å; R361-G366 WeakPolarHBondContact CD-O 3.48Å; S362-G366 PolarHBondContact N-O 3.21Å; S362-G366 PolarHBondContact OG-N 3.32Å; S362-G366 VanDerWaalsContact OG-N 3.15Å; S362-G366 PolarHBondContact OG-O 3.11Å
367	P	67.2	Low	78.4	Confident	16 Å²	16	16.1 Å²	16.1	10%	0.104	9%	0.086	C	C	.	.	B	Isolated β-bridge	trans	-63.6	146.6	169.7	30.4	-32.9	0	0	0	109.8	M27	M27-P367 HydrophobicContact CE-CG 4.25Å; M27-P367 VanDerWaalsContact CE-O 3.29Å; M27-P367 WeakPolarHBondContact CE-O 3.5Å
368	V	71.5	Confident	78.4	Confident	7 Å²	7	16.1 Å²	16.1	4%	0.042	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-89	134.9	170.7	174.8	0	0	0	0	108.4	L323 V360 E372 A373	L323-V368 HydrophobicContact CD1-CG2 4.26Å; L323-V368 HydrophobicContact CD2-CG2 3.98Å; V360-V368 VanDerWaalsContact C-CG2 3.49Å; V360-V368 HydrophobicContact CB-CB 4.49Å; V360-V368 PolarHBondContact O-N 3.07Å; V368-E372 HydrophobicContact CG1-CB 3.62Å; V368-E372 HydrophobicContact CG1-CG 3.64Å; V368-A373 HydrophobicContact CG1-CB 4.06Å
369	V	73.1	Confident	78.5	Confident	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.086	C	C	.	.	P	Polyproline II helix	trans	-72.5	150.3	177.7	-65.4	0	0	0	0	111.1	L24 M27 L164 R371 E372 A373	L24-V369 HydrophobicContact CD1-CG1 4.33Å; M27-V369 HydrophobicContact CB-CG1 4.48Å; M27-V369 HydrophobicContact CE-CG1 4.04Å; L164-V369 HydrophobicContact CD2-CG2 3.52Å; V369-R371 VanDerWaalsContact C-N 3.28Å; V369-R371 PolarHBondContact O-N 3.14Å; V369-R371 VanDerWaalsContact O-N 3.14Å; V369-E372 HydrophobicContact CG2-CB 3.91Å; V369-E372 PolarHBondContact O-N 2.59Å; V369-A373 PolarHBondContact O-N 2.84Å
370	T	78.9	Confident	78.7	Confident	3 Å²	3	16.1 Å²	16.1	2%	0.018	9%	0.086	C	C	.	.	H	α-helix	trans	-52.2	-43.4	-172.6	-80.9	0	0	0	0	113.2	F140 E142 Y159 R240 E372 A373 D374	F140-T370 HydrophobicContact CD1-CG2 3.98Å; F140-T370 HydrophobicContact CE1-CG2 4.17Å; E142-T370 VanDerWaalsContact CD-CB 3.46Å; E142-T370 WeakPolarHBondContact OE1-CB 3.37Å; E142-T370 PolarHBondContact OE1-N 2.89Å; E142-T370 PolarHBondContact OE1-OG1 3.02Å; E142-T370 PolarHBondContact OE2-OG1 3.07Å; Y159-T370 PolarHBondContact OH-N 2.88Å; R240-T370 VanDerWaalsContact CZ-CG2 3.44Å; T370-E372 VanDerWaalsContact C-N 3.32Å; T370-E372 PolarHBondContact O-N 2.87Å; T370-A373 PolarHBondContact O-N 3.11Å; T370-D374 PolarHBondContact O-N 2.86Å
371	R	78.2	Confident	79.4	Confident	9 Å²	9	16 Å²	16	3%	0.034	9%	0.085	C	C	.	.	H	α-helix	trans	-59.8	-40.4	179.3	178.8	153.9	-172.3	68	21.3	113.3	H138 F140 Y159 L164 V369 I375 G415 K421	H138-R371 PolarHBondContact ND1-NH1 2.86Å; F140-R371 HydrophobicContact CD1-CB 4.25Å; F140-R371 HydrophobicContact CD2-CB 4.3Å; F140-R371 HydrophobicContact CE1-CB 3.88Å; F140-R371 HydrophobicContact CE2-CB 4Å; F140-R371 VanDerWaalsContact CE2-CD 3.47Å; F140-R371 HydrophobicContact CE2-CG 4.17Å; F140-R371 HydrophobicContact CG-CB 4.46Å; F140-R371 HydrophobicContact CZ-CB 3.77Å; F140-R371 HydrophobicContact CZ-CG 3.98Å; Y159-R371 HydrophobicContact CE2-CB 4.38Å; Y159-R371 PolarHBondContact OH-N 2.98Å; L164-R371 HydrophobicContact CD1-CB 4.03Å; L164-R371 HydrophobicContact CD1-CG 3.77Å; V369-R371 VanDerWaalsContact C-N 3.28Å; V369-R371 PolarHBondContact O-N 3.14Å; V369-R371 VanDerWaalsContact O-N 3.14Å; R371-I375 HydrophobicContact CG-CD1 4.21Å; R371-I375 WeakPolarHBondContact O-CG1 3.31Å; R371-I375 PolarHBondContact O-N 3.37Å; R371-G415 PolarHBondContact NE-O 3.43Å; R371-G415 PolarHBondContact NH2-O 3.17Å; R371-K421 VanDerWaalsContact NH2-CG 3.26Å
372	E	77.6	Confident	80.3	Confident	42 Å²	42	13.3 Å²	13.3	20%	0.196	8%	0.075	C	C	.	.	H	α-helix	trans	-71.4	-42.5	177.9	-176.6	178.9	-171	0	0	110.1	L323 V368 V369 T370 D374 I375 V376	L323-E372 HydrophobicContact CD1-CG 4.29Å; L323-E372 WeakPolarHBondContact CD1-OE1 3.12Å; V368-E372 HydrophobicContact CG1-CB 3.62Å; V368-E372 HydrophobicContact CG1-CG 3.64Å; V369-E372 HydrophobicContact CG2-CB 3.91Å; V369-E372 PolarHBondContact O-N 2.59Å; T370-E372 VanDerWaalsContact C-N 3.32Å; T370-E372 PolarHBondContact O-N 2.87Å; E372-D374 VanDerWaalsContact C-N 3.33Å; E372-D374 PolarHBondContact O-N 2.78Å; E372-I375 PolarHBondContact O-N 2.87Å; E372-I375 VanDerWaalsContact O-N 3.12Å; E372-V376 HydrophobicContact CG-CG2 4.46Å; E372-V376 VanDerWaalsContact O-CG2 3.3Å; E372-V376 WeakPolarHBondContact O-CG2 3.41Å; E372-V376 PolarHBondContact O-N 3.44Å
373	A	83.9	Confident	81.6	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-60.4	-38.6	176.2	0	0	0	0	0	113.3	L237 V360 V368 V369 T370 T377	L237-A373 HydrophobicContact CD1-CB 4.41Å; V360-A373 HydrophobicContact CG1-CB 4.4Å; V368-A373 HydrophobicContact CG1-CB 4.06Å; V369-A373 PolarHBondContact O-N 2.84Å; T370-A373 PolarHBondContact O-N 3.11Å; A373-T377 WeakPolarHBondContact O-CB 3.31Å; A373-T377 PolarHBondContact O-N 2.88Å; A373-T377 PolarHBondContact O-OG1 3.39Å
374	D	87.9	Confident	83	Confident	7 Å²	7	10.3 Å²	10.3	4%	0.037	5%	0.054	C	C	.	.	H	α-helix	trans	-62.1	-44.7	173.8	-64.2	-20	0	0	0	111	R240 V241 T370 E372 T377 A378	R240-D374 WeakPolarHBondContact CD-OD2 3.4Å; R240-D374 IonicContact CZ-OD1 2.77Å; R240-D374 VanDerWaalsContact CZ-OD1 3.3Å; R240-D374 IonicContact CZ-OD2 2.78Å; R240-D374 VanDerWaalsContact NE-CG 3.27Å; R240-D374 IonicContact NE-OD1 3.71Å; R240-D374 PolarHBondContact NE-OD1 2.76Å; R240-D374 IonicContact NE-OD2 2.96Å; R240-D374 PolarHBondContact NE-OD2 2.85Å; R240-D374 IonicContact NH2-OD1 3.75Å; R240-D374 PolarHBondContact NH2-OD1 2.68Å; R240-D374 IonicContact NH2-OD2 3.85Å; V241-D374 HydrophobicContact CG2-CB 4.45Å; V241-D374 WeakPolarHBondContact CG2-O 3.42Å; T370-D374 PolarHBondContact O-N 2.86Å; E372-D374 VanDerWaalsContact C-N 3.33Å; E372-D374 PolarHBondContact O-N 2.78Å; D374-T377 PolarHBondContact O-N 3.13Å; D374-A378 WeakPolarHBondContact O-CB 3.35Å; D374-A378 PolarHBondContact O-N 3.25Å
375	I	85.7	Confident	84.5	Confident	4 Å²	4	5.6 Å²	5.6	2%	0.021	4%	0.035	C	C	.	.	H	α-helix	trans	-68.9	-44.8	-179.4	-67.3	168.3	0	0	0	111.4	R371 E372 T377 A378 H379 V413 G415	R371-I375 HydrophobicContact CG-CD1 4.21Å; R371-I375 WeakPolarHBondContact O-CG1 3.31Å; R371-I375 PolarHBondContact O-N 3.37Å; E372-I375 PolarHBondContact O-N 2.87Å; E372-I375 VanDerWaalsContact O-N 3.12Å; I375-T377 VanDerWaalsContact C-N 3.3Å; I375-T377 PolarHBondContact O-N 3.46Å; I375-A378 PolarHBondContact O-N 2.95Å; I375-H379 WeakPolarHBondContact O-CB 3.48Å; I375-H379 PolarHBondContact O-N 2.98Å; I375-V413 HydrophobicContact CG2-CG2 3.66Å; I375-G415 VanDerWaalsContact CD1-CA 3.41Å
376	V	87.6	Confident	85.9	Confident	0 Å²	0	4.6 Å²	4.6	0%	0	3%	0.025	C	C	.	.	H	α-helix	trans	-56.7	-47.6	174.4	-176.1	0	0	0	0	109.6	F175 L323 T358 E372 A378 H379 E380	F175-V376 HydrophobicContact CE1-CG2 4.17Å; F175-V376 HydrophobicContact CE2-CG2 3.63Å; F175-V376 HydrophobicContact CZ-CB 4.04Å; F175-V376 HydrophobicContact CZ-CG1 4.47Å; F175-V376 HydrophobicContact CZ-CG2 3.3Å; L323-V376 HydrophobicContact CB-CG1 3.84Å; L323-V376 HydrophobicContact CB-CG2 3.78Å; L323-V376 HydrophobicContact CD1-CG2 3.65Å; L323-V376 HydrophobicContact CG-CG2 4.38Å; T358-V376 HydrophobicContact CG2-CB 3.98Å; T358-V376 HydrophobicContact CG2-CG1 3.64Å; E372-V376 HydrophobicContact CG-CG2 4.46Å; E372-V376 VanDerWaalsContact O-CG2 3.3Å; E372-V376 WeakPolarHBondContact O-CG2 3.41Å; E372-V376 PolarHBondContact O-N 3.44Å; V376-A378 VanDerWaalsContact C-N 3.34Å; V376-A378 PolarHBondContact O-N 2.84Å; V376-H379 WeakPolarHBondContact O-CB 3.4Å; V376-H379 PolarHBondContact O-N 2.94Å; V376-E380 HydrophobicContact CG1-CG 4.4Å; V376-E380 WeakPolarHBondContact O-CG 3.25Å; V376-E380 PolarHBondContact O-N 3.15Å
377	T	93.4	Very high	87.5	Confident	0 Å²	0	4.7 Å²	4.7	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-64.9	-40.3	-178.4	-51	0	0	0	0	111.4	L237 I238 V241 F313 A373 D374 I375 H379 E380 F381	L237-T377 HydrophobicContact CD2-CG2 3.8Å; I238-T377 HydrophobicContact CD1-CG2 4.46Å; V241-T377 HydrophobicContact CG2-CG2 4.18Å; F313-T377 HydrophobicContact CE1-CG2 4.14Å; F313-T377 HydrophobicContact CZ-CG2 3.94Å; A373-T377 WeakPolarHBondContact O-CB 3.31Å; A373-T377 PolarHBondContact O-N 2.88Å; A373-T377 PolarHBondContact O-OG1 3.39Å; D374-T377 PolarHBondContact O-N 3.13Å; I375-T377 VanDerWaalsContact C-N 3.3Å; I375-T377 PolarHBondContact O-N 3.46Å; T377-H379 VanDerWaalsContact C-N 3.31Å; T377-H379 PolarHBondContact O-N 3.12Å; T377-E380 PolarHBondContact O-N 3.31Å; T377-F381 HydrophobicContact CG2-CD2 4.38Å; T377-F381 HydrophobicContact CG2-CE1 4.21Å; T377-F381 HydrophobicContact CG2-CE2 4.05Å; T377-F381 HydrophobicContact CG2-CZ 3.96Å; T377-F381 WeakPolarHBondContact O-CB 3.3Å; T377-F381 WeakPolarHBondContact O-CG 3.08Å; T377-F381 PolarHBondContact O-N 3.42Å
378	A	95.1	Very high	88.6	Confident	0 Å²	0	6.9 Å²	6.9	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-63.3	-35.4	175	0	0	0	0	0	112.8	V241 I244 Y245 D374 I375 V376 G382 I407	V241-A378 HydrophobicContact CG1-CB 4.16Å; I244-A378 HydrophobicContact CD1-CB 3.94Å; Y245-A378 HydrophobicContact CE2-CB 4.24Å; Y245-A378 PolarHBondContact OH-O 3.44Å; D374-A378 WeakPolarHBondContact O-CB 3.35Å; D374-A378 PolarHBondContact O-N 3.25Å; I375-A378 PolarHBondContact O-N 2.95Å; V376-A378 VanDerWaalsContact C-N 3.34Å; V376-A378 PolarHBondContact O-N 2.84Å; A378-G382 PolarHBondContact O-N 3.02Å; A378-I407 HydrophobicContact CB-CD1 4.48Å; A378-I407 HydrophobicContact CB-CG2 4.3Å
379	H	93.3	Very high	89.5	Confident	1 Å²	1	8.1 Å²	8.1	1%	0.005	5%	0.045	C	C	.	.	H	α-helix	trans	-66.7	-49.6	175.2	-175.1	111.3	0	0	0	111.9	F175 C176 I375 V376 T377 F381 G382 H383 H389 I407 M408 F409	F175-H379 HydrophobicContact CE1-CB 4.34Å; C176-H379 PolarHBondContact SG-CD2 2.89Å; C176-H379 PolarHBondContact SG-NE2 3.44Å; I375-H379 WeakPolarHBondContact O-CB 3.48Å; I375-H379 PolarHBondContact O-N 2.98Å; V376-H379 WeakPolarHBondContact O-CB 3.4Å; V376-H379 PolarHBondContact O-N 2.94Å; T377-H379 VanDerWaalsContact C-N 3.31Å; T377-H379 PolarHBondContact O-N 3.12Å; H379-F381 VanDerWaalsContact C-N 3.33Å; H379-F381 PolarHBondContact O-N 2.97Å; H379-G382 WeakPolarHBondContact O-CA 3.44Å; H379-G382 PolarHBondContact O-N 2.68Å; H379-H383 AromaticContact CD2-CD2 3.77Å; H379-H383 AromaticContact CD2-NE2 3.71Å; H379-H383 AromaticContact NE2-CD2 3.82Å; H379-H383 AromaticContact NE2-CE1 3.9Å; H379-H383 AromaticContact NE2-NE2 3.24Å; H379-H383 PolarHBondContact NE2-NE2 2.77Å; H379-H383 PolarHBondContact O-N 3.09Å; H379-H389 AromaticContact CE1-CD2 3.4Å; H379-H389 PolarHBondContact CE1-CD2 2.9Å; H379-H389 AromaticContact CE1-NE2 3.42Å; H379-H389 PolarHBondContact CE1-NE2 3.18Å; H379-H389 AromaticContact NE2-CD2 3.35Å; H379-H389 PolarHBondContact NE2-CD2 2.61Å; H379-H389 VanDerWaalsContact NE2-CD2 3.35Å; H379-H389 AromaticContact NE2-NE2 2.98Å; H379-H389 PolarHBondContact NE2-NE2 3.05Å; H379-I407 HydrophobicContact CB-CG2 4.15Å; H379-I407 PolarHBondContact ND1-O 2.92Å; H379-M408 HydrophobicContact CB-SD 4.43Å; H379-M408 WeakPolarHBondContact O-CE 3.23Å; H379-M408 VanDerWaalsContact O-SD 3.41Å; H379-F409 PolarHBondContact CE1-O 2.83Å
380	E	95	Very high	90.2	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-64.3	-37.4	178.6	-63.6	-51.9	151.7	0	0	112.7	C176 G324 L325 G326 A356 V376 T377 G382 H383 N384	C176-E380 PolarHBondContact SG-OE1 3.35Å; G324-E380 VanDerWaalsContact C-CD 3.48Å; G324-E380 WeakPolarHBondContact CA-OE1 3.41Å; L325-E380 VanDerWaalsContact CA-OE2 3.28Å; L325-E380 WeakPolarHBondContact CA-OE2 3.47Å; L325-E380 VanDerWaalsContact N-CD 3.27Å; L325-E380 PolarHBondContact N-OE1 2.88Å; L325-E380 PolarHBondContact N-OE2 3.01Å; G326-E380 PolarHBondContact N-OE2 2.63Å; A356-E380 HydrophobicContact CB-CB 4.14Å; V376-E380 HydrophobicContact CG1-CG 4.4Å; V376-E380 WeakPolarHBondContact O-CG 3.25Å; V376-E380 PolarHBondContact O-N 3.15Å; T377-E380 PolarHBondContact O-N 3.31Å; E380-G382 PolarHBondContact O-N 2.82Å; E380-H383 WeakPolarHBondContact O-CB 3.43Å; E380-H383 PolarHBondContact O-N 2.84Å; E380-H383 IonicContact OE2-CD2 3.21Å; E380-N384 PolarHBondContact O-N 2.88Å
381	F	96.9	Very high	90.5	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-63.9	-31.3	169.4	-74.5	-1.2	0	0	0	112	L210 I238 V241 Y245 F264 L309 H311 T377 H379 N384 W385	L210-F381 HydrophobicContact CD1-CE2 4.03Å; L210-F381 HydrophobicContact CD1-CZ 3.9Å; L210-F381 HydrophobicContact CD2-CZ 4.37Å; I238-F381 HydrophobicContact CD1-CE2 3.7Å; I238-F381 HydrophobicContact CD1-CZ 3.65Å; V241-F381 HydrophobicContact CG1-CD2 3.7Å; V241-F381 HydrophobicContact CG1-CE2 3.98Å; Y245-F381 HydrophobicContact CE1-CB 4.49Å; Y245-F381 HydrophobicContact CE2-CB 4.27Å; Y245-F381 WeakPolarHBondContact OH-CB 3.34Å; F264-F381 HydrophobicContact CD1-CE2 4.47Å; F264-F381 HydrophobicContact CD2-CD2 4.28Å; F264-F381 HydrophobicContact CD2-CE2 4.35Å; F264-F381 AromaticContact CE1-CD2 3.89Å; F264-F381 HydrophobicContact CE1-CD2 3.89Å; F264-F381 HydrophobicContact CE1-CE2 4.18Å; F264-F381 HydrophobicContact CE1-CG 4.36Å; F264-F381 AromaticContact CE2-CD2 3.56Å; F264-F381 HydrophobicContact CE2-CD2 3.56Å; F264-F381 HydrophobicContact CE2-CE2 4.07Å; F264-F381 HydrophobicContact CE2-CG 4.49Å; F264-F381 HydrophobicContact CZ-CB 3.99Å; F264-F381 AromaticContact CZ-CD2 3.34Å; F264-F381 HydrophobicContact CZ-CD2 3.34Å; F264-F381 AromaticContact CZ-CE2 3.99Å; F264-F381 HydrophobicContact CZ-CE2 3.99Å; F264-F381 AromaticContact CZ-CG 3.89Å; F264-F381 HydrophobicContact CZ-CG 3.89Å; L309-F381 HydrophobicContact CD1-CD1 4.42Å; H311-F381 HydrophobicContact CB-CE1 4.06Å; H311-F381 AromaticContact CE1-CE1 3.98Å; H311-F381 AromaticContact CG-CE1 3.77Å; H311-F381 AromaticContact ND1-CD1 4Å; H311-F381 AromaticContact ND1-CE1 3.49Å; H311-F381 WeakPolarHBondContact ND1-CE1 3.41Å; T377-F381 HydrophobicContact CG2-CD2 4.38Å; T377-F381 HydrophobicContact CG2-CE1 4.21Å; T377-F381 HydrophobicContact CG2-CE2 4.05Å; T377-F381 HydrophobicContact CG2-CZ 3.96Å; T377-F381 WeakPolarHBondContact O-CB 3.3Å; T377-F381 WeakPolarHBondContact O-CG 3.08Å; T377-F381 PolarHBondContact O-N 3.42Å; H379-F381 VanDerWaalsContact C-N 3.33Å; H379-F381 PolarHBondContact O-N 2.97Å; F381-N384 CarbonylContact O-C 3.53Å; F381-N384 PolarHBondContact O-N 2.8Å; F381-W385 WeakPolarHBondContact O-CB 3.47Å; F381-W385 PolarHBondContact O-N 3.44Å
382	G	96.4	Very high	90.7	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-70.3	-40.7	179.8	0	0	0	0	0	111.3	Y245 A378 H379 E380 W385 G386 S387	Y245-G382 VanDerWaalsContact OH-CA 3.27Å; Y245-G382 WeakPolarHBondContact OH-CA 3.46Å; Y245-G382 PolarHBondContact OH-N 2.96Å; A378-G382 PolarHBondContact O-N 3.02Å; H379-G382 WeakPolarHBondContact O-CA 3.44Å; H379-G382 PolarHBondContact O-N 2.68Å; E380-G382 PolarHBondContact O-N 2.82Å; G382-W385 PolarHBondContact O-N 3.19Å; G382-G386 PolarHBondContact O-N 3.02Å; G382-G386 VanDerWaalsContact O-N 3.08Å; G382-S387 WeakPolarHBondContact O-CB 3.46Å; G382-S387 PolarHBondContact O-N 3.13Å
383	H	94.1	Very high	91.1	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.005	5%	0.051	C	C	.	.	H	α-helix	trans	-56.1	-54.2	164.6	-77.3	-31.7	0	0	0	111.4	I328 A329 H379 E380 W385 G386 S387 H389 M408	I328-H383 VanDerWaalsContact CA-O 3.26Å; I328-H383 WeakPolarHBondContact CA-O 3.36Å; I328-H383 HydrophobicContact CG1-CB 3.89Å; A329-H383 PolarHBondContact N-O 3.11Å; H379-H383 AromaticContact CD2-CD2 3.77Å; H379-H383 AromaticContact CD2-NE2 3.71Å; H379-H383 AromaticContact NE2-CD2 3.82Å; H379-H383 AromaticContact NE2-CE1 3.9Å; H379-H383 AromaticContact NE2-NE2 3.24Å; H379-H383 PolarHBondContact NE2-NE2 2.77Å; H379-H383 PolarHBondContact O-N 3.09Å; E380-H383 WeakPolarHBondContact O-CB 3.43Å; E380-H383 PolarHBondContact O-N 2.84Å; E380-H383 IonicContact OE2-CD2 3.21Å; H383-W385 PolarHBondContact O-N 2.91Å; H383-W385 VanDerWaalsContact O-N 3.16Å; H383-G386 VanDerWaalsContact O-CA 3.31Å; H383-G386 WeakPolarHBondContact O-CA 3.29Å; H383-G386 PolarHBondContact O-N 2.85Å; H383-S387 WeakPolarHBondContact CA-O 3.39Å; H383-S387 PolarHBondContact ND1-O 3.46Å; H383-H389 AromaticContact CE1-CD2 3.41Å; H383-H389 PolarHBondContact CE1-CD2 3.43Å; H383-H389 VanDerWaalsContact CE1-CD2 3.41Å; H383-H389 AromaticContact CE1-NE2 3.4Å; H383-H389 PolarHBondContact CE1-NE2 3.44Å; H383-H389 AromaticContact NE2-CD2 3.59Å; H383-H389 AromaticContact NE2-CE1 3.83Å; H383-H389 AromaticContact NE2-NE2 3.09Å; H383-H389 PolarHBondContact NE2-NE2 3.42Å; H383-M408 VanDerWaalsContact CE1-CE 3.44Å; H383-M408 WeakPolarHBondContact CE1-CE 3.42Å; H383-M408 VanDerWaalsContact ND1-CE 3.29Å; H383-M408 WeakPolarHBondContact ND1-CE 3.23Å
384	N	96.2	Very high	91.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.1	-29.5	177.7	-82.3	179.6	0	0	0	113.8	L309 Y327 A329 G338 I339 T355 A356 E380 F381 G386	L309-N384 HydrophobicContact CD1-CB 3.67Å; L309-N384 HydrophobicContact CD2-CB 3.69Å; L309-N384 WeakPolarHBondContact CD2-OD1 3.26Å; L309-N384 HydrophobicContact CG-CB 4.35Å; Y327-N384 PolarHBondContact N-ND2 2.77Å; Y327-N384 WeakPolarHBondContact O-CA 3.17Å; Y327-N384 PolarHBondContact O-ND2 3.27Å; A329-N384 WeakPolarHBondContact CB-O 3.35Å; G338-N384 CarbonylContact C-O 3.3Å; G338-N384 VanDerWaalsContact CA-O 3.25Å; G338-N384 WeakPolarHBondContact CA-O 3.36Å; I339-N384 PolarHBondContact N-O 3.29Å; T355-N384 PolarHBondContact O-ND2 3.41Å; A356-N384 WeakPolarHBondContact CB-OD1 3.49Å; E380-N384 PolarHBondContact O-N 2.88Å; F381-N384 CarbonylContact O-C 3.53Å; F381-N384 PolarHBondContact O-N 2.8Å; N384-G386 VanDerWaalsContact C-N 3.3Å
385	W	96.6	Very high	91.4	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-83	-6.1	173.5	-77.4	43.4	0	0	0	113.3	C208 Y245 W250 V262 F264 I339 F381 G382 H383 I431 V434 L435 F443	C208-W385 HydrophobicContact CB-CZ2 4.09Å; Y245-W385 HydrophobicContact CD1-CD2 4.04Å; Y245-W385 AromaticContact CD1-CE2 3.95Å; Y245-W385 AromaticContact CD1-CE3 3.93Å; Y245-W385 HydrophobicContact CD1-CE3 3.93Å; Y245-W385 AromaticContact CD1-CH2 3.63Å; Y245-W385 HydrophobicContact CD1-CH2 3.63Å; Y245-W385 AromaticContact CD1-CZ2 3.77Å; Y245-W385 HydrophobicContact CD1-CZ2 3.77Å; Y245-W385 AromaticContact CD1-CZ3 3.73Å; Y245-W385 HydrophobicContact CD1-CZ3 3.73Å; Y245-W385 AromaticContact CE1-CD2 3.73Å; Y245-W385 HydrophobicContact CE1-CD2 3.73Å; Y245-W385 AromaticContact CE1-CE2 3.84Å; Y245-W385 AromaticContact CE1-CE3 3.94Å; Y245-W385 HydrophobicContact CE1-CE3 3.94Å; Y245-W385 HydrophobicContact CE1-CG 4.11Å; Y245-W385 HydrophobicContact CE1-CH2 4.31Å; Y245-W385 HydrophobicContact CE1-CZ2 4.15Å; Y245-W385 HydrophobicContact CE1-CZ3 4.23Å; W250-W385 AromaticContact CE2-CZ3 3.98Å; W250-W385 HydrophobicContact CZ2-CE3 4.21Å; W250-W385 AromaticContact CZ2-CZ3 3.96Å; W250-W385 HydrophobicContact CZ2-CZ3 3.96Å; V262-W385 HydrophobicContact CB-CH2 4.08Å; V262-W385 HydrophobicContact CB-CZ3 4.19Å; V262-W385 HydrophobicContact CG1-CH2 3.56Å; V262-W385 HydrophobicContact CG1-CZ3 3.86Å; F264-W385 HydrophobicContact CD1-CZ2 4.34Å; F264-W385 AromaticContact CE1-CE2 3.76Å; F264-W385 AromaticContact CE1-CZ2 3.67Å; F264-W385 HydrophobicContact CE1-CZ2 3.67Å; F264-W385 AromaticContact CE1-NE1 3.3Å; F264-W385 VanDerWaalsContact CE1-NE1 3.3Å; F264-W385 HydrophobicContact CE2-CZ2 4.18Å; F264-W385 AromaticContact CZ-CE2 3.61Å; F264-W385 AromaticContact CZ-CZ2 3.56Å; F264-W385 HydrophobicContact CZ-CZ2 3.56Å; F264-W385 AromaticContact CZ-NE1 3.37Å; I339-W385 HydrophobicContact CD1-CG 4.43Å; I339-W385 VanDerWaalsContact CG2-CD1 3.43Å; I339-W385 HydrophobicContact CG2-CG 4.13Å; F381-W385 WeakPolarHBondContact O-CB 3.47Å; F381-W385 PolarHBondContact O-N 3.44Å; G382-W385 PolarHBondContact O-N 3.19Å; H383-W385 PolarHBondContact O-N 2.91Å; H383-W385 VanDerWaalsContact O-N 3.16Å; W385-I431 HydrophobicContact CB-CD1 4.05Å; W385-I431 HydrophobicContact CB-CG1 3.93Å; W385-I431 HydrophobicContact CB-CG2 4.13Å; W385-I431 HydrophobicContact CE3-CG2 3.69Å; W385-V434 VanDerWaalsContact O-CB 3.28Å; W385-V434 WeakPolarHBondContact O-CB 3.47Å; W385-V434 WeakPolarHBondContact O-CG1 3.39Å; W385-L435 HydrophobicContact CE3-CD1 4.06Å; W385-L435 HydrophobicContact CE3-CD2 3.9Å; W385-L435 HydrophobicContact CE3-CG 4.23Å; W385-L435 HydrophobicContact CZ3-CD1 3.95Å; W385-L435 HydrophobicContact CZ3-CD2 3.94Å; W385-L435 HydrophobicContact CZ3-CG 4.43Å; W385-F443 HydrophobicContact CH2-CE1 4.35Å; W385-F443 HydrophobicContact CZ2-CE1 4.34Å; W385-F443 HydrophobicContact CZ2-CZ 4.24Å
386	G	94	Very high	91.7	Very high	7 Å²	7	19 Å²	19	7%	0.072	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	103.4	16.3	168.2	0	0	0	0	0	115.7	A329 G382 H383 N384	A329-G386 WeakPolarHBondContact O-CA 3.38Å; G382-G386 PolarHBondContact O-N 3.02Å; G382-G386 VanDerWaalsContact O-N 3.08Å; H383-G386 VanDerWaalsContact O-CA 3.31Å; H383-G386 WeakPolarHBondContact O-CA 3.29Å; H383-G386 PolarHBondContact O-N 2.85Å; N384-G386 VanDerWaalsContact C-N 3.3Å
387	S	94.6	Very high	91.7	Very high	1 Å²	1	19 Å²	19	1%	0.007	10%	0.099	C	C	.	.			trans	-76	128.6	165.1	-165.3	0	0	0	0	110.5	G382 H383 S427	G382-S387 WeakPolarHBondContact O-CB 3.46Å; G382-S387 PolarHBondContact O-N 3.13Å; H383-S387 WeakPolarHBondContact CA-O 3.39Å; H383-S387 PolarHBondContact ND1-O 3.46Å; S387-S427 WeakPolarHBondContact OG-CA 3.33Å; S387-S427 PolarHBondContact OG-OG 3.05Å
388	P	91	Very high	91.2	Very high	62 Å²	62	19.6 Å²	19.6	40%	0.403	10%	0.103	S	C	.	.			trans	-66.2	-177.4	155.5	33.6	-34.7	0	0	0	109.5
389	H	89	Confident	90.2	Very high	34 Å²	34	20.7 Å²	20.7	16%	0.157	11%	0.11	C	C	.	.	P	Polyproline II helix	trans	-60.5	146.5	161.8	-70.7	140.2	0	0	0	110.3	H379 H383 M408 T410	H379-H389 AromaticContact CE1-CD2 3.4Å; H379-H389 PolarHBondContact CE1-CD2 2.9Å; H379-H389 AromaticContact CE1-NE2 3.42Å; H379-H389 PolarHBondContact CE1-NE2 3.18Å; H379-H389 AromaticContact NE2-CD2 3.35Å; H379-H389 PolarHBondContact NE2-CD2 2.61Å; H379-H389 VanDerWaalsContact NE2-CD2 3.35Å; H379-H389 AromaticContact NE2-NE2 2.98Å; H379-H389 PolarHBondContact NE2-NE2 3.05Å; H383-H389 AromaticContact CE1-CD2 3.41Å; H383-H389 PolarHBondContact CE1-CD2 3.43Å; H383-H389 VanDerWaalsContact CE1-CD2 3.41Å; H383-H389 AromaticContact CE1-NE2 3.4Å; H383-H389 PolarHBondContact CE1-NE2 3.44Å; H383-H389 AromaticContact NE2-CD2 3.59Å; H383-H389 AromaticContact NE2-CE1 3.83Å; H383-H389 AromaticContact NE2-NE2 3.09Å; H383-H389 PolarHBondContact NE2-NE2 3.42Å; H389-M408 CarbonylContact C-O 3.5Å; H389-M408 WeakPolarHBondContact CA-O 3.36Å; H389-M408 WeakPolarHBondContact CB-O 3.43Å; H389-M408 PolarHBondContact CD2-O 2.03Å; H389-M408 VanDerWaalsContact CD2-O 3.32Å; H389-T410 WeakPolarHBondContact CB-OG1 3.44Å
390	D	88.6	Confident	88.9	Confident	2 Å²	2	23.1 Å²	23.1	1%	0.011	12%	0.122	C	C	.	.	B	Isolated β-bridge	trans	-58.8	130.1	170.9	-73.1	-43.5	0	0	0	108.4	C396 M408 S424 S427	D390-C396 HydrophobicContact CB-CB 4.41Å; D390-C396 WeakPolarHBondContact CB-O 3.39Å; D390-C396 VanDerWaalsContact OD2-O 3.1Å; D390-M408 PolarHBondContact N-O 2.53Å; D390-M408 WeakPolarHBondContact OD2-CB 3.42Å; D390-M408 PolarHBondContact OD2-N 3.09Å; D390-S424 VanDerWaalsContact CG-OG 3.32Å; D390-S424 VanDerWaalsContact OD1-CB 3.32Å; D390-S424 WeakPolarHBondContact OD1-CB 3.48Å; D390-S424 PolarHBondContact OD1-OG 2.79Å; D390-S427 PolarHBondContact OD1-OG 2.85Å
391	P	86.1	Confident	87.6	Confident	21 Å²	21	25.3 Å²	25.3	14%	0.136	14%	0.141	C	C	.	.	P	Polyproline II helix	trans	-60.1	151	176.2	27.6	-34	0	0	0	107.6	S393 C396 S397 D648	P391-S393 PolarHBondContact O-N 3.41Å; P391-C396 HydrophobicContact CG-CB 4.23Å; P391-S397 PolarHBondContact O-OG 2.75Å; P391-D648 WeakPolarHBondContact CB-OD2 3.18Å; P391-D648 WeakPolarHBondContact CG-OD2 3.06Å
392	V	81.2	Confident	86.8	Confident	11 Å²	11	28.3 Å²	28.3	7%	0.067	17%	0.165	C	C	.	.	S	Bend	trans	-72.3	81	164	179.4	0	0	0	0	102.1	F409 E644 H645 I646 W647	V392-F409 HydrophobicContact CG2-CE2 4.46Å; V392-E644 VanDerWaalsContact C-C 3.48Å; V392-E644 CarbonylContact C-O 3.45Å; V392-H645 CarbonylContact O-C 3.52Å; V392-H645 WeakPolarHBondContact O-CA 3.39Å; V392-I646 HydrophobicContact CB-CB 4.47Å; V392-I646 HydrophobicContact CG1-CB 4.03Å; V392-I646 HydrophobicContact CG1-CG1 4.23Å; V392-I646 PolarHBondContact O-N 3.24Å; V392-W647 PolarHBondContact O-N 3.4Å
393	S	86.3	Confident	85.7	Confident	22 Å²	22	28.3 Å²	28.3	15%	0.154	17%	0.165	C	C	.	.	B	Isolated β-bridge	trans	-147.1	20.9	-144.9	-171.8	0	0	0	0	115	P391 E395 E644 H645 D648	P391-S393 PolarHBondContact O-N 3.41Å; S393-E395 PolarHBondContact O-N 3.48Å; S393-E644 VanDerWaalsContact C-OE1 3.24Å; S393-E644 WeakPolarHBondContact CA-OE1 3.49Å; S393-E644 PolarHBondContact N-O 2.9Å; S393-E644 VanDerWaalsContact N-O 3.13Å; S393-E644 PolarHBondContact N-OE1 3.15Å; S393-H645 VanDerWaalsContact CB-ND1 3.28Å; S393-H645 WeakPolarHBondContact CB-ND1 3.26Å; S393-H645 PolarHBondContact OG-CE1 3Å; S393-H645 PolarHBondContact OG-ND1 2.86Å; S393-D648 WeakPolarHBondContact CA-OD2 3.23Å; S393-D648 WeakPolarHBondContact CB-OD2 3.48Å; S393-D648 WeakPolarHBondContact OG-CB 3.34Å; S393-D648 PolarHBondContact OG-OD2 3.02Å
394	K	86.4	Confident	84.7	Confident	144 Å²	144	28.2 Å²	28.2	63%	0.626	17%	0.165	S	C	*	.	S	Bend	trans	53	-17.6	171.2	-129.9	-154.2	-177.1	-164.9	0	121.3	E644	K394-E644 VanDerWaalsContact CA-O 3.3Å; K394-E644 WeakPolarHBondContact CA-O 3.5Å; K394-E644 WeakPolarHBondContact CA-OE2 3.42Å; K394-E644 PolarHBondContact N-O 3.47Å; K394-E644 PolarHBondContact N-OE1 2.82Å; K394-E644 PolarHBondContact N-OE2 3.43Å; K394-E644 VanDerWaalsContact N-OE2 3.16Å
395	E	92	Very high	84	Confident	93 Å²	93	28.9 Å²	28.9	44%	0.435	17%	0.169	S	C	.	.	S	Bend	trans	-100.5	-22.3	173.7	176.8	-169.6	-178.3	0	0	110.9	S393 P425 R429 E644	S393-E395 PolarHBondContact O-N 3.48Å; E395-P425 HydrophobicContact CG-CB 3.94Å; E395-P425 HydrophobicContact CG-CG 3.93Å; E395-P425 WeakPolarHBondContact O-CD 2.97Å; E395-P425 VanDerWaalsContact OE1-CB 3.22Å; E395-P425 WeakPolarHBondContact OE1-CB 3.27Å; E395-R429 IonicContact OE1-CZ 2.85Å; E395-R429 IonicContact OE1-NH1 3.45Å; E395-R429 PolarHBondContact OE1-NH1 3.03Å; E395-R429 IonicContact OE1-NH2 2.99Å; E395-R429 PolarHBondContact OE1-NH2 3.09Å; E395-R429 IonicContact OE2-CZ 3.26Å; E395-R429 IonicContact OE2-NH1 3.75Å; E395-R429 IonicContact OE2-NH2 3.25Å; E395-R429 PolarHBondContact OE2-NH2 2.73Å; E395-E644 PolarHBondContact N-OE2 2.82Å
396	C	92.1	Very high	83.7	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	-126.8	1.3	-147.6	-70	0	0	0	0	115.7	D390 P391 Y406 S424 C426 E644	D390-C396 HydrophobicContact CB-CB 4.41Å; D390-C396 WeakPolarHBondContact CB-O 3.39Å; D390-C396 VanDerWaalsContact OD2-O 3.1Å; P391-C396 HydrophobicContact CG-CB 4.23Å; C396-Y406 VanDerWaalsContact C-CD2 3.41Å; C396-Y406 VanDerWaalsContact O-CD2 3.24Å; C396-Y406 WeakPolarHBondContact O-CD2 3.31Å; C396-S424 WeakPolarHBondContact O-CB 3.41Å; C396-S424 PolarHBondContact O-OG 3.1Å; C396-C426 HydrophobicContact CB-CB 3.65Å; C396-C426 WeakPolarHBondContact CB-SG 3.24Å; C396-C426 WeakPolarHBondContact SG-CB 3.4Å; C396-C426 PolarHBondContact SG-N 3.2Å; C396-C426 CovalentContact SG-SG 2.03Å; C396-C426 PolarHBondContact SG-SG 3.46Å; C396-E644 WeakPolarHBondContact CA-OE1 3.09Å; C396-E644 PolarHBondContact N-OE1 2.89Å; C396-E644 PolarHBondContact N-OE2 3.28Å
397	S	86.5	Confident	83.6	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.172	C	C	.	.	S	Bend	trans	-171.6	53.1	171.4	39.1	0	0	0	0	108.5	P391 F409 E644	P391-S397 PolarHBondContact O-OG 2.75Å; S397-F409 VanDerWaalsContact CB-CD2 3.5Å; S397-F409 WeakPolarHBondContact OG-CD2 3.31Å; S397-E644 VanDerWaalsContact C-CG 3.49Å; S397-E644 VanDerWaalsContact CA-CD 3.42Å; S397-E644 PolarHBondContact N-OE1 2.93Å; S397-E644 PolarHBondContact N-OE2 2.73Å; S397-E644 VanDerWaalsContact O-CB 3.26Å; S397-E644 WeakPolarHBondContact O-CB 3.22Å; S397-E644 WeakPolarHBondContact O-CG 3.41Å; S397-E644 VanDerWaalsContact OG-CD 3.24Å; S397-E644 WeakPolarHBondContact OG-CG 3.45Å; S397-E644 PolarHBondContact OG-OE1 2.82Å; S397-E644 VanDerWaalsContact OG-OE1 3.08Å
398	P	83.6	Confident	83.5	Confident	13 Å²	13	30.1 Å²	30.1	8%	0.084	17%	0.171	C	C	.	.			trans	-63	170.7	-158.2	28.2	-38.7	0	0	0	111.7	I400 A402 G404 Y406 N419 E644	P398-I400 PolarHBondContact O-N 2.99Å; P398-A402 HydrophobicContact CB-CB 4.32Å; P398-G404 WeakPolarHBondContact CD-O 3.49Å; P398-G404 WeakPolarHBondContact CG-O 3.35Å; P398-G404 CarbonylContact O-C 3.57Å; P398-G404 WeakPolarHBondContact O-CA 3.24Å; P398-Y406 HydrophobicContact CG-CE2 4.01Å; P398-N419 VanDerWaalsContact CG-ND2 3.26Å; P398-N419 WeakPolarHBondContact CG-ND2 3.37Å; P398-E644 WeakPolarHBondContact CA-OE2 3.42Å
399	P	74.3	Confident	83.2	Confident	22 Å²	22	28.4 Å²	28.4	14%	0.143	16%	0.158	C	C	.	.			trans	-30.3	135.7	159.4	-8	-9.2	0	0	0	114.5	A401 A402 G403 G404 D641 L642	P399-A401 HydrophobicContact CB-CB 3.4Å; P399-A401 HydrophobicContact CG-CB 4.35Å; P399-A401 PolarHBondContact O-N 3.03Å; P399-A402 HydrophobicContact CB-CB 4.46Å; P399-A402 HydrophobicContact CG-CB 4.3Å; P399-A402 CarbonylContact O-C 3.58Å; P399-A402 WeakPolarHBondContact O-CA 3.08Å; P399-A402 PolarHBondContact O-N 3.24Å; P399-G403 PolarHBondContact O-N 3.43Å; P399-G404 WeakPolarHBondContact O-CA 3.35Å; P399-G404 PolarHBondContact O-N 3.32Å; P399-D641 CarbonylContact C-O 3.5Å; P399-L642 HydrophobicContact CB-CB 4.35Å; P399-L642 HydrophobicContact CB-CD1 3.72Å; P399-L642 HydrophobicContact CB-CG 3.79Å; P399-L642 HydrophobicContact CG-CD1 3.93Å; P399-L642 HydrophobicContact CG-CG 3.85Å
400	I	65.1	Low	82.5	Confident	52 Å²	52	28.3 Å²	28.3	27%	0.267	16%	0.16	S	C	.	.	G	3₁₀ helix	trans	-44.6	-33.4	153.9	-50.3	159.8	0	0	0	106.5	P398 A402 G403 D417 V639 Q640 D641	P398-I400 PolarHBondContact O-N 2.99Å; I400-A402 PolarHBondContact O-N 3.41Å; I400-G403 PolarHBondContact O-N 3.2Å; I400-D417 WeakPolarHBondContact CG2-OD1 3.38Å; I400-V639 WeakPolarHBondContact CG2-O 3.18Å; I400-Q640 VanDerWaalsContact C-CB 3.44Å; I400-Q640 WeakPolarHBondContact O-CA 3.34Å; I400-Q640 WeakPolarHBondContact O-CB 3.44Å; I400-Q640 VanDerWaalsContact O-CD 3.22Å; I400-Q640 WeakPolarHBondContact O-CG 3.15Å; I400-D641 VanDerWaalsContact CA-O 3.24Å; I400-D641 WeakPolarHBondContact CA-O 3.46Å; I400-D641 WeakPolarHBondContact CB-O 3.47Å; I400-D641 VanDerWaalsContact CG1-O 3.25Å; I400-D641 WeakPolarHBondContact CG1-O 3.37Å; I400-D641 PolarHBondContact N-O 3.36Å
401	A	69.7	Low	81.4	Confident	47 Å²	47	32.1 Å²	32.1	39%	0.388	18%	0.175	S	C	.	.	G	3₁₀ helix	trans	-54.3	-17.6	173.6	0	0	0	0	0	115.5	P399 Q640 L642	P399-A401 HydrophobicContact CB-CB 3.4Å; P399-A401 HydrophobicContact CG-CB 4.35Å; P399-A401 PolarHBondContact O-N 3.03Å; A401-Q640 VanDerWaalsContact CA-CB 3.47Å; A401-Q640 WeakPolarHBondContact CA-O 3.46Å; A401-Q640 WeakPolarHBondContact CB-O 3.11Å; A401-Q640 PolarHBondContact N-O 3.31Å; A401-Q640 PolarHBondContact O-OE1 3.48Å; A401-L642 HydrophobicContact CB-CD1 4.03Å
402	A	78.8	Confident	80	Confident	62 Å²	62	33.9 Å²	33.9	51%	0.512	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-138.1	33.3	-179.2	0	0	0	0	0	110.7	P398 P399 I400 N419	P398-A402 HydrophobicContact CB-CB 4.32Å; P399-A402 HydrophobicContact CB-CB 4.46Å; P399-A402 HydrophobicContact CG-CB 4.3Å; P399-A402 CarbonylContact O-C 3.58Å; P399-A402 WeakPolarHBondContact O-CA 3.08Å; P399-A402 PolarHBondContact O-N 3.24Å; I400-A402 PolarHBondContact O-N 3.41Å; A402-N419 PolarHBondContact O-ND2 3.38Å
403	G	73	Confident	79	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	100	-4.5	174.5	0	0	0	0	0	116.1	P399 I400 D417 Q418 N419	P399-G403 PolarHBondContact O-N 3.43Å; I400-G403 PolarHBondContact O-N 3.2Å; G403-D417 CarbonylContact O-C 3.59Å; G403-D417 WeakPolarHBondContact O-CB 3.32Å; G403-Q418 PolarHBondContact O-N 3.46Å; G403-Q418 VanDerWaalsContact O-N 3.09Å; G403-N419 WeakPolarHBondContact CA-ND2 3.03Å; G403-N419 WeakPolarHBondContact O-CB 3.48Å; G403-N419 VanDerWaalsContact O-CG 3.31Å; G403-N419 PolarHBondContact O-N 2.99Å; G403-N419 PolarHBondContact O-ND2 3.27Å
404	G	73.8	Confident	77.3	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.189	C	C	.	.			trans	94.9	173.5	170.8	0	0	0	0	0	116.1	P398 P399 N419	P398-G404 WeakPolarHBondContact CD-O 3.49Å; P398-G404 WeakPolarHBondContact CG-O 3.35Å; P398-G404 CarbonylContact O-C 3.57Å; P398-G404 WeakPolarHBondContact O-CA 3.24Å; P399-G404 WeakPolarHBondContact O-CA 3.35Å; P399-G404 PolarHBondContact O-N 3.32Å; G404-N419 PolarHBondContact N-ND2 2.92Å; G404-N419 WeakPolarHBondContact O-CB 3.45Å; G404-N419 PolarHBondContact O-ND2 3.43Å
405	P	80.7	Confident	76.1	Confident	13 Å²	13	27.3 Å²	27.3	8%	0.084	16%	0.159	C	C	.	.			trans	-57.9	147.2	168.4	21.6	-31.5	0	0	0	111.5	F409 V413 N419 N420	P405-F409 HydrophobicContact CB-CB 3.64Å; P405-F409 HydrophobicContact CB-CD1 3.45Å; P405-F409 VanDerWaalsContact CB-CD1 3.45Å; P405-F409 HydrophobicContact CB-CD2 3.88Å; P405-F409 HydrophobicContact CB-CE1 3.94Å; P405-F409 HydrophobicContact CB-CE2 4.32Å; P405-F409 HydrophobicContact CB-CG 3.4Å; P405-F409 VanDerWaalsContact CB-CG 3.4Å; P405-F409 HydrophobicContact CB-CZ 4.34Å; P405-F409 HydrophobicContact CG-CD1 3.87Å; P405-F409 HydrophobicContact CG-CE1 4.1Å; P405-F409 HydrophobicContact CG-CG 4.33Å; P405-V413 HydrophobicContact CB-CG1 3.86Å; P405-V413 HydrophobicContact CG-CG1 3.72Å; P405-N419 CarbonylContact O-C 3.08Å; P405-N419 VanDerWaalsContact O-C 3.29Å; P405-N420 WeakPolarHBondContact O-CA 3.11Å; P405-N420 PolarHBondContact O-N 3.4Å; P405-N420 VanDerWaalsContact O-N 3.11Å; P405-N420 PolarHBondContact O-ND2 3.44Å
406	Y	91.1	Very high	74.3	Confident	34 Å²	34	25.3 Å²	25.3	13%	0.133	15%	0.148	C	C	.	.			trans	-83.7	177.4	175.2	-70.3	-79.8	0	0	0	111.5	C396 P398 M408 F409 N419 I422	C396-Y406 VanDerWaalsContact C-CD2 3.41Å; C396-Y406 VanDerWaalsContact O-CD2 3.24Å; C396-Y406 WeakPolarHBondContact O-CD2 3.31Å; P398-Y406 HydrophobicContact CG-CE2 4.01Å; Y406-M408 PolarHBondContact O-N 3.41Å; Y406-F409 WeakPolarHBondContact O-CB 3.34Å; Y406-F409 PolarHBondContact O-N 2.96Å; Y406-N419 WeakPolarHBondContact CA-O 3.01Å; Y406-N419 HydrophobicContact CD1-CB 3.48Å; Y406-N419 VanDerWaalsContact CD1-CB 3.48Å; Y406-N419 WeakPolarHBondContact CD1-O 3.35Å; Y406-N419 HydrophobicContact CD2-CB 4.39Å; Y406-N419 HydrophobicContact CE1-CB 3.5Å; Y406-N419 WeakPolarHBondContact CE1-OD1 3.32Å; Y406-N419 HydrophobicContact CE2-CB 4.48Å; Y406-N419 HydrophobicContact CG-CB 3.95Å; Y406-I422 HydrophobicContact CD1-CD1 4.43Å; Y406-I422 HydrophobicContact CD1-CG1 3.71Å; Y406-I422 WeakPolarHBondContact CD1-O 3.42Å; Y406-I422 HydrophobicContact CE1-CD1 3.89Å; Y406-I422 HydrophobicContact CE1-CG1 3.7Å
407	I	91.5	Very high	73	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	15%	0.151	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-38.9	-178.6	-72.1	171.2	0	0	0	112.9	I244 A378 H379 F409 I422 F423	I244-I407 HydrophobicContact CD1-CD1 4.46Å; I244-I407 HydrophobicContact CG2-CD1 3.6Å; A378-I407 HydrophobicContact CB-CD1 4.48Å; A378-I407 HydrophobicContact CB-CG2 4.3Å; H379-I407 HydrophobicContact CB-CG2 4.15Å; H379-I407 PolarHBondContact ND1-O 2.92Å; I407-F409 VanDerWaalsContact C-N 3.3Å; I407-F409 PolarHBondContact O-N 3.29Å; I407-I422 WeakPolarHBondContact CG1-O 3.26Å; I407-I422 PolarHBondContact N-O 2.77Å; I407-F423 HydrophobicContact CB-CD1 4.37Å; I407-F423 HydrophobicContact CB-CE1 4.2Å; I407-F423 HydrophobicContact CD1-CD2 4.36Å; I407-F423 HydrophobicContact CD1-CE2 4.1Å; I407-F423 HydrophobicContact CD1-CZ 4.23Å; I407-F423 HydrophobicContact CG2-CD1 4.49Å; I407-F423 HydrophobicContact CG2-CE1 3.84Å; I407-F423 HydrophobicContact CG2-CZ 4.07Å
408	M	92.4	Very high	72.5	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	15.7	-173.7	-60	-56.4	-51.3	0	0	114.1	H379 H383 H389 D390 Y406 F423 S427	H379-M408 HydrophobicContact CB-SD 4.43Å; H379-M408 WeakPolarHBondContact O-CE 3.23Å; H379-M408 VanDerWaalsContact O-SD 3.41Å; H383-M408 VanDerWaalsContact CE1-CE 3.44Å; H383-M408 WeakPolarHBondContact CE1-CE 3.42Å; H383-M408 VanDerWaalsContact ND1-CE 3.29Å; H383-M408 WeakPolarHBondContact ND1-CE 3.23Å; H389-M408 CarbonylContact C-O 3.5Å; H389-M408 WeakPolarHBondContact CA-O 3.36Å; H389-M408 WeakPolarHBondContact CB-O 3.43Å; H389-M408 PolarHBondContact CD2-O 2.03Å; H389-M408 VanDerWaalsContact CD2-O 3.32Å; D390-M408 PolarHBondContact N-O 2.53Å; D390-M408 WeakPolarHBondContact OD2-CB 3.42Å; D390-M408 PolarHBondContact OD2-N 3.09Å; Y406-M408 PolarHBondContact O-N 3.41Å; M408-F423 HydrophobicContact CG-CD1 3.87Å; M408-F423 HydrophobicContact CG-CE1 3.83Å; M408-F423 HydrophobicContact SD-CD1 4.49Å; M408-F423 HydrophobicContact SD-CE1 3.85Å; M408-S427 WeakPolarHBondContact CB-OG 3.35Å; M408-S427 WeakPolarHBondContact CG-OG 3.17Å
409	F	85.8	Confident	72.6	Confident	26 Å²	26	32.1 Å²	32.1	11%	0.114	18%	0.18	C	C	.	.	B	Isolated β-bridge	trans	-61.9	140.7	176.4	-171	-128.1	0	0	0	112.6	H379 V392 S397 P405 Y406 I407 Y411 V413	H379-F409 PolarHBondContact CE1-O 2.83Å; V392-F409 HydrophobicContact CG2-CE2 4.46Å; S397-F409 VanDerWaalsContact CB-CD2 3.5Å; S397-F409 WeakPolarHBondContact OG-CD2 3.31Å; P405-F409 HydrophobicContact CB-CB 3.64Å; P405-F409 HydrophobicContact CB-CD1 3.45Å; P405-F409 VanDerWaalsContact CB-CD1 3.45Å; P405-F409 HydrophobicContact CB-CD2 3.88Å; P405-F409 HydrophobicContact CB-CE1 3.94Å; P405-F409 HydrophobicContact CB-CE2 4.32Å; P405-F409 HydrophobicContact CB-CG 3.4Å; P405-F409 VanDerWaalsContact CB-CG 3.4Å; P405-F409 HydrophobicContact CB-CZ 4.34Å; P405-F409 HydrophobicContact CG-CD1 3.87Å; P405-F409 HydrophobicContact CG-CE1 4.1Å; P405-F409 HydrophobicContact CG-CG 4.33Å; Y406-F409 WeakPolarHBondContact O-CB 3.34Å; Y406-F409 PolarHBondContact O-N 2.96Å; I407-F409 VanDerWaalsContact C-N 3.3Å; I407-F409 PolarHBondContact O-N 3.29Å; F409-Y411 WeakPolarHBondContact CD1-O 3.47Å; F409-Y411 AromaticContact CE1-CD2 3.87Å; F409-Y411 HydrophobicContact CE1-CD2 3.87Å; F409-Y411 HydrophobicContact CE1-CG 4.36Å; F409-Y411 AromaticContact CZ-CD2 3.87Å; F409-Y411 HydrophobicContact CZ-CD2 3.87Å; F409-Y411 PolarHBondContact O-N 2.95Å; F409-Y411 VanDerWaalsContact O-N 3.16Å; F409-V413 HydrophobicContact CB-CG1 3.87Å; F409-V413 HydrophobicContact CD1-CG1 3.97Å; F409-V413 HydrophobicContact CG-CG1 4.4Å
410	T	73.1	Confident	72.9	Confident	32 Å²	32	31 Å²	31	20%	0.196	17%	0.173	C	C	.	.	S	Bend	trans	-60	-25.7	-176.5	-48	0	0	0	0	114.3	H389	H389-T410 WeakPolarHBondContact CB-OG1 3.44Å
411	Y	65.4	Low	73.5	Confident	83 Å²	83	31.2 Å²	31.2	33%	0.325	17%	0.172	S	C	.	.	B	Isolated β-bridge	trans	-110.6	159.3	-179.9	-54.3	-62.5	0	0	0	111.2	P172 F409 V413	P172-Y411 HydrophobicContact CB-CD1 3.84Å; P172-Y411 HydrophobicContact CB-CE1 3.39Å; P172-Y411 HydrophobicContact CB-CE2 4.32Å; P172-Y411 HydrophobicContact CB-CG 4.47Å; F409-Y411 WeakPolarHBondContact CD1-O 3.47Å; F409-Y411 AromaticContact CE1-CD2 3.87Å; F409-Y411 HydrophobicContact CE1-CD2 3.87Å; F409-Y411 HydrophobicContact CE1-CG 4.36Å; F409-Y411 AromaticContact CZ-CD2 3.87Å; F409-Y411 HydrophobicContact CZ-CD2 3.87Å; F409-Y411 PolarHBondContact O-N 2.95Å; F409-Y411 VanDerWaalsContact O-N 3.16Å; Y411-V413 PolarHBondContact O-N 3.46Å
412	S	58.4	Low	74.6	Confident	57 Å²	57	32.6 Å²	32.6	40%	0.399	17%	0.172	S	C	.	.			trans	-59.3	121.1	-177.7	180	0	0	0	0	111	F175	F175-S412 VanDerWaalsContact CD2-CB 3.42Å; F175-S412 WeakPolarHBondContact CD2-OG 3.23Å
413	V	58.5	Low	75.3	Confident	7 Å²	7	30 Å²	30	4%	0.042	15%	0.149	C	C	.	.			trans	-89.4	137.6	171.4	-55.7	0	0	0	0	109.6	I375 P405 F409 Y411 G415 N420	I375-V413 HydrophobicContact CG2-CG2 3.66Å; P405-V413 HydrophobicContact CB-CG1 3.86Å; P405-V413 HydrophobicContact CG-CG1 3.72Å; F409-V413 HydrophobicContact CB-CG1 3.87Å; F409-V413 HydrophobicContact CD1-CG1 3.97Å; F409-V413 HydrophobicContact CG-CG1 4.4Å; Y411-V413 PolarHBondContact O-N 3.46Å; V413-G415 PolarHBondContact O-N 2.92Å; V413-N420 HydrophobicContact CB-CB 4.18Å; V413-N420 HydrophobicContact CG2-CB 3.98Å
414	S	51.6	Low	76.4	Confident	32 Å²	32	30 Å²	30	22%	0.224	15%	0.149	C	C	.	.			trans	-72.2	-13.8	-175.9	64.9	0	0	0	0	114	L164 Y416	L164-S414 VanDerWaalsContact CD1-O 3.28Å; L164-S414 WeakPolarHBondContact CD1-O 3.37Å; S414-Y416 PolarHBondContact O-N 3.34Å; S414-Y416 WeakPolarHBondContact OG-CB 3.43Å; S414-Y416 PolarHBondContact OG-N 3.19Å
415	G	60.4	Low	77.3	Confident	0 Å²	0	31.4 Å²	31.4	0%	0	16%	0.158	C	C	.	.	S	Bend	trans	75.1	1.9	-170.2	0	0	0	0	0	114	R371 I375 V413 N420 K421	R371-G415 PolarHBondContact NE-O 3.43Å; R371-G415 PolarHBondContact NH2-O 3.17Å; I375-G415 VanDerWaalsContact CD1-CA 3.41Å; V413-G415 PolarHBondContact O-N 2.92Å; G415-N420 VanDerWaalsContact CA-OD1 3.32Å; G415-N420 WeakPolarHBondContact CA-OD1 3.29Å; G415-N420 PolarHBondContact N-OD1 3.48Å; G415-K421 VanDerWaalsContact O-CE 3.26Å; G415-K421 WeakPolarHBondContact O-CE 3.45Å; G415-K421 PolarHBondContact O-NZ 3.41Å
416	Y	54.3	Low	78	Confident	51 Å²	51	31.7 Å²	31.7	20%	0.2	16%	0.16	C	C	.	.			trans	-66.2	-59.3	175.8	-175.6	-104.7	0	0	0	110.3	S414 N420 K421 E638	S414-Y416 PolarHBondContact O-N 3.34Å; S414-Y416 WeakPolarHBondContact OG-CB 3.43Å; S414-Y416 PolarHBondContact OG-N 3.19Å; Y416-N420 PolarHBondContact N-OD1 2.85Å; Y416-N420 VanDerWaalsContact N-OD1 3.16Å; Y416-K421 VanDerWaalsContact O-CE 3.27Å; Y416-K421 WeakPolarHBondContact O-CE 2.98Å; Y416-K421 PolarHBondContact O-NZ 3.08Å; Y416-E638 WeakPolarHBondContact OH-CA 3.49Å
417	D	65.8	Low	78.2	Confident	12 Å²	12	30 Å²	30	6%	0.064	15%	0.154	C	C	.	.	S	Bend	trans	-69.7	155.6	-165	-32.6	-53.8	0	0	0	112.2	I400 G403 N419 N420 K421	I400-D417 WeakPolarHBondContact CG2-OD1 3.38Å; G403-D417 CarbonylContact O-C 3.59Å; G403-D417 WeakPolarHBondContact O-CB 3.32Å; D417-N419 PolarHBondContact O-N 2.91Å; D417-N420 WeakPolarHBondContact CB-ND2 3.44Å; D417-N420 PolarHBondContact N-OD1 3.38Å; D417-N420 VanDerWaalsContact N-OD1 3.11Å; D417-N420 WeakPolarHBondContact O-CB 3.16Å; D417-N420 PolarHBondContact O-N 3.05Å; D417-N420 PolarHBondContact OD2-ND2 2.85Å; D417-N420 PolarHBondContact OD2-OD1 2.77Å; D417-K421 WeakPolarHBondContact O-CE 3.44Å
418	Q	75.7	Confident	78.5	Confident	134 Å²	134	32.1 Å²	32.1	63%	0.626	16%	0.161	S	C	*	.	S	Bend	trans	-54.2	-39.9	-179	-176.6	173.7	4.3	0	0	112.9	G403	G403-Q418 PolarHBondContact O-N 3.46Å; G403-Q418 VanDerWaalsContact O-N 3.09Å
419	N	85.6	Confident	78.5	Confident	10 Å²	10	35.7 Å²	35.7	5%	0.053	18%	0.175	C	C	.	.	G	3₁₀ helix	trans	-82.8	-23.6	-175.4	-66.9	-20	0	0	0	113	P398 A402 G403 G404 P405 Y406 D417 K421 I422	P398-N419 VanDerWaalsContact CG-ND2 3.26Å; P398-N419 WeakPolarHBondContact CG-ND2 3.37Å; A402-N419 PolarHBondContact O-ND2 3.38Å; G403-N419 WeakPolarHBondContact CA-ND2 3.03Å; G403-N419 WeakPolarHBondContact O-CB 3.48Å; G403-N419 VanDerWaalsContact O-CG 3.31Å; G403-N419 PolarHBondContact O-N 2.99Å; G403-N419 PolarHBondContact O-ND2 3.27Å; G404-N419 PolarHBondContact N-ND2 2.92Å; G404-N419 WeakPolarHBondContact O-CB 3.45Å; G404-N419 PolarHBondContact O-ND2 3.43Å; P405-N419 CarbonylContact O-C 3.08Å; P405-N419 VanDerWaalsContact O-C 3.29Å; Y406-N419 WeakPolarHBondContact CA-O 3.01Å; Y406-N419 HydrophobicContact CD1-CB 3.48Å; Y406-N419 VanDerWaalsContact CD1-CB 3.48Å; Y406-N419 WeakPolarHBondContact CD1-O 3.35Å; Y406-N419 HydrophobicContact CD2-CB 4.39Å; Y406-N419 HydrophobicContact CE1-CB 3.5Å; Y406-N419 WeakPolarHBondContact CE1-OD1 3.32Å; Y406-N419 HydrophobicContact CE2-CB 4.48Å; Y406-N419 HydrophobicContact CG-CB 3.95Å; D417-N419 PolarHBondContact O-N 2.91Å; N419-K421 PolarHBondContact O-N 3.44Å; N419-I422 PolarHBondContact O-N 3.18Å; N419-I422 VanDerWaalsContact O-N 3.08Å; N419-I422 VanDerWaalsContact O-O 3.06Å
420	N	79.8	Confident	78.9	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-59.2	-4.9	177.8	-59.9	176.4	0	0	0	113.4	P405 V413 G415 Y416 D417	P405-N420 WeakPolarHBondContact O-CA 3.11Å; P405-N420 PolarHBondContact O-N 3.4Å; P405-N420 VanDerWaalsContact O-N 3.11Å; P405-N420 PolarHBondContact O-ND2 3.44Å; V413-N420 HydrophobicContact CB-CB 4.18Å; V413-N420 HydrophobicContact CG2-CB 3.98Å; G415-N420 VanDerWaalsContact CA-OD1 3.32Å; G415-N420 WeakPolarHBondContact CA-OD1 3.29Å; G415-N420 PolarHBondContact N-OD1 3.48Å; Y416-N420 PolarHBondContact N-OD1 2.85Å; Y416-N420 VanDerWaalsContact N-OD1 3.16Å; D417-N420 WeakPolarHBondContact CB-ND2 3.44Å; D417-N420 PolarHBondContact N-OD1 3.38Å; D417-N420 VanDerWaalsContact N-OD1 3.11Å; D417-N420 WeakPolarHBondContact O-CB 3.16Å; D417-N420 PolarHBondContact O-N 3.05Å; D417-N420 PolarHBondContact OD2-ND2 2.85Å; D417-N420 PolarHBondContact OD2-OD1 2.77Å
421	K	78.9	Confident	80	Confident	56 Å²	56	34.8 Å²	34.8	24%	0.243	17%	0.173	C	C	.	.	G	3₁₀ helix	trans	-115.9	-2.2	-170.4	-26.8	-169.7	-177.1	-168.3	0	112.3	R371 G415 Y416 D417 N419	R371-K421 VanDerWaalsContact NH2-CG 3.26Å; G415-K421 VanDerWaalsContact O-CE 3.26Å; G415-K421 WeakPolarHBondContact O-CE 3.45Å; G415-K421 PolarHBondContact O-NZ 3.41Å; Y416-K421 VanDerWaalsContact O-CE 3.27Å; Y416-K421 WeakPolarHBondContact O-CE 2.98Å; Y416-K421 PolarHBondContact O-NZ 3.08Å; D417-K421 WeakPolarHBondContact O-CE 3.44Å; N419-K421 PolarHBondContact O-N 3.44Å
422	I	91.3	Very high	81.4	Confident	76 Å²	76	31.3 Å²	31.3	39%	0.39	16%	0.16	S	C	.	.	S	Bend	trans	-140.8	164.9	-176.9	61.1	-176.3	0	0	0	110.9	Y406 I407 N419	Y406-I422 HydrophobicContact CD1-CD1 4.43Å; Y406-I422 HydrophobicContact CD1-CG1 3.71Å; Y406-I422 WeakPolarHBondContact CD1-O 3.42Å; Y406-I422 HydrophobicContact CE1-CD1 3.89Å; Y406-I422 HydrophobicContact CE1-CG1 3.7Å; I407-I422 WeakPolarHBondContact CG1-O 3.26Å; I407-I422 PolarHBondContact N-O 2.77Å; N419-I422 PolarHBondContact O-N 3.18Å; N419-I422 VanDerWaalsContact O-N 3.08Å; N419-I422 VanDerWaalsContact O-O 3.06Å
423	F	94.9	Very high	83.1	Confident	7 Å²	7	30.4 Å²	30.4	3%	0.031	16%	0.155	C	C	.	.			trans	-85.4	144.1	176.4	-72.2	-80.9	0	0	0	112.1	I244 Y245 T248 W250 I407 M408 R428 I431	I244-F423 HydrophobicContact CG2-CD2 4.34Å; I244-F423 HydrophobicContact CG2-CE2 3.9Å; Y245-F423 HydrophobicContact CD2-CE2 4.16Å; Y245-F423 HydrophobicContact CE1-CE2 4.34Å; Y245-F423 HydrophobicContact CE1-CZ 4.24Å; Y245-F423 AromaticContact CE2-CE2 3.79Å; Y245-F423 HydrophobicContact CE2-CE2 3.79Å; Y245-F423 AromaticContact CE2-CZ 3.72Å; Y245-F423 HydrophobicContact CE2-CZ 3.72Å; Y245-F423 AromaticContact CZ-CE2 3.87Å; Y245-F423 AromaticContact CZ-CZ 3.54Å; Y245-F423 WeakPolarHBondContact OH-CZ 3.31Å; T248-F423 HydrophobicContact CG2-CB 4.39Å; T248-F423 HydrophobicContact CG2-CD2 4.28Å; W250-F423 HydrophobicContact CH2-CD1 4.49Å; W250-F423 AromaticContact CH2-CD2 3.47Å; W250-F423 HydrophobicContact CH2-CD2 3.47Å; W250-F423 VanDerWaalsContact CH2-CD2 3.47Å; W250-F423 AromaticContact CH2-CE2 3.7Å; W250-F423 HydrophobicContact CH2-CE2 3.7Å; W250-F423 AromaticContact CH2-CG 3.92Å; W250-F423 HydrophobicContact CH2-CG 3.92Å; W250-F423 HydrophobicContact CH2-CZ 4.31Å; W250-F423 HydrophobicContact CZ2-CD2 4.41Å; W250-F423 HydrophobicContact CZ3-CB 4.23Å; W250-F423 HydrophobicContact CZ3-CD1 4.5Å; W250-F423 AromaticContact CZ3-CD2 3.98Å; W250-F423 HydrophobicContact CZ3-CD2 3.98Å; W250-F423 AromaticContact CZ3-CG 3.96Å; W250-F423 HydrophobicContact CZ3-CG 3.96Å; I407-F423 HydrophobicContact CB-CD1 4.37Å; I407-F423 HydrophobicContact CB-CE1 4.2Å; I407-F423 HydrophobicContact CD1-CD2 4.36Å; I407-F423 HydrophobicContact CD1-CE2 4.1Å; I407-F423 HydrophobicContact CD1-CZ 4.23Å; I407-F423 HydrophobicContact CG2-CD1 4.49Å; I407-F423 HydrophobicContact CG2-CE1 3.84Å; I407-F423 HydrophobicContact CG2-CZ 4.07Å; M408-F423 HydrophobicContact CG-CD1 3.87Å; M408-F423 HydrophobicContact CG-CE1 3.83Å; M408-F423 HydrophobicContact SD-CD1 4.49Å; M408-F423 HydrophobicContact SD-CE1 3.85Å; F423-R428 HydrophobicContact CB-CG 4.16Å; F423-I431 HydrophobicContact CD1-CD1 4.43Å; F423-I431 HydrophobicContact CE1-CD1 4.43Å
424	S	94.6	Very high	84.9	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.154	C	C	.	.			trans	-69.5	165.7	177.2	90.3	0	0	0	0	112.8	D390 C396 C426 S427 R428	D390-S424 VanDerWaalsContact CG-OG 3.32Å; D390-S424 VanDerWaalsContact OD1-CB 3.32Å; D390-S424 WeakPolarHBondContact OD1-CB 3.48Å; D390-S424 PolarHBondContact OD1-OG 2.79Å; C396-S424 WeakPolarHBondContact O-CB 3.41Å; C396-S424 PolarHBondContact O-OG 3.1Å; S424-C426 VanDerWaalsContact C-N 3.3Å; S424-C426 PolarHBondContact O-N 3.5Å; S424-C426 PolarHBondContact OG-N 2.88Å; S424-S427 PolarHBondContact O-N 3.37Å; S424-S427 PolarHBondContact OG-N 2.9Å; S424-S427 PolarHBondContact OG-OG 2.79Å; S424-R428 WeakPolarHBondContact O-CB 3.34Å; S424-R428 WeakPolarHBondContact O-CD 3.28Å; S424-R428 WeakPolarHBondContact O-CG 3.42Å; S424-R428 PolarHBondContact O-N 2.75Å
425	P	94.4	Very high	86.9	Confident	29 Å²	29	28.6 Å²	28.6	19%	0.188	14%	0.143	C	C	.	.	H	α-helix	trans	-56.1	-39.5	167.8	-26.1	37.3	0	0	0	113.6	E395 R428 R429	E395-P425 HydrophobicContact CG-CB 3.94Å; E395-P425 HydrophobicContact CG-CG 3.93Å; E395-P425 WeakPolarHBondContact O-CD 2.97Å; E395-P425 VanDerWaalsContact OE1-CB 3.22Å; E395-P425 WeakPolarHBondContact OE1-CB 3.27Å; P425-R428 PolarHBondContact O-N 3.38Å; P425-R429 WeakPolarHBondContact O-CG 3.47Å; P425-R429 PolarHBondContact O-N 3.42Å
426	C	94.7	Very high	88.5	Confident	19 Å²	19	32.9 Å²	32.9	13%	0.128	16%	0.163	C	C	.	.	H	α-helix	trans	-64.6	-48.1	176.2	-67.3	0	0	0	0	111.7	C396 S424 R428 R429 S430	C396-C426 HydrophobicContact CB-CB 3.65Å; C396-C426 WeakPolarHBondContact CB-SG 3.24Å; C396-C426 WeakPolarHBondContact SG-CB 3.4Å; C396-C426 PolarHBondContact SG-N 3.2Å; C396-C426 CovalentContact SG-SG 2.03Å; C396-C426 PolarHBondContact SG-SG 3.46Å; S424-C426 VanDerWaalsContact C-N 3.3Å; S424-C426 PolarHBondContact O-N 3.5Å; S424-C426 PolarHBondContact OG-N 2.88Å; C426-R428 VanDerWaalsContact C-N 3.33Å; C426-R428 PolarHBondContact O-N 3.12Å; C426-R429 PolarHBondContact O-N 2.94Å; C426-R429 PolarHBondContact SG-NH2 3.2Å; C426-R429 VanDerWaalsContact SG-NH2 3.44Å; C426-S430 PolarHBondContact O-N 2.76Å; C426-S430 PolarHBondContact O-OG 3.29Å; C426-S430 VanDerWaalsContact O-OG 3.13Å
427	S	96.1	Very high	90.2	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-57.1	-46.3	175.4	-72.3	0	0	0	0	111.3	S387 D390 M408 S424 R429 S430 I431	S387-S427 WeakPolarHBondContact OG-CA 3.33Å; S387-S427 PolarHBondContact OG-OG 3.05Å; D390-S427 PolarHBondContact OD1-OG 2.85Å; M408-S427 WeakPolarHBondContact CB-OG 3.35Å; M408-S427 WeakPolarHBondContact CG-OG 3.17Å; S424-S427 PolarHBondContact O-N 3.37Å; S424-S427 PolarHBondContact OG-N 2.9Å; S424-S427 PolarHBondContact OG-OG 2.79Å; S427-R429 PolarHBondContact O-N 3.11Å; S427-S430 PolarHBondContact O-N 3.04Å; S427-I431 WeakPolarHBondContact O-CB 3.25Å; S427-I431 WeakPolarHBondContact O-CG1 3.46Å; S427-I431 PolarHBondContact O-N 2.74Å
428	R	96	Very high	91.5	Very high	44 Å²	44	31.6 Å²	31.6	17%	0.166	16%	0.164	C	C	.	.	H	α-helix	trans	-60.5	-42.6	179	-73	165.3	74.9	-156.3	4.8	112.2	T248 I249 W250 E254 F423 S424 P425 C426 K432	T248-R428 HydrophobicContact CG2-CG 4.15Å; I249-R428 VanDerWaalsContact O-CZ 3.32Å; I249-R428 PolarHBondContact O-NE 3.03Å; I249-R428 PolarHBondContact O-NH2 2.82Å; W250-R428 HydrophobicContact CE3-CG 4.35Å; E254-R428 IonicContact OE1-CZ 2.73Å; E254-R428 IonicContact OE1-NH1 3.24Å; E254-R428 PolarHBondContact OE1-NH1 2.96Å; E254-R428 IonicContact OE1-NH2 3.42Å; E254-R428 PolarHBondContact OE1-NH2 3.33Å; F423-R428 HydrophobicContact CB-CG 4.16Å; S424-R428 WeakPolarHBondContact O-CB 3.34Å; S424-R428 WeakPolarHBondContact O-CD 3.28Å; S424-R428 WeakPolarHBondContact O-CG 3.42Å; S424-R428 PolarHBondContact O-N 2.75Å; P425-R428 PolarHBondContact O-N 3.38Å; C426-R428 VanDerWaalsContact C-N 3.33Å; C426-R428 PolarHBondContact O-N 3.12Å; R428-K432 VanDerWaalsContact O-CB 3.27Å; R428-K432 WeakPolarHBondContact O-CB 3.37Å; R428-K432 PolarHBondContact O-N 3.37Å
429	R	94	Very high	92.2	Very high	74 Å²	74	25.4 Å²	25.4	28%	0.279	14%	0.135	S	C	.	.	H	α-helix	trans	-62.4	-52.5	174.6	-75	-174.9	-68.7	-102.2	11.7	112.4	D252 E395 P425 C426 S427 I431 K432 A433	D252-R429 HydrophobicContact CB-CG 4.1Å; D252-R429 WeakPolarHBondContact OD1-CG 3.45Å; E395-R429 IonicContact OE1-CZ 2.85Å; E395-R429 IonicContact OE1-NH1 3.45Å; E395-R429 PolarHBondContact OE1-NH1 3.03Å; E395-R429 IonicContact OE1-NH2 2.99Å; E395-R429 PolarHBondContact OE1-NH2 3.09Å; E395-R429 IonicContact OE2-CZ 3.26Å; E395-R429 IonicContact OE2-NH1 3.75Å; E395-R429 IonicContact OE2-NH2 3.25Å; E395-R429 PolarHBondContact OE2-NH2 2.73Å; P425-R429 WeakPolarHBondContact O-CG 3.47Å; P425-R429 PolarHBondContact O-N 3.42Å; C426-R429 PolarHBondContact O-N 2.94Å; C426-R429 PolarHBondContact SG-NH2 3.2Å; C426-R429 VanDerWaalsContact SG-NH2 3.44Å; S427-R429 PolarHBondContact O-N 3.11Å; R429-I431 VanDerWaalsContact C-N 3.33Å; R429-I431 PolarHBondContact O-N 3.21Å; R429-K432 PolarHBondContact O-N 2.97Å; R429-A433 PolarHBondContact O-N 2.91Å; R429-A433 VanDerWaalsContact O-N 3.08Å
430	S	94.5	Very high	92.5	Very high	39 Å²	39	28.5 Å²	28.5	27%	0.273	15%	0.15	S	C	.	.	H	α-helix	trans	-58.7	-45.7	-178.8	-60.9	0	0	0	0	111.5	C426 S427 A433 V434	C426-S430 PolarHBondContact O-N 2.76Å; C426-S430 PolarHBondContact O-OG 3.29Å; C426-S430 VanDerWaalsContact O-OG 3.13Å; S427-S430 PolarHBondContact O-N 3.04Å; S430-A433 PolarHBondContact O-N 3Å; S430-V434 WeakPolarHBondContact O-CG2 3.44Å; S430-V434 PolarHBondContact O-N 3.39Å
431	I	96	Very high	93	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-69.6	-39.5	178.5	-71.2	171.4	0	0	0	111.7	W250 W385 F423 S427 R429 A433 V434 L435	W250-I431 HydrophobicContact CD2-CG2 3.77Å; W250-I431 HydrophobicContact CE3-CB 3.75Å; W250-I431 HydrophobicContact CE3-CD1 4.31Å; W250-I431 HydrophobicContact CE3-CG2 3.35Å; W250-I431 HydrophobicContact CG-CG2 4.46Å; W250-I431 HydrophobicContact CH2-CD1 3.92Å; W250-I431 HydrophobicContact CH2-CG2 4.15Å; W250-I431 HydrophobicContact CZ3-CB 3.84Å; W250-I431 HydrophobicContact CZ3-CD1 3.48Å; W250-I431 VanDerWaalsContact CZ3-CD1 3.48Å; W250-I431 HydrophobicContact CZ3-CG1 4.23Å; W250-I431 HydrophobicContact CZ3-CG2 3.59Å; W385-I431 HydrophobicContact CB-CD1 4.05Å; W385-I431 HydrophobicContact CB-CG1 3.93Å; W385-I431 HydrophobicContact CB-CG2 4.13Å; W385-I431 HydrophobicContact CE3-CG2 3.69Å; F423-I431 HydrophobicContact CD1-CD1 4.43Å; F423-I431 HydrophobicContact CE1-CD1 4.43Å; S427-I431 WeakPolarHBondContact O-CB 3.25Å; S427-I431 WeakPolarHBondContact O-CG1 3.46Å; S427-I431 PolarHBondContact O-N 2.74Å; R429-I431 VanDerWaalsContact C-N 3.33Å; R429-I431 PolarHBondContact O-N 3.21Å; I431-A433 VanDerWaalsContact C-N 3.32Å; I431-A433 PolarHBondContact O-N 3.23Å; I431-V434 PolarHBondContact O-N 3.48Å; I431-L435 HydrophobicContact CG2-CD1 3.74Å; I431-L435 HydrophobicContact CG2-CG 4.04Å; I431-L435 WeakPolarHBondContact O-CB 3.42Å; I431-L435 WeakPolarHBondContact O-CG 3.21Å; I431-L435 PolarHBondContact O-N 2.88Å
432	K	95	Very high	93.7	Very high	11 Å²	11	32.1 Å²	32.1	5%	0.048	17%	0.173	C	C	.	.	H	α-helix	trans	-54.8	-47.2	173.3	-176.2	-156.9	-176	-170	0	110.9	D252 E256 F259 R428 R429 V434 L435 Q436	D252-K432 HydrophobicContact CB-CD 4.44Å; D252-K432 VanDerWaalsContact CG-CD 3.42Å; D252-K432 WeakPolarHBondContact OD1-CD 3.39Å; D252-K432 IonicContact OD1-NZ 3.52Å; D252-K432 WeakPolarHBondContact OD2-CD 3.41Å; D252-K432 IonicContact OD2-NZ 3.05Å; D252-K432 PolarHBondContact OD2-NZ 2.94Å; E256-K432 IonicContact OE2-NZ 3.54Å; E256-K432 PolarHBondContact OE2-NZ 3.14Å; F259-K432 HydrophobicContact CD2-CG 4.33Å; F259-K432 HydrophobicContact CE2-CG 4.22Å; F259-K432 WeakPolarHBondContact CE2-O 3.44Å; R428-K432 VanDerWaalsContact O-CB 3.27Å; R428-K432 WeakPolarHBondContact O-CB 3.37Å; R428-K432 PolarHBondContact O-N 3.37Å; R429-K432 PolarHBondContact O-N 2.97Å; K432-V434 VanDerWaalsContact C-N 3.31Å; K432-V434 PolarHBondContact O-N 3.48Å; K432-L435 PolarHBondContact O-N 2.98Å; K432-Q436 WeakPolarHBondContact O-CB 3.38Å; K432-Q436 WeakPolarHBondContact O-CG 3.35Å; K432-Q436 PolarHBondContact O-N 3.43Å
433	A	93.9	Very high	93.9	Very high	37 Å²	37	28.7 Å²	28.7	31%	0.306	16%	0.155	S	C	.	.	H	α-helix	trans	-60.9	-38.9	-179.9	0	0	0	0	0	112.6	P331 R429 S430 I431 A437	P331-A433 HydrophobicContact CB-CB 4.11Å; P331-A433 HydrophobicContact CG-CB 4.41Å; R429-A433 PolarHBondContact O-N 2.91Å; R429-A433 VanDerWaalsContact O-N 3.08Å; S430-A433 PolarHBondContact O-N 3Å; I431-A433 VanDerWaalsContact C-N 3.32Å; I431-A433 PolarHBondContact O-N 3.23Å; A433-A437 PolarHBondContact O-N 3.35Å
434	V	94.8	Very high	93.7	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-75.2	-40.7	179.3	-178.3	0	0	0	0	111	A329 P331 I339 W385 S430 I431 K432 Q436 A437 K438	A329-V434 HydrophobicContact CB-CG1 3.7Å; P331-V434 HydrophobicContact CB-CG2 4.07Å; P331-V434 HydrophobicContact CG-CG2 4.43Å; I339-V434 HydrophobicContact CD1-CG1 3.92Å; I339-V434 HydrophobicContact CG1-CG1 3.98Å; W385-V434 VanDerWaalsContact O-CB 3.28Å; W385-V434 WeakPolarHBondContact O-CB 3.47Å; W385-V434 WeakPolarHBondContact O-CG1 3.39Å; S430-V434 WeakPolarHBondContact O-CG2 3.44Å; S430-V434 PolarHBondContact O-N 3.39Å; I431-V434 PolarHBondContact O-N 3.48Å; K432-V434 VanDerWaalsContact C-N 3.31Å; K432-V434 PolarHBondContact O-N 3.48Å; V434-Q436 VanDerWaalsContact C-N 3.32Å; V434-Q436 PolarHBondContact O-N 1.84Å; V434-A437 PolarHBondContact O-N 2.86Å; V434-K438 HydrophobicContact CG1-CD 4.11Å; V434-K438 WeakPolarHBondContact O-CB 3.43Å; V434-K438 PolarHBondContact O-N 2.82Å
435	L	94.7	Very high	93.3	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-60.9	-39.6	173.4	-72.9	174.7	0	0	0	111.6	W250 F259 V262 I339 W385 I431 K432 A437 S439 F443	W250-L435 HydrophobicContact CB-CD1 4.14Å; W250-L435 HydrophobicContact CD2-CD1 4.3Å; W250-L435 HydrophobicContact CG-CD1 3.83Å; F259-L435 HydrophobicContact CB-CD1 4.35Å; F259-L435 HydrophobicContact CD2-CB 3.54Å; F259-L435 HydrophobicContact CD2-CD1 3.72Å; F259-L435 HydrophobicContact CD2-CG 4.3Å; F259-L435 HydrophobicContact CE2-CB 3.31Å; F259-L435 HydrophobicContact CE2-CD1 4.38Å; F259-L435 HydrophobicContact CE2-CG 4.5Å; F259-L435 HydrophobicContact CG-CB 4.45Å; F259-L435 HydrophobicContact CG-CD1 4.31Å; F259-L435 HydrophobicContact CZ-CB 4.08Å; V262-L435 HydrophobicContact CG1-CD2 4.37Å; I339-L435 HydrophobicContact CD1-CD2 4.16Å; W385-L435 HydrophobicContact CE3-CD1 4.06Å; W385-L435 HydrophobicContact CE3-CD2 3.9Å; W385-L435 HydrophobicContact CE3-CG 4.23Å; W385-L435 HydrophobicContact CZ3-CD1 3.95Å; W385-L435 HydrophobicContact CZ3-CD2 3.94Å; W385-L435 HydrophobicContact CZ3-CG 4.43Å; I431-L435 HydrophobicContact CG2-CD1 3.74Å; I431-L435 HydrophobicContact CG2-CG 4.04Å; I431-L435 WeakPolarHBondContact O-CB 3.42Å; I431-L435 WeakPolarHBondContact O-CG 3.21Å; I431-L435 PolarHBondContact O-N 2.88Å; K432-L435 PolarHBondContact O-N 2.98Å; L435-A437 VanDerWaalsContact C-N 3.34Å; L435-A437 PolarHBondContact O-N 2.83Å; L435-S439 WeakPolarHBondContact O-CB 3.42Å; L435-S439 PolarHBondContact O-N 3.49Å; L435-S439 VanDerWaalsContact O-N 3.12Å; L435-S439 PolarHBondContact O-OG 2.86Å; L435-F443 HydrophobicContact CD2-CE1 4.13Å; L435-F443 HydrophobicContact CD2-CZ 3.79Å
436	Q	92.8	Very high	92.6	Very high	90 Å²	90	36.6 Å²	36.6	42%	0.421	19%	0.192	S	C	.	.	H	α-helix	trans	-59.9	-41.4	172.9	-79.1	176.9	-27.1	0	0	112.4	F259 K432 V434	F259-Q436 HydrophobicContact CE2-CB 4.41Å; F259-Q436 HydrophobicContact CE2-CG 3.66Å; F259-Q436 HydrophobicContact CZ-CB 4.26Å; F259-Q436 HydrophobicContact CZ-CG 3.54Å; K432-Q436 WeakPolarHBondContact O-CB 3.38Å; K432-Q436 WeakPolarHBondContact O-CG 3.35Å; K432-Q436 PolarHBondContact O-N 3.43Å; V434-Q436 VanDerWaalsContact C-N 3.32Å; V434-Q436 PolarHBondContact O-N 1.84Å
437	A	91.8	Very high	91.4	Very high	31 Å²	31	40.9 Å²	40.9	26%	0.256	21%	0.21	S	C	.	.	H	α-helix	trans	-79.8	-40.2	-178.5	0	0	0	0	0	113.8	P331 L333 A433 V434 L435	P331-A437 HydrophobicContact CB-CB 4.38Å; P331-A437 WeakPolarHBondContact O-CB 3.16Å; L333-A437 HydrophobicContact CD2-CB 4.46Å; A433-A437 PolarHBondContact O-N 3.35Å; V434-A437 PolarHBondContact O-N 2.86Å; L435-A437 VanDerWaalsContact C-N 3.34Å; L435-A437 PolarHBondContact O-N 2.83Å
438	K	92.8	Very high	89.7	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	24%	0.239	C	C	.	.	H	α-helix	trans	-116.4	-21.1	-162.1	-68.8	-172.8	169.7	172.4	0	116.1	S330 L333 T335 I339 C340 V434 Q440 L441	S330-K438 WeakPolarHBondContact O-CE 3.49Å; S330-K438 PolarHBondContact O-NZ 2.82Å; L333-K438 HydrophobicContact CD2-CG 4.38Å; T335-K438 PolarHBondContact O-NZ 2.98Å; I339-K438 WeakPolarHBondContact O-CD 3.44Å; C340-K438 HydrophobicContact CB-CB 4.35Å; C340-K438 PolarHBondContact SG-O 2.84Å; V434-K438 HydrophobicContact CG1-CD 4.11Å; V434-K438 WeakPolarHBondContact O-CB 3.43Å; V434-K438 PolarHBondContact O-N 2.82Å; K438-Q440 VanDerWaalsContact C-N 3.32Å; K438-Q440 PolarHBondContact O-N 2.69Å; K438-L441 HydrophobicContact CB-CD1 4.2Å; K438-L441 HydrophobicContact CG-CD1 4.12Å; K438-L441 VanDerWaalsContact O-CB 3.27Å; K438-L441 WeakPolarHBondContact O-CB 3.48Å; K438-L441 WeakPolarHBondContact O-CG 3.45Å; K438-L441 PolarHBondContact O-N 3.34Å
439	S	90.5	Very high	87.8	Confident	4 Å²	4	47.8 Å²	47.8	3%	0.028	25%	0.248	C	C	.	.	H	α-helix	trans	-52.6	-48.3	-173	56.6	0	0	0	0	113	L435 L441 C442 F443	L435-S439 WeakPolarHBondContact O-CB 3.42Å; L435-S439 PolarHBondContact O-N 3.49Å; L435-S439 VanDerWaalsContact O-N 3.12Å; L435-S439 PolarHBondContact O-OG 2.86Å; S439-L441 PolarHBondContact O-N 2.94Å; S439-C442 PolarHBondContact O-N 3.48Å; S439-F443 VanDerWaalsContact O-CB 3.24Å; S439-F443 WeakPolarHBondContact O-CB 3.2Å; S439-F443 WeakPolarHBondContact O-CD2 3.42Å; S439-F443 PolarHBondContact O-N 2.96Å
440	Q	90.5	Very high	86.3	Confident	76 Å²	76	46.3 Å²	46.3	36%	0.355	24%	0.244	S	C	.	.	H	α-helix	trans	-62.1	-16.9	-178.3	-62.6	-58.4	-44.4	0	0	114.7	K438	K438-Q440 VanDerWaalsContact C-N 3.32Å; K438-Q440 PolarHBondContact O-N 2.69Å
441	L	91.9	Very high	84.9	Confident	104 Å²	104	46.4 Å²	46.4	55%	0.545	24%	0.244	S	C	.	.	H	α-helix	trans	-75.4	-37.5	-178.8	-55.7	177	0	0	0	113	L333 C340 K438 S439	L333-L441 HydrophobicContact CD2-CD1 4.08Å; C340-L441 HydrophobicContact CB-CB 4.07Å; C340-L441 HydrophobicContact CB-CD1 4.41Å; K438-L441 HydrophobicContact CB-CD1 4.2Å; K438-L441 HydrophobicContact CG-CD1 4.12Å; K438-L441 VanDerWaalsContact O-CB 3.27Å; K438-L441 WeakPolarHBondContact O-CB 3.48Å; K438-L441 WeakPolarHBondContact O-CG 3.45Å; K438-L441 PolarHBondContact O-N 3.34Å; S439-L441 PolarHBondContact O-N 2.94Å
442	C	93.4	Very high	83.4	Confident	27 Å²	27	46.5 Å²	46.5	18%	0.182	25%	0.245	C	C	.	.	H	α-helix	trans	-144.4	-3.4	-171.3	82	0	0	0	0	116.4	C308 C340 S439	C308-C442 VanDerWaalsContact CA-SG 3.56Å; C340-C442 WeakPolarHBondContact CA-SG 3.22Å; C340-C442 HydrophobicContact CB-CB 3.75Å; C340-C442 WeakPolarHBondContact CB-SG 3.45Å; C340-C442 WeakPolarHBondContact SG-CB 3.46Å; C340-C442 CovalentContact SG-SG 2.03Å; C340-C442 PolarHBondContact SG-SG 3.13Å; S439-C442 PolarHBondContact O-N 3.48Å
443	F	94.8	Very high	81.7	Confident	4 Å²	4	46.7 Å²	46.7	2%	0.018	25%	0.247	C	C	.	.			trans	-74	153	173.8	-75.7	-131.4	0	0	0	110.2	K205 R207 C208 V262 C308 I339 W385 L435 S439	K205-F443 HydrophobicContact CB-CB 4Å; K205-F443 WeakPolarHBondContact CD-O 3.24Å; K205-F443 WeakPolarHBondContact O-CB 3.33Å; R207-F443 WeakPolarHBondContact O-CA 3.44Å; C208-F443 HydrophobicContact CB-CD1 4.3Å; C208-F443 HydrophobicContact CB-CE1 3.77Å; C208-F443 HydrophobicContact CB-CE2 4.15Å; C208-F443 HydrophobicContact CB-CZ 3.69Å; V262-F443 HydrophobicContact CG1-CD1 4.24Å; V262-F443 HydrophobicContact CG1-CE1 3.63Å; C308-F443 VanDerWaalsContact SG-CE2 3.53Å; I339-F443 HydrophobicContact CB-CE2 4.47Å; I339-F443 HydrophobicContact CD1-CE2 4.02Å; I339-F443 HydrophobicContact CD1-CZ 4.15Å; W385-F443 HydrophobicContact CH2-CE1 4.35Å; W385-F443 HydrophobicContact CZ2-CE1 4.34Å; W385-F443 HydrophobicContact CZ2-CZ 4.24Å; L435-F443 HydrophobicContact CD2-CE1 4.13Å; L435-F443 HydrophobicContact CD2-CZ 3.79Å; S439-F443 VanDerWaalsContact O-CB 3.24Å; S439-F443 WeakPolarHBondContact O-CB 3.2Å; S439-F443 WeakPolarHBondContact O-CD2 3.42Å; S439-F443 PolarHBondContact O-N 2.96Å
444	V	91.4	Very high	80	Confident	38 Å²	38	45.9 Å²	45.9	23%	0.23	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-113.7	162.7	176.1	-60.6	0	0	0	0	109.8	F81 K205 N206 R207 V265	F81-V444 HydrophobicContact CD2-CG2 4.46Å; F81-V444 HydrophobicContact CE2-CB 4.47Å; F81-V444 HydrophobicContact CE2-CG2 3.93Å; K205-V444 CarbonylContact C-O 3.57Å; K205-V444 VanDerWaalsContact C-O 3.26Å; K205-V444 VanDerWaalsContact CA-O 3.27Å; K205-V444 WeakPolarHBondContact CA-O 3.43Å; N206-V444 PolarHBondContact N-O 3.06Å; R207-V444 HydrophobicContact CB-CG2 3.92Å; R207-V444 PolarHBondContact N-O 2.79Å; R207-V444 PolarHBondContact O-N 3.17Å; V265-V444 HydrophobicContact CG1-CG2 3.87Å
445	E	86.4	Confident	78.3	Confident	109 Å²	109	50.5 Å²	50.5	51%	0.509	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-71.5	152.8	174.7	-54.1	-170.1	159.2	0	0	110	K205	K205-E445 HydrophobicContact CG-CG 3.84Å
446	E	79	Confident	76.8	Confident	55 Å²	55	51 Å²	51	26%	0.257	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-74.8	120.8	171.1	174.8	167.2	-145.5	0	0	109.8	N206 R207 N261	N206-E446 PolarHBondContact ND2-OE2 2.02Å; N206-E446 WeakPolarHBondContact OD1-CB 3.19Å; N206-E446 PolarHBondContact OD1-N 3.46Å; R207-E446 HydrophobicContact CG-CB 3.95Å; R207-E446 IonicContact CZ-OE1 3.72Å; R207-E446 IonicContact CZ-OE2 3.84Å; R207-E446 IonicContact NE-OE1 3.92Å; R207-E446 IonicContact NH2-OE1 2.7Å; R207-E446 PolarHBondContact NH2-OE1 2.84Å; R207-E446 IonicContact NH2-OE2 3.14Å; R207-E446 PolarHBondContact NH2-OE2 3.24Å; N261-E446 PolarHBondContact ND2-OE2 2.83Å
447	E	68.4	Low	75.2	Confident	109 Å²	109	47.8 Å²	47.8	51%	0.509	24%	0.242	S	C	.	.	P	Polyproline II helix	trans	-85.4	131	176.1	-62.5	-163.1	-134.7	0	0	110.2	P82	P82-E447 WeakPolarHBondContact CD-OE1 3.37Å; P82-E447 HydrophobicContact CG-CB 4.33Å; P82-E447 HydrophobicContact CG-CG 4.26Å; P82-E447 VanDerWaalsContact CG-OE1 3.24Å; P82-E447 WeakPolarHBondContact CG-OE1 3.41Å; P82-E447 WeakPolarHBondContact CG-OE2 3.35Å
448	H	61.6	Low	73.8	Confident	131 Å²	131	51.3 Å²	51.3	61%	0.606	26%	0.262	S	S	*	.			trans	-104.6	8.9	-171.2	-61	-47.6	0	0	0	113.8
449	T	56.7	Low	72.4	Confident	58 Å²	58	53.6 Å²	53.6	36%	0.356	29%	0.287	S	S	.	.			trans	-140.6	120.7	-171	52.3	0	0	0	0	110.4	E457 P458	T449-E457 WeakPolarHBondContact CA-OE2 3.41Å; T449-E457 HydrophobicContact CG2-CB 4.02Å; T449-P458 VanDerWaalsContact CG2-O 3.23Å; T449-P458 WeakPolarHBondContact CG2-O 3.47Å
450	F	60.8	Low	71.5	Confident	43 Å²	43	54 Å²	54	19%	0.189	29%	0.289	C	S	.	.			trans	-135	100	173.8	-168.5	-68.3	0	0	0	111.1	G452 N453 E457	F450-G452 PolarHBondContact O-N 2.84Å; F450-N453 HydrophobicContact CD1-CB 4.23Å; F450-N453 WeakPolarHBondContact O-CB 2.8Å; F450-N453 PolarHBondContact O-ND2 2.79Å; F450-E457 PolarHBondContact N-OE2 2.85Å
451	C	66.6	Low	70.7	Confident	42 Å²	42	52.4 Å²	52.4	28%	0.284	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	134.8	173.2	-178.2	0	0	0	0	111.3	E460 A478 C480	C451-E460 VanDerWaalsContact CA-OE1 3.27Å; C451-E460 WeakPolarHBondContact CA-OE1 3.47Å; C451-E460 PolarHBondContact N-OE1 3.33Å; C451-A478 PolarHBondContact SG-O 2.88Å; C451-C480 WeakPolarHBondContact CA-SG 3.14Å; C451-C480 HydrophobicContact CB-CB 3.88Å; C451-C480 WeakPolarHBondContact CB-SG 3.44Å; C451-C480 WeakPolarHBondContact SG-CB 3.31Å; C451-C480 PolarHBondContact SG-N 2.75Å; C451-C480 VanDerWaalsContact SG-N 3.44Å; C451-C480 CovalentContact SG-SG 2.03Å; C451-C480 PolarHBondContact SG-SG 2.77Å
452	G	63.3	Low	69.8	Low	2 Å²	2	47.5 Å²	47.5	2%	0.021	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	102.4	9.2	-177.4	0	0	0	0	0	114.8	R77 F450 D463 V464 L466	R77-G452 PolarHBondContact NH1-O 2.95Å; R77-G452 PolarHBondContact NH2-O 2.7Å; F450-G452 PolarHBondContact O-N 2.84Å; G452-D463 WeakPolarHBondContact CA-OD1 3.19Å; G452-D463 PolarHBondContact N-OD1 2.05Å; G452-V464 VanDerWaalsContact CA-O 3.3Å; G452-V464 WeakPolarHBondContact CA-O 3.13Å; G452-L466 PolarHBondContact O-N 3.06Å
453	N	58.8	Low	68.6	Low	15 Å²	15	46.2 Å²	46.2	8%	0.08	25%	0.248	C	C	.	.	S	Bend	trans	-103.9	-4.5	-173.5	84.2	28.3	0	0	0	114.1	F450 R455 E457 D463	F450-N453 HydrophobicContact CD1-CB 4.23Å; F450-N453 WeakPolarHBondContact O-CB 2.8Å; F450-N453 PolarHBondContact O-ND2 2.79Å; N453-R455 VanDerWaalsContact C-N 3.34Å; N453-R455 WeakPolarHBondContact OD1-CA 3.27Å; N453-R455 WeakPolarHBondContact OD1-CB 3.31Å; N453-R455 PolarHBondContact OD1-N 3.11Å; N453-R455 PolarHBondContact OD1-O 2.84Å; N453-E457 PolarHBondContact ND2-OE2 2.82Å; N453-E457 VanDerWaalsContact ND2-OE2 3.09Å; N453-D463 WeakPolarHBondContact CA-OD2 3.45Å; N453-D463 PolarHBondContact N-OD1 2.92Å; N453-D463 PolarHBondContact N-OD2 2.85Å; N453-D463 PolarHBondContact OD1-OD2 2.89Å; N453-D463 VanDerWaalsContact OD1-OD2 3.06Å
454	Q	60	Low	67.2	Low	19 Å²	19	46.9 Å²	46.9	9%	0.089	25%	0.252	C	S	.	.	S	Bend	trans	71.3	11	-175.3	-55	178	33.7	0	0	116.7	H56 D463 S465 V507 N508	H56-Q454 PolarHBondContact CD2-NE2 2.78Å; H56-Q454 PolarHBondContact CD2-OE1 3.17Å; H56-Q454 VanDerWaalsContact CD2-OE1 3.3Å; H56-Q454 PolarHBondContact NE2-NE2 2.96Å; H56-Q454 PolarHBondContact NE2-OE1 3.28Å; Q454-D463 WeakPolarHBondContact CA-OD2 3.45Å; Q454-D463 VanDerWaalsContact N-CG 3.31Å; Q454-D463 PolarHBondContact N-OD2 2.98Å; Q454-S465 PolarHBondContact NE2-OG 2.85Å; Q454-S465 VanDerWaalsContact NE2-OG 3.08Å; Q454-V507 HydrophobicContact CB-CG1 4.29Å; Q454-V507 HydrophobicContact CG-CG1 4.18Å; Q454-N508 PolarHBondContact O-ND2 2.74Å
455	R	58.8	Low	65.7	Low	98 Å²	98	45.7 Å²	45.7	37%	0.37	25%	0.246	S	C	.	.	S	Bend	trans	-123.9	104.2	177.4	174.3	-157.5	-176.2	-165.3	11.4	108.4	N453 E457 D463	N453-R455 VanDerWaalsContact C-N 3.34Å; N453-R455 WeakPolarHBondContact OD1-CA 3.27Å; N453-R455 WeakPolarHBondContact OD1-CB 3.31Å; N453-R455 PolarHBondContact OD1-N 3.11Å; N453-R455 PolarHBondContact OD1-O 2.84Å; R455-E457 WeakPolarHBondContact CD-OE1 3.47Å; R455-E457 HydrophobicContact CG-CG 4.33Å; R455-E457 IonicContact CZ-OE1 2.69Å; R455-E457 IonicContact NE-OE1 3.28Å; R455-E457 IonicContact NH1-OE1 2.75Å; R455-E457 PolarHBondContact NH1-OE1 3.28Å; R455-E457 WeakPolarHBondContact O-CG 3.41Å; R455-E457 PolarHBondContact O-N 3.42Å; R455-D463 PolarHBondContact N-OD2 3.34Å; R455-D463 VanDerWaalsContact N-OD2 3.11Å
456	V	61.5	Low	64.1	Low	11 Å²	11	44.7 Å²	44.7	7%	0.067	24%	0.243	C	C	.	.			trans	-52.7	112.4	169.7	173.3	0	0	0	0	111	E460 D463	V456-E460 WeakPolarHBondContact CA-OE2 3.46Å; V456-E460 HydrophobicContact CG1-CB 4.07Å; V456-E460 WeakPolarHBondContact CG1-O 3.42Å; V456-D463 HydrophobicContact CG2-CB 4Å
457	E	61.1	Low	62.5	Low	22 Å²	22	47.1 Å²	47.1	10%	0.103	26%	0.258	C	S	.	.			trans	-103.8	167.5	177.9	-80.4	166.4	164.9	0	0	110.5	T449 F450 N453 R455 G459 E460	T449-E457 WeakPolarHBondContact CA-OE2 3.41Å; T449-E457 HydrophobicContact CG2-CB 4.02Å; F450-E457 PolarHBondContact N-OE2 2.85Å; N453-E457 PolarHBondContact ND2-OE2 2.82Å; N453-E457 VanDerWaalsContact ND2-OE2 3.09Å; R455-E457 WeakPolarHBondContact CD-OE1 3.47Å; R455-E457 HydrophobicContact CG-CG 4.33Å; R455-E457 IonicContact CZ-OE1 2.69Å; R455-E457 IonicContact NE-OE1 3.28Å; R455-E457 IonicContact NH1-OE1 2.75Å; R455-E457 PolarHBondContact NH1-OE1 3.28Å; R455-E457 WeakPolarHBondContact O-CG 3.41Å; R455-E457 PolarHBondContact O-N 3.42Å; E457-G459 PolarHBondContact O-N 2.99Å; E457-E460 PolarHBondContact N-OE2 3.07Å; E457-E460 WeakPolarHBondContact O-CB 3.38Å; E457-E460 PolarHBondContact O-N 2.93Å
458	P	60.8	Low	61.3	Low	106 Å²	106	45.4 Å²	45.4	69%	0.688	25%	0.25	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.8	110.8	-170.7	-25	35.9	0	0	0	113.3	T449	T449-P458 VanDerWaalsContact CG2-O 3.23Å; T449-P458 WeakPolarHBondContact CG2-O 3.47Å
459	G	65.1	Low	60.2	Low	53 Å²	53	45.6 Å²	45.6	55%	0.546	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	115.7	-14	-177.1	0	0	0	0	0	113.8	E457 K481	E457-G459 PolarHBondContact O-N 2.99Å; G459-K481 PolarHBondContact O-NZ 3.4Å
460	E	70.1	Confident	59.4	Low	13 Å²	13	46.4 Å²	46.4	6%	0.061	27%	0.27	C	S	.	.			trans	-88.5	153.7	170.3	-64.1	168.5	174.2	0	0	110.4	C451 V456 E457 C480 S501	C451-E460 VanDerWaalsContact CA-OE1 3.27Å; C451-E460 WeakPolarHBondContact CA-OE1 3.47Å; C451-E460 PolarHBondContact N-OE1 3.33Å; V456-E460 WeakPolarHBondContact CA-OE2 3.46Å; V456-E460 HydrophobicContact CG1-CB 4.07Å; V456-E460 WeakPolarHBondContact CG1-O 3.42Å; E457-E460 PolarHBondContact N-OE2 3.07Å; E457-E460 WeakPolarHBondContact O-CB 3.38Å; E457-E460 PolarHBondContact O-N 2.93Å; E460-C480 HydrophobicContact CB-CB 3.98Å; E460-C480 HydrophobicContact CG-CB 3.72Å; E460-S501 WeakPolarHBondContact O-CB 3.16Å; E460-S501 PolarHBondContact O-OG 3.39Å
461	D	74.1	Confident	58.9	Low	42 Å²	42	51.7 Å²	51.7	23%	0.225	30%	0.295	C	S	.	.	S	Bend	trans	-102.1	-36.3	173.4	-60.8	6.5	0	0	0	110.6	C480 K481 F482 S503	D461-C480 PolarHBondContact N-O 2.76Å; D461-K481 HydrophobicContact CB-CD 4.37Å; D461-K481 IonicContact OD1-NZ 2.84Å; D461-K481 PolarHBondContact OD1-NZ 3.35Å; D461-K481 WeakPolarHBondContact OD2-CD 3.3Å; D461-F482 HydrophobicContact CB-CD1 4.27Å; D461-F482 HydrophobicContact CB-CD2 3.63Å; D461-F482 HydrophobicContact CB-CE1 4.25Å; D461-F482 HydrophobicContact CB-CE2 3.66Å; D461-F482 HydrophobicContact CB-CG 3.95Å; D461-F482 HydrophobicContact CB-CZ 3.96Å; D461-F482 VanDerWaalsContact O-CE1 3.24Å; D461-F482 WeakPolarHBondContact O-CE1 3.48Å; D461-F482 WeakPolarHBondContact O-CZ 3Å; D461-S503 WeakPolarHBondContact O-CA 3.13Å
462	C	73.5	Confident	58.6	Low	0 Å²	0	55.8 Å²	55.8	0%	0	32%	0.315	C	S	.	.			trans	-148.5	160.7	178.8	57.5	0	0	0	0	108.5	C476 C480 K481 F482	C462-C476 HydrophobicContact CB-CB 3.74Å; C462-C476 WeakPolarHBondContact CB-SG 3.31Å; C462-C476 WeakPolarHBondContact SG-CA 3.45Å; C462-C476 WeakPolarHBondContact SG-CB 3.37Å; C462-C476 CovalentContact SG-SG 2.03Å; C462-C476 PolarHBondContact SG-SG 2.88Å; C462-C480 PolarHBondContact N-O 3.49Å; C462-C480 CarbonylContact O-C 3.52Å; C462-C480 WeakPolarHBondContact O-CA 3.34Å; C462-C480 WeakPolarHBondContact O-CB 3.21Å; C462-C480 PolarHBondContact O-SG 3.16Å; C462-C480 VanDerWaalsContact O-SG 3.36Å; C462-K481 PolarHBondContact SG-O 3.35Å; C462-F482 HydrophobicContact CB-CD1 3.93Å; C462-F482 HydrophobicContact CB-CE1 3.68Å
463	D	68.2	Low	58.9	Low	0 Å²	0	56.8 Å²	56.8	0%	0	32%	0.319	C	S	.	.			trans	-146.3	127.5	173.5	-175.8	12.3	0	0	0	110.5	G452 N453 Q454 R455 V456 C480 N508	G452-D463 WeakPolarHBondContact CA-OD1 3.19Å; G452-D463 PolarHBondContact N-OD1 2.05Å; N453-D463 WeakPolarHBondContact CA-OD2 3.45Å; N453-D463 PolarHBondContact N-OD1 2.92Å; N453-D463 PolarHBondContact N-OD2 2.85Å; N453-D463 PolarHBondContact OD1-OD2 2.89Å; N453-D463 VanDerWaalsContact OD1-OD2 3.06Å; Q454-D463 WeakPolarHBondContact CA-OD2 3.45Å; Q454-D463 VanDerWaalsContact N-CG 3.31Å; Q454-D463 PolarHBondContact N-OD2 2.98Å; R455-D463 PolarHBondContact N-OD2 3.34Å; R455-D463 VanDerWaalsContact N-OD2 3.11Å; V456-D463 HydrophobicContact CG2-CB 4Å; D463-C480 PolarHBondContact OD1-SG 2.98Å; D463-C480 VanDerWaalsContact OD1-SG 3.37Å; D463-N508 PolarHBondContact N-OD1 3.19Å; D463-N508 VanDerWaalsContact N-OD1 3.12Å; D463-N508 PolarHBondContact O-ND2 3.11Å; D463-N508 PolarHBondContact O-OD1 2.83Å
464	V	65.8	Low	59.8	Low	18 Å²	18	59.9 Å²	59.9	11%	0.109	34%	0.339	C	S	.	.			trans	-124.3	155.2	-177.2	-67.2	0	0	0	0	109.8	G452 L466 D473 C476 V507	G452-V464 VanDerWaalsContact CA-O 3.3Å; G452-V464 WeakPolarHBondContact CA-O 3.13Å; V464-L466 PolarHBondContact O-N 2.58Å; V464-D473 HydrophobicContact CB-CB 4.45Å; V464-D473 HydrophobicContact CG1-CB 4.02Å; V464-D473 HydrophobicContact CG2-CB 4.22Å; V464-C476 HydrophobicContact CG1-CB 3.68Å; V464-C476 HydrophobicContact CG2-CB 4.16Å; V464-V507 HydrophobicContact CG1-CB 4.46Å; V464-V507 HydrophobicContact CG1-CG2 4.25Å
465	S	58.5	Low	60.6	Low	14 Å²	14	59 Å²	59	10%	0.098	33%	0.334	C	S	.	.			trans	-57.1	134.8	-173.6	-152.2	0	0	0	0	111.2	Q454 L467 Q468	Q454-S465 PolarHBondContact NE2-OG 2.85Å; Q454-S465 VanDerWaalsContact NE2-OG 3.08Å; S465-L467 PolarHBondContact O-N 2.95Å; S465-Q468 WeakPolarHBondContact O-CB 3.47Å; S465-Q468 PolarHBondContact O-N 2.91Å
466	L	53	Low	61.4	Low	87 Å²	87	54.3 Å²	54.3	46%	0.455	32%	0.317	S	S	.	.	G	3₁₀ helix	trans	-55	-27.4	173.9	-152.8	78.7	0	0	0	112.2	G452 V464 Q468 H469	G452-L466 PolarHBondContact O-N 3.06Å; V464-L466 PolarHBondContact O-N 2.58Å; L466-Q468 PolarHBondContact O-N 2.86Å; L466-H469 PolarHBondContact O-N 3.35Å; L466-H469 PolarHBondContact O-ND1 3.48Å
467	L	45.2	Very low	62.1	Low	107 Å²	107	54.9 Å²	54.9	56%	0.56	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-65.6	-13	173.9	-67.2	176.1	0	0	0	115.1	D101 S465 H469	D101-L467 HydrophobicContact CB-CD2 4.33Å; S465-L467 PolarHBondContact O-N 2.95Å; L467-H469 VanDerWaalsContact C-N 3.27Å; L467-H469 PolarHBondContact O-N 2.7Å
468	Q	43.5	Very low	62.6	Low	72 Å²	72	56.8 Å²	56.8	34%	0.336	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	-84.2	10	171.8	-82	-179	-42.4	0	0	113.7	S465 L466 G470 E471	S465-Q468 WeakPolarHBondContact O-CB 3.47Å; S465-Q468 PolarHBondContact O-N 2.91Å; L466-Q468 PolarHBondContact O-N 2.86Å; Q468-G470 PolarHBondContact O-N 3.36Å; Q468-E471 CarbonylContact O-C 3.58Å; Q468-E471 VanDerWaalsContact O-C 3.3Å; Q468-E471 PolarHBondContact O-N 3.42Å
469	H	38.7	Very low	63	Low	136 Å²	136	56.9 Å²	56.9	63%	0.63	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	3.8	168.6	-87.8	78.6	0	0	0	115	L466 L467	L466-H469 PolarHBondContact O-N 3.35Å; L466-H469 PolarHBondContact O-ND1 3.48Å; L467-H469 VanDerWaalsContact C-N 3.27Å; L467-H469 PolarHBondContact O-N 2.7Å
470	G	40.3	Very low	63.5	Low	74 Å²	74	54.4 Å²	54.4	76%	0.763	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.5	-15.5	166.4	0	0	0	0	0	115.8	Q468	Q468-G470 PolarHBondContact O-N 3.36Å
471	E	50.5	Low	63.9	Low	154 Å²	154	57.1 Å²	57.1	72%	0.72	32%	0.321	S	S	*	.	S	Bend	trans	-135.7	103.9	173.8	-78.4	-164.8	146.2	0	0	109.3	Q468 D473	Q468-E471 CarbonylContact O-C 3.58Å; Q468-E471 VanDerWaalsContact O-C 3.3Å; Q468-E471 PolarHBondContact O-N 3.42Å; E471-D473 PolarHBondContact O-N 3.16Å; E471-D473 VanDerWaalsContact O-N 3.08Å
472	D	60.2	Low	64	Low	128 Å²	128	56.8 Å²	56.8	68%	0.684	32%	0.318	S	S	*	.			trans	-65.3	103.1	-171.5	-166.6	26	0	0	0	111.6	V474 K483	D472-V474 PolarHBondContact O-N 3.49Å; D472-K483 IonicContact OD1-NZ 2.63Å; D472-K483 PolarHBondContact OD1-NZ 3.32Å; D472-K483 IonicContact OD2-NZ 2.69Å; D472-K483 PolarHBondContact OD2-NZ 3.47Å
473	D	68.6	Low	64.4	Low	23 Å²	23	58.6 Å²	58.6	12%	0.123	33%	0.326	C	S	.	.			trans	-51.7	135.9	-170.8	178.1	-96.1	0	0	0	112.1	V464 E471 C475 C476 K483	V464-D473 HydrophobicContact CB-CB 4.45Å; V464-D473 HydrophobicContact CG1-CB 4.02Å; V464-D473 HydrophobicContact CG2-CB 4.22Å; E471-D473 PolarHBondContact O-N 3.16Å; E471-D473 VanDerWaalsContact O-N 3.08Å; D473-C475 PolarHBondContact O-N 2.88Å; D473-C475 WeakPolarHBondContact OD1-CA 3.11Å; D473-C475 PolarHBondContact OD1-N 3.06Å; D473-C476 HydrophobicContact CB-CB 4.37Å; D473-C476 WeakPolarHBondContact OD1-CB 3.42Å; D473-C476 PolarHBondContact OD1-N 3.01Å; D473-K483 VanDerWaalsContact O-CD 3.32Å; D473-K483 WeakPolarHBondContact O-CD 3.37Å; D473-K483 WeakPolarHBondContact O-CE 3.41Å; D473-K483 PolarHBondContact O-NZ 2.84Å
474	V	77.6	Confident	65	Low	80 Å²	80	65.4 Å²	65.4	49%	0.485	37%	0.37	S	S	.	.	S	Bend	trans	-66.7	-25.1	-170.8	-179.6	0	0	0	0	112.1	D472 N485	D472-V474 PolarHBondContact O-N 3.49Å; V474-N485 WeakPolarHBondContact CG1-ND2 3.24Å; V474-N485 PolarHBondContact O-ND2 3.32Å; V474-N485 PolarHBondContact O-OD1 3.16Å
475	C	77.3	Confident	65.5	Low	0 Å²	0	68.1 Å²	68.1	0%	0	38%	0.384	C	S	.	.	S	Bend	trans	-110.9	-21.8	-172.8	-48.8	0	0	0	0	113.7	D473 K483 P506 C516	D473-C475 PolarHBondContact O-N 2.88Å; D473-C475 WeakPolarHBondContact OD1-CA 3.11Å; D473-C475 PolarHBondContact OD1-N 3.06Å; C475-K483 PolarHBondContact O-N 2.92Å; C475-P506 VanDerWaalsContact SG-CD 3.59Å; C475-C516 WeakPolarHBondContact CA-SG 3.49Å; C475-C516 HydrophobicContact CB-CB 4Å; C475-C516 WeakPolarHBondContact CB-SG 3.13Å; C475-C516 VanDerWaalsContact SG-CA 3.56Å; C475-C516 WeakPolarHBondContact SG-CB 3.38Å; C475-C516 CovalentContact SG-SG 2.03Å; C475-C516 PolarHBondContact SG-SG 2.96Å
476	C	76.3	Confident	66.2	Low	1 Å²	1	68 Å²	68	1%	0.007	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-126.1	137.8	-170.9	-162.2	0	0	0	0	112.6	C462 V464 D473 K481 K483	C462-C476 HydrophobicContact CB-CB 3.74Å; C462-C476 WeakPolarHBondContact CB-SG 3.31Å; C462-C476 WeakPolarHBondContact SG-CA 3.45Å; C462-C476 WeakPolarHBondContact SG-CB 3.37Å; C462-C476 CovalentContact SG-SG 2.03Å; C462-C476 PolarHBondContact SG-SG 2.88Å; V464-C476 HydrophobicContact CG1-CB 3.68Å; V464-C476 HydrophobicContact CG2-CB 4.16Å; D473-C476 HydrophobicContact CB-CB 4.37Å; D473-C476 WeakPolarHBondContact OD1-CB 3.42Å; D473-C476 PolarHBondContact OD1-N 3.01Å; C476-K481 WeakPolarHBondContact CA-O 3.34Å; C476-K483 WeakPolarHBondContact O-CE 3.36Å; C476-K483 PolarHBondContact O-NZ 2.97Å
477	S	75.8	Confident	67.2	Low	22 Å²	22	67.6 Å²	67.6	15%	0.154	39%	0.385	C	S	.	.			trans	-90.2	164	172.3	61.1	0	0	0	0	112.3	D479 C480 K481	S477-D479 WeakPolarHBondContact CB-OD1 3.38Å; S477-D479 PolarHBondContact O-N 2.8Å; S477-D479 VanDerWaalsContact O-N 3.17Å; S477-D479 PolarHBondContact OG-OD1 2.77Å; S477-C480 PolarHBondContact O-N 3.13Å; S477-K481 PolarHBondContact N-O 3.4Å; S477-K481 WeakPolarHBondContact OG-CA 3.37Å; S477-K481 WeakPolarHBondContact OG-CB 3.33Å; S477-K481 PolarHBondContact OG-N 3.42Å; S477-K481 VanDerWaalsContact OG-N 3.15Å; S477-K481 PolarHBondContact OG-O 3.32Å
478	A	70.8	Confident	68.3	Low	62 Å²	62	62.5 Å²	62.5	51%	0.512	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.1	-179.9	0	0	0	0	0	114.7	C451	C451-A478 PolarHBondContact SG-O 2.88Å
479	D	70.4	Confident	69.3	Low	108 Å²	108	66.1 Å²	66.1	58%	0.578	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	19.1	171.6	65.7	-46.2	0	0	0	113.1	S477 K481	S477-D479 WeakPolarHBondContact CB-OD1 3.38Å; S477-D479 PolarHBondContact O-N 2.8Å; S477-D479 VanDerWaalsContact O-N 3.17Å; S477-D479 PolarHBondContact OG-OD1 2.77Å; D479-K481 PolarHBondContact O-N 3.08Å; D479-K481 WeakPolarHBondContact OD2-CG 3.42Å
480	C	74.6	Confident	70	Confident	1 Å²	1	61.6 Å²	61.6	1%	0.007	35%	0.348	C	S	.	.	S	Bend	trans	61.6	38.5	176.5	-74.5	0	0	0	0	113.9	C451 E460 D461 C462 D463 S477	C451-C480 WeakPolarHBondContact CA-SG 3.14Å; C451-C480 HydrophobicContact CB-CB 3.88Å; C451-C480 WeakPolarHBondContact CB-SG 3.44Å; C451-C480 WeakPolarHBondContact SG-CB 3.31Å; C451-C480 PolarHBondContact SG-N 2.75Å; C451-C480 VanDerWaalsContact SG-N 3.44Å; C451-C480 CovalentContact SG-SG 2.03Å; C451-C480 PolarHBondContact SG-SG 2.77Å; E460-C480 HydrophobicContact CB-CB 3.98Å; E460-C480 HydrophobicContact CG-CB 3.72Å; D461-C480 PolarHBondContact N-O 2.76Å; C462-C480 PolarHBondContact N-O 3.49Å; C462-C480 CarbonylContact O-C 3.52Å; C462-C480 WeakPolarHBondContact O-CA 3.34Å; C462-C480 WeakPolarHBondContact O-CB 3.21Å; C462-C480 PolarHBondContact O-SG 3.16Å; C462-C480 VanDerWaalsContact O-SG 3.36Å; D463-C480 PolarHBondContact OD1-SG 2.98Å; D463-C480 VanDerWaalsContact OD1-SG 3.37Å; S477-C480 PolarHBondContact O-N 3.13Å
481	K	79.7	Confident	70.4	Confident	70 Å²	70	63 Å²	63	30%	0.304	34%	0.341	S	S	.	.			trans	-117.4	151.6	177.5	-61.8	-67	160.9	-170.6	0	113	G459 D461 C462 C476 S477 D479 K483	G459-K481 PolarHBondContact O-NZ 3.4Å; D461-K481 HydrophobicContact CB-CD 4.37Å; D461-K481 IonicContact OD1-NZ 2.84Å; D461-K481 PolarHBondContact OD1-NZ 3.35Å; D461-K481 WeakPolarHBondContact OD2-CD 3.3Å; C462-K481 PolarHBondContact SG-O 3.35Å; C476-K481 WeakPolarHBondContact CA-O 3.34Å; S477-K481 PolarHBondContact N-O 3.4Å; S477-K481 WeakPolarHBondContact OG-CA 3.37Å; S477-K481 WeakPolarHBondContact OG-CB 3.33Å; S477-K481 PolarHBondContact OG-N 3.42Å; S477-K481 VanDerWaalsContact OG-N 3.15Å; S477-K481 PolarHBondContact OG-O 3.32Å; D479-K481 PolarHBondContact O-N 3.08Å; D479-K481 WeakPolarHBondContact OD2-CG 3.42Å; K481-K483 PolarHBondContact O-N 2.99Å
482	F	76.2	Confident	69.9	Low	36 Å²	36	59.3 Å²	59.3	16%	0.158	33%	0.329	C	S	.	.	B	Isolated β-bridge	trans	-67.6	129.4	176.7	-68.6	-45.4	0	0	0	111.7	D461 C462 A486 R489 S504	D461-F482 HydrophobicContact CB-CD1 4.27Å; D461-F482 HydrophobicContact CB-CD2 3.63Å; D461-F482 HydrophobicContact CB-CE1 4.25Å; D461-F482 HydrophobicContact CB-CE2 3.66Å; D461-F482 HydrophobicContact CB-CG 3.95Å; D461-F482 HydrophobicContact CB-CZ 3.96Å; D461-F482 VanDerWaalsContact O-CE1 3.24Å; D461-F482 WeakPolarHBondContact O-CE1 3.48Å; D461-F482 WeakPolarHBondContact O-CZ 3Å; C462-F482 HydrophobicContact CB-CD1 3.93Å; C462-F482 HydrophobicContact CB-CE1 3.68Å; F482-A486 HydrophobicContact CB-CB 4.12Å; F482-A486 HydrophobicContact CD1-CB 4.23Å; F482-A486 HydrophobicContact CG-CB 4.33Å; F482-R489 HydrophobicContact CD2-CB 4.21Å; F482-R489 HydrophobicContact CD2-CG 3.69Å; F482-R489 HydrophobicContact CE2-CB 4.28Å; F482-R489 HydrophobicContact CE2-CG 3.79Å; F482-S504 WeakPolarHBondContact CD1-OG 3.43Å; F482-S504 VanDerWaalsContact CE1-CB 3.43Å; F482-S504 WeakPolarHBondContact CE1-OG 3.09Å; F482-S504 VanDerWaalsContact CZ-CB 3.41Å; F482-S504 VanDerWaalsContact CZ-N 3.33Å; F482-S504 VanDerWaalsContact CZ-OG 3.22Å; F482-S504 WeakPolarHBondContact CZ-OG 3.18Å
483	K	80.5	Confident	68.9	Low	38 Å²	38	58.2 Å²	58.2	17%	0.165	33%	0.332	C	S	.	.			trans	-68.4	150.6	166	-69.6	-176.7	177.5	170.4	0	110	D472 D473 C475 C476 K481 N485 A486	D472-K483 IonicContact OD1-NZ 2.63Å; D472-K483 PolarHBondContact OD1-NZ 3.32Å; D472-K483 IonicContact OD2-NZ 2.69Å; D472-K483 PolarHBondContact OD2-NZ 3.47Å; D473-K483 VanDerWaalsContact O-CD 3.32Å; D473-K483 WeakPolarHBondContact O-CD 3.37Å; D473-K483 WeakPolarHBondContact O-CE 3.41Å; D473-K483 PolarHBondContact O-NZ 2.84Å; C475-K483 PolarHBondContact O-N 2.92Å; C476-K483 WeakPolarHBondContact O-CE 3.36Å; C476-K483 PolarHBondContact O-NZ 2.97Å; K481-K483 PolarHBondContact O-N 2.99Å; K483-N485 VanDerWaalsContact CB-OD1 3.25Å; K483-N485 WeakPolarHBondContact CB-OD1 3.25Å; K483-N485 PolarHBondContact O-N 3.34Å; K483-A486 WeakPolarHBondContact O-CB 3.49Å; K483-A486 PolarHBondContact O-N 3.32Å
484	P	80.6	Confident	67.3	Low	142 Å²	142	66.6 Å²	66.6	92%	0.922	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-19.7	-170.3	-27.6	36.2	0	0	0	116.3
485	N	77.8	Confident	65.3	Low	75 Å²	75	69.4 Å²	69.4	40%	0.401	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-1.4	178.3	59.2	-56.4	0	0	0	114.3	V474 K483 V487	V474-N485 WeakPolarHBondContact CG1-ND2 3.24Å; V474-N485 PolarHBondContact O-ND2 3.32Å; V474-N485 PolarHBondContact O-OD1 3.16Å; K483-N485 VanDerWaalsContact CB-OD1 3.25Å; K483-N485 WeakPolarHBondContact CB-OD1 3.25Å; K483-N485 PolarHBondContact O-N 3.34Å; N485-V487 PolarHBondContact O-N 3.36Å; N485-V487 VanDerWaalsContact O-N 3.09Å
486	A	73.5	Confident	63.3	Low	11 Å²	11	77.9 Å²	77.9	9%	0.091	42%	0.416	C	S	.	.			trans	-75.7	93.7	-178.9	0	0	0	0	0	112.8	F482 K483 R489 C516	F482-A486 HydrophobicContact CB-CB 4.12Å; F482-A486 HydrophobicContact CD1-CB 4.23Å; F482-A486 HydrophobicContact CG-CB 4.33Å; K483-A486 WeakPolarHBondContact O-CB 3.49Å; K483-A486 PolarHBondContact O-N 3.32Å; A486-R489 WeakPolarHBondContact O-CB 3.28Å; A486-C516 HydrophobicContact CB-CB 4.26Å
487	V	73.7	Confident	61.1	Low	79 Å²	79	88.6 Å²	88.6	48%	0.479	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.3	-27.3	178.4	179	0	0	0	0	112.4	N485 R489 C516 Q517	N485-V487 PolarHBondContact O-N 3.36Å; N485-V487 VanDerWaalsContact O-N 3.09Å; V487-R489 PolarHBondContact O-N 3.34Å; V487-C516 WeakPolarHBondContact CA-O 3.36Å; V487-C516 WeakPolarHBondContact CB-O 3.44Å; V487-C516 PolarHBondContact N-O 3.01Å; V487-Q517 VanDerWaalsContact CG2-NE2 3.29Å
488	C	68.3	Low	59.1	Low	0 Å²	0	95.4 Å²	95.4	0%	0	49%	0.485	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-2.4	173.7	-65.2	0	0	0	0	115.2	Q490 S504 C512 C516 Q517 F518 A544	C488-Q490 PolarHBondContact O-N 3.05Å; C488-S504 VanDerWaalsContact C-CB 3.4Å; C488-S504 WeakPolarHBondContact O-CB 3.43Å; C488-C512 HydrophobicContact CB-CB 3.9Å; C488-C512 WeakPolarHBondContact CB-SG 3.26Å; C488-C512 VanDerWaalsContact SG-CA 3.59Å; C488-C512 WeakPolarHBondContact SG-CB 3.37Å; C488-C512 CovalentContact SG-SG 2.04Å; C488-C512 PolarHBondContact SG-SG 3.07Å; C488-C516 PolarHBondContact N-O 3.42Å; C488-C516 PolarHBondContact SG-O 2.93Å; C488-Q517 PolarHBondContact SG-N 3.35Å; C488-Q517 PolarHBondContact SG-O 3.23Å; C488-Q517 VanDerWaalsContact SG-O 3.33Å; C488-F518 HydrophobicContact CB-CD1 4.45Å; C488-F518 HydrophobicContact CB-CE1 4.15Å; C488-A544 HydrophobicContact CB-CB 4.28Å
489	R	63.4	Low	57.2	Low	149 Å²	149	100.8 Å²	100.8	56%	0.562	50%	0.504	S	S	*	.			trans	-58.7	94.9	-176.4	-178.1	179.1	-171.9	-162.1	4.8	111.6	F482 A486 V487 V491 S504	F482-R489 HydrophobicContact CD2-CB 4.21Å; F482-R489 HydrophobicContact CD2-CG 3.69Å; F482-R489 HydrophobicContact CE2-CB 4.28Å; F482-R489 HydrophobicContact CE2-CG 3.79Å; A486-R489 WeakPolarHBondContact O-CB 3.28Å; V487-R489 PolarHBondContact O-N 3.34Å; R489-V491 HydrophobicContact CG-CG2 4.09Å; R489-V491 PolarHBondContact O-N 3.12Å; R489-S504 PolarHBondContact N-OG 2.75Å
490	Q	54.2	Low	55.7	Low	40 Å²	40	99.5 Å²	99.5	19%	0.187	50%	0.496	C	S	.	.			trans	-73	94.1	169.5	-91.2	176.1	-19.1	0	0	110	C488 T492 L502 N543	C488-Q490 PolarHBondContact O-N 3.05Å; Q490-T492 PolarHBondContact O-N 2.78Å; Q490-L502 HydrophobicContact CB-CB 4.14Å; Q490-N543 VanDerWaalsContact NE2-CG 3.27Å; Q490-N543 PolarHBondContact NE2-OD1 3.26Å
491	V	47.9	Very low	53.9	Low	103 Å²	103	101.5 Å²	101.5	62%	0.624	51%	0.511	S	S	*	.			trans	-72.9	104.7	163.5	-170.6	0	0	0	0	107.1	R489 S493	R489-V491 HydrophobicContact CG-CG2 4.09Å; R489-V491 PolarHBondContact O-N 3.12Å; V491-S493 PolarHBondContact O-N 3.15Å
492	T	41.6	Very low	52.4	Low	77 Å²	77	99.7 Å²	99.7	47%	0.472	50%	0.504	S	S	.	.			trans	-62.2	112.1	168.6	38.6	0	0	0	0	108.1	Q490 F494 L502	Q490-T492 PolarHBondContact O-N 2.78Å; T492-F494 PolarHBondContact O-N 3.43Å; T492-L502 HydrophobicContact CG2-CD1 3.93Å
493	S	37.4	Very low	50.9	Low	105 Å²	105	98.1 Å²	98.1	73%	0.734	50%	0.497	S	S	*	.			trans	-59	135.4	-175.3	-171	0	0	0	0	110.4	V491 L495	V491-S493 PolarHBondContact O-N 3.15Å; S493-L495 VanDerWaalsContact C-N 3.32Å; S493-L495 PolarHBondContact O-N 3.2Å
494	F	35.3	Very low	49.5	Very low	199 Å²	199	96.3 Å²	96.3	87%	0.873	49%	0.49	S	S	*	.	S	Bend	trans	-63.7	89	173.4	-84.7	-108.7	0	0	0	109.9	T492	T492-F494 PolarHBondContact O-N 3.43Å
495	L	36.4	Very low	48.3	Very low	140 Å²	140	89.5 Å²	89.5	73%	0.733	45%	0.446	S	S	*	.	S	Bend	trans	-175	113	156	-98.6	152.8	0	0	0	109.7	S493	S493-L495 VanDerWaalsContact C-N 3.32Å; S493-L495 PolarHBondContact O-N 3.2Å
496	F	35.4	Very low	47.1	Very low	178 Å²	178	87.7 Å²	87.7	78%	0.781	44%	0.438	S	S	*	.	S	Bend	trans	65.4	111.1	169.2	-73.3	-97.4	0	0	0	119.3
497	Y	30.2	Very low	46.3	Very low	225 Å²	225	89.3 Å²	89.3	88%	0.882	45%	0.447	S	S	*	.	S	Bend	trans	69.5	121.3	160	-80.8	-92.8	0	0	0	120.6
498	K	34.3	Very low	45.5	Very low	166 Å²	166	85.9 Å²	85.9	72%	0.722	43%	0.426	S	S	*	.			trans	74	92.3	158.3	-141	171.1	-172.9	-179.6	0	116.9	I500	K498-I500 HydrophobicContact CG-CG1 4.46Å; K498-I500 PolarHBondContact O-N 2.88Å; K498-I500 VanDerWaalsContact O-N 3.09Å
499	L	29.8	Very low	45.4	Very low	174 Å²	174	85.9 Å²	85.9	91%	0.911	43%	0.426	S	S	*	.			trans	-51.1	108.9	158.3	-80.1	147.8	0	0	0	110.5
500	I	39.7	Very low	45.6	Very low	81 Å²	81	79.1 Å²	79.1	42%	0.415	40%	0.401	S	S	.	.			trans	-128.9	112.2	160.4	-60.1	178.4	0	0	0	105.1	K498 L502	K498-I500 HydrophobicContact CG-CG1 4.46Å; K498-I500 PolarHBondContact O-N 2.88Å; K498-I500 VanDerWaalsContact O-N 3.09Å; I500-L502 HydrophobicContact CG2-CG 4.33Å; I500-L502 PolarHBondContact O-N 3.43Å; I500-L502 VanDerWaalsContact O-N 3.08Å
501	S	36.5	Very low	46.7	Very low	44 Å²	44	77.2 Å²	77.2	31%	0.308	39%	0.392	S	S	.	.			trans	-60.2	113.5	167.8	-77.1	0	0	0	0	108.4	E460	E460-S501 WeakPolarHBondContact O-CB 3.16Å; E460-S501 PolarHBondContact O-OG 3.39Å
502	L	46.9	Very low	48.1	Very low	31 Å²	31	72.7 Å²	72.7	16%	0.162	37%	0.365	C	S	.	.			trans	-98	108.6	-178.2	-87.5	158.5	0	0	0	109.4	Q490 T492 I500 D545	Q490-L502 HydrophobicContact CB-CB 4.14Å; T492-L502 HydrophobicContact CG2-CD1 3.93Å; I500-L502 HydrophobicContact CG2-CG 4.33Å; I500-L502 PolarHBondContact O-N 3.43Å; I500-L502 VanDerWaalsContact O-N 3.08Å; L502-D545 WeakPolarHBondContact CD2-OD1 3.47Å; L502-D545 VanDerWaalsContact CD2-OD2 3.27Å; L502-D545 WeakPolarHBondContact CD2-OD2 3.13Å
503	S	45.3	Very low	49.8	Very low	3 Å²	3	70 Å²	70	2%	0.021	35%	0.349	C	S	.	.			trans	-66	141.1	-173.4	59.1	0	0	0	0	112.6	D461 N508 S509	D461-S503 WeakPolarHBondContact O-CA 3.13Å; S503-N508 WeakPolarHBondContact OG-CB 3.3Å; S503-N508 PolarHBondContact OG-O 2.8Å; S503-S509 WeakPolarHBondContact O-CB 3.09Å; S503-S509 PolarHBondContact O-OG 2.98Å
504	S	52.1	Low	51.5	Low	0 Å²	0	68.9 Å²	68.9	0%	0	35%	0.346	C	S	.	.			trans	-135.9	21.8	-176.3	104.9	0	0	0	0	116.3	F482 C488 R489 C512	F482-S504 WeakPolarHBondContact CD1-OG 3.43Å; F482-S504 VanDerWaalsContact CE1-CB 3.43Å; F482-S504 WeakPolarHBondContact CE1-OG 3.09Å; F482-S504 VanDerWaalsContact CZ-CB 3.41Å; F482-S504 VanDerWaalsContact CZ-N 3.33Å; F482-S504 VanDerWaalsContact CZ-OG 3.22Å; F482-S504 WeakPolarHBondContact CZ-OG 3.18Å; C488-S504 VanDerWaalsContact C-CB 3.4Å; C488-S504 WeakPolarHBondContact O-CB 3.43Å; R489-S504 PolarHBondContact N-OG 2.75Å; S504-C512 PolarHBondContact O-SG 2.81Å
505	S	53.9	Low	53.4	Low	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.329	C	S	.	.	S	Bend	trans	-82.7	145.3	154.6	169.7	0	0	0	0	109.5	V507 N508 S509	S505-V507 PolarHBondContact O-N 2.78Å; S505-V507 VanDerWaalsContact O-N 3.12Å; S505-V507 PolarHBondContact OG-N 3.09Å; S505-N508 PolarHBondContact O-N 2.96Å; S505-S509 WeakPolarHBondContact O-CB 3.48Å; S505-S509 PolarHBondContact O-N 3.21Å
506	P	53.5	Low	55.4	Low	36 Å²	36	56.1 Å²	56.1	23%	0.234	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-28.7	172.1	23.4	-37.8	0	0	0	113.8	C475 N508 S509	C475-P506 VanDerWaalsContact SG-CD 3.59Å; P506-N508 VanDerWaalsContact C-N 3.26Å; P506-N508 PolarHBondContact O-N 3.29Å; P506-S509 PolarHBondContact O-N 2.88Å
507	V	56.1	Low	57.7	Low	46 Å²	46	51.6 Å²	51.6	28%	0.279	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.3	-35.1	176	179.1	0	0	0	0	111.9	Q454 V464 S505	Q454-V507 HydrophobicContact CB-CG1 4.29Å; Q454-V507 HydrophobicContact CG-CG1 4.18Å; V464-V507 HydrophobicContact CG1-CB 4.46Å; V464-V507 HydrophobicContact CG1-CG2 4.25Å; S505-V507 PolarHBondContact O-N 2.78Å; S505-V507 VanDerWaalsContact O-N 3.12Å; S505-V507 PolarHBondContact OG-N 3.09Å
508	N	57.7	Low	60.3	Low	7 Å²	7	44 Å²	44	4%	0.037	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.9	-11.8	-178.4	-40.3	117	0	0	0	113.3	K46 Q454 D463 S503 S505 P506	K46-N508 WeakPolarHBondContact CE-O 3.48Å; Q454-N508 PolarHBondContact O-ND2 2.74Å; D463-N508 PolarHBondContact N-OD1 3.19Å; D463-N508 VanDerWaalsContact N-OD1 3.12Å; D463-N508 PolarHBondContact O-ND2 3.11Å; D463-N508 PolarHBondContact O-OD1 2.83Å; S503-N508 WeakPolarHBondContact OG-CB 3.3Å; S503-N508 PolarHBondContact OG-O 2.8Å; S505-N508 PolarHBondContact O-N 2.96Å; P506-N508 VanDerWaalsContact C-N 3.26Å; P506-N508 PolarHBondContact O-N 3.29Å
509	S	66.6	Low	62.5	Low	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.224	C	C	.	.			trans	-134.6	100.1	-169.9	-100.8	0	0	0	0	112.8	K46 S503 S505 P506 C511 C512 A544	K46-S509 PolarHBondContact NZ-OG 2.75Å; S503-S509 WeakPolarHBondContact O-CB 3.09Å; S503-S509 PolarHBondContact O-OG 2.98Å; S505-S509 WeakPolarHBondContact O-CB 3.48Å; S505-S509 PolarHBondContact O-N 3.21Å; P506-S509 PolarHBondContact O-N 2.88Å; S509-C511 PolarHBondContact O-N 2.61Å; S509-C511 VanDerWaalsContact O-N 3.13Å; S509-C512 WeakPolarHBondContact O-CB 3.21Å; S509-C512 PolarHBondContact O-N 3.03Å; S509-A544 PolarHBondContact OG-O 3Å
510	P	65.9	Low	65.3	Low	7 Å²	7	34.2 Å²	34.2	5%	0.045	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	1.3	-174.6	33.9	-38.5	0	0	0	115.2	M44 K46 L519 C525 C546	M44-P510 HydrophobicContact CB-CB 3.68Å; M44-P510 HydrophobicContact CE-CB 3.84Å; M44-P510 HydrophobicContact CG-CB 3.88Å; M44-P510 VanDerWaalsContact SD-CA 3.57Å; M44-P510 HydrophobicContact SD-CB 3.4Å; M44-P510 WeakPolarHBondContact SD-CB 3.41Å; K46-P510 HydrophobicContact CB-CG 3.86Å; K46-P510 VanDerWaalsContact CD-CD 3.48Å; K46-P510 HydrophobicContact CD-CG 3.82Å; K46-P510 VanDerWaalsContact CE-CD 3.43Å; K46-P510 HydrophobicContact CG-CG 3.79Å; P510-L519 WeakPolarHBondContact O-CD1 3.19Å; P510-C525 HydrophobicContact CB-CB 4.4Å; P510-C546 HydrophobicContact CG-CB 3.96Å
511	C	78.8	Confident	67.8	Low	0 Å²	0	38.5 Å²	38.5	0%	0	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111	20.2	165	-65.4	0	0	0	0	112.4	S509 F518 L519 C539 N543 A544	S509-C511 PolarHBondContact O-N 2.61Å; S509-C511 VanDerWaalsContact O-N 3.13Å; C511-F518 CarbonylContact O-C 3.49Å; C511-F518 WeakPolarHBondContact O-CA 3.19Å; C511-L519 PolarHBondContact O-N 2.97Å; C511-C539 WeakPolarHBondContact CA-SG 3.48Å; C511-C539 HydrophobicContact CB-CB 3.83Å; C511-C539 WeakPolarHBondContact CB-SG 2.98Å; C511-C539 WeakPolarHBondContact SG-CA 3.39Å; C511-C539 WeakPolarHBondContact SG-CB 3.28Å; C511-C539 CovalentContact SG-SG 2.04Å; C511-C539 PolarHBondContact SG-SG 3.48Å; C511-N543 VanDerWaalsContact CB-O 3.22Å; C511-N543 WeakPolarHBondContact CB-O 3.4Å; C511-A544 PolarHBondContact N-O 3.1Å
512	C	76.6	Confident	70.2	Confident	7 Å²	7	38.6 Å²	38.6	5%	0.047	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-115.1	141.6	169.7	-169.3	0	0	0	0	110.6	C488 S504 S509 Q517	C488-C512 HydrophobicContact CB-CB 3.9Å; C488-C512 WeakPolarHBondContact CB-SG 3.26Å; C488-C512 VanDerWaalsContact SG-CA 3.59Å; C488-C512 WeakPolarHBondContact SG-CB 3.37Å; C488-C512 CovalentContact SG-SG 2.04Å; C488-C512 PolarHBondContact SG-SG 3.07Å; S504-C512 PolarHBondContact O-SG 2.81Å; S509-C512 WeakPolarHBondContact O-CB 3.21Å; S509-C512 PolarHBondContact O-N 3.03Å; C512-Q517 CarbonylContact C-O 3.59Å; C512-Q517 WeakPolarHBondContact CA-O 3.16Å
513	S	77.7	Confident	72	Confident	20 Å²	20	39.2 Å²	39.2	14%	0.14	24%	0.238	C	C	.	.			trans	-83.7	166.7	179.2	73.7	0	0	0	0	112.9	S515 C516 Q517	S513-S515 PolarHBondContact O-N 3.22Å; S513-S515 VanDerWaalsContact O-N 3.12Å; S513-S515 PolarHBondContact OG-N 3.11Å; S513-S515 VanDerWaalsContact OG-N 3.11Å; S513-S515 PolarHBondContact OG-OG 3.16Å; S513-C516 PolarHBondContact O-N 3.22Å; S513-C516 PolarHBondContact OG-N 2.93Å; S513-Q517 WeakPolarHBondContact CB-O 3.12Å; S513-Q517 PolarHBondContact N-O 3Å; S513-Q517 PolarHBondContact OG-N 3.23Å; S513-Q517 PolarHBondContact OG-O 2.78Å
514	A	72.8	Confident	73.6	Confident	82 Å²	82	41.7 Å²	41.7	68%	0.678	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-20.3	166.6	0	0	0	0	0	114.2
515	S	76.2	Confident	74.6	Confident	72 Å²	72	41.8 Å²	41.8	50%	0.503	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	16.3	176.4	55.8	0	0	0	0	113.5	S513 Q517	S513-S515 PolarHBondContact O-N 3.22Å; S513-S515 VanDerWaalsContact O-N 3.12Å; S513-S515 PolarHBondContact OG-N 3.11Å; S513-S515 VanDerWaalsContact OG-N 3.11Å; S513-S515 PolarHBondContact OG-OG 3.16Å; S515-Q517 VanDerWaalsContact C-N 3.28Å; S515-Q517 PolarHBondContact O-N 3.01Å
516	C	77.9	Confident	75.2	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	59.2	31.4	180	-31.4	0	0	0	0	114.6	C475 A486 V487 C488 S513	C475-C516 WeakPolarHBondContact CA-SG 3.49Å; C475-C516 HydrophobicContact CB-CB 4Å; C475-C516 WeakPolarHBondContact CB-SG 3.13Å; C475-C516 VanDerWaalsContact SG-CA 3.56Å; C475-C516 WeakPolarHBondContact SG-CB 3.38Å; C475-C516 CovalentContact SG-SG 2.03Å; C475-C516 PolarHBondContact SG-SG 2.96Å; A486-C516 HydrophobicContact CB-CB 4.26Å; V487-C516 WeakPolarHBondContact CA-O 3.36Å; V487-C516 WeakPolarHBondContact CB-O 3.44Å; V487-C516 PolarHBondContact N-O 3.01Å; C488-C516 PolarHBondContact N-O 3.42Å; C488-C516 PolarHBondContact SG-O 2.93Å; S513-C516 PolarHBondContact O-N 3.22Å; S513-C516 PolarHBondContact OG-N 2.93Å
517	Q	84	Confident	76.2	Confident	83 Å²	83	44.4 Å²	44.4	39%	0.388	26%	0.262	S	S	.	.			trans	-111.2	151.6	177	-57.6	-59.2	-41.7	0	0	111.4	V487 C488 C512 S513 S515 L519	V487-Q517 VanDerWaalsContact CG2-NE2 3.29Å; C488-Q517 PolarHBondContact SG-N 3.35Å; C488-Q517 PolarHBondContact SG-O 3.23Å; C488-Q517 VanDerWaalsContact SG-O 3.33Å; C512-Q517 CarbonylContact C-O 3.59Å; C512-Q517 WeakPolarHBondContact CA-O 3.16Å; S513-Q517 WeakPolarHBondContact CB-O 3.12Å; S513-Q517 PolarHBondContact N-O 3Å; S513-Q517 PolarHBondContact OG-N 3.23Å; S513-Q517 PolarHBondContact OG-O 2.78Å; S515-Q517 VanDerWaalsContact C-N 3.28Å; S515-Q517 PolarHBondContact O-N 3.01Å; Q517-L519 PolarHBondContact O-N 3.42Å
518	F	83.1	Confident	77	Confident	66 Å²	66	44.7 Å²	44.7	29%	0.289	27%	0.265	S	S	.	.	B	Isolated β-bridge	trans	-63.3	136.5	174.9	-59.5	-66.5	0	0	0	111.4	C488 C511 V542 N543 A544	C488-F518 HydrophobicContact CB-CD1 4.45Å; C488-F518 HydrophobicContact CB-CE1 4.15Å; C511-F518 CarbonylContact O-C 3.49Å; C511-F518 WeakPolarHBondContact O-CA 3.19Å; F518-V542 WeakPolarHBondContact CZ-O 3.33Å; F518-N543 VanDerWaalsContact CD1-C 3.48Å; F518-A544 HydrophobicContact CD1-CB 4.28Å; F518-A544 HydrophobicContact CE1-CB 3.95Å
519	L	81.1	Confident	77.6	Confident	47 Å²	47	46.7 Å²	46.7	25%	0.246	28%	0.276	C	S	.	.	P	Polyproline II helix	trans	-70.5	145	172	-63.3	-177	0	0	0	110.2	P510 C511 Q517 T523 G541	P510-L519 WeakPolarHBondContact O-CD1 3.19Å; C511-L519 PolarHBondContact O-N 2.97Å; Q517-L519 PolarHBondContact O-N 3.42Å; L519-T523 HydrophobicContact CB-CG2 4.23Å; L519-T523 HydrophobicContact CD1-CG2 3.92Å; L519-G541 WeakPolarHBondContact O-CA 3.26Å
520	S	88.7	Confident	77.8	Confident	86 Å²	86	50.6 Å²	50.6	60%	0.601	30%	0.296	S	S	*	.	P	Polyproline II helix	trans	-61.2	149.9	-175.7	56.6	0	0	0	0	113.1	G522 T523	S520-G522 PolarHBondContact O-N 3.14Å; S520-T523 WeakPolarHBondContact O-CB 3.44Å; S520-T523 PolarHBondContact O-N 3.35Å; S520-T523 VanDerWaalsContact O-N 3.08Å; S520-T523 PolarHBondContact O-OG1 3Å; S520-T523 PolarHBondContact OG-OG1 3.33Å
521	K	91.6	Very high	77.6	Confident	171 Å²	171	53.9 Å²	53.9	74%	0.743	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	130.4	176.2	-174.7	173	-179.3	174.8	0	111	C539 D540	K521-C539 CarbonylContact C-O 3.42Å; K521-C539 WeakPolarHBondContact CA-O 3.32Å; K521-D540 WeakPolarHBondContact CB-O 3.5Å; K521-D540 WeakPolarHBondContact CD-O 3.27Å; K521-D540 WeakPolarHBondContact CG-O 2.98Å
522	G	88.2	Confident	77	Confident	46 Å²	46	56.3 Å²	56.3	47%	0.474	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.3	-0.4	-176.6	0	0	0	0	0	115	S520 V524 F538 C539	S520-G522 PolarHBondContact O-N 3.14Å; G522-V524 PolarHBondContact O-N 3.26Å; G522-F538 WeakPolarHBondContact O-CD1 3.36Å; G522-C539 PolarHBondContact N-O 3.25Å
523	T	84	Confident	77.2	Confident	44 Å²	44	56 Å²	56	27%	0.27	33%	0.328	S	S	.	.			trans	-66.1	125.9	169.5	-57	0	0	0	0	110.5	L519 S520 C525 F538 C539	L519-T523 HydrophobicContact CB-CG2 4.23Å; L519-T523 HydrophobicContact CD1-CG2 3.92Å; S520-T523 WeakPolarHBondContact O-CB 3.44Å; S520-T523 PolarHBondContact O-N 3.35Å; S520-T523 VanDerWaalsContact O-N 3.08Å; S520-T523 PolarHBondContact O-OG1 3Å; S520-T523 PolarHBondContact OG-OG1 3.33Å; T523-C525 PolarHBondContact O-N 2.84Å; T523-F538 CarbonylContact O-C 3.58Å; T523-F538 WeakPolarHBondContact O-CA 3.46Å; T523-C539 PolarHBondContact O-N 3.01Å
524	V	78.3	Confident	77.3	Confident	55 Å²	55	58.4 Å²	58.4	33%	0.333	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.3	123.3	178.7	179.8	0	0	0	0	110.3	G522 F538	G522-V524 PolarHBondContact O-N 3.26Å; V524-F538 HydrophobicContact CB-CD1 4.46Å; V524-F538 HydrophobicContact CG2-CD1 3.72Å; V524-F538 HydrophobicContact CG2-CE1 3.57Å
525	C	73.3	Confident	77.8	Confident	3 Å²	3	57.8 Å²	57.8	2%	0.02	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	-9.3	-175.7	57.7	0	0	0	0	114.8	P510 T523 S537 C539 C546	P510-C525 HydrophobicContact CB-CB 4.4Å; T523-C525 PolarHBondContact O-N 2.84Å; C525-S537 PolarHBondContact N-O 3.31Å; C525-C539 VanDerWaalsContact CB-SG 3.58Å; C525-C539 PolarHBondContact SG-N 3.35Å; C525-C546 HydrophobicContact CB-CB 3.58Å; C525-C546 WeakPolarHBondContact CB-SG 3.48Å; C525-C546 VanDerWaalsContact SG-CA 3.57Å; C525-C546 WeakPolarHBondContact SG-CB 3.36Å; C525-C546 CovalentContact SG-SG 2.02Å; C525-C546 PolarHBondContact SG-SG 3.4Å
526	R	67.7	Low	78.2	Confident	11 Å²	11	59.1 Å²	59.1	4%	0.042	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	138.1	158.8	-66.2	174.3	-148.5	-160.2	2.5	109.9	Y45 K46 R47 D48 K536 S537 C546 P547	Y45-R526 HydrophobicContact CD1-CG 4.42Å; K46-R526 PolarHBondContact O-NE 3.17Å; K46-R526 PolarHBondContact O-NH1 2.87Å; K46-R526 VanDerWaalsContact O-NH1 3.11Å; R47-R526 PolarHBondContact O-NH1 2.85Å; R47-R526 PolarHBondContact O-NH2 3.43Å; D48-R526 IonicContact OD1-CZ 2.93Å; D48-R526 IonicContact OD1-NH1 2.85Å; D48-R526 PolarHBondContact OD1-NH1 3.15Å; D48-R526 IonicContact OD2-NH1 2.76Å; R526-K536 WeakPolarHBondContact O-CA 3.3Å; R526-S537 WeakPolarHBondContact CB-OG 3.47Å; R526-S537 WeakPolarHBondContact CD-OG 3.35Å; R526-S537 WeakPolarHBondContact CG-OG 3.38Å; R526-S537 PolarHBondContact N-O 2.77Å; R526-S537 PolarHBondContact O-N 3.28Å; R526-C546 PolarHBondContact NH2-O 2.79Å; R526-P547 PolarHBondContact NE-O 2.84Å; R526-P547 PolarHBondContact NH2-O 3.17Å
527	Q	74	Confident	78.4	Confident	79 Å²	79	59.4 Å²	59.4	37%	0.369	32%	0.32	S	S	.	.			trans	-80.9	162.3	167.8	-66.5	-60.1	-20.4	0	0	109.9	Y45	Y45-Q527 PolarHBondContact OH-O 3.4Å
528	P	74.1	Confident	78.6	Confident	53 Å²	53	60.4 Å²	60.4	34%	0.344	32%	0.323	S	S	.	.			trans	-77.6	142.1	-178.7	31.9	-27.6	0	0	0	110.2	K534 K536	P528-K534 CarbonylContact C-O 3.26Å; P528-K534 WeakPolarHBondContact CA-O 3.47Å; P528-K536 HydrophobicContact CB-CG 4.16Å; P528-K536 HydrophobicContact CG-CG 3.99Å
529	D	68.8	Low	78.7	Confident	48 Å²	48	57.4 Å²	57.4	26%	0.257	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-123.3	90.8	171.1	178.4	13.1	0	0	0	109.2	N531 S532 C533 K534	D529-N531 VanDerWaalsContact C-N 3.28Å; D529-N531 PolarHBondContact O-N 3.34Å; D529-N531 WeakPolarHBondContact OD1-CB 3.5Å; D529-N531 PolarHBondContact OD1-N 3.17Å; D529-N531 VanDerWaalsContact OD1-N 3.15Å; D529-S532 CarbonylContact O-C 3.59Å; D529-S532 PolarHBondContact O-N 2.94Å; D529-S532 PolarHBondContact OD1-N 3.28Å; D529-S532 WeakPolarHBondContact OD2-CB 3.09Å; D529-S532 PolarHBondContact OD2-OG 2.87Å; D529-C533 PolarHBondContact O-N 3.12Å; D529-C533 VanDerWaalsContact O-N 3.1Å; D529-K534 CarbonylContact C-O 3.46Å; D529-K534 PolarHBondContact N-O 2.84Å; D529-K534 PolarHBondContact O-N 2.86Å
530	L	71.4	Confident	79	Confident	82 Å²	82	57.5 Å²	57.5	43%	0.429	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-20.7	-179.1	-58	-179.7	0	0	0	112.7	S532 C533 L535 A552 T556 C558	L530-S532 VanDerWaalsContact C-N 3.25Å; L530-S532 PolarHBondContact O-N 3.26Å; L530-C533 PolarHBondContact O-N 3.35Å; L530-L535 HydrophobicContact CD2-CD2 4.37Å; L530-A552 HydrophobicContact CD2-CB 4.26Å; L530-T556 HydrophobicContact CD2-CG2 4.43Å; L530-C558 WeakPolarHBondContact O-CB 3.4Å
531	N	61.3	Low	78.8	Confident	77 Å²	77	54.7 Å²	54.7	41%	0.412	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-32	174.2	-70.2	-12.3	0	0	0	111.1	D529 M559	D529-N531 VanDerWaalsContact C-N 3.28Å; D529-N531 PolarHBondContact O-N 3.34Å; D529-N531 WeakPolarHBondContact OD1-CB 3.5Å; D529-N531 PolarHBondContact OD1-N 3.17Å; D529-N531 VanDerWaalsContact OD1-N 3.15Å; N531-M559 HydrophobicContact CB-CE 4.35Å
532	S	65.4	Low	78.4	Confident	50 Å²	50	51.1 Å²	51.1	35%	0.35	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.9	18.1	173.8	-46.4	0	0	0	0	113.3	D529 L530 K534	D529-S532 CarbonylContact O-C 3.59Å; D529-S532 PolarHBondContact O-N 2.94Å; D529-S532 PolarHBondContact OD1-N 3.28Å; D529-S532 WeakPolarHBondContact OD2-CB 3.09Å; D529-S532 PolarHBondContact OD2-OG 2.87Å; L530-S532 VanDerWaalsContact C-N 3.25Å; L530-S532 PolarHBondContact O-N 3.26Å; S532-K534 WeakPolarHBondContact O-CG 3.18Å; S532-K534 PolarHBondContact O-N 3.26Å
533	C	81.6	Confident	77.9	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	38.5	174.9	-60.2	0	0	0	0	116.2	D529 L530 P551 A552 C564 G567	D529-C533 PolarHBondContact O-N 3.12Å; D529-C533 VanDerWaalsContact O-N 3.1Å; L530-C533 PolarHBondContact O-N 3.35Å; C533-P551 CarbonylContact O-C 3.56Å; C533-P551 WeakPolarHBondContact O-CA 3.48Å; C533-A552 HydrophobicContact CB-CB 4.41Å; C533-A552 PolarHBondContact O-N 2.99Å; C533-C564 WeakPolarHBondContact CA-SG 3.4Å; C533-C564 HydrophobicContact CB-CB 3.73Å; C533-C564 WeakPolarHBondContact CB-SG 2.98Å; C533-C564 WeakPolarHBondContact SG-CA 3.06Å; C533-C564 WeakPolarHBondContact SG-CB 3.42Å; C533-C564 CovalentContact SG-SG 2.03Å; C533-C564 PolarHBondContact SG-SG 3.32Å; C533-G567 WeakPolarHBondContact CB-O 3.26Å
534	K	79	Confident	77.3	Confident	72 Å²	72	49.8 Å²	49.8	31%	0.313	27%	0.268	S	S	.	.	B	Isolated β-bridge	trans	-123.3	135.9	-177.1	-71	168.2	-166.2	-171.9	0	113	D48 P528 D529 S532 A549	D48-K534 WeakPolarHBondContact OD2-CE 3.39Å; D48-K534 IonicContact OD2-NZ 3.81Å; D48-K534 PolarHBondContact OD2-NZ 2.6Å; P528-K534 CarbonylContact C-O 3.26Å; P528-K534 WeakPolarHBondContact CA-O 3.47Å; D529-K534 CarbonylContact C-O 3.46Å; D529-K534 PolarHBondContact N-O 2.84Å; D529-K534 PolarHBondContact O-N 2.86Å; S532-K534 WeakPolarHBondContact O-CG 3.18Å; S532-K534 PolarHBondContact O-N 3.26Å; K534-A549 HydrophobicContact CB-CB 3.92Å; K534-A549 HydrophobicContact CG-CB 4.31Å
535	L	85.2	Confident	76.9	Confident	69 Å²	69	49.6 Å²	49.6	36%	0.361	27%	0.266	S	S	.	.			trans	-86.6	-175.5	176.2	-60.7	179.4	0	0	0	112.1	L530 A549 L550 P551 A552	L530-L535 HydrophobicContact CD2-CD2 4.37Å; L535-A549 VanDerWaalsContact O-CB 3.29Å; L535-A549 WeakPolarHBondContact O-CB 3Å; L535-L550 WeakPolarHBondContact CB-O 3.49Å; L535-L550 HydrophobicContact CD1-CB 4.23Å; L535-L550 WeakPolarHBondContact CG-O 2.98Å; L535-L550 PolarHBondContact N-O 2.65Å; L535-P551 WeakPolarHBondContact CD1-O 3.17Å; L535-A552 HydrophobicContact CD2-CB 4.26Å
536	K	83.7	Confident	76.8	Confident	100 Å²	100	49.6 Å²	49.6	44%	0.435	27%	0.266	S	S	.	.			trans	-68	150.9	170.4	-69.4	176.8	179.4	178.3	0	110.9	R526 P528 F538	R526-K536 WeakPolarHBondContact O-CA 3.3Å; P528-K536 HydrophobicContact CB-CG 4.16Å; P528-K536 HydrophobicContact CG-CG 3.99Å; K536-F538 HydrophobicContact CB-CE2 4.48Å; K536-F538 HydrophobicContact CB-CZ 4.45Å
537	S	82.1	Confident	77.6	Confident	6 Å²	6	51.1 Å²	51.1	4%	0.042	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	161.2	164.7	71.1	0	0	0	0	112.8	C525 R526 C546 P547	C525-S537 PolarHBondContact N-O 3.31Å; R526-S537 WeakPolarHBondContact CB-OG 3.47Å; R526-S537 WeakPolarHBondContact CD-OG 3.35Å; R526-S537 WeakPolarHBondContact CG-OG 3.38Å; R526-S537 PolarHBondContact N-O 2.77Å; R526-S537 PolarHBondContact O-N 3.28Å; S537-C546 PolarHBondContact OG-SG 3.4Å; S537-P547 VanDerWaalsContact CB-O 3.29Å; S537-P547 WeakPolarHBondContact CB-O 3.2Å; S537-P547 PolarHBondContact OG-O 2.94Å
538	F	87.7	Confident	77.7	Confident	104 Å²	104	51.8 Å²	51.8	46%	0.456	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	143.7	-164.2	-52.1	-97.1	0	0	0	110.9	G522 T523 V524 K536 P547	G522-F538 WeakPolarHBondContact O-CD1 3.36Å; T523-F538 CarbonylContact O-C 3.58Å; T523-F538 WeakPolarHBondContact O-CA 3.46Å; V524-F538 HydrophobicContact CB-CD1 4.46Å; V524-F538 HydrophobicContact CG2-CD1 3.72Å; V524-F538 HydrophobicContact CG2-CE1 3.57Å; K536-F538 HydrophobicContact CB-CE2 4.48Å; K536-F538 HydrophobicContact CB-CZ 4.45Å; F538-P547 VanDerWaalsContact O-CD 3.26Å; F538-P547 WeakPolarHBondContact O-CD 3.49Å; F538-P547 WeakPolarHBondContact O-CG 3.26Å
539	C	85.4	Confident	78	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.014	28%	0.279	C	S	.	.			trans	-60.3	145.9	174.3	-58.7	0	0	0	0	111.1	C511 K521 G522 T523 C525	C511-C539 WeakPolarHBondContact CA-SG 3.48Å; C511-C539 HydrophobicContact CB-CB 3.83Å; C511-C539 WeakPolarHBondContact CB-SG 2.98Å; C511-C539 WeakPolarHBondContact SG-CA 3.39Å; C511-C539 WeakPolarHBondContact SG-CB 3.28Å; C511-C539 CovalentContact SG-SG 2.04Å; C511-C539 PolarHBondContact SG-SG 3.48Å; K521-C539 CarbonylContact C-O 3.42Å; K521-C539 WeakPolarHBondContact CA-O 3.32Å; G522-C539 PolarHBondContact N-O 3.25Å; T523-C539 PolarHBondContact O-N 3.01Å; C525-C539 VanDerWaalsContact CB-SG 3.58Å; C525-C539 PolarHBondContact SG-N 3.35Å
540	D	86.8	Confident	78.9	Confident	49 Å²	49	53.8 Å²	53.8	26%	0.262	30%	0.298	S	S	.	.			trans	-90.1	-14	179.3	59.5	16.3	0	0	0	113.9	K521 V542 N543	K521-D540 WeakPolarHBondContact CB-O 3.5Å; K521-D540 WeakPolarHBondContact CD-O 3.27Å; K521-D540 WeakPolarHBondContact CG-O 2.98Å; D540-V542 HydrophobicContact CB-CG2 4.43Å; D540-V542 WeakPolarHBondContact OD1-CG2 3.4Å; D540-V542 PolarHBondContact OD1-N 3.35Å; D540-N543 PolarHBondContact OD1-N 3.29Å; D540-N543 WeakPolarHBondContact OD2-CB 3.3Å; D540-N543 PolarHBondContact OD2-ND2 2.04Å
541	G	85	Confident	79.6	Confident	27 Å²	27	53.5 Å²	53.5	28%	0.278	30%	0.3	S	S	.	.	S	Bend	trans	92.6	-1.5	-178.9	0	0	0	0	0	115.2	L519	L519-G541 WeakPolarHBondContact O-CA 3.26Å
542	V	83.9	Confident	80.9	Confident	97 Å²	97	50 Å²	50	59%	0.588	28%	0.282	S	S	*	.	S	Bend	trans	-133.6	-14.5	-174.3	-64.8	0	0	0	0	113.8	F518 D540	F518-V542 WeakPolarHBondContact CZ-O 3.33Å; D540-V542 HydrophobicContact CB-CG2 4.43Å; D540-V542 WeakPolarHBondContact OD1-CG2 3.4Å; D540-V542 PolarHBondContact OD1-N 3.35Å
543	N	77.6	Confident	82.1	Confident	62 Å²	62	51 Å²	51	33%	0.332	29%	0.294	S	S	.	.			trans	-119	144.5	-179.7	-70.7	-49.9	0	0	0	111.8	Q490 C511 F518 D540	Q490-N543 VanDerWaalsContact NE2-CG 3.27Å; Q490-N543 PolarHBondContact NE2-OD1 3.26Å; C511-N543 VanDerWaalsContact CB-O 3.22Å; C511-N543 WeakPolarHBondContact CB-O 3.4Å; F518-N543 VanDerWaalsContact CD1-C 3.48Å; D540-N543 PolarHBondContact OD1-N 3.29Å; D540-N543 WeakPolarHBondContact OD2-CB 3.3Å; D540-N543 PolarHBondContact OD2-ND2 2.04Å
544	A	71	Confident	82.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	32%	0.321	C	S	.	.	S	Bend	trans	-77.4	-18.1	172.4	0	0	0	0	0	111.6	K46 C488 S509 C511 F518	K46-A544 PolarHBondContact NZ-O 3.32Å; C488-A544 HydrophobicContact CB-CB 4.28Å; S509-A544 PolarHBondContact OG-O 3Å; C511-A544 PolarHBondContact N-O 3.1Å; F518-A544 HydrophobicContact CD1-CB 4.28Å; F518-A544 HydrophobicContact CE1-CB 3.95Å
545	D	69.2	Low	83.1	Confident	51 Å²	51	54.6 Å²	54.6	27%	0.273	33%	0.326	S	S	.	.	S	Bend	trans	-72.1	136.2	167.5	-89.8	-5.6	0	0	0	112.2	K46 L502 P547	K46-D545 HydrophobicContact CD-CB 4.4Å; K46-D545 WeakPolarHBondContact CD-OD1 3.33Å; K46-D545 WeakPolarHBondContact CE-OD1 3.48Å; K46-D545 IonicContact NZ-OD1 3.83Å; K46-D545 PolarHBondContact NZ-OD1 2.67Å; L502-D545 WeakPolarHBondContact CD2-OD1 3.47Å; L502-D545 VanDerWaalsContact CD2-OD2 3.27Å; L502-D545 WeakPolarHBondContact CD2-OD2 3.13Å; D545-P547 WeakPolarHBondContact O-CD 3.18Å
546	C	72.2	Confident	83.3	Confident	3 Å²	3	52.9 Å²	52.9	2%	0.02	32%	0.319	C	S	.	.	P	Polyproline II helix	trans	-84.4	121.4	166.3	-179.6	0	0	0	0	108.3	K46 P510 C525 R526 S537	K46-C546 HydrophobicContact CB-CB 3.9Å; K46-C546 HydrophobicContact CD-CB 4.39Å; P510-C546 HydrophobicContact CG-CB 3.96Å; C525-C546 HydrophobicContact CB-CB 3.58Å; C525-C546 WeakPolarHBondContact CB-SG 3.48Å; C525-C546 VanDerWaalsContact SG-CA 3.57Å; C525-C546 WeakPolarHBondContact SG-CB 3.36Å; C525-C546 CovalentContact SG-SG 2.02Å; C525-C546 PolarHBondContact SG-SG 3.4Å; R526-C546 PolarHBondContact NH2-O 2.79Å; S537-C546 PolarHBondContact OG-SG 3.4Å
547	P	83.4	Confident	83.4	Confident	42 Å²	42	52.8 Å²	52.8	27%	0.273	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-51.1	153.5	177.5	-29.3	35.8	0	0	0	113.6	R526 S537 F538 D545	R526-P547 PolarHBondContact NE-O 2.84Å; R526-P547 PolarHBondContact NH2-O 3.17Å; S537-P547 VanDerWaalsContact CB-O 3.29Å; S537-P547 WeakPolarHBondContact CB-O 3.2Å; S537-P547 PolarHBondContact OG-O 2.94Å; F538-P547 VanDerWaalsContact O-CD 3.26Å; F538-P547 WeakPolarHBondContact O-CD 3.49Å; F538-P547 WeakPolarHBondContact O-CG 3.26Å; D545-P547 WeakPolarHBondContact O-CD 3.18Å
548	P	75.9	Confident	83.3	Confident	93 Å²	93	53 Å²	53	60%	0.604	33%	0.33	S	S	*	.	P	Polyproline II helix	trans	-51.7	149.3	173.5	-27.4	35.9	0	0	0	112.9
549	A	80.3	Confident	82.5	Confident	19 Å²	19	50.1 Å²	50.1	16%	0.157	32%	0.318	C	S	.	.	P	Polyproline II helix	trans	-73	140.2	173	0	0	0	0	0	110.7	K534 L535	K534-A549 HydrophobicContact CB-CB 3.92Å; K534-A549 HydrophobicContact CG-CB 4.31Å; L535-A549 VanDerWaalsContact O-CB 3.29Å; L535-A549 WeakPolarHBondContact O-CB 3Å
550	L	88.1	Confident	81.7	Confident	125 Å²	125	54.2 Å²	54.2	65%	0.654	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-67.3	145.4	166.7	-67.4	175	0	0	0	109.4	L535	L535-L550 WeakPolarHBondContact CB-O 3.49Å; L535-L550 HydrophobicContact CD1-CB 4.23Å; L535-L550 WeakPolarHBondContact CG-O 2.98Å; L535-L550 PolarHBondContact N-O 2.65Å
551	P	86.4	Confident	81.3	Confident	75 Å²	75	53.5 Å²	53.5	49%	0.487	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-63.8	148.3	175.7	27.7	-34.8	0	0	0	111	C533 L535	C533-P551 CarbonylContact O-C 3.56Å; C533-P551 WeakPolarHBondContact O-CA 3.48Å; L535-P551 WeakPolarHBondContact CD1-O 3.17Å
552	A	88.2	Confident	81.2	Confident	4 Å²	4	52.2 Å²	52.2	3%	0.033	33%	0.331	C	S	.	.	P	Polyproline II helix	trans	-65.3	154.7	166.1	0	0	0	0	0	110.1	L530 C533 L535 T556	L530-A552 HydrophobicContact CD2-CB 4.26Å; C533-A552 HydrophobicContact CB-CB 4.41Å; C533-A552 PolarHBondContact O-N 2.99Å; L535-A552 HydrophobicContact CD2-CB 4.26Å; A552-T556 HydrophobicContact CB-CG2 4.34Å
553	A	91.8	Very high	81.5	Confident	72 Å²	72	48.3 Å²	48.3	60%	0.595	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-63.5	143.9	179	0	0	0	0	0	111.3	T556	A553-T556 VanDerWaalsContact O-CB 3.23Å; A553-T556 WeakPolarHBondContact O-CB 3.38Å; A553-T556 PolarHBondContact O-N 2.74Å; A553-T556 VanDerWaalsContact O-N 3.1Å; A553-T556 PolarHBondContact O-OG1 3.23Å
554	D	91.3	Very high	82.1	Confident	106 Å²	106	45.4 Å²	45.4	57%	0.567	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	142.6	177	-64.2	-28.4	0	0	0	111.3	T556 C564 Q565 N566	D554-T556 VanDerWaalsContact C-N 3.29Å; D554-T556 PolarHBondContact O-N 2.94Å; D554-C564 CarbonylContact C-O 3.55Å; D554-C564 VanDerWaalsContact CA-O 3.27Å; D554-C564 WeakPolarHBondContact CA-O 3.26Å; D554-Q565 VanDerWaalsContact OD1-CA 3.31Å; D554-Q565 WeakPolarHBondContact OD1-CA 3.34Å; D554-N566 PolarHBondContact OD1-N 3Å
555	G	89.3	Confident	83	Confident	41 Å²	41	48.1 Å²	48.1	42%	0.423	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.6	-2	-172.5	0	0	0	0	0	115	P557 C564	G555-P557 WeakPolarHBondContact O-CD 3.45Å; G555-C564 PolarHBondContact N-O 3.35Å
556	T	90	Very high	83.8	Confident	33 Å²	33	52.7 Å²	52.7	20%	0.202	33%	0.328	C	S	.	.			trans	-61.6	126.9	170.6	-62	0	0	0	0	109.8	L530 A552 A553 D554 E563 C564	L530-T556 HydrophobicContact CD2-CG2 4.43Å; A552-T556 HydrophobicContact CB-CG2 4.34Å; A553-T556 VanDerWaalsContact O-CB 3.23Å; A553-T556 WeakPolarHBondContact O-CB 3.38Å; A553-T556 PolarHBondContact O-N 2.74Å; A553-T556 VanDerWaalsContact O-N 3.1Å; A553-T556 PolarHBondContact O-OG1 3.23Å; D554-T556 VanDerWaalsContact C-N 3.29Å; D554-T556 PolarHBondContact O-N 2.94Å; T556-E563 CarbonylContact O-C 3.52Å; T556-E563 VanDerWaalsContact O-CA 3.32Å; T556-E563 WeakPolarHBondContact O-CA 3.09Å; T556-C564 PolarHBondContact O-N 3.23Å; T556-C564 PolarHBondContact O-SG 2.97Å; T556-C564 VanDerWaalsContact O-SG 3.38Å
557	P	85.4	Confident	84.3	Confident	98 Å²	98	53.3 Å²	53.3	64%	0.636	34%	0.335	S	S	*	.	B	Isolated β-bridge	trans	-63	136.5	178.4	-23.5	34.3	0	0	0	112.4	G555	G555-P557 WeakPolarHBondContact O-CD 3.45Å
558	C	80.6	Confident	84.3	Confident	10 Å²	10	58.3 Å²	58.3	7%	0.068	36%	0.355	C	S	.	.			trans	-133.4	-161.4	-178.9	70.4	0	0	0	0	111.7	L530 G561 G562 E563 C569	L530-C558 WeakPolarHBondContact O-CB 3.4Å; C558-G561 PolarHBondContact O-N 3.05Å; C558-G562 PolarHBondContact N-O 2.83Å; C558-G562 VanDerWaalsContact N-O 3.11Å; C558-E563 VanDerWaalsContact SG-CA 3.6Å; C558-E563 PolarHBondContact SG-N 3Å; C558-E563 PolarHBondContact SG-O 2.94Å; C558-C569 HydrophobicContact CB-CB 3.76Å; C558-C569 WeakPolarHBondContact CB-SG 3.22Å; C558-C569 WeakPolarHBondContact SG-CA 3.29Å; C558-C569 WeakPolarHBondContact SG-CB 3.42Å; C558-C569 CovalentContact SG-SG 2.03Å; C558-C569 PolarHBondContact SG-SG 3.23Å
559	M	70.8	Confident	84.4	Confident	44 Å²	44	56.1 Å²	56.1	22%	0.217	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-54.8	150.3	-175.3	-163.7	178.7	-62.1	0	0	113.3	D111 P114 N531 G561 G562 C569	D111-M559 WeakPolarHBondContact O-CE 3.18Å; P114-M559 VanDerWaalsContact CD-SD 3.53Å; P114-M559 HydrophobicContact CG-CE 3.87Å; P114-M559 HydrophobicContact CG-SD 3.4Å; P114-M559 WeakPolarHBondContact CG-SD 3.27Å; N531-M559 HydrophobicContact CB-CE 4.35Å; M559-G561 PolarHBondContact O-N 2.93Å; M559-G562 PolarHBondContact O-N 2.82Å; M559-C569 PolarHBondContact N-SG 2.91Å
560	D	68.8	Low	84.8	Confident	87 Å²	87	56.4 Å²	56.4	47%	0.465	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	58.3	14	179.9	-165.8	33.5	0	0	0	115.6	G562 R594	D560-G562 VanDerWaalsContact C-N 3.27Å; D560-R594 PolarHBondContact O-NH1 3.31Å; D560-R594 IonicContact OD1-CZ 3.94Å; D560-R594 IonicContact OD1-NH1 3Å; D560-R594 PolarHBondContact OD1-NH1 3.11Å; D560-R594 IonicContact OD1-NH2 3.67Å; D560-R594 PolarHBondContact OD1-NH2 2.86Å; D560-R594 IonicContact OD2-CZ 3.33Å; D560-R594 IonicContact OD2-NH1 3.44Å; D560-R594 PolarHBondContact OD2-NH1 2.87Å; D560-R594 IonicContact OD2-NH2 2.62Å; D560-R594 PolarHBondContact OD2-NH2 3.28Å
561	G	77.3	Confident	84.5	Confident	34 Å²	34	51.8 Å²	51.8	35%	0.351	32%	0.319	S	S	.	.	G	3₁₀ helix	trans	73	22.6	-171.3	0	0	0	0	0	113	C558 M559 F572	C558-G561 PolarHBondContact O-N 3.05Å; M559-G561 PolarHBondContact O-N 2.93Å; G561-F572 WeakPolarHBondContact O-CD2 3.33Å
562	G	82.9	Confident	84.5	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	30%	0.301	C	S	.	.			trans	-70.7	-170.6	166.5	0	0	0	0	0	113.2	C558 M559 D560 V570	C558-G562 PolarHBondContact N-O 2.83Å; C558-G562 VanDerWaalsContact N-O 3.11Å; M559-G562 PolarHBondContact O-N 2.82Å; D560-G562 VanDerWaalsContact C-N 3.27Å; G562-V570 WeakPolarHBondContact CA-O 3.38Å
563	E	90.5	Very high	84.4	Confident	16 Å²	16	49.3 Å²	49.3	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	158.1	174.1	69.7	-171.9	-160.6	0	0	111.6	T556 C558 Q565 V570 R575 H576	T556-E563 CarbonylContact O-C 3.52Å; T556-E563 VanDerWaalsContact O-CA 3.32Å; T556-E563 WeakPolarHBondContact O-CA 3.09Å; C558-E563 VanDerWaalsContact SG-CA 3.6Å; C558-E563 PolarHBondContact SG-N 3Å; C558-E563 PolarHBondContact SG-O 2.94Å; E563-Q565 HydrophobicContact CG-CG 4.29Å; E563-Q565 PolarHBondContact OE1-NE2 3Å; E563-V570 HydrophobicContact CG-CG2 3.83Å; E563-V570 PolarHBondContact N-O 3.1Å; E563-V570 WeakPolarHBondContact O-CG2 3.46Å; E563-V570 PolarHBondContact O-N 3.45Å; E563-R575 HydrophobicContact CB-CG 4.34Å; E563-R575 HydrophobicContact CG-CB 4.24Å; E563-R575 HydrophobicContact CG-CG 3.89Å; E563-R575 WeakPolarHBondContact OE1-CA 3.36Å; E563-R575 IonicContact OE2-CZ 3.84Å; E563-R575 IonicContact OE2-NH1 3.8Å; E563-H576 WeakPolarHBondContact OE1-CB 3.19Å; E563-H576 PolarHBondContact OE1-N 2.95Å
564	C	90.9	Very high	84.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	133.3	173.7	-61.2	0	0	0	0	111	C533 D554 G555 T556 E568	C533-C564 WeakPolarHBondContact CA-SG 3.4Å; C533-C564 HydrophobicContact CB-CB 3.73Å; C533-C564 WeakPolarHBondContact CB-SG 2.98Å; C533-C564 WeakPolarHBondContact SG-CA 3.06Å; C533-C564 WeakPolarHBondContact SG-CB 3.42Å; C533-C564 CovalentContact SG-SG 2.03Å; C533-C564 PolarHBondContact SG-SG 3.32Å; D554-C564 CarbonylContact C-O 3.55Å; D554-C564 VanDerWaalsContact CA-O 3.27Å; D554-C564 WeakPolarHBondContact CA-O 3.26Å; G555-C564 PolarHBondContact N-O 3.35Å; T556-C564 PolarHBondContact O-N 3.23Å; T556-C564 PolarHBondContact O-SG 2.97Å; T556-C564 VanDerWaalsContact O-SG 3.38Å; C564-E568 CarbonylContact C-O 3.55Å; C564-E568 VanDerWaalsContact CA-O 3.32Å; C564-E568 WeakPolarHBondContact CA-O 3.14Å
565	Q	88.9	Confident	84.1	Confident	57 Å²	57	46.1 Å²	46.1	27%	0.266	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	122.7	168.5	-63.3	-178.2	6.8	0	0	108.4	D554 E563 G567 E568 V570	D554-Q565 VanDerWaalsContact OD1-CA 3.31Å; D554-Q565 WeakPolarHBondContact OD1-CA 3.34Å; E563-Q565 HydrophobicContact CG-CG 4.29Å; E563-Q565 PolarHBondContact OE1-NE2 3Å; Q565-G567 PolarHBondContact O-N 3.08Å; Q565-G567 VanDerWaalsContact O-N 3.12Å; Q565-E568 PolarHBondContact N-O 3.2Å; Q565-E568 PolarHBondContact O-N 2.85Å; Q565-V570 HydrophobicContact CB-CG1 4.06Å; Q565-V570 HydrophobicContact CG-CG1 4.22Å; Q565-V570 HydrophobicContact CG-CG2 4.02Å
566	N	87.2	Confident	84.1	Confident	147 Å²	147	52 Å²	52	79%	0.786	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	27.7	-177.8	-61.1	-65.2	0	0	0	114.9	D554	D554-N566 PolarHBondContact OD1-N 3Å
567	G	83.2	Confident	83.9	Confident	17 Å²	17	53.9 Å²	53.9	18%	0.175	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	85.3	4.1	-177.4	0	0	0	0	0	115.6	C533 Q565	C533-G567 WeakPolarHBondContact CB-O 3.26Å; Q565-G567 PolarHBondContact O-N 3.08Å; Q565-G567 VanDerWaalsContact O-N 3.12Å
568	E	82.1	Confident	84	Confident	147 Å²	147	50.1 Å²	50.1	69%	0.687	27%	0.266	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.2	149.7	171.3	-62.7	-169.5	157	0	0	111.1	C564 Q565	C564-E568 CarbonylContact C-O 3.55Å; C564-E568 VanDerWaalsContact CA-O 3.32Å; C564-E568 WeakPolarHBondContact CA-O 3.14Å; Q565-E568 PolarHBondContact N-O 3.2Å; Q565-E568 PolarHBondContact O-N 2.85Å
569	C	79.3	Confident	84.3	Confident	46 Å²	46	52.1 Å²	52.1	31%	0.311	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	106.9	175.4	177.5	0	0	0	0	110	C558 M559	C558-C569 HydrophobicContact CB-CB 3.76Å; C558-C569 WeakPolarHBondContact CB-SG 3.22Å; C558-C569 WeakPolarHBondContact SG-CA 3.29Å; C558-C569 WeakPolarHBondContact SG-CB 3.42Å; C558-C569 CovalentContact SG-SG 2.03Å; C558-C569 PolarHBondContact SG-SG 3.23Å; M559-C569 PolarHBondContact N-SG 2.91Å
570	V	87.2	Confident	85.1	Confident	26 Å²	26	51.7 Å²	51.7	16%	0.158	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	147.5	175	-55.1	0	0	0	0	110.7	G562 E563 Q565 E574	G562-V570 WeakPolarHBondContact CA-O 3.38Å; E563-V570 HydrophobicContact CG-CG2 3.83Å; E563-V570 PolarHBondContact N-O 3.1Å; E563-V570 WeakPolarHBondContact O-CG2 3.46Å; E563-V570 PolarHBondContact O-N 3.45Å; Q565-V570 HydrophobicContact CB-CG1 4.06Å; Q565-V570 HydrophobicContact CG-CG1 4.22Å; Q565-V570 HydrophobicContact CG-CG2 4.02Å; V570-E574 HydrophobicContact CB-CB 3.92Å; V570-E574 HydrophobicContact CG2-CB 4.16Å
571	S	81.6	Confident	85.7	Confident	27 Å²	27	51.6 Å²	51.6	19%	0.189	28%	0.282	C	S	.	.			trans	-68.6	166.4	-175.4	74.9	0	0	0	0	113	C573 E574 R575	S571-C573 VanDerWaalsContact C-N 3.27Å; S571-C573 PolarHBondContact O-N 2.79Å; S571-C573 VanDerWaalsContact O-N 3.13Å; S571-E574 WeakPolarHBondContact CB-OE2 3.26Å; S571-E574 PolarHBondContact N-OE2 3.46Å; S571-E574 WeakPolarHBondContact O-CA 3.14Å; S571-E574 PolarHBondContact O-N 2.87Å; S571-E574 PolarHBondContact OG-OE2 3.32Å; S571-R575 PolarHBondContact O-N 3.44Å
572	F	86.9	Confident	86	Confident	25 Å²	25	53.4 Å²	53.4	11%	0.11	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-49.5	-41.5	179.7	178.4	-86.6	0	0	0	114.2	G561 E574 R575 I578 R594 F607 K617	G561-F572 WeakPolarHBondContact O-CD2 3.33Å; F572-E574 VanDerWaalsContact C-N 3.28Å; F572-E574 PolarHBondContact O-N 3.18Å; F572-R575 WeakPolarHBondContact O-CD 3.4Å; F572-R575 WeakPolarHBondContact O-CG 3.5Å; F572-I578 HydrophobicContact CD1-CD1 4.27Å; F572-I578 HydrophobicContact CE1-CD1 3.92Å; F572-I578 HydrophobicContact CZ-CD1 4.15Å; F572-I578 WeakPolarHBondContact O-CD1 3.16Å; F572-R594 HydrophobicContact CD1-CG 3.92Å; F572-R594 HydrophobicContact CE1-CG 4.2Å; F572-F607 AromaticContact CE1-CD1 3.74Å; F572-F607 HydrophobicContact CE1-CD1 3.74Å; F572-F607 AromaticContact CE1-CD2 3.88Å; F572-F607 HydrophobicContact CE1-CD2 3.88Å; F572-F607 AromaticContact CE1-CE1 3.64Å; F572-F607 HydrophobicContact CE1-CE1 3.64Å; F572-F607 AromaticContact CE1-CE2 3.8Å; F572-F607 HydrophobicContact CE1-CE2 3.8Å; F572-F607 AromaticContact CE1-CG 3.83Å; F572-F607 HydrophobicContact CE1-CG 3.83Å; F572-F607 AromaticContact CE1-CZ 3.64Å; F572-F607 HydrophobicContact CE1-CZ 3.64Å; F572-F607 AromaticContact CZ-CD1 3.9Å; F572-F607 HydrophobicContact CZ-CD1 3.9Å; F572-F607 AromaticContact CZ-CE1 3.44Å; F572-F607 HydrophobicContact CZ-CE1 3.44Å; F572-F607 VanDerWaalsContact CZ-CE1 3.44Å; F572-F607 HydrophobicContact CZ-CE2 4.26Å; F572-F607 HydrophobicContact CZ-CG 4.44Å; F572-F607 AromaticContact CZ-CZ 3.62Å; F572-F607 HydrophobicContact CZ-CZ 3.62Å; F572-K617 HydrophobicContact CE2-CD 4.41Å; F572-K617 HydrophobicContact CZ-CD 4.47Å
573	C	86.5	Confident	86	Confident	2 Å²	2	55 Å²	55	1%	0.014	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-73.6	-21	-179.9	-68	0	0	0	0	113	S571 I578 M580 P582 C595 C596	S571-C573 VanDerWaalsContact C-N 3.27Å; S571-C573 PolarHBondContact O-N 2.79Å; S571-C573 VanDerWaalsContact O-N 3.13Å; C573-I578 VanDerWaalsContact O-CG2 3.27Å; C573-I578 WeakPolarHBondContact O-CG2 3.43Å; C573-M580 CarbonylContact C-O 3.59Å; C573-M580 VanDerWaalsContact C-O 3.23Å; C573-M580 HydrophobicContact CB-CB 4.42Å; C573-M580 CarbonylContact O-C 3.32Å; C573-M580 WeakPolarHBondContact O-CA 3.25Å; C573-M580 PolarHBondContact O-N 2.66Å; C573-P582 HydrophobicContact CB-CB 4.43Å; C573-C595 PolarHBondContact SG-O 3.4Å; C573-C596 HydrophobicContact CB-CB 3.81Å; C573-C596 WeakPolarHBondContact CB-SG 3.28Å; C573-C596 WeakPolarHBondContact SG-CB 3.47Å; C573-C596 CovalentContact SG-SG 2.05Å; C573-C596 PolarHBondContact SG-SG 3.42Å
574	E	88	Confident	85.4	Confident	52 Å²	52	58 Å²	58	24%	0.243	31%	0.314	C	S	.	.	G	3₁₀ helix	trans	-94.2	-5.4	-173.1	-67.3	169	128.2	0	0	113.3	V570 S571 F572 M580 K581	V570-E574 HydrophobicContact CB-CB 3.92Å; V570-E574 HydrophobicContact CG2-CB 4.16Å; S571-E574 WeakPolarHBondContact CB-OE2 3.26Å; S571-E574 PolarHBondContact N-OE2 3.46Å; S571-E574 WeakPolarHBondContact O-CA 3.14Å; S571-E574 PolarHBondContact O-N 2.87Å; S571-E574 PolarHBondContact OG-OE2 3.32Å; F572-E574 VanDerWaalsContact C-N 3.28Å; F572-E574 PolarHBondContact O-N 3.18Å; E574-M580 WeakPolarHBondContact CA-O 2.98Å; E574-M580 WeakPolarHBondContact CG-O 3.34Å; E574-M580 PolarHBondContact N-O 3.27Å; E574-K581 HydrophobicContact CG-CD 4.03Å; E574-K581 VanDerWaalsContact OE1-CD 3.24Å; E574-K581 WeakPolarHBondContact OE1-CD 3.06Å; E574-K581 WeakPolarHBondContact OE1-CE 3.02Å; E574-K581 IonicContact OE1-NZ 3.54Å; E574-K581 PolarHBondContact OE1-NZ 3.27Å
575	R	89.8	Confident	85.1	Confident	59 Å²	59	58.2 Å²	58.2	22%	0.223	32%	0.315	C	S	.	.	S	Bend	trans	-48.9	146.3	169.4	-67	167	44.3	96.1	1.6	111.4	E563 S571 F572 D577 I578 G579	E563-R575 HydrophobicContact CB-CG 4.34Å; E563-R575 HydrophobicContact CG-CB 4.24Å; E563-R575 HydrophobicContact CG-CG 3.89Å; E563-R575 WeakPolarHBondContact OE1-CA 3.36Å; E563-R575 IonicContact OE2-CZ 3.84Å; E563-R575 IonicContact OE2-NH1 3.8Å; S571-R575 PolarHBondContact O-N 3.44Å; F572-R575 WeakPolarHBondContact O-CD 3.4Å; F572-R575 WeakPolarHBondContact O-CG 3.5Å; R575-D577 WeakPolarHBondContact CB-OD1 3.31Å; R575-D577 IonicContact CZ-OD1 3.18Å; R575-D577 IonicContact CZ-OD2 3.04Å; R575-D577 IonicContact NE-OD1 2.7Å; R575-D577 PolarHBondContact NE-OD1 3.43Å; R575-D577 IonicContact NE-OD2 3.22Å; R575-D577 IonicContact NH2-OD1 2.95Å; R575-D577 PolarHBondContact NH2-OD1 3Å; R575-D577 VanDerWaalsContact NH2-OD1 3.09Å; R575-D577 IonicContact NH2-OD2 2.74Å; R575-D577 PolarHBondContact NH2-OD2 2.81Å; R575-D577 PolarHBondContact O-N 2.88Å; R575-D577 VanDerWaalsContact O-N 3.15Å; R575-I578 HydrophobicContact CB-CD1 4.31Å; R575-I578 PolarHBondContact O-N 3.42Å; R575-G579 PolarHBondContact O-N 3.02Å
576	H	87.6	Confident	84.5	Confident	165 Å²	165	62.4 Å²	62.4	76%	0.764	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-29.3	-177.1	-179	-80.9	0	0	0	113.3	E563 I578	E563-H576 WeakPolarHBondContact OE1-CB 3.19Å; E563-H576 PolarHBondContact OE1-N 2.95Å; H576-I578 VanDerWaalsContact C-N 3.28Å; H576-I578 PolarHBondContact O-N 2.94Å
577	D	86.7	Confident	84.2	Confident	73 Å²	73	59.5 Å²	59.5	39%	0.39	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-9.9	176.3	65.1	-29.8	0	0	0	114.4	R575 Y613	R575-D577 WeakPolarHBondContact CB-OD1 3.31Å; R575-D577 IonicContact CZ-OD1 3.18Å; R575-D577 IonicContact CZ-OD2 3.04Å; R575-D577 IonicContact NE-OD1 2.7Å; R575-D577 PolarHBondContact NE-OD1 3.43Å; R575-D577 IonicContact NE-OD2 3.22Å; R575-D577 IonicContact NH2-OD1 2.95Å; R575-D577 PolarHBondContact NH2-OD1 3Å; R575-D577 VanDerWaalsContact NH2-OD1 3.09Å; R575-D577 IonicContact NH2-OD2 2.74Å; R575-D577 PolarHBondContact NH2-OD2 2.81Å; R575-D577 PolarHBondContact O-N 2.88Å; R575-D577 VanDerWaalsContact O-N 3.15Å; D577-Y613 PolarHBondContact O-OH 3.12Å; D577-Y613 PolarHBondContact OD2-OH 3.48Å
578	I	87.7	Confident	83.9	Confident	18 Å²	18	61.6 Å²	61.6	9%	0.092	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-120	-46.5	-173.8	-58	166.8	0	0	0	111.6	F572 C573 R575 H576 M580 F607 L610 Y613	F572-I578 HydrophobicContact CD1-CD1 4.27Å; F572-I578 HydrophobicContact CE1-CD1 3.92Å; F572-I578 HydrophobicContact CZ-CD1 4.15Å; F572-I578 WeakPolarHBondContact O-CD1 3.16Å; C573-I578 VanDerWaalsContact O-CG2 3.27Å; C573-I578 WeakPolarHBondContact O-CG2 3.43Å; R575-I578 HydrophobicContact CB-CD1 4.31Å; R575-I578 PolarHBondContact O-N 3.42Å; H576-I578 VanDerWaalsContact C-N 3.28Å; H576-I578 PolarHBondContact O-N 2.94Å; I578-M580 HydrophobicContact CG2-CB 4.12Å; I578-M580 HydrophobicContact CG2-CG 4.23Å; I578-M580 WeakPolarHBondContact O-CG 3.24Å; I578-M580 PolarHBondContact O-N 3.16Å; I578-F607 HydrophobicContact CB-CE2 4.37Å; I578-F607 HydrophobicContact CD1-CD2 4.42Å; I578-F607 HydrophobicContact CD1-CE2 3.35Å; I578-F607 HydrophobicContact CD1-CZ 3.5Å; I578-F607 HydrophobicContact CG1-CE2 3.62Å; I578-F607 HydrophobicContact CG1-CZ 3.99Å; I578-F607 HydrophobicContact CG2-CD2 4.31Å; I578-F607 HydrophobicContact CG2-CE2 3.79Å; I578-L610 HydrophobicContact CG2-CD1 4.17Å; I578-Y613 HydrophobicContact CG1-CE2 4.06Å
579	G	86.7	Confident	84.1	Confident	53 Å²	53	59.6 Å²	59.6	55%	0.546	32%	0.323	S	S	.	.			trans	63.7	31.7	172.3	0	0	0	0	0	115.4	R575	R575-G579 PolarHBondContact O-N 3.02Å
580	M	88.4	Confident	84.5	Confident	35 Å²	35	59.3 Å²	59.3	17%	0.172	32%	0.317	C	S	.	.			trans	-122.9	177.3	-176.2	-67.9	-162.1	-174.8	0	0	112.2	C573 E574 I578 C596 R597 P598 L610	C573-M580 CarbonylContact C-O 3.59Å; C573-M580 VanDerWaalsContact C-O 3.23Å; C573-M580 HydrophobicContact CB-CB 4.42Å; C573-M580 CarbonylContact O-C 3.32Å; C573-M580 WeakPolarHBondContact O-CA 3.25Å; C573-M580 PolarHBondContact O-N 2.66Å; E574-M580 WeakPolarHBondContact CA-O 2.98Å; E574-M580 WeakPolarHBondContact CG-O 3.34Å; E574-M580 PolarHBondContact N-O 3.27Å; I578-M580 HydrophobicContact CG2-CB 4.12Å; I578-M580 HydrophobicContact CG2-CG 4.23Å; I578-M580 WeakPolarHBondContact O-CG 3.24Å; I578-M580 PolarHBondContact O-N 3.16Å; M580-C596 HydrophobicContact CB-CB 3.84Å; M580-C596 HydrophobicContact SD-CB 4.05Å; M580-R597 WeakPolarHBondContact CB-O 3.5Å; M580-P598 HydrophobicContact CE-CG 4.42Å; M580-L610 HydrophobicContact CE-CD1 4.11Å; M580-L610 HydrophobicContact CE-CD2 3.59Å; M580-L610 HydrophobicContact SD-CD1 4.14Å; M580-L610 HydrophobicContact SD-CD2 4.22Å
581	K	80.9	Confident	84	Confident	85 Å²	85	58.1 Å²	58.1	37%	0.37	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.9	172.3	-67	-69.9	176.4	177.9	0	110.7	E574 C596 R597 V599	E574-K581 HydrophobicContact CG-CD 4.03Å; E574-K581 VanDerWaalsContact OE1-CD 3.24Å; E574-K581 WeakPolarHBondContact OE1-CD 3.06Å; E574-K581 WeakPolarHBondContact OE1-CE 3.02Å; E574-K581 IonicContact OE1-NZ 3.54Å; E574-K581 PolarHBondContact OE1-NZ 3.27Å; K581-C596 CarbonylContact O-C 3.53Å; K581-C596 WeakPolarHBondContact O-CA 3.33Å; K581-R597 HydrophobicContact CB-CG 4.38Å; K581-R597 PolarHBondContact N-O 3.05Å; K581-R597 PolarHBondContact O-N 3.37Å; K581-V599 HydrophobicContact CG-CG2 4.28Å
582	P	82.4	Confident	84.1	Confident	71 Å²	71	56.9 Å²	56.9	46%	0.461	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	149.6	175.8	28.3	-34.8	0	0	0	111.8	C573	C573-P582 HydrophobicContact CB-CB 4.43Å
583	C	84.1	Confident	84.3	Confident	33 Å²	33	57 Å²	57	22%	0.223	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	169.4	177.5	61.3	0	0	0	0	111.9	C595 R597 C604	C583-C595 PolarHBondContact N-O 2.02Å; C583-C595 VanDerWaalsContact N-O 3.17Å; C583-C595 WeakPolarHBondContact O-CB 3.15Å; C583-R597 HydrophobicContact CB-CG 4.17Å; C583-C604 HydrophobicContact CB-CB 3.77Å; C583-C604 WeakPolarHBondContact CB-SG 2.94Å; C583-C604 WeakPolarHBondContact SG-CA 3.44Å; C583-C604 WeakPolarHBondContact SG-CB 3.21Å; C583-C604 CovalentContact SG-SG 2.02Å; C583-C604 PolarHBondContact SG-SG 3.07Å
584	I	77.5	Confident	84.4	Confident	81 Å²	81	58.8 Å²	58.8	42%	0.415	31%	0.31	S	S	.	.			trans	-102.3	128.6	172.7	-59.6	175.3	0	0	0	108.5	C604 I626	I584-C604 PolarHBondContact O-SG 2.64Å; I584-I626 HydrophobicContact CG2-CB 4.36Å
585	C	83.6	Confident	84.4	Confident	3 Å²	3	56.5 Å²	56.5	2%	0.02	30%	0.3	C	S	.	.			trans	-66.4	136.5	177.6	-80.6	0	0	0	0	112.1	N587 L590 S591 C595 T605 P606	C585-N587 VanDerWaalsContact C-N 3.28Å; C585-N587 PolarHBondContact O-N 3.48Å; C585-L590 HydrophobicContact CB-CB 3.85Å; C585-S591 VanDerWaalsContact O-CB 3.26Å; C585-S591 WeakPolarHBondContact O-CB 3.42Å; C585-C595 HydrophobicContact CB-CB 4.16Å; C585-C595 WeakPolarHBondContact CB-SG 3.29Å; C585-C595 WeakPolarHBondContact SG-CB 3.39Å; C585-C595 CovalentContact SG-SG 2.04Å; C585-C595 PolarHBondContact SG-SG 2.87Å; C585-T605 VanDerWaalsContact SG-C 3.51Å; C585-P606 WeakPolarHBondContact SG-CD 3.34Å; C585-P606 VanDerWaalsContact SG-N 3.35Å
586	E	76.5	Confident	84.4	Confident	146 Å²	146	53.8 Å²	53.8	68%	0.682	29%	0.29	S	S	*	.	S	Bend	trans	-67.9	-23.1	-175.9	-66.6	176.5	-179.4	0	0	114.3	I626	E586-I626 WeakPolarHBondContact O-CD1 2.97Å
587	N	82.7	Confident	84.3	Confident	86 Å²	86	50 Å²	50	46%	0.46	27%	0.269	S	S	.	.	S	Bend	trans	-84.1	124.6	175.9	-173	-27	0	0	0	110.1	C585 T589 L590 S591	C585-N587 VanDerWaalsContact C-N 3.28Å; C585-N587 PolarHBondContact O-N 3.48Å; N587-T589 PolarHBondContact O-N 3.03Å; N587-T589 VanDerWaalsContact O-N 3.11Å; N587-T589 PolarHBondContact OD1-N 2.96Å; N587-T589 PolarHBondContact OD1-OG1 3.2Å; N587-L590 HydrophobicContact CB-CB 4.23Å; N587-L590 HydrophobicContact CB-CD1 4.02Å; N587-L590 HydrophobicContact CB-CG 4.06Å; N587-L590 CarbonylContact O-C 3.52Å; N587-L590 WeakPolarHBondContact O-CA 3.1Å; N587-L590 PolarHBondContact O-N 2.77Å; N587-S591 WeakPolarHBondContact O-CB 3.28Å; N587-S591 PolarHBondContact O-N 3.48Å
588	Q	76.4	Confident	84.3	Confident	60 Å²	60	49 Å²	49	28%	0.28	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52	-35.4	178.7	-172.1	178.1	-13.6	0	0	113.4	L590 S591 I626 C635	Q588-L590 VanDerWaalsContact C-N 3.29Å; Q588-L590 PolarHBondContact O-N 3.34Å; Q588-S591 PolarHBondContact O-OG 2.89Å; Q588-I626 HydrophobicContact CB-CG2 4.12Å; Q588-I626 HydrophobicContact CG-CG2 4.45Å; Q588-C635 HydrophobicContact CG-CB 3.73Å; Q588-C635 PolarHBondContact NE2-O 3.28Å; Q588-C635 VanDerWaalsContact O-CB 3.28Å; Q588-C635 WeakPolarHBondContact O-CB 3.13Å
589	T	84.9	Confident	83.7	Confident	106 Å²	106	52.3 Å²	52.3	65%	0.65	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-18.1	177.7	63.6	0	0	0	0	113.9	N587	N587-T589 PolarHBondContact O-N 3.03Å; N587-T589 VanDerWaalsContact O-N 3.11Å; N587-T589 PolarHBondContact OD1-N 2.96Å; N587-T589 PolarHBondContact OD1-OG1 3.2Å
590	L	88.3	Confident	83.4	Confident	39 Å²	39	57.8 Å²	57.8	20%	0.204	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.3	-17.6	-179.5	-56.7	-179.2	0	0	0	112.9	C585 N587 Q588 C592 L593 P606	C585-L590 HydrophobicContact CB-CB 3.85Å; N587-L590 HydrophobicContact CB-CB 4.23Å; N587-L590 HydrophobicContact CB-CD1 4.02Å; N587-L590 HydrophobicContact CB-CG 4.06Å; N587-L590 CarbonylContact O-C 3.52Å; N587-L590 WeakPolarHBondContact O-CA 3.1Å; N587-L590 PolarHBondContact O-N 2.77Å; Q588-L590 VanDerWaalsContact C-N 3.29Å; Q588-L590 PolarHBondContact O-N 3.34Å; L590-C592 PolarHBondContact O-N 2.88Å; L590-L593 HydrophobicContact CD2-CD1 4.02Å; L590-L593 WeakPolarHBondContact O-CB 3.32Å; L590-L593 PolarHBondContact O-N 3.12Å; L590-P606 HydrophobicContact CB-CG 4.18Å; L590-P606 HydrophobicContact CD1-CG 4.01Å; L590-P606 HydrophobicContact CD2-CG 4.32Å; L590-P606 HydrophobicContact CG-CG 4.4Å
591	S	77.5	Confident	82.9	Confident	1 Å²	1	58 Å²	58	1%	0.007	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-6	-176	64.3	0	0	0	0	115.5	C585 N587 Q588 C625 C635	C585-S591 VanDerWaalsContact O-CB 3.26Å; C585-S591 WeakPolarHBondContact O-CB 3.42Å; N587-S591 WeakPolarHBondContact O-CB 3.28Å; N587-S591 PolarHBondContact O-N 3.48Å; Q588-S591 PolarHBondContact O-OG 2.89Å; S591-C625 WeakPolarHBondContact O-CB 3Å; S591-C625 WeakPolarHBondContact OG-CB 3.34Å; S591-C635 WeakPolarHBondContact OG-CB 3.35Å; S591-C635 PolarHBondContact OG-SG 2.65Å; S591-C635 VanDerWaalsContact OG-SG 3.4Å
592	C	83.6	Confident	82.6	Confident	1 Å²	1	58.8 Å²	58.8	1%	0.007	33%	0.325	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	13.6	171.2	-72.3	0	0	0	0	114.2	L590 L619 C630 G633 K634 C635	L590-C592 PolarHBondContact O-N 2.88Å; C592-L619 PolarHBondContact O-N 3.22Å; C592-C630 WeakPolarHBondContact CA-SG 3.33Å; C592-C630 HydrophobicContact CB-CB 3.87Å; C592-C630 WeakPolarHBondContact CB-SG 3.27Å; C592-C630 WeakPolarHBondContact SG-CA 3.4Å; C592-C630 WeakPolarHBondContact SG-CB 3.24Å; C592-C630 CovalentContact SG-SG 2.04Å; C592-C630 PolarHBondContact SG-SG 3.33Å; C592-G633 VanDerWaalsContact CB-O 3.23Å; C592-G633 WeakPolarHBondContact CB-O 3.08Å; C592-K634 VanDerWaalsContact SG-C 3.58Å; C592-C635 VanDerWaalsContact SG-CA 3.56Å; C592-C635 PolarHBondContact SG-N 3.44Å; C592-C635 VanDerWaalsContact SG-N 3.42Å
593	L	90.9	Very high	82.6	Confident	29 Å²	29	60.9 Å²	60.9	15%	0.152	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-99.9	151.8	165.9	-55.9	177.8	0	0	0	109	L590 C595 P606 P616 K617 V618	L590-L593 HydrophobicContact CD2-CD1 4.02Å; L590-L593 WeakPolarHBondContact O-CB 3.32Å; L590-L593 PolarHBondContact O-N 3.12Å; L593-C595 PolarHBondContact O-N 3.28Å; L593-C595 VanDerWaalsContact O-N 3.1Å; L593-C595 PolarHBondContact O-SG 2.88Å; L593-P606 HydrophobicContact CB-CB 4.41Å; L593-P606 HydrophobicContact CD1-CB 4.04Å; L593-P606 HydrophobicContact CD1-CG 4.21Å; L593-P616 HydrophobicContact CD1-CB 4.27Å; L593-P616 HydrophobicContact CD2-CB 3.89Å; L593-K617 CarbonylContact C-O 3.57Å; L593-K617 WeakPolarHBondContact CA-O 3.39Å; L593-V618 HydrophobicContact CD2-CG2 4.07Å
594	R	87.8	Confident	82.6	Confident	39 Å²	39	60.2 Å²	60.2	15%	0.147	33%	0.325	C	S	.	.			trans	-64.1	113.4	168.8	-179	141.4	-71.5	175.4	-1.4	109	D560 F572 F607 K617 L619	D560-R594 PolarHBondContact O-NH1 3.31Å; D560-R594 IonicContact OD1-CZ 3.94Å; D560-R594 IonicContact OD1-NH1 3Å; D560-R594 PolarHBondContact OD1-NH1 3.11Å; D560-R594 IonicContact OD1-NH2 3.67Å; D560-R594 PolarHBondContact OD1-NH2 2.86Å; D560-R594 IonicContact OD2-CZ 3.33Å; D560-R594 IonicContact OD2-NH1 3.44Å; D560-R594 PolarHBondContact OD2-NH1 2.87Å; D560-R594 IonicContact OD2-NH2 2.62Å; D560-R594 PolarHBondContact OD2-NH2 3.28Å; F572-R594 HydrophobicContact CD1-CG 3.92Å; F572-R594 HydrophobicContact CE1-CG 4.2Å; R594-F607 WeakPolarHBondContact O-CB 3.46Å; R594-F607 PolarHBondContact O-N 2.04Å; R594-K617 HydrophobicContact CB-CB 4.23Å; R594-K617 PolarHBondContact N-O 3.34Å; R594-L619 HydrophobicContact CB-CD2 3.98Å
595	C	87.6	Confident	83.1	Confident	4 Å²	4	57.3 Å²	57.3	3%	0.027	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	143.5	180	-58.4	0	0	0	0	111	C573 C583 C585 L593 C604 T605	C573-C595 PolarHBondContact SG-O 3.4Å; C583-C595 PolarHBondContact N-O 2.02Å; C583-C595 VanDerWaalsContact N-O 3.17Å; C583-C595 WeakPolarHBondContact O-CB 3.15Å; C585-C595 HydrophobicContact CB-CB 4.16Å; C585-C595 WeakPolarHBondContact CB-SG 3.29Å; C585-C595 WeakPolarHBondContact SG-CB 3.39Å; C585-C595 CovalentContact SG-SG 2.04Å; C585-C595 PolarHBondContact SG-SG 2.87Å; L593-C595 PolarHBondContact O-N 3.28Å; L593-C595 VanDerWaalsContact O-N 3.1Å; L593-C595 PolarHBondContact O-SG 2.88Å; C595-C604 WeakPolarHBondContact CB-SG 3.28Å; C595-T605 CarbonylContact C-O 3.58Å; C595-T605 WeakPolarHBondContact CA-O 2.97Å; C595-T605 VanDerWaalsContact CB-O 3.27Å; C595-T605 WeakPolarHBondContact CB-O 3.44Å
596	C	89.8	Confident	83.4	Confident	2 Å²	2	57.3 Å²	57.3	1%	0.014	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	155.7	177	-52.7	0	0	0	0	109.5	C573 M580 K581 T605	C573-C596 HydrophobicContact CB-CB 3.81Å; C573-C596 WeakPolarHBondContact CB-SG 3.28Å; C573-C596 WeakPolarHBondContact SG-CB 3.47Å; C573-C596 CovalentContact SG-SG 2.05Å; C573-C596 PolarHBondContact SG-SG 3.42Å; M580-C596 HydrophobicContact CB-CB 3.84Å; M580-C596 HydrophobicContact SD-CB 4.05Å; K581-C596 CarbonylContact O-C 3.53Å; K581-C596 WeakPolarHBondContact O-CA 3.33Å; C596-T605 PolarHBondContact N-O 3.31Å; C596-T605 PolarHBondContact O-N 3.19Å; C596-T605 VanDerWaalsContact O-N 3.13Å
597	R	86.2	Confident	83.9	Confident	85 Å²	85	51 Å²	51	32%	0.321	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144.6	173.2	66.9	-174.3	-175.4	93.8	-1.1	111.1	M580 K581 C583 S601 M603	M580-R597 WeakPolarHBondContact CB-O 3.5Å; K581-R597 HydrophobicContact CB-CG 4.38Å; K581-R597 PolarHBondContact N-O 3.05Å; K581-R597 PolarHBondContact O-N 3.37Å; C583-R597 HydrophobicContact CB-CG 4.17Å; R597-S601 WeakPolarHBondContact CD-O 3.26Å; R597-S601 PolarHBondContact NH1-O 3.5Å; R597-M603 WeakPolarHBondContact CB-O 3.04Å
598	P	86.7	Confident	84	Confident	53 Å²	53	48.2 Å²	48.2	34%	0.344	27%	0.269	S	S	.	.			trans	-54.8	145.9	166.4	-23.1	32.7	0	0	0	111.1	M580 N600 S601	M580-P598 HydrophobicContact CE-CG 4.42Å; P598-N600 PolarHBondContact O-N 2.55Å; P598-N600 VanDerWaalsContact O-N 3.12Å; P598-S601 PolarHBondContact O-N 2.75Å
599	V	76	Confident	84.3	Confident	87 Å²	87	53 Å²	53	53%	0.527	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-40.2	-178.9	-177.9	0	0	0	0	111.9	K581	K581-V599 HydrophobicContact CG-CG2 4.28Å
600	N	79.8	Confident	84	Confident	167 Å²	167	49.6 Å²	49.6	89%	0.893	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.1	19.6	-176.3	-59.9	-14.6	0	0	0	113.8	P598	P598-N600 PolarHBondContact O-N 2.55Å; P598-N600 VanDerWaalsContact O-N 3.12Å
601	S	77.9	Confident	83.3	Confident	39 Å²	39	53.1 Å²	53.1	27%	0.273	29%	0.287	S	S	.	.			trans	-134.1	143	-179.6	-169.9	0	0	0	0	112.4	R597 P598 M603	R597-S601 WeakPolarHBondContact CD-O 3.26Å; R597-S601 PolarHBondContact NH1-O 3.5Å; P598-S601 PolarHBondContact O-N 2.75Å; S601-M603 PolarHBondContact OG-N 3.02Å; S601-M603 VanDerWaalsContact OG-N 3.14Å
602	S	75	Confident	83.4	Confident	102 Å²	102	59.7 Å²	59.7	71%	0.713	32%	0.323	S	S	*	.			trans	-76.8	-22.3	166.6	50.4	0	0	0	0	112.7	C604	S602-C604 PolarHBondContact O-N 2.93Å
603	M	83	Confident	83.2	Confident	116 Å²	116	62.2 Å²	62.2	57%	0.571	33%	0.332	S	S	*	.			trans	-68.3	104	-171.3	-171.3	-177.3	67.4	0	0	111.3	R597 S601 T605	R597-M603 WeakPolarHBondContact CB-O 3.04Å; S601-M603 PolarHBondContact OG-N 3.02Å; S601-M603 VanDerWaalsContact OG-N 3.14Å; M603-T605 HydrophobicContact CE-CG2 3.98Å; M603-T605 HydrophobicContact CG-CG2 4.07Å; M603-T605 HydrophobicContact SD-CG2 4.32Å
604	C	83.1	Confident	82.6	Confident	18 Å²	18	71.1 Å²	71.1	12%	0.122	36%	0.364	C	S	.	.			trans	-85.2	127.3	175.3	-170.8	0	0	0	0	111.2	C583 I584 C595 S602	C583-C604 HydrophobicContact CB-CB 3.77Å; C583-C604 WeakPolarHBondContact CB-SG 2.94Å; C583-C604 WeakPolarHBondContact SG-CA 3.44Å; C583-C604 WeakPolarHBondContact SG-CB 3.21Å; C583-C604 CovalentContact SG-SG 2.02Å; C583-C604 PolarHBondContact SG-SG 3.07Å; I584-C604 PolarHBondContact O-SG 2.64Å; C595-C604 WeakPolarHBondContact CB-SG 3.28Å; S602-C604 PolarHBondContact O-N 2.93Å
605	T	88.9	Confident	82.4	Confident	21 Å²	21	75 Å²	75	13%	0.129	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	150.8	-179.5	60.6	0	0	0	0	112.3	C585 C595 C596 M603 F607	C585-T605 VanDerWaalsContact SG-C 3.51Å; C595-T605 CarbonylContact C-O 3.58Å; C595-T605 WeakPolarHBondContact CA-O 2.97Å; C595-T605 VanDerWaalsContact CB-O 3.27Å; C595-T605 WeakPolarHBondContact CB-O 3.44Å; C596-T605 PolarHBondContact N-O 3.31Å; C596-T605 PolarHBondContact O-N 3.19Å; C596-T605 VanDerWaalsContact O-N 3.13Å; M603-T605 HydrophobicContact CE-CG2 3.98Å; M603-T605 HydrophobicContact CG-CG2 4.07Å; M603-T605 HydrophobicContact SD-CG2 4.32Å; T605-F607 PolarHBondContact O-N 3.03Å
606	P	89.6	Confident	82.2	Confident	3 Å²	3	78 Å²	78	2%	0.019	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.9	133.4	173.9	-21.8	33.1	0	0	0	109.9	C585 L590 L593 S608 R609	C585-P606 WeakPolarHBondContact SG-CD 3.34Å; C585-P606 VanDerWaalsContact SG-N 3.35Å; L590-P606 HydrophobicContact CB-CG 4.18Å; L590-P606 HydrophobicContact CD1-CG 4.01Å; L590-P606 HydrophobicContact CD2-CG 4.32Å; L590-P606 HydrophobicContact CG-CG 4.4Å; L593-P606 HydrophobicContact CB-CB 4.41Å; L593-P606 HydrophobicContact CD1-CB 4.04Å; L593-P606 HydrophobicContact CD1-CG 4.21Å; P606-S608 PolarHBondContact O-N 3.42Å; P606-R609 WeakPolarHBondContact O-CB 3.43Å; P606-R609 PolarHBondContact O-N 2.84Å
607	F	86.4	Confident	82	Confident	12 Å²	12	82 Å²	82	5%	0.053	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-52.5	-31.7	179.4	176.1	-109.3	0	0	0	113.2	F572 I578 R594 T605 R609 L610 Y613	F572-F607 AromaticContact CE1-CD1 3.74Å; F572-F607 HydrophobicContact CE1-CD1 3.74Å; F572-F607 AromaticContact CE1-CD2 3.88Å; F572-F607 HydrophobicContact CE1-CD2 3.88Å; F572-F607 AromaticContact CE1-CE1 3.64Å; F572-F607 HydrophobicContact CE1-CE1 3.64Å; F572-F607 AromaticContact CE1-CE2 3.8Å; F572-F607 HydrophobicContact CE1-CE2 3.8Å; F572-F607 AromaticContact CE1-CG 3.83Å; F572-F607 HydrophobicContact CE1-CG 3.83Å; F572-F607 AromaticContact CE1-CZ 3.64Å; F572-F607 HydrophobicContact CE1-CZ 3.64Å; F572-F607 AromaticContact CZ-CD1 3.9Å; F572-F607 HydrophobicContact CZ-CD1 3.9Å; F572-F607 AromaticContact CZ-CE1 3.44Å; F572-F607 HydrophobicContact CZ-CE1 3.44Å; F572-F607 VanDerWaalsContact CZ-CE1 3.44Å; F572-F607 HydrophobicContact CZ-CE2 4.26Å; F572-F607 HydrophobicContact CZ-CG 4.44Å; F572-F607 AromaticContact CZ-CZ 3.62Å; F572-F607 HydrophobicContact CZ-CZ 3.62Å; I578-F607 HydrophobicContact CB-CE2 4.37Å; I578-F607 HydrophobicContact CD1-CD2 4.42Å; I578-F607 HydrophobicContact CD1-CE2 3.35Å; I578-F607 HydrophobicContact CD1-CZ 3.5Å; I578-F607 HydrophobicContact CG1-CE2 3.62Å; I578-F607 HydrophobicContact CG1-CZ 3.99Å; I578-F607 HydrophobicContact CG2-CD2 4.31Å; I578-F607 HydrophobicContact CG2-CE2 3.79Å; R594-F607 WeakPolarHBondContact O-CB 3.46Å; R594-F607 PolarHBondContact O-N 2.04Å; T605-F607 PolarHBondContact O-N 3.03Å; F607-R609 PolarHBondContact O-N 3.4Å; F607-L610 HydrophobicContact CD2-CD1 3.66Å; F607-L610 HydrophobicContact CE2-CD1 3.78Å; F607-L610 WeakPolarHBondContact O-CB 3.34Å; F607-L610 WeakPolarHBondContact O-CG 3.27Å; F607-L610 PolarHBondContact O-N 2.91Å; F607-L610 VanDerWaalsContact O-N 3.08Å; F607-Y613 HydrophobicContact CD1-CG 4.24Å; F607-Y613 VanDerWaalsContact CE1-CB 3.45Å; F607-Y613 AromaticContact CE1-CD1 3.41Å; F607-Y613 HydrophobicContact CE1-CD1 3.41Å; F607-Y613 VanDerWaalsContact CE1-CD1 3.41Å; F607-Y613 AromaticContact CE1-CD2 3.95Å; F607-Y613 HydrophobicContact CE1-CD2 3.95Å; F607-Y613 HydrophobicContact CE1-CE1 4.06Å; F607-Y613 AromaticContact CE1-CG 3.32Å; F607-Y613 HydrophobicContact CE1-CG 3.32Å; F607-Y613 HydrophobicContact CE2-CD1 4.38Å; F607-Y613 AromaticContact CE2-CD2 3.64Å; F607-Y613 HydrophobicContact CE2-CD2 3.64Å; F607-Y613 AromaticContact CE2-CE2 3.83Å; F607-Y613 HydrophobicContact CE2-CE2 3.83Å; F607-Y613 AromaticContact CE2-CG 3.92Å; F607-Y613 HydrophobicContact CE2-CG 3.92Å; F607-Y613 AromaticContact CZ-CD1 3.27Å; F607-Y613 HydrophobicContact CZ-CD1 3.27Å; F607-Y613 AromaticContact CZ-CD2 3.31Å; F607-Y613 HydrophobicContact CZ-CD2 3.31Å; F607-Y613 AromaticContact CZ-CE1 3.51Å; F607-Y613 HydrophobicContact CZ-CE1 3.51Å; F607-Y613 AromaticContact CZ-CE2 3.55Å; F607-Y613 HydrophobicContact CZ-CE2 3.55Å; F607-Y613 AromaticContact CZ-CG 3.15Å; F607-Y613 HydrophobicContact CZ-CG 3.15Å; F607-Y613 AromaticContact CZ-CZ 3.64Å
608	S	84.5	Confident	82.1	Confident	29 Å²	29	81.8 Å²	81.8	20%	0.203	44%	0.436	C	S	.	.	G	3₁₀ helix	trans	-68	6.5	176.3	61.8	0	0	0	0	115.7	P606 Y613	P606-S608 PolarHBondContact O-N 3.42Å; S608-Y613 CarbonylContact C-O 3.47Å; S608-Y613 WeakPolarHBondContact CA-O 3.14Å; S608-Y613 VanDerWaalsContact O-O 3.12Å
609	R	82.1	Confident	81.7	Confident	161 Å²	161	80.4 Å²	80.4	61%	0.608	43%	0.426	S	S	*	.	G	3₁₀ helix	trans	-98.1	-5.9	169.9	-63.8	-171.5	179.5	167.6	-1.2	113.2	P606 F607	P606-R609 WeakPolarHBondContact O-CB 3.43Å; P606-R609 PolarHBondContact O-N 2.84Å; F607-R609 PolarHBondContact O-N 3.4Å
610	L	79.2	Confident	81.5	Confident	33 Å²	33	79.7 Å²	79.7	17%	0.173	43%	0.429	C	S	.	.	S	Bend	trans	-78.9	145.8	177.8	-62	-177.6	0	0	0	110.8	I578 M580 F607 N612 Y613	I578-L610 HydrophobicContact CG2-CD1 4.17Å; M580-L610 HydrophobicContact CE-CD1 4.11Å; M580-L610 HydrophobicContact CE-CD2 3.59Å; M580-L610 HydrophobicContact SD-CD1 4.14Å; M580-L610 HydrophobicContact SD-CD2 4.22Å; F607-L610 HydrophobicContact CD2-CD1 3.66Å; F607-L610 HydrophobicContact CE2-CD1 3.78Å; F607-L610 WeakPolarHBondContact O-CB 3.34Å; F607-L610 WeakPolarHBondContact O-CG 3.27Å; F607-L610 PolarHBondContact O-N 2.91Å; F607-L610 VanDerWaalsContact O-N 3.08Å; L610-N612 PolarHBondContact O-N 2.79Å; L610-Y613 HydrophobicContact CB-CD2 3.94Å; L610-Y613 HydrophobicContact CD1-CD2 4.43Å; L610-Y613 PolarHBondContact O-N 2.9Å; L610-Y613 VanDerWaalsContact O-O 3.12Å
611	P	73.9	Confident	80.9	Confident	113 Å²	113	74.2 Å²	74.2	73%	0.734	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	-32.6	-167.9	-29.7	36	0	0	0	116.1
612	N	79.3	Confident	79.3	Confident	140 Å²	140	73 Å²	73	75%	0.749	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-6.4	-176.1	-64.4	-16.8	0	0	0	113.9	L610	L610-N612 PolarHBondContact O-N 2.79Å
613	Y	79.9	Confident	78.6	Confident	54 Å²	54	70.5 Å²	70.5	21%	0.212	37%	0.374	C	S	.	.			trans	-129.5	106	-171.6	-52.4	-80.3	0	0	0	109.7	D577 I578 F607 S608 L610	D577-Y613 PolarHBondContact O-OH 3.12Å; D577-Y613 PolarHBondContact OD2-OH 3.48Å; I578-Y613 HydrophobicContact CG1-CE2 4.06Å; F607-Y613 HydrophobicContact CD1-CG 4.24Å; F607-Y613 VanDerWaalsContact CE1-CB 3.45Å; F607-Y613 AromaticContact CE1-CD1 3.41Å; F607-Y613 HydrophobicContact CE1-CD1 3.41Å; F607-Y613 VanDerWaalsContact CE1-CD1 3.41Å; F607-Y613 AromaticContact CE1-CD2 3.95Å; F607-Y613 HydrophobicContact CE1-CD2 3.95Å; F607-Y613 HydrophobicContact CE1-CE1 4.06Å; F607-Y613 AromaticContact CE1-CG 3.32Å; F607-Y613 HydrophobicContact CE1-CG 3.32Å; F607-Y613 HydrophobicContact CE2-CD1 4.38Å; F607-Y613 AromaticContact CE2-CD2 3.64Å; F607-Y613 HydrophobicContact CE2-CD2 3.64Å; F607-Y613 AromaticContact CE2-CE2 3.83Å; F607-Y613 HydrophobicContact CE2-CE2 3.83Å; F607-Y613 AromaticContact CE2-CG 3.92Å; F607-Y613 HydrophobicContact CE2-CG 3.92Å; F607-Y613 AromaticContact CZ-CD1 3.27Å; F607-Y613 HydrophobicContact CZ-CD1 3.27Å; F607-Y613 AromaticContact CZ-CD2 3.31Å; F607-Y613 HydrophobicContact CZ-CD2 3.31Å; F607-Y613 AromaticContact CZ-CE1 3.51Å; F607-Y613 HydrophobicContact CZ-CE1 3.51Å; F607-Y613 AromaticContact CZ-CE2 3.55Å; F607-Y613 HydrophobicContact CZ-CE2 3.55Å; F607-Y613 AromaticContact CZ-CG 3.15Å; F607-Y613 HydrophobicContact CZ-CG 3.15Å; F607-Y613 AromaticContact CZ-CZ 3.64Å; S608-Y613 CarbonylContact C-O 3.47Å; S608-Y613 WeakPolarHBondContact CA-O 3.14Å; S608-Y613 VanDerWaalsContact O-O 3.12Å; L610-Y613 HydrophobicContact CB-CD2 3.94Å; L610-Y613 HydrophobicContact CD1-CD2 4.43Å; L610-Y613 PolarHBondContact O-N 2.9Å; L610-Y613 VanDerWaalsContact O-O 3.12Å
614	R	79.2	Confident	77.2	Confident	215 Å²	215	68.6 Å²	68.6	81%	0.811	36%	0.36	S	S	*	.			trans	-106.9	-11.2	-175.3	-57.2	-172.7	-170	-176	4.7	114.4	P616	R614-P616 WeakPolarHBondContact O-CD 3.43Å
615	V	82.7	Confident	76.8	Confident	120 Å²	120	68 Å²	68	73%	0.727	36%	0.356	S	S	*	.	S	Bend	trans	-93.9	118.8	-177.8	-176.6	0	0	0	0	109.3	K617	V615-K617 PolarHBondContact O-N 3.14Å
616	P	83.9	Confident	75.9	Confident	67 Å²	67	70.2 Å²	70.2	44%	0.435	37%	0.366	S	S	.	.			trans	-62.7	121.6	172.1	-20.3	33.1	0	0	0	110.6	L593 R614	L593-P616 HydrophobicContact CD1-CB 4.27Å; L593-P616 HydrophobicContact CD2-CB 3.89Å; R614-P616 WeakPolarHBondContact O-CD 3.43Å
617	K	85.8	Confident	74.7	Confident	88 Å²	88	74.3 Å²	74.3	38%	0.383	39%	0.385	S	S	.	.			trans	-89.8	105.7	172.5	-170	173.6	-179.2	-175.3	0	108.5	F572 L593 R594 V615	F572-K617 HydrophobicContact CE2-CD 4.41Å; F572-K617 HydrophobicContact CZ-CD 4.47Å; L593-K617 CarbonylContact C-O 3.57Å; L593-K617 WeakPolarHBondContact CA-O 3.39Å; R594-K617 HydrophobicContact CB-CB 4.23Å; R594-K617 PolarHBondContact N-O 3.34Å; V615-K617 PolarHBondContact O-N 3.14Å
618	V	86.9	Confident	73.5	Confident	80 Å²	80	74 Å²	74	49%	0.485	39%	0.386	S	S	.	.	B	Isolated β-bridge	trans	-68.2	138.1	175.3	-175.7	0	0	0	0	109	L593 G633	L593-V618 HydrophobicContact CD2-CG2 4.07Å; V618-G633 VanDerWaalsContact CG1-CA 3.45Å
619	L	79	Confident	72.2	Confident	23 Å²	23	74.6 Å²	74.6	12%	0.12	38%	0.384	C	S	.	.	P	Polyproline II helix	trans	-74.3	148.9	174.5	-62.4	175.3	0	0	0	110	C592 R594 T623	C592-L619 PolarHBondContact O-N 3.22Å; R594-L619 HydrophobicContact CB-CD2 3.98Å; L619-T623 HydrophobicContact CB-CG2 3.98Å; L619-T623 HydrophobicContact CD1-CG2 3.82Å; L619-T623 HydrophobicContact CD2-CG2 4.5Å; L619-T623 HydrophobicContact CG-CG2 4.31Å
620	A	71.6	Confident	71.2	Confident	72 Å²	72	66.9 Å²	66.9	60%	0.595	36%	0.355	S	S	*	.	P	Polyproline II helix	trans	-60.1	148.5	179.3	0	0	0	0	0	111.5	G622 T623	A620-G622 PolarHBondContact O-N 2.88Å; A620-T623 PolarHBondContact N-OG1 2.82Å; A620-T623 VanDerWaalsContact O-CB 3.26Å; A620-T623 WeakPolarHBondContact O-CB 3.47Å; A620-T623 PolarHBondContact O-N 3.13Å; A620-T623 PolarHBondContact O-OG1 3.1Å
621	D	66.7	Low	70.9	Confident	53 Å²	53	67 Å²	67	28%	0.283	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	135.8	175.5	-81.4	-1.6	0	0	0	110.5	C630 V631 D632	D621-C630 WeakPolarHBondContact CA-O 3.36Å; D621-V631 VanDerWaalsContact OD1-CA 3.32Å; D621-V631 WeakPolarHBondContact OD1-CA 3.21Å; D621-D632 PolarHBondContact OD1-N 3.22Å
622	G	45.3	Very low	71.5	Confident	13 Å²	13	66.9 Å²	66.9	13%	0.134	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	85	-3.3	-170.3	0	0	0	0	0	115.3	S136 A620 C630	S136-G622 WeakPolarHBondContact CB-O 3.4Å; S136-G622 PolarHBondContact OG-O 2.85Å; A620-G622 PolarHBondContact O-N 2.88Å; G622-C630 PolarHBondContact N-O 3.43Å
623	T	60	Low	71.6	Confident	49 Å²	49	61.1 Å²	61.1	30%	0.301	32%	0.324	S	S	.	.			trans	-67.1	142.2	170.8	-51.1	0	0	0	0	110.4	L619 A620 Y629 C630	L619-T623 HydrophobicContact CB-CG2 3.98Å; L619-T623 HydrophobicContact CD1-CG2 3.82Å; L619-T623 HydrophobicContact CD2-CG2 4.5Å; L619-T623 HydrophobicContact CG-CG2 4.31Å; A620-T623 PolarHBondContact N-OG1 2.82Å; A620-T623 VanDerWaalsContact O-CB 3.26Å; A620-T623 WeakPolarHBondContact O-CB 3.47Å; A620-T623 PolarHBondContact O-N 3.13Å; A620-T623 PolarHBondContact O-OG1 3.1Å; T623-Y629 WeakPolarHBondContact O-CA 3.5Å; T623-C630 PolarHBondContact O-N 2.87Å; T623-C630 PolarHBondContact O-SG 3.25Å; T623-C630 VanDerWaalsContact O-SG 3.4Å
624	R	53.6	Low	71.9	Confident	77 Å²	77	64.8 Å²	64.8	29%	0.291	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	145	175.7	-75.1	-142	-149.1	-114.7	20.5	112.2	F135 G628	F135-R624 HydrophobicContact CD1-CG 3.86Å; F135-R624 HydrophobicContact CE1-CG 4.05Å; F135-R624 PolarHBondContact O-NE 2.81Å; F135-R624 PolarHBondContact O-NH1 2.98Å; F135-R624 PolarHBondContact O-NH2 3.13Å; R624-G628 WeakPolarHBondContact CA-O 3.37Å
625	C	73.8	Confident	71.6	Confident	6 Å²	6	55 Å²	55	4%	0.041	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	178.4	172.4	68.9	0	0	0	0	109.7	S591 H627 G628 Y629 C635	S591-C625 WeakPolarHBondContact O-CB 3Å; S591-C625 WeakPolarHBondContact OG-CB 3.34Å; C625-H627 VanDerWaalsContact C-N 3.28Å; C625-H627 PolarHBondContact O-N 2.92Å; C625-H627 VanDerWaalsContact O-N 3.12Å; C625-G628 PolarHBondContact N-O 3.29Å; C625-G628 PolarHBondContact O-N 2.97Å; C625-G628 PolarHBondContact SG-O 3.4Å; C625-Y629 VanDerWaalsContact SG-C 3.54Å; C625-Y629 PolarHBondContact SG-N 3.39Å; C625-C635 HydrophobicContact CB-CB 3.61Å; C625-C635 WeakPolarHBondContact CB-SG 3.29Å; C625-C635 WeakPolarHBondContact SG-CA 3.23Å; C625-C635 WeakPolarHBondContact SG-CB 3.36Å; C625-C635 CovalentContact SG-SG 2.02Å; C625-C635 PolarHBondContact SG-SG 3Å
626	I	70.1	Confident	70.9	Confident	66 Å²	66	54.3 Å²	54.3	34%	0.338	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-36	-167.6	-176.9	174.6	0	0	0	114.6	I584 E586 Q588	I584-I626 HydrophobicContact CG2-CB 4.36Å; E586-I626 WeakPolarHBondContact O-CD1 2.97Å; Q588-I626 HydrophobicContact CB-CG2 4.12Å; Q588-I626 HydrophobicContact CG-CG2 4.45Å
627	H	64.1	Low	69.4	Low	90 Å²	90	57.1 Å²	57.1	42%	0.417	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	16.2	-176	-62.2	131.4	0	0	0	113.1	C625 K637 E638	C625-H627 VanDerWaalsContact C-N 3.28Å; C625-H627 PolarHBondContact O-N 2.92Å; C625-H627 VanDerWaalsContact O-N 3.12Å; H627-K637 HydrophobicContact CB-CD 4.45Å; H627-K637 HydrophobicContact CB-CG 3.96Å; H627-K637 CarbonylContact O-C 3.52Å; H627-K637 VanDerWaalsContact O-CA 3.24Å; H627-K637 WeakPolarHBondContact O-CA 3.33Å; H627-E638 PolarHBondContact O-N 3.3Å
628	G	61.5	Low	67.5	Low	6 Å²	6	55.7 Å²	55.7	6%	0.062	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	158.1	-123.6	-177.5	0	0	0	0	0	113	R624 C625 K636	R624-G628 WeakPolarHBondContact CA-O 3.37Å; C625-G628 PolarHBondContact N-O 3.29Å; C625-G628 PolarHBondContact O-N 2.97Å; C625-G628 PolarHBondContact SG-O 3.4Å; G628-K636 WeakPolarHBondContact CA-O 3.46Å
629	Y	58.2	Low	65.2	Low	40 Å²	40	56.5 Å²	56.5	16%	0.157	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	154.9	-174.7	63.2	-79	0	0	0	113.7	T623 C625 V631 K636 E638	T623-Y629 WeakPolarHBondContact O-CA 3.5Å; C625-Y629 VanDerWaalsContact SG-C 3.54Å; C625-Y629 PolarHBondContact SG-N 3.39Å; Y629-V631 HydrophobicContact CD2-CG2 3.62Å; Y629-V631 HydrophobicContact CE2-CG2 3.4Å; Y629-V631 VanDerWaalsContact CE2-CG2 3.4Å; Y629-K636 HydrophobicContact CE1-CB 4.46Å; Y629-K636 PolarHBondContact N-O 3.27Å; Y629-K636 PolarHBondContact O-N 2.94Å; Y629-E638 HydrophobicContact CD1-CG 3.9Å; Y629-E638 HydrophobicContact CE1-CG 4.09Å
630	C	61.3	Low	62.8	Low	0 Å²	0	59.7 Å²	59.7	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	132.7	178.4	-61.8	0	0	0	0	112.1	C592 D621 G622 T623 K634	C592-C630 WeakPolarHBondContact CA-SG 3.33Å; C592-C630 HydrophobicContact CB-CB 3.87Å; C592-C630 WeakPolarHBondContact CB-SG 3.27Å; C592-C630 WeakPolarHBondContact SG-CA 3.4Å; C592-C630 WeakPolarHBondContact SG-CB 3.24Å; C592-C630 CovalentContact SG-SG 2.04Å; C592-C630 PolarHBondContact SG-SG 3.33Å; D621-C630 WeakPolarHBondContact CA-O 3.36Å; G622-C630 PolarHBondContact N-O 3.43Å; T623-C630 PolarHBondContact O-N 2.87Å; T623-C630 PolarHBondContact O-SG 3.25Å; T623-C630 VanDerWaalsContact O-SG 3.4Å; C630-K634 WeakPolarHBondContact CA-O 3.49Å
631	V	73.2	Confident	60.7	Low	34 Å²	34	61 Å²	61	21%	0.206	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	126.1	166	-178.4	0	0	0	0	107.9	D621 Y629 G633 K634 K636	D621-V631 VanDerWaalsContact OD1-CA 3.32Å; D621-V631 WeakPolarHBondContact OD1-CA 3.21Å; Y629-V631 HydrophobicContact CD2-CG2 3.62Å; Y629-V631 HydrophobicContact CE2-CG2 3.4Å; Y629-V631 VanDerWaalsContact CE2-CG2 3.4Å; V631-G633 PolarHBondContact O-N 2.76Å; V631-K634 PolarHBondContact N-O 3.13Å; V631-K634 PolarHBondContact O-N 2.88Å; V631-K636 HydrophobicContact CB-CD 3.98Å; V631-K636 HydrophobicContact CB-CG 4.36Å; V631-K636 HydrophobicContact CG2-CD 3.84Å; V631-K636 HydrophobicContact CG2-CG 4.38Å
632	D	84.6	Confident	58.9	Low	111 Å²	111	63.9 Å²	63.9	59%	0.594	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	44.3	-178.5	-179.8	49.7	0	0	0	111.6	D621 K634	D621-D632 PolarHBondContact OD1-N 3.22Å; D632-K634 PolarHBondContact O-N 2.89Å; D632-K634 IonicContact OD2-NZ 2.7Å; D632-K634 PolarHBondContact OD2-NZ 3Å
633	G	82.2	Confident	58.2	Low	20 Å²	20	67.8 Å²	67.8	21%	0.206	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	63.2	8.9	-177.5	0	0	0	0	0	116.1	C592 V618 V631	C592-G633 VanDerWaalsContact CB-O 3.23Å; C592-G633 WeakPolarHBondContact CB-O 3.08Å; V618-G633 VanDerWaalsContact CG1-CA 3.45Å; V631-G633 PolarHBondContact O-N 2.76Å
634	K	85.7	Confident	56.9	Low	130 Å²	130	65.7 Å²	65.7	57%	0.565	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.3	134.4	179.7	-66.1	160.6	-168.5	136.6	0	110.4	C592 C630 V631 D632 K636	C592-K634 VanDerWaalsContact SG-C 3.58Å; C630-K634 WeakPolarHBondContact CA-O 3.49Å; V631-K634 PolarHBondContact N-O 3.13Å; V631-K634 PolarHBondContact O-N 2.88Å; D632-K634 PolarHBondContact O-N 2.89Å; D632-K634 IonicContact OD2-NZ 2.7Å; D632-K634 PolarHBondContact OD2-NZ 3Å; K634-K636 PolarHBondContact O-N 2.81Å; K634-K636 VanDerWaalsContact O-N 3.17Å
635	C	73.7	Confident	55.9	Low	10 Å²	10	67.4 Å²	67.4	7%	0.068	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	102.1	176	-178.3	0	0	0	0	110.3	Q588 S591 C592 C625	Q588-C635 HydrophobicContact CG-CB 3.73Å; Q588-C635 PolarHBondContact NE2-O 3.28Å; Q588-C635 VanDerWaalsContact O-CB 3.28Å; Q588-C635 WeakPolarHBondContact O-CB 3.13Å; S591-C635 WeakPolarHBondContact OG-CB 3.35Å; S591-C635 PolarHBondContact OG-SG 2.65Å; S591-C635 VanDerWaalsContact OG-SG 3.4Å; C592-C635 VanDerWaalsContact SG-CA 3.56Å; C592-C635 PolarHBondContact SG-N 3.44Å; C592-C635 VanDerWaalsContact SG-N 3.42Å; C625-C635 HydrophobicContact CB-CB 3.61Å; C625-C635 WeakPolarHBondContact CB-SG 3.29Å; C625-C635 WeakPolarHBondContact SG-CA 3.23Å; C625-C635 WeakPolarHBondContact SG-CB 3.36Å; C625-C635 CovalentContact SG-SG 2.02Å; C625-C635 PolarHBondContact SG-SG 3Å
636	K	67.5	Low	54.3	Low	106 Å²	106	71.9 Å²	71.9	46%	0.461	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77	131.7	171.8	-69.7	-168.4	176.3	178.1	0	108.7	G628 Y629 V631 K634	G628-K636 WeakPolarHBondContact CA-O 3.46Å; Y629-K636 HydrophobicContact CE1-CB 4.46Å; Y629-K636 PolarHBondContact N-O 3.27Å; Y629-K636 PolarHBondContact O-N 2.94Å; V631-K636 HydrophobicContact CB-CD 3.98Å; V631-K636 HydrophobicContact CB-CG 4.36Å; V631-K636 HydrophobicContact CG2-CD 3.84Å; V631-K636 HydrophobicContact CG2-CG 4.38Å; K634-K636 PolarHBondContact O-N 2.81Å; K634-K636 VanDerWaalsContact O-N 3.17Å
637	K	53	Low	52.8	Low	125 Å²	125	74.5 Å²	74.5	54%	0.543	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	134.3	178	-64.1	-165.3	175.2	-173.7	0	110.2	H627	H627-K637 HydrophobicContact CB-CD 4.45Å; H627-K637 HydrophobicContact CB-CG 3.96Å; H627-K637 CarbonylContact O-C 3.52Å; H627-K637 VanDerWaalsContact O-CA 3.24Å; H627-K637 WeakPolarHBondContact O-CA 3.33Å
638	E	45.2	Very low	51.9	Low	59 Å²	59	72.7 Å²	72.7	28%	0.276	36%	0.364	S	S	.	.	P	Polyproline II helix	trans	-79.8	122.2	160.3	-67.3	-179.7	136.1	0	0	107.3	Y416 H627 Y629	Y416-E638 WeakPolarHBondContact OH-CA 3.49Å; H627-E638 PolarHBondContact O-N 3.3Å; Y629-E638 HydrophobicContact CD1-CG 3.9Å; Y629-E638 HydrophobicContact CE1-CG 4.09Å
639	V	39.5	Very low	51	Low	97 Å²	97	78.5 Å²	78.5	59%	0.588	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-81.4	136.3	-175.3	178.8	0	0	0	0	109.4	I400	I400-V639 WeakPolarHBondContact CG2-O 3.18Å
640	Q	28.2	Very low	50.4	Low	89 Å²	89	80.2 Å²	80.2	42%	0.416	40%	0.403	S	S	.	.			trans	-132.9	107.5	-170.4	-82.1	-150.3	-30.5	0	0	106.9	I400 A401	I400-Q640 VanDerWaalsContact C-CB 3.44Å; I400-Q640 WeakPolarHBondContact O-CA 3.34Å; I400-Q640 WeakPolarHBondContact O-CB 3.44Å; I400-Q640 VanDerWaalsContact O-CD 3.22Å; I400-Q640 WeakPolarHBondContact O-CG 3.15Å; A401-Q640 VanDerWaalsContact CA-CB 3.47Å; A401-Q640 WeakPolarHBondContact CA-O 3.46Å; A401-Q640 WeakPolarHBondContact CB-O 3.11Å; A401-Q640 PolarHBondContact N-O 3.31Å; A401-Q640 PolarHBondContact O-OE1 3.48Å
641	D	27.5	Very low	49.7	Very low	100 Å²	100	86.7 Å²	86.7	54%	0.535	44%	0.438	S	S	.	.			trans	-137.1	149.5	179.1	-124.5	-35.3	0	0	0	123.1	P399 I400	P399-D641 CarbonylContact C-O 3.5Å; I400-D641 VanDerWaalsContact CA-O 3.24Å; I400-D641 WeakPolarHBondContact CA-O 3.46Å; I400-D641 WeakPolarHBondContact CB-O 3.47Å; I400-D641 VanDerWaalsContact CG1-O 3.25Å; I400-D641 WeakPolarHBondContact CG1-O 3.37Å; I400-D641 PolarHBondContact N-O 3.36Å
642	L	28.3	Very low	48.4	Very low	114 Å²	114	93.1 Å²	93.1	60%	0.597	46%	0.463	S	S	*	.			trans	-53	152.9	-173.7	-92.5	80.7	0	0	0	117.7	P399 A401	P399-L642 HydrophobicContact CB-CB 4.35Å; P399-L642 HydrophobicContact CB-CD1 3.72Å; P399-L642 HydrophobicContact CB-CG 3.79Å; P399-L642 HydrophobicContact CG-CD1 3.93Å; P399-L642 HydrophobicContact CG-CG 3.85Å; A401-L642 HydrophobicContact CB-CD1 4.03Å
643	V	31.5	Very low	46.5	Very low	94 Å²	94	93 Å²	93	57%	0.57	46%	0.462	S	S	*	.				-167.4	133.3	74.4	161.4	0	0	0	0	112.4
644	E	32.2	Very low	45	Very low	5 Å²	5	96.4 Å²	96.4	2%	0.023	48%	0.476	C	S	.	.			trans	-155.4	58.8	-178	-153.9	-144	157	0	0	115	V392 S393 K394 E395 C396 S397 P398	V392-E644 VanDerWaalsContact C-C 3.48Å; V392-E644 CarbonylContact C-O 3.45Å; S393-E644 VanDerWaalsContact C-OE1 3.24Å; S393-E644 WeakPolarHBondContact CA-OE1 3.49Å; S393-E644 PolarHBondContact N-O 2.9Å; S393-E644 VanDerWaalsContact N-O 3.13Å; S393-E644 PolarHBondContact N-OE1 3.15Å; K394-E644 VanDerWaalsContact CA-O 3.3Å; K394-E644 WeakPolarHBondContact CA-O 3.5Å; K394-E644 WeakPolarHBondContact CA-OE2 3.42Å; K394-E644 PolarHBondContact N-O 3.47Å; K394-E644 PolarHBondContact N-OE1 2.82Å; K394-E644 PolarHBondContact N-OE2 3.43Å; K394-E644 VanDerWaalsContact N-OE2 3.16Å; E395-E644 PolarHBondContact N-OE2 2.82Å; C396-E644 WeakPolarHBondContact CA-OE1 3.09Å; C396-E644 PolarHBondContact N-OE1 2.89Å; C396-E644 PolarHBondContact N-OE2 3.28Å; S397-E644 VanDerWaalsContact C-CG 3.49Å; S397-E644 VanDerWaalsContact CA-CD 3.42Å; S397-E644 PolarHBondContact N-OE1 2.93Å; S397-E644 PolarHBondContact N-OE2 2.73Å; S397-E644 VanDerWaalsContact O-CB 3.26Å; S397-E644 WeakPolarHBondContact O-CB 3.22Å; S397-E644 WeakPolarHBondContact O-CG 3.41Å; S397-E644 VanDerWaalsContact OG-CD 3.24Å; S397-E644 WeakPolarHBondContact OG-CG 3.45Å; S397-E644 PolarHBondContact OG-OE1 2.82Å; S397-E644 VanDerWaalsContact OG-OE1 3.08Å; P398-E644 WeakPolarHBondContact CA-OE2 3.42Å
645	H	32.8	Very low	43.6	Very low	113 Å²	113	96.5 Å²	96.5	52%	0.523	48%	0.48	S	S	.	.	B	Isolated β-bridge	trans	-154.9	81.4	172.7	-137.2	0.2	0	0	0	117.9	V392 S393	V392-H645 CarbonylContact O-C 3.52Å; V392-H645 WeakPolarHBondContact O-CA 3.39Å; S393-H645 VanDerWaalsContact CB-ND1 3.28Å; S393-H645 WeakPolarHBondContact CB-ND1 3.26Å; S393-H645 PolarHBondContact OG-CE1 3Å; S393-H645 PolarHBondContact OG-ND1 2.86Å
646	I	41	Very low	42.9	Very low	101 Å²	101	100.5 Å²	100.5	52%	0.518	50%	0.5	S	S	.	.	S	Bend	trans	-145.3	-49.9	176	-60.8	-173.4	0	0	0	114.7	V392	V392-I646 HydrophobicContact CB-CB 4.47Å; V392-I646 HydrophobicContact CG1-CB 4.03Å; V392-I646 HydrophobicContact CG1-CG1 4.23Å; V392-I646 PolarHBondContact O-N 3.24Å
647	W	37.1	Very low	42.6	Very low	120 Å²	120	97.8 Å²	97.8	46%	0.455	50%	0.497	S	S	.	.	G	3₁₀ helix	trans	-82.7	-23.8	-160.1	-69.2	106.3	0	0	0	117.2	V392 I649 I650 D651	V392-W647 PolarHBondContact O-N 3.4Å; W647-I649 PolarHBondContact O-N 2.97Å; W647-I650 HydrophobicContact CE3-CB 4.06Å; W647-I650 HydrophobicContact CE3-CD1 3.73Å; W647-I650 HydrophobicContact CE3-CG1 4.4Å; W647-I650 HydrophobicContact CE3-CG2 4.28Å; W647-I650 HydrophobicContact CH2-CD1 4.36Å; W647-I650 HydrophobicContact CZ3-CB 4.37Å; W647-I650 HydrophobicContact CZ3-CD1 3.6Å; W647-I650 HydrophobicContact CZ3-CG2 4.17Å; W647-I650 PolarHBondContact O-N 2.88Å; W647-D651 PolarHBondContact O-N 3.43Å
648	D	46.1	Very low	43.1	Very low	53 Å²	53	94.4 Å²	94.4	28%	0.283	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-62.1	-5.5	177.1	-94.5	-35.6	0	0	0	115.4	P391 S393	P391-D648 WeakPolarHBondContact CB-OD2 3.18Å; P391-D648 WeakPolarHBondContact CG-OD2 3.06Å; S393-D648 WeakPolarHBondContact CA-OD2 3.23Å; S393-D648 WeakPolarHBondContact CB-OD2 3.48Å; S393-D648 WeakPolarHBondContact OG-CB 3.34Å; S393-D648 PolarHBondContact OG-OD2 3.02Å
649	I	42.8	Very low	43.9	Very low	127 Å²	127	96.5 Å²	96.5	65%	0.651	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-97.8	-26.7	176.8	-61.4	175.6	0	0	0	111	W647	W647-I649 PolarHBondContact O-N 2.97Å
650	I	45.1	Very low	45.5	Very low	76 Å²	76	98.5 Å²	98.5	39%	0.39	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-37.6	-175.4	-62.4	175.4	0	0	0	110.9	W647 K652 L653	W647-I650 HydrophobicContact CE3-CB 4.06Å; W647-I650 HydrophobicContact CE3-CD1 3.73Å; W647-I650 HydrophobicContact CE3-CG1 4.4Å; W647-I650 HydrophobicContact CE3-CG2 4.28Å; W647-I650 HydrophobicContact CH2-CD1 4.36Å; W647-I650 HydrophobicContact CZ3-CB 4.37Å; W647-I650 HydrophobicContact CZ3-CD1 3.6Å; W647-I650 HydrophobicContact CZ3-CG2 4.17Å; W647-I650 PolarHBondContact O-N 2.88Å; I650-K652 PolarHBondContact O-N 3.17Å; I650-L653 WeakPolarHBondContact O-CB 3.22Å; I650-L653 PolarHBondContact O-N 2.98Å
651	D	46.2	Very low	47.8	Very low	137 Å²	137	99.8 Å²	99.8	73%	0.733	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-1.6	177.1	-71.1	-28.3	0	0	0	114.2	W647	W647-D651 PolarHBondContact O-N 3.43Å
652	K	47.1	Very low	50	Low	169 Å²	169	98 Å²	98	74%	0.735	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.5	-0.6	168.8	-72.8	175.2	-177.6	152.9	0	113.8	I650 D654	I650-K652 PolarHBondContact O-N 3.17Å; K652-D654 PolarHBondContact O-N 2.85Å
653	L	44.7	Very low	52.3	Low	107 Å²	107	100.5 Å²	100.5	56%	0.56	50%	0.498	S	S	*	.	S	Bend	trans	-93.6	89.4	174.5	-73.9	163.6	0	0	0	109.9	I650 M655 I658	I650-L653 WeakPolarHBondContact O-CB 3.22Å; I650-L653 PolarHBondContact O-N 2.98Å; L653-M655 PolarHBondContact O-N 3.3Å; L653-I658 HydrophobicContact CB-CD1 3.87Å; L653-I658 HydrophobicContact CD2-CD1 4.06Å
654	D	50.2	Low	54.7	Low	93 Å²	93	101.7 Å²	101.7	50%	0.497	50%	0.501	S	S	.	.			trans	-59.4	101.8	173.2	173.3	6	0	0	0	110.2	K652 N656 A657 I658	K652-D654 PolarHBondContact O-N 2.85Å; D654-N656 PolarHBondContact O-N 3.48Å; D654-N656 VanDerWaalsContact O-N 3.13Å; D654-N656 WeakPolarHBondContact OD1-CA 3.4Å; D654-N656 WeakPolarHBondContact OD1-CB 3.17Å; D654-N656 PolarHBondContact OD1-N 3.44Å; D654-A657 HydrophobicContact CB-CB 3.81Å; D654-A657 VanDerWaalsContact CG-N 3.34Å; D654-A657 CarbonylContact O-C 3.57Å; D654-A657 WeakPolarHBondContact O-CA 3.41Å; D654-A657 WeakPolarHBondContact O-CB 3.5Å; D654-A657 PolarHBondContact O-N 2.98Å; D654-A657 PolarHBondContact OD1-N 3Å; D654-A657 WeakPolarHBondContact OD2-CB 3.25Å; D654-A657 PolarHBondContact OD2-N 3.03Å; D654-I658 WeakPolarHBondContact O-CG1 3.27Å; D654-I658 PolarHBondContact O-N 1.93Å
655	M	56.2	Low	57.3	Low	132 Å²	132	104.5 Å²	104.5	65%	0.65	52%	0.516	S	S	*	.	H	α-helix	trans	-56.1	-26.9	178.9	-86.3	-71.8	-70	0	0	113.3	L653 I658 L659	L653-M655 PolarHBondContact O-N 3.3Å; M655-I658 HydrophobicContact SD-CD1 4.47Å; M655-L659 WeakPolarHBondContact O-CB 3.41Å; M655-L659 PolarHBondContact O-N 3.36Å
656	N	58.1	Low	59.9	Low	93 Å²	93	104.3 Å²	104.3	50%	0.497	52%	0.518	S	S	.	.	H	α-helix	trans	-81.3	-35.5	175.8	-65.2	-56.9	0	0	0	111.8	T187 D654 I658 L659 K660	T187-N656 HydrophobicContact CG2-CB 4.15Å; D654-N656 PolarHBondContact O-N 3.48Å; D654-N656 VanDerWaalsContact O-N 3.13Å; D654-N656 WeakPolarHBondContact OD1-CA 3.4Å; D654-N656 WeakPolarHBondContact OD1-CB 3.17Å; D654-N656 PolarHBondContact OD1-N 3.44Å; N656-I658 VanDerWaalsContact C-N 3.32Å; N656-L659 PolarHBondContact O-N 2.87Å; N656-K660 VanDerWaalsContact O-CB 3.23Å; N656-K660 WeakPolarHBondContact O-CB 3.36Å; N656-K660 PolarHBondContact O-N 2.92Å
657	A	62.1	Low	62	Low	49 Å²	49	105.1 Å²	105.1	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-39	167.2	0	0	0	0	0	111.3	D654 K660 F661	D654-A657 HydrophobicContact CB-CB 3.81Å; D654-A657 VanDerWaalsContact CG-N 3.34Å; D654-A657 CarbonylContact O-C 3.57Å; D654-A657 WeakPolarHBondContact O-CA 3.41Å; D654-A657 WeakPolarHBondContact O-CB 3.5Å; D654-A657 PolarHBondContact O-N 2.98Å; D654-A657 PolarHBondContact OD1-N 3Å; D654-A657 WeakPolarHBondContact OD2-CB 3.25Å; D654-A657 PolarHBondContact OD2-N 3.03Å; A657-K660 PolarHBondContact O-N 3.3Å; A657-F661 VanDerWaalsContact O-CB 3.23Å; A657-F661 WeakPolarHBondContact O-CB 3.47Å; A657-F661 PolarHBondContact O-N 3.49Å
658	I	64	Low	64.2	Low	55 Å²	55	102.6 Å²	102.6	28%	0.282	53%	0.528	S	S	.	.	H	α-helix	trans	-63.4	-49.5	172.5	-65.9	166.9	0	0	0	109.9	L653 D654 M655 N656 K660 F661 M662	L653-I658 HydrophobicContact CB-CD1 3.87Å; L653-I658 HydrophobicContact CD2-CD1 4.06Å; D654-I658 WeakPolarHBondContact O-CG1 3.27Å; D654-I658 PolarHBondContact O-N 1.93Å; M655-I658 HydrophobicContact SD-CD1 4.47Å; N656-I658 VanDerWaalsContact C-N 3.32Å; I658-K660 VanDerWaalsContact C-N 3.27Å; I658-K660 PolarHBondContact O-N 3.24Å; I658-F661 PolarHBondContact O-N 3.46Å; I658-M662 HydrophobicContact CG2-CE 4.2Å; I658-M662 HydrophobicContact CG2-CG 4.2Å; I658-M662 HydrophobicContact CG2-SD 4.35Å; I658-M662 WeakPolarHBondContact O-CB 3.49Å; I658-M662 VanDerWaalsContact O-CG 3.25Å; I658-M662 WeakPolarHBondContact O-CG 3.32Å; I658-M662 PolarHBondContact O-N 3.14Å
659	L	62	Low	66	Low	102 Å²	102	100.9 Å²	100.9	53%	0.534	52%	0.519	S	S	.	.	H	α-helix	trans	-60.7	-37	178.4	-139.1	90.8	0	0	0	112.2	M655 N656 M662 K663	M655-L659 WeakPolarHBondContact O-CB 3.41Å; M655-L659 PolarHBondContact O-N 3.36Å; N656-L659 PolarHBondContact O-N 2.87Å; L659-M662 HydrophobicContact CD1-CE 3.79Å; L659-M662 HydrophobicContact CG-CE 4.35Å; L659-K663 VanDerWaalsContact O-CB 3.3Å; L659-K663 WeakPolarHBondContact O-CB 2.91Å; L659-K663 PolarHBondContact O-N 2.9Å
660	K	72.7	Confident	68.1	Low	140 Å²	140	98.9 Å²	98.9	61%	0.609	51%	0.513	S	S	*	.	H	α-helix	trans	-72.6	-38.3	176.4	-168	174.5	-175.9	177.5	0	112.1	N656 A657 I658 K663 N664	N656-K660 VanDerWaalsContact O-CB 3.23Å; N656-K660 WeakPolarHBondContact O-CB 3.36Å; N656-K660 PolarHBondContact O-N 2.92Å; A657-K660 PolarHBondContact O-N 3.3Å; I658-K660 VanDerWaalsContact C-N 3.27Å; I658-K660 PolarHBondContact O-N 3.24Å; K660-K663 PolarHBondContact O-N 2.9Å; K660-N664 VanDerWaalsContact O-CB 3.31Å; K660-N664 WeakPolarHBondContact O-CB 3.36Å; K660-N664 VanDerWaalsContact O-CG 3.23Å; K660-N664 PolarHBondContact O-N 3.32Å; K660-N664 PolarHBondContact O-OD1 3.41Å
661	F	76.6	Confident	70.2	Confident	115 Å²	115	98 Å²	98	50%	0.504	52%	0.517	S	S	.	.	H	α-helix	trans	-62.8	-45.3	170.9	176.8	-90.1	0	0	0	110.8	A657 I658 K663 N664 N665	A657-F661 VanDerWaalsContact O-CB 3.23Å; A657-F661 WeakPolarHBondContact O-CB 3.47Å; A657-F661 PolarHBondContact O-N 3.49Å; I658-F661 PolarHBondContact O-N 3.46Å; F661-K663 PolarHBondContact O-N 2.87Å; F661-N664 PolarHBondContact O-N 2.82Å; F661-N665 VanDerWaalsContact CD2-ND2 3.33Å; F661-N665 WeakPolarHBondContact CD2-ND2 3.33Å; F661-N665 HydrophobicContact CE1-CB 4.37Å; F661-N665 WeakPolarHBondContact CE2-ND2 3.23Å; F661-N665 HydrophobicContact CZ-CB 4.32Å; F661-N665 WeakPolarHBondContact O-CB 3.42Å; F661-N665 PolarHBondContact O-N 2.88Å; F661-N665 PolarHBondContact O-ND2 3.45Å
662	M	72.2	Confident	72.1	Confident	62 Å²	62	96.1 Å²	96.1	31%	0.305	51%	0.507	S	S	.	.	H	α-helix	trans	-61.8	-41.7	175.8	-71.7	-159.7	-60.9	0	0	111.8	I658 L659 N665 I666 T669	I658-M662 HydrophobicContact CG2-CE 4.2Å; I658-M662 HydrophobicContact CG2-CG 4.2Å; I658-M662 HydrophobicContact CG2-SD 4.35Å; I658-M662 WeakPolarHBondContact O-CB 3.49Å; I658-M662 VanDerWaalsContact O-CG 3.25Å; I658-M662 WeakPolarHBondContact O-CG 3.32Å; I658-M662 PolarHBondContact O-N 3.14Å; L659-M662 HydrophobicContact CD1-CE 3.79Å; L659-M662 HydrophobicContact CG-CE 4.35Å; M662-N665 CarbonylContact O-C 3.6Å; M662-I666 WeakPolarHBondContact O-CA 3.4Å; M662-I666 PolarHBondContact O-N 2.78Å; M662-I666 VanDerWaalsContact O-N 3.1Å; M662-T669 WeakPolarHBondContact CA-OG1 3.32Å; M662-T669 HydrophobicContact CB-CG2 3.83Å; M662-T669 HydrophobicContact CG-CG2 3.45Å; M662-T669 VanDerWaalsContact CG-CG2 3.45Å; M662-T669 HydrophobicContact SD-CG2 3.61Å
663	K	77.1	Confident	74	Confident	168 Å²	168	91.5 Å²	91.5	73%	0.73	49%	0.489	S	S	*	.	H	α-helix	trans	-67.4	-39.9	176.2	-171.2	175	-178.4	178	0	112.6	L659 K660 F661	L659-K663 VanDerWaalsContact O-CB 3.3Å; L659-K663 WeakPolarHBondContact O-CB 2.91Å; L659-K663 PolarHBondContact O-N 2.9Å; K660-K663 PolarHBondContact O-N 2.9Å; F661-K663 PolarHBondContact O-N 2.87Å
664	N	83.4	Confident	76.1	Confident	119 Å²	119	89.3 Å²	89.3	64%	0.636	48%	0.48	S	S	*	.	H	α-helix	trans	-76.9	-28.9	179.6	-72	3.4	0	0	0	112.9	K660 F661	K660-N664 VanDerWaalsContact O-CB 3.31Å; K660-N664 WeakPolarHBondContact O-CB 3.36Å; K660-N664 VanDerWaalsContact O-CG 3.23Å; K660-N664 PolarHBondContact O-N 3.32Å; K660-N664 PolarHBondContact O-OD1 3.41Å; F661-N664 PolarHBondContact O-N 2.82Å
665	N	85.6	Confident	78	Confident	63 Å²	63	90.3 Å²	90.3	34%	0.337	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	44.8	-178.3	-56.1	-83.5	0	0	0	110.7	F661 M662 V667 S668 T669	F661-N665 VanDerWaalsContact CD2-ND2 3.33Å; F661-N665 WeakPolarHBondContact CD2-ND2 3.33Å; F661-N665 HydrophobicContact CE1-CB 4.37Å; F661-N665 WeakPolarHBondContact CE2-ND2 3.23Å; F661-N665 HydrophobicContact CZ-CB 4.32Å; F661-N665 WeakPolarHBondContact O-CB 3.42Å; F661-N665 PolarHBondContact O-N 2.88Å; F661-N665 PolarHBondContact O-ND2 3.45Å; M662-N665 CarbonylContact O-C 3.6Å; N665-V667 VanDerWaalsContact C-N 3.27Å; N665-V667 PolarHBondContact O-N 3.18Å; N665-S668 PolarHBondContact O-N 2.9Å; N665-T669 WeakPolarHBondContact O-CB 3.41Å; N665-T669 PolarHBondContact O-N 3.32Å; N665-T669 PolarHBondContact O-OG1 3.4Å
666	I	87.1	Confident	79.5	Confident	109 Å²	109	89.1 Å²	89.1	56%	0.559	48%	0.48	S	S	*	.	H	α-helix	trans	-58.1	-38	-170.4	-166.8	167.8	0	0	0	112.8	M662 T669 V670	M662-I666 WeakPolarHBondContact O-CA 3.4Å; M662-I666 PolarHBondContact O-N 2.78Å; M662-I666 VanDerWaalsContact O-N 3.1Å; I666-T669 PolarHBondContact O-N 2.74Å; I666-V670 HydrophobicContact CG1-CG2 4.4Å; I666-V670 WeakPolarHBondContact O-CB 3.36Å; I666-V670 VanDerWaalsContact O-CG2 3.28Å; I666-V670 WeakPolarHBondContact O-CG2 3.29Å; I666-V670 PolarHBondContact O-N 3.06Å
667	V	86.4	Confident	80.9	Confident	118 Å²	118	88.5 Å²	88.5	72%	0.715	48%	0.479	S	S	*	.	H	α-helix	trans	-64.7	-51.2	177.6	-177.2	0	0	0	0	111.3	N665 T669 V670 A671	N665-V667 VanDerWaalsContact C-N 3.27Å; N665-V667 PolarHBondContact O-N 3.18Å; V667-T669 VanDerWaalsContact C-N 3.28Å; V667-T669 PolarHBondContact O-N 2.99Å; V667-V670 PolarHBondContact O-N 3.36Å; V667-A671 WeakPolarHBondContact O-CB 3.22Å; V667-A671 PolarHBondContact O-N 3.09Å
668	S	83.2	Confident	82	Confident	68 Å²	68	94.3 Å²	94.3	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-34.9	178.2	-51.6	0	0	0	0	112.3	N665 L672	N665-S668 PolarHBondContact O-N 2.9Å; S668-L672 WeakPolarHBondContact O-CB 3.34Å; S668-L672 PolarHBondContact O-N 3.49Å
669	T	83.3	Confident	83.1	Confident	16 Å²	16	95.4 Å²	95.4	10%	0.098	50%	0.497	C	S	.	.	H	α-helix	trans	-67.2	-49	177.2	-58.9	0	0	0	0	111.3	M662 N665 I666 V667 A671 L672 I673	M662-T669 WeakPolarHBondContact CA-OG1 3.32Å; M662-T669 HydrophobicContact CB-CG2 3.83Å; M662-T669 HydrophobicContact CG-CG2 3.45Å; M662-T669 VanDerWaalsContact CG-CG2 3.45Å; M662-T669 HydrophobicContact SD-CG2 3.61Å; N665-T669 WeakPolarHBondContact O-CB 3.41Å; N665-T669 PolarHBondContact O-N 3.32Å; N665-T669 PolarHBondContact O-OG1 3.4Å; I666-T669 PolarHBondContact O-N 2.74Å; V667-T669 VanDerWaalsContact C-N 3.28Å; V667-T669 PolarHBondContact O-N 2.99Å; T669-A671 VanDerWaalsContact C-N 3.3Å; T669-A671 PolarHBondContact O-N 3.18Å; T669-L672 PolarHBondContact O-N 3.16Å; T669-I673 HydrophobicContact CG2-CD1 3.79Å; T669-I673 HydrophobicContact CG2-CG1 4.46Å; T669-I673 WeakPolarHBondContact O-CG1 3.3Å; T669-I673 PolarHBondContact O-N 3.05Å
670	V	86.6	Confident	84.3	Confident	85 Å²	85	93.7 Å²	93.7	52%	0.515	49%	0.492	S	S	.	.	H	α-helix	trans	-62.1	-39.6	176.2	169.9	0	0	0	0	110.8	I666 V667 T674	I666-V670 HydrophobicContact CG1-CG2 4.4Å; I666-V670 WeakPolarHBondContact O-CB 3.36Å; I666-V670 VanDerWaalsContact O-CG2 3.28Å; I666-V670 WeakPolarHBondContact O-CG2 3.29Å; I666-V670 PolarHBondContact O-N 3.06Å; V667-V670 PolarHBondContact O-N 3.36Å; V670-T674 VanDerWaalsContact O-CB 3.26Å; V670-T674 WeakPolarHBondContact O-CB 3.41Å; V670-T674 PolarHBondContact O-N 3Å; V670-T674 PolarHBondContact O-OG1 3.08Å
671	A	88.4	Confident	85	Confident	58 Å²	58	89 Å²	89	48%	0.479	48%	0.479	S	S	.	.	H	α-helix	trans	-62.3	-45.5	174.9	0	0	0	0	0	112.4	V667 T669 T674 L675	V667-A671 WeakPolarHBondContact O-CB 3.22Å; V667-A671 PolarHBondContact O-N 3.09Å; T669-A671 VanDerWaalsContact C-N 3.3Å; T669-A671 PolarHBondContact O-N 3.18Å; A671-T674 PolarHBondContact O-N 2.8Å; A671-L675 WeakPolarHBondContact O-CB 3.41Å; A671-L675 PolarHBondContact O-N 2.88Å
672	L	88	Confident	85.5	Confident	98 Å²	98	87.2 Å²	87.2	51%	0.513	48%	0.481	S	S	.	.	H	α-helix	trans	-65	-45.6	177.1	-89.1	162.4	0	0	0	112.8	S668 T669 T674 L675 I676	S668-L672 WeakPolarHBondContact O-CB 3.34Å; S668-L672 PolarHBondContact O-N 3.49Å; T669-L672 PolarHBondContact O-N 3.16Å; L672-T674 VanDerWaalsContact C-N 3.3Å; L672-T674 PolarHBondContact O-N 3.03Å; L672-L675 PolarHBondContact O-N 2.95Å; L672-I676 HydrophobicContact CD2-CD1 3.69Å; L672-I676 WeakPolarHBondContact O-CB 3.13Å; L672-I676 WeakPolarHBondContact O-CG1 3.41Å; L672-I676 PolarHBondContact O-N 3.3Å
673	I	86.1	Confident	86.3	Confident	71 Å²	71	91.1 Å²	91.1	36%	0.364	50%	0.496	S	S	.	.	H	α-helix	trans	-65.2	-37.5	177.3	-64.9	172.5	0	0	0	110.3	T669 V677 W678	T669-I673 HydrophobicContact CG2-CD1 3.79Å; T669-I673 HydrophobicContact CG2-CG1 4.46Å; T669-I673 WeakPolarHBondContact O-CG1 3.3Å; T669-I673 PolarHBondContact O-N 3.05Å; I673-V677 HydrophobicContact CG2-CB 4.24Å; I673-V677 HydrophobicContact CG2-CG2 4.23Å; I673-V677 WeakPolarHBondContact O-CA 3.33Å; I673-V677 VanDerWaalsContact O-CB 3.29Å; I673-V677 WeakPolarHBondContact O-CB 3.46Å; I673-V677 PolarHBondContact O-N 2.96Å; I673-W678 PolarHBondContact O-N 3.03Å; I673-W678 VanDerWaalsContact O-N 3.14Å
674	T	88	Confident	86.7	Confident	61 Å²	61	89.9 Å²	89.9	37%	0.374	49%	0.491	S	S	.	.	I	π-helix	trans	-61	-47.5	172.3	-59.3	0	0	0	0	111.6	V670 A671 L672 W678 I679	V670-T674 VanDerWaalsContact O-CB 3.26Å; V670-T674 WeakPolarHBondContact O-CB 3.41Å; V670-T674 PolarHBondContact O-N 3Å; V670-T674 PolarHBondContact O-OG1 3.08Å; A671-T674 PolarHBondContact O-N 2.8Å; L672-T674 VanDerWaalsContact C-N 3.3Å; L672-T674 PolarHBondContact O-N 3.03Å; T674-W678 PolarHBondContact O-N 3.43Å; T674-I679 WeakPolarHBondContact O-CG1 3.12Å; T674-I679 PolarHBondContact O-N 3.21Å
675	L	89.9	Confident	86.9	Confident	115 Å²	115	88.3 Å²	88.3	60%	0.602	49%	0.486	S	S	*	.	I	π-helix	trans	-71.9	-36.3	-175.8	-168.2	145.2	0	0	0	113.6	A671 L672	A671-L675 WeakPolarHBondContact O-CB 3.41Å; A671-L675 PolarHBondContact O-N 2.88Å; L672-L675 PolarHBondContact O-N 2.95Å
676	I	89.6	Confident	86.9	Confident	106 Å²	106	89.5 Å²	89.5	54%	0.544	49%	0.492	S	S	.	.	I	π-helix	trans	-95.7	-32.7	-173.7	-61.8	172.9	0	0	0	112.6	L672 P680	L672-I676 HydrophobicContact CD2-CD1 3.69Å; L672-I676 WeakPolarHBondContact O-CB 3.13Å; L672-I676 WeakPolarHBondContact O-CG1 3.41Å; L672-I676 PolarHBondContact O-N 3.3Å; I676-P680 WeakPolarHBondContact O-CD 3.48Å; I676-P680 WeakPolarHBondContact O-CG 3.13Å
677	V	86	Confident	86.7	Confident	80 Å²	80	87.1 Å²	87.1	49%	0.485	49%	0.485	S	S	.	.	I	π-helix	trans	-107.8	-57.2	-175.7	-172.8	0	0	0	0	111.1	I673 A681	I673-V677 HydrophobicContact CG2-CB 4.24Å; I673-V677 HydrophobicContact CG2-CG2 4.23Å; I673-V677 WeakPolarHBondContact O-CA 3.33Å; I673-V677 VanDerWaalsContact O-CB 3.29Å; I673-V677 WeakPolarHBondContact O-CB 3.46Å; I673-V677 PolarHBondContact O-N 2.96Å; V677-A681 WeakPolarHBondContact O-CB 3.25Å; V677-A681 PolarHBondContact O-N 3.46Å
678	W	86.1	Confident	86.6	Confident	171 Å²	171	85.7 Å²	85.7	65%	0.648	47%	0.473	S	S	*	.	I	π-helix	trans	-71.6	-36.9	-171.6	-65.2	108.1	0	0	0	113.5	I673 T674 S682	I673-W678 PolarHBondContact O-N 3.03Å; I673-W678 VanDerWaalsContact O-N 3.14Å; T674-W678 PolarHBondContact O-N 3.43Å; W678-S682 WeakPolarHBondContact O-CB 3.45Å; W678-S682 PolarHBondContact O-N 3.33Å
679	I	87.4	Confident	86.5	Confident	78 Å²	78	86 Å²	86	40%	0.4	47%	0.471	S	S	.	.	H	α-helix	trans	-64.2	-54	175.5	-71.4	178.9	0	0	0	111.1	T674 A681 S682 F683	T674-I679 WeakPolarHBondContact O-CG1 3.12Å; T674-I679 PolarHBondContact O-N 3.21Å; I679-A681 PolarHBondContact O-N 2.86Å; I679-S682 WeakPolarHBondContact O-CB 3.2Å; I679-S682 PolarHBondContact O-N 3.5Å; I679-F683 HydrophobicContact CG2-CD2 3.8Å; I679-F683 HydrophobicContact CG2-CE2 3.54Å; I679-F683 VanDerWaalsContact O-CD2 3.25Å; I679-F683 WeakPolarHBondContact O-CD2 3.15Å; I679-F683 PolarHBondContact O-N 3.47Å
680	P	87.5	Confident	86.2	Confident	67 Å²	67	89.1 Å²	89.1	44%	0.435	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-37.5	176.2	-28.2	39.4	0	0	0	114.1	I676 S682 F683 F684	I676-P680 WeakPolarHBondContact O-CD 3.48Å; I676-P680 WeakPolarHBondContact O-CG 3.13Å; P680-S682 VanDerWaalsContact C-N 3.34Å; P680-S682 PolarHBondContact O-N 3.49Å; P680-F683 PolarHBondContact O-N 2.98Å; P680-F684 WeakPolarHBondContact O-CB 3.43Å; P680-F684 PolarHBondContact O-N 3.46Å
681	A	87.2	Confident	85.8	Confident	40 Å²	40	91.1 Å²	91.1	33%	0.331	49%	0.491	S	S	.	.	H	α-helix	trans	-63.9	-38.9	174.6	0	0	0	0	0	112.1	V677 I679 F684 V685	V677-A681 WeakPolarHBondContact O-CB 3.25Å; V677-A681 PolarHBondContact O-N 3.46Å; I679-A681 PolarHBondContact O-N 2.86Å; A681-F684 PolarHBondContact O-N 2.89Å; A681-V685 WeakPolarHBondContact O-CB 3.45Å; A681-V685 WeakPolarHBondContact O-CG2 3.46Å; A681-V685 PolarHBondContact O-N 3.45Å
682	S	87	Confident	85.3	Confident	79 Å²	79	90.4 Å²	90.4	55%	0.552	48%	0.484	S	S	*	.	H	α-helix	trans	-62.8	-44.9	174	-175	0	0	0	0	111.6	W678 I679 P680 F684 V685 N686	W678-S682 WeakPolarHBondContact O-CB 3.45Å; W678-S682 PolarHBondContact O-N 3.33Å; I679-S682 WeakPolarHBondContact O-CB 3.2Å; I679-S682 PolarHBondContact O-N 3.5Å; P680-S682 VanDerWaalsContact C-N 3.34Å; P680-S682 PolarHBondContact O-N 3.49Å; S682-F684 PolarHBondContact O-N 2.9Å; S682-V685 PolarHBondContact O-N 3.33Å; S682-N686 VanDerWaalsContact O-CB 3.24Å; S682-N686 WeakPolarHBondContact O-CB 3.24Å; S682-N686 PolarHBondContact O-N 2.87Å
683	F	87.9	Confident	84.7	Confident	144 Å²	144	88.2 Å²	88.2	63%	0.632	48%	0.475	S	S	*	.	H	α-helix	trans	-61.7	-41.1	173.6	-78.4	-64.8	0	0	0	112.8	I679 P680 N686 S687	I679-F683 HydrophobicContact CG2-CD2 3.8Å; I679-F683 HydrophobicContact CG2-CE2 3.54Å; I679-F683 VanDerWaalsContact O-CD2 3.25Å; I679-F683 WeakPolarHBondContact O-CD2 3.15Å; I679-F683 PolarHBondContact O-N 3.47Å; P680-F683 PolarHBondContact O-N 2.98Å; F683-N686 PolarHBondContact O-N 3.3Å; F683-S687 WeakPolarHBondContact O-CB 3.31Å; F683-S687 PolarHBondContact O-N 2.86Å
684	F	87	Confident	83.9	Confident	142 Å²	142	86.8 Å²	86.8	62%	0.623	47%	0.471	S	S	*	.	H	α-helix	trans	-67.4	-45.1	178.7	-175.3	-109.1	0	0	0	112.4	P680 A681 S682 S687 I688	P680-F684 WeakPolarHBondContact O-CB 3.43Å; P680-F684 PolarHBondContact O-N 3.46Å; A681-F684 PolarHBondContact O-N 2.89Å; S682-F684 PolarHBondContact O-N 2.9Å; F684-S687 PolarHBondContact O-N 3.28Å; F684-I688 HydrophobicContact CD1-CD1 3.86Å; F684-I688 HydrophobicContact CE1-CD1 3.41Å; F684-I688 VanDerWaalsContact CE1-CD1 3.41Å; F684-I688 HydrophobicContact CE1-CG1 4.49Å; F684-I688 HydrophobicContact CE2-CD1 4.4Å; F684-I688 HydrophobicContact CZ-CD1 3.72Å; F684-I688 HydrophobicContact CZ-CG1 4.5Å; F684-I688 WeakPolarHBondContact O-CG1 3.33Å; F684-I688 PolarHBondContact O-N 2.82Å
685	V	87.3	Confident	83.2	Confident	86 Å²	86	91.9 Å²	91.9	52%	0.521	49%	0.491	S	S	.	.	H	α-helix	trans	-63.3	-42.3	174.2	171.6	0	0	0	0	110.7	A681 S682 S687 I688 V689	A681-V685 WeakPolarHBondContact O-CB 3.45Å; A681-V685 WeakPolarHBondContact O-CG2 3.46Å; A681-V685 PolarHBondContact O-N 3.45Å; S682-V685 PolarHBondContact O-N 3.33Å; V685-S687 VanDerWaalsContact C-N 3.33Å; V685-S687 PolarHBondContact O-N 2.98Å; V685-I688 PolarHBondContact O-N 2.98Å; V685-V689 HydrophobicContact CG1-CG2 4.27Å; V685-V689 WeakPolarHBondContact O-CB 3.49Å; V685-V689 VanDerWaalsContact O-CG2 3.29Å; V685-V689 WeakPolarHBondContact O-CG2 3.37Å; V685-V689 PolarHBondContact O-N 3.04Å
686	N	84.3	Confident	82.3	Confident	87 Å²	87	93.5 Å²	93.5	47%	0.465	50%	0.499	S	S	.	.	H	α-helix	trans	-64.1	-38.1	176.7	-164.7	38.1	0	0	0	111.8	S682 F683 V689 L690	S682-N686 VanDerWaalsContact O-CB 3.24Å; S682-N686 WeakPolarHBondContact O-CB 3.24Å; S682-N686 PolarHBondContact O-N 2.87Å; F683-N686 PolarHBondContact O-N 3.3Å; N686-V689 PolarHBondContact O-N 3.36Å; N686-L690 VanDerWaalsContact O-CB 3.31Å; N686-L690 WeakPolarHBondContact O-CB 3.48Å; N686-L690 WeakPolarHBondContact O-CD1 3.36Å; N686-L690 VanDerWaalsContact O-CG 3.25Å; N686-L690 WeakPolarHBondContact O-CG 3.29Å; N686-L690 PolarHBondContact O-N 3.37Å
687	S	83.9	Confident	81.4	Confident	59 Å²	59	92 Å²	92	41%	0.413	50%	0.495	S	S	.	.	H	α-helix	trans	-62.6	-44.4	173.2	-178.2	0	0	0	0	112.3	F683 F684 V685 L690 H691	F683-S687 WeakPolarHBondContact O-CB 3.31Å; F683-S687 PolarHBondContact O-N 2.86Å; F684-S687 PolarHBondContact O-N 3.28Å; V685-S687 VanDerWaalsContact C-N 3.33Å; V685-S687 PolarHBondContact O-N 2.98Å; S687-L690 PolarHBondContact O-N 2.93Å; S687-H691 WeakPolarHBondContact O-CB 3.29Å; S687-H691 PolarHBondContact O-CD2 3.42Å; S687-H691 PolarHBondContact O-N 3.42Å
688	I	83.8	Confident	80	Confident	89 Å²	89	91.7 Å²	91.7	46%	0.456	51%	0.508	S	S	.	.	H	α-helix	trans	-63.1	-43.3	174.4	-70	170.3	0	0	0	111.3	F684 V685 H691 A692	F684-I688 HydrophobicContact CD1-CD1 3.86Å; F684-I688 HydrophobicContact CE1-CD1 3.41Å; F684-I688 VanDerWaalsContact CE1-CD1 3.41Å; F684-I688 HydrophobicContact CE1-CG1 4.49Å; F684-I688 HydrophobicContact CE2-CD1 4.4Å; F684-I688 HydrophobicContact CZ-CD1 3.72Å; F684-I688 HydrophobicContact CZ-CG1 4.5Å; F684-I688 WeakPolarHBondContact O-CG1 3.33Å; F684-I688 PolarHBondContact O-N 2.82Å; V685-I688 PolarHBondContact O-N 2.98Å; I688-H691 PolarHBondContact O-N 3.43Å; I688-A692 WeakPolarHBondContact O-CB 3.48Å; I688-A692 PolarHBondContact O-N 3.47Å
689	V	81.8	Confident	78.7	Confident	73 Å²	73	89 Å²	89	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-41.8	178.6	170.5	0	0	0	0	110.9	V685 N686 A692 V693	V685-V689 HydrophobicContact CG1-CG2 4.27Å; V685-V689 WeakPolarHBondContact O-CB 3.49Å; V685-V689 VanDerWaalsContact O-CG2 3.29Å; V685-V689 WeakPolarHBondContact O-CG2 3.37Å; V685-V689 PolarHBondContact O-N 3.04Å; N686-V689 PolarHBondContact O-N 3.36Å; V689-A692 PolarHBondContact O-N 2.97Å; V689-V693 HydrophobicContact CG1-CG2 4.26Å; V689-V693 WeakPolarHBondContact O-CB 3.25Å; V689-V693 VanDerWaalsContact O-CG2 3.23Å; V689-V693 WeakPolarHBondContact O-CG2 3.34Å; V689-V693 PolarHBondContact O-N 2.88Å
690	L	77.4	Confident	77.2	Confident	82 Å²	82	92.4 Å²	92.4	43%	0.429	52%	0.524	S	S	.	.	H	α-helix	trans	-62.8	-44	174.8	-76.3	164.6	0	0	0	111.7	N686 S687 V693 S694	N686-L690 VanDerWaalsContact O-CB 3.31Å; N686-L690 WeakPolarHBondContact O-CB 3.48Å; N686-L690 WeakPolarHBondContact O-CD1 3.36Å; N686-L690 VanDerWaalsContact O-CG 3.25Å; N686-L690 WeakPolarHBondContact O-CG 3.29Å; N686-L690 PolarHBondContact O-N 3.37Å; S687-L690 PolarHBondContact O-N 2.93Å; L690-V693 PolarHBondContact O-N 3.41Å; L690-S694 VanDerWaalsContact O-CB 3.29Å; L690-S694 WeakPolarHBondContact O-CB 3.23Å; L690-S694 PolarHBondContact O-N 2.86Å
691	H	77.8	Confident	75.7	Confident	128 Å²	128	94.9 Å²	94.9	59%	0.593	53%	0.534	S	S	*	.	H	α-helix	trans	-60.6	-47	173.2	-92.6	-73	0	0	0	112.3	S687 I688 V693 S694 E695	S687-H691 WeakPolarHBondContact O-CB 3.29Å; S687-H691 PolarHBondContact O-CD2 3.42Å; S687-H691 PolarHBondContact O-N 3.42Å; I688-H691 PolarHBondContact O-N 3.43Å; H691-V693 PolarHBondContact O-N 3.43Å; H691-S694 WeakPolarHBondContact O-CB 3.43Å; H691-S694 PolarHBondContact O-N 3.49Å; H691-E695 PolarHBondContact O-N 2.84Å
692	A	76.4	Confident	73.9	Confident	42 Å²	42	104.3 Å²	104.3	35%	0.347	58%	0.576	S	S	.	*	H	α-helix	trans	-65.5	-37.1	179	0	0	0	0	0	112.8	I688 V689 L696	I688-A692 WeakPolarHBondContact O-CB 3.48Å; I688-A692 PolarHBondContact O-N 3.47Å; V689-A692 PolarHBondContact O-N 2.97Å; A692-L696 WeakPolarHBondContact O-CB 3.37Å; A692-L696 WeakPolarHBondContact O-CD1 3.36Å; A692-L696 VanDerWaalsContact O-CG 3.3Å; A692-L696 WeakPolarHBondContact O-CG 3.44Å; A692-L696 PolarHBondContact O-N 3.04Å
693	V	75.4	Confident	73.3	Confident	53 Å²	53	105.6 Å²	105.6	32%	0.321	58%	0.577	S	S	.	*	H	α-helix	trans	-70.1	-38.7	174.9	170.2	0	0	0	0	110.9	V689 L690 H691 L696 T697 L701	V689-V693 HydrophobicContact CG1-CG2 4.26Å; V689-V693 WeakPolarHBondContact O-CB 3.25Å; V689-V693 VanDerWaalsContact O-CG2 3.23Å; V689-V693 WeakPolarHBondContact O-CG2 3.34Å; V689-V693 PolarHBondContact O-N 2.88Å; L690-V693 PolarHBondContact O-N 3.41Å; H691-V693 PolarHBondContact O-N 3.43Å; V693-L696 PolarHBondContact O-N 2.9Å; V693-T697 HydrophobicContact CG1-CG2 4.12Å; V693-T697 WeakPolarHBondContact O-CB 3.5Å; V693-T697 WeakPolarHBondContact O-CG2 3.3Å; V693-T697 PolarHBondContact O-N 3.05Å; V693-T697 PolarHBondContact O-OG1 2.96Å; V693-L701 HydrophobicContact CG1-CD1 4.05Å
694	S	71.1	Confident	72.5	Confident	40 Å²	40	103.6 Å²	103.6	28%	0.28	57%	0.574	S	S	.	*	H	α-helix	trans	-60.5	-47.1	174.1	178.9	0	0	0	0	111.3	L690 H691 L696 T697 G698	L690-S694 VanDerWaalsContact O-CB 3.29Å; L690-S694 WeakPolarHBondContact O-CB 3.23Å; L690-S694 PolarHBondContact O-N 2.86Å; H691-S694 WeakPolarHBondContact O-CB 3.43Å; H691-S694 PolarHBondContact O-N 3.49Å; S694-L696 VanDerWaalsContact C-N 3.35Å; S694-L696 PolarHBondContact O-N 3.43Å; S694-T697 PolarHBondContact O-N 3.29Å; S694-G698 PolarHBondContact O-N 3.32Å
695	E	73.4	Confident	71.7	Confident	168 Å²	168	101.4 Å²	101.4	79%	0.785	57%	0.572	S	S	*	*	H	α-helix	trans	-63.3	-36.4	175.7	-73.5	-174.1	157.7	0	0	113.1	H691	H691-E695 PolarHBondContact O-N 2.84Å
696	L	70.5	Confident	70.8	Confident	150 Å²	150	102.4 Å²	102.4	79%	0.785	58%	0.575	S	S	*	*	H	α-helix	trans	-81	-26.2	-178.7	-77.7	166.5	0	0	0	114.6	A692 V693 S694	A692-L696 WeakPolarHBondContact O-CB 3.37Å; A692-L696 WeakPolarHBondContact O-CD1 3.36Å; A692-L696 VanDerWaalsContact O-CG 3.3Å; A692-L696 WeakPolarHBondContact O-CG 3.44Å; A692-L696 PolarHBondContact O-N 3.04Å; V693-L696 PolarHBondContact O-N 2.9Å; S694-L696 VanDerWaalsContact C-N 3.35Å; S694-L696 PolarHBondContact O-N 3.43Å
697	T	70.5	Confident	69.9	Low	75 Å²	75	103.3 Å²	103.3	46%	0.46	58%	0.581	S	S	.	*	H	α-helix	trans	-109.2	-15.9	-174.3	62	0	0	0	0	114.1	V693 S694 L699	V693-T697 HydrophobicContact CG1-CG2 4.12Å; V693-T697 WeakPolarHBondContact O-CB 3.5Å; V693-T697 WeakPolarHBondContact O-CG2 3.3Å; V693-T697 PolarHBondContact O-N 3.05Å; V693-T697 PolarHBondContact O-OG1 2.96Å; S694-T697 PolarHBondContact O-N 3.29Å; T697-L699 PolarHBondContact O-N 2.68Å
698	G	56	Low	69	Low	72 Å²	72	106.3 Å²	106.3	74%	0.742	59%	0.593	S	S	*	*			trans	63.3	19.3	-176.5	0	0	0	0	0	113.6	S694	S694-G698 PolarHBondContact O-N 3.32Å
699	L	59.1	Low	67.9	Low	116 Å²	116	107.5 Å²	107.5	61%	0.607	60%	0.602	S	S	*	*			trans	-113.4	116.6	179.5	-76.1	162.1	0	0	0	109.1	T697 L701	T697-L699 PolarHBondContact O-N 2.68Å; L699-L701 PolarHBondContact O-N 3.23Å
700	D	56	Low	66.9	Low	148 Å²	148	110.2 Å²	110.2	79%	0.791	62%	0.615	S	S	*	*			trans	-66.2	100.9	165.5	-68.4	-43.3	0	0	0	108.7	I702	D700-I702 PolarHBondContact O-N 3.45Å
701	L	55.4	Low	66	Low	120 Å²	120	112.5 Å²	112.5	63%	0.628	63%	0.63	S	S	*	*			trans	-79.8	112.2	172.2	-77.8	164.2	0	0	0	109.1	V693 L699	V693-L701 HydrophobicContact CG1-CD1 4.05Å; L699-L701 PolarHBondContact O-N 3.23Å
702	I	50.3	Low	64.9	Low	238 Å²	238	111.1 Å²	111.1	100%	1.221	63%	0.633	S	S	*	*			trans	-68.1	0	178.9	-57.3	173.2	0	0	0	111.4	D700	D700-I702 PolarHBondContact O-N 3.45Å

Retrieved 702 of 702 residues in 572.8 ms (Link to these results)

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