A0A096LVU1_POEFO Loading...

Matrix metallopeptidase 30

AlphaFold DB , UniProt , Accession A0A096LVU1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 309 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	47.4	Very low	45.4	Very low	237 Å²	237	147.1 Å²	147.1	100%	1.167	85%	0.846	S	S	*	*				0	101.7	0	-81.2	163.3	159.4	0	0	106
2	D	39.4	Very low	45.7	Very low	173 Å²	173	147 Å²	147	93%	0.925	84%	0.838	S	S	*	*			trans	-168	139.9	147.3	-98.4	-30.5	0	0	0	110.2
3	S	38.8	Very low	45.8	Very low	107 Å²	107	146.6 Å²	146.6	75%	0.748	83%	0.831	S	S	*	*			trans	-66.5	137.8	-155.2	-76	0	0	0	0	116.2	N5	S3-N5 PolarHBondContact O-N 2.95Å
4	M	41.6	Very low	46.1	Very low	187 Å²	187	144 Å²	144	92%	0.921	82%	0.819	S	S	*	*			trans	-67.7	112	155.1	-77.2	154.7	54.8	0	0	109.9
5	N	40.2	Very low	46	Very low	151 Å²	151	141.3 Å²	141.3	81%	0.807	81%	0.811	S	S	*	*			trans	-86	105.8	163.6	-85.8	-20.3	0	0	0	109.1	S3 V7	S3-N5 PolarHBondContact O-N 2.95Å; N5-V7 PolarHBondContact O-N 3.26Å
6	A	47.8	Very low	46.4	Very low	94 Å²	94	139.4 Å²	139.4	78%	0.777	80%	0.803	S	S	*	*			trans	-76.1	109.7	171.8	0	0	0	0	0	109.8	K8	A6-K8 PolarHBondContact O-N 3.25Å
7	V	48.1	Very low	46.9	Very low	137 Å²	137	136.9 Å²	136.9	83%	0.83	80%	0.803	S	S	*	*			trans	-77.1	107.7	169.4	179.6	0	0	0	0	108	N5 A9	N5-V7 PolarHBondContact O-N 3.26Å; V7-A9 PolarHBondContact O-N 2.88Å
8	K	47.8	Very low	47.4	Very low	202 Å²	202	136.4 Å²	136.4	88%	0.878	80%	0.802	S	S	*	*			trans	-77.7	101.2	168.2	-74.7	-176.4	177.2	-178.2	0	108.6	A6 A10	A6-K8 PolarHBondContact O-N 3.25Å; K8-A10 PolarHBondContact O-N 3.28Å
9	A	49.2	Very low	47.4	Very low	87 Å²	87	135.6 Å²	135.6	72%	0.719	80%	0.803	S	S	*	*			trans	-76.5	111.7	167.7	0	0	0	0	0	109.1	V7	V7-A9 PolarHBondContact O-N 2.88Å
10	A	49.5	Very low	47.5	Very low	91 Å²	91	132.4 Å²	132.4	75%	0.752	80%	0.799	S	S	*	*			trans	-85.9	107.8	169	0	0	0	0	0	108.5	K8 I12	K8-A10 PolarHBondContact O-N 3.28Å; A10-I12 PolarHBondContact O-N 3.13Å
11	I	49.2	Very low	47.9	Very low	152 Å²	152	130.1 Å²	130.1	78%	0.779	80%	0.795	S	S	*	*			trans	-79.7	106.4	170.9	-64	175.7	0	0	0	107.2	L13	I11-L13 PolarHBondContact O-N 3.12Å
12	I	49.2	Very low	48.2	Very low	146 Å²	146	126.9 Å²	126.9	75%	0.749	78%	0.778	S	S	*	*			trans	-82.7	102.5	168.6	-61.1	177.5	0	0	0	106.8	A10 V14	A10-I12 PolarHBondContact O-N 3.13Å; I12-V14 HydrophobicContact CG2-CG2 4.01Å; I12-V14 PolarHBondContact O-N 2.79Å; I12-V14 VanDerWaalsContact O-N 3.16Å
13	L	47.1	Very low	48.9	Very low	142 Å²	142	124.8 Å²	124.8	74%	0.743	78%	0.775	S	S	*	*			trans	-76.1	96.9	171.6	-165.6	80.3	0	0	0	108.4	I11 C15	I11-L13 PolarHBondContact O-N 3.12Å; L13-C15 PolarHBondContact O-N 2.95Å; L13-C15 VanDerWaalsContact O-N 3.12Å
14	V	50.6	Low	49.8	Very low	110 Å²	110	126.1 Å²	126.1	67%	0.667	78%	0.778	S	S	*	*			trans	-77.3	93.2	169.9	-177.2	0	0	0	0	107.6	I12 T16	I12-V14 HydrophobicContact CG2-CG2 4.01Å; I12-V14 PolarHBondContact O-N 2.79Å; I12-V14 VanDerWaalsContact O-N 3.16Å; V14-T16 VanDerWaalsContact C-N 3.3Å; V14-T16 HydrophobicContact CG1-CG2 4.02Å; V14-T16 PolarHBondContact O-N 3.43Å
15	C	44.8	Very low	50.9	Low	103 Å²	103	120.6 Å²	120.6	70%	0.696	76%	0.758	S	S	*	*			trans	-69.6	91	165.5	-72.3	0	0	0	0	108.3	L13 A17	L13-C15 PolarHBondContact O-N 2.95Å; L13-C15 VanDerWaalsContact O-N 3.12Å; C15-A17 PolarHBondContact O-N 2.86Å
16	T	51.1	Low	52.8	Low	111 Å²	111	116.6 Å²	116.6	68%	0.681	74%	0.742	S	S	*	*			trans	-70	99.5	163.5	42.9	0	0	0	0	107.3	V14 T18	V14-T16 VanDerWaalsContact C-N 3.3Å; V14-T16 HydrophobicContact CG1-CG2 4.02Å; V14-T16 PolarHBondContact O-N 3.43Å; T16-T18 PolarHBondContact O-N 2.8Å
17	A	55.1	Low	54.3	Low	98 Å²	98	116.8 Å²	116.8	81%	0.81	74%	0.735	S	S	*	*			trans	-67.7	91.5	164.7	0	0	0	0	0	107.1	C15 C19	C15-A17 PolarHBondContact O-N 2.86Å; A17-C19 PolarHBondContact O-N 3.48Å
18	T	55.6	Low	55.8	Low	128 Å²	128	119.6 Å²	119.6	79%	0.785	73%	0.731	S	S	*	*			trans	-68.5	91.5	164.8	44.9	0	0	0	0	106.8	T16 G20	T16-T18 PolarHBondContact O-N 2.8Å; T18-G20 PolarHBondContact O-N 2.9Å
19	C	48.9	Very low	57.4	Low	121 Å²	121	116.1 Å²	116.1	82%	0.818	72%	0.718	S	S	*	*			trans	-64.2	93.2	164.6	-169.3	0	0	0	0	106.5	A17 A21	A17-C19 PolarHBondContact O-N 3.48Å; C19-A21 PolarHBondContact O-N 3.12Å
20	G	49.1	Very low	59.1	Low	70 Å²	70	115.9 Å²	115.9	72%	0.722	70%	0.702	S	S	*	*			trans	-69.6	80.5	169.4	0	0	0	0	0	108.4	T18 M22	T18-G20 PolarHBondContact O-N 2.9Å; G20-M22 VanDerWaalsContact C-N 3.34Å; G20-M22 PolarHBondContact O-N 3.13Å
21	A	54.9	Low	61	Low	86 Å²	86	113.4 Å²	113.4	71%	0.711	68%	0.679	S	S	*	*			trans	-64.3	102.1	163.5	0	0	0	0	0	106.5	C19	C19-A21 PolarHBondContact O-N 3.12Å
22	M	54.6	Low	62.9	Low	168 Å²	168	109.8 Å²	109.8	83%	0.828	66%	0.66	S	S	*	*			trans	-58.5	133.4	167.4	-72.6	-157.1	173.9	0	0	107.7	G20 T24	G20-M22 VanDerWaalsContact C-N 3.34Å; G20-M22 PolarHBondContact O-N 3.13Å; M22-T24 PolarHBondContact O-N 3.08Å
23	P	53.8	Low	64.8	Low	130 Å²	130	105.4 Å²	105.4	84%	0.844	64%	0.643	S	S	*	*			trans	-62.4	112.3	176.7	23.4	-30.1	0	0	0	108.8
24	T	58.3	Low	66.8	Low	135 Å²	135	104.5 Å²	104.5	83%	0.828	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-77.6	124.1	169.5	48.1	0	0	0	0	108.3	M22	M22-T24 PolarHBondContact O-N 3.08Å
25	S	64.8	Low	68.8	Low	70 Å²	70	99.3 Å²	99.3	49%	0.49	60%	0.602	S	S	.	*	P	Polyproline II helix	trans	-62.6	143.4	174.6	47.3	0	0	0	0	110.6
26	S	80.4	Confident	71	Confident	67 Å²	67	100.3 Å²	100.3	47%	0.469	60%	0.596	S	S	.	*	P	Polyproline II helix	trans	-62.8	146.3	172.5	175.5	0	0	0	0	110.4	R28 Q29 E30	S26-R28 PolarHBondContact O-N 3.37Å; S26-Q29 WeakPolarHBondContact O-CA 3.29Å; S26-Q29 WeakPolarHBondContact O-CB 3.2Å; S26-Q29 PolarHBondContact O-N 3.05Å; S26-E30 PolarHBondContact O-N 3.25Å; S26-E30 VanDerWaalsContact O-N 3.08Å
27	P	77.6	Confident	72.9	Confident	98 Å²	98	100.2 Å²	100.2	64%	0.636	59%	0.591	S	S	*	*	H	α-helix	trans	-51.5	-32.5	175.2	-28.5	34.7	0	0	0	113.9	S31	P27-S31 WeakPolarHBondContact O-CB 3.2Å; P27-S31 PolarHBondContact O-N 2.9Å; P27-S31 PolarHBondContact O-OG 2.71Å
28	R	80	Confident	74.7	Confident	197 Å²	197	96.4 Å²	96.4	74%	0.743	56%	0.556	S	S	*	*	H	α-helix	trans	-68	-39.3	176	-172.1	176.1	-173.5	163.8	4	112.4	S26 L32	S26-R28 PolarHBondContact O-N 3.37Å; R28-L32 HydrophobicContact CG-CD1 4.45Å; R28-L32 VanDerWaalsContact O-CG 3.3Å; R28-L32 WeakPolarHBondContact O-CG 3.41Å; R28-L32 PolarHBondContact O-N 3.01Å; R28-L32 VanDerWaalsContact O-N 3.12Å
29	Q	80.9	Confident	76.4	Confident	129 Å²	129	90.7 Å²	90.7	60%	0.603	52%	0.521	S	S	*	.	H	α-helix	trans	-71.9	-37.1	179.7	-170.4	170.1	8.8	0	0	111.2	S26 L32 S33	S26-Q29 WeakPolarHBondContact O-CA 3.29Å; S26-Q29 WeakPolarHBondContact O-CB 3.2Å; S26-Q29 PolarHBondContact O-N 3.05Å; Q29-L32 PolarHBondContact O-N 3Å; Q29-S33 PolarHBondContact O-N 3.01Å; Q29-S33 PolarHBondContact O-OG 3.24Å
30	E	86.1	Confident	78.3	Confident	82 Å²	82	88.7 Å²	88.7	38%	0.383	51%	0.508	S	S	.	.	H	α-helix	trans	-63.3	-47.5	173.5	-168.1	-169.8	152.1	0	0	111.6	S26 L32 S33 K34	S26-E30 PolarHBondContact O-N 3.25Å; S26-E30 VanDerWaalsContact O-N 3.08Å; E30-L32 VanDerWaalsContact C-N 3.29Å; E30-L32 PolarHBondContact O-N 2.8Å; E30-S33 PolarHBondContact O-N 3.48Å; E30-S33 VanDerWaalsContact O-N 3.13Å; E30-S33 PolarHBondContact O-OG 3.24Å; E30-K34 HydrophobicContact CG-CD 4.41Å; E30-K34 PolarHBondContact O-N 3.06Å; E30-K34 WeakPolarHBondContact OE1-CE 3.46Å; E30-K34 IonicContact OE1-NZ 2.79Å; E30-K34 PolarHBondContact OE1-NZ 2.73Å
31	S	88.4	Confident	80.2	Confident	39 Å²	39	89 Å²	89	27%	0.273	49%	0.491	S	S	.	.	H	α-helix	trans	-59.9	-40	178	-56.6	0	0	0	0	112	P27 K34 A35	P27-S31 WeakPolarHBondContact O-CB 3.2Å; P27-S31 PolarHBondContact O-N 2.9Å; P27-S31 PolarHBondContact O-OG 2.71Å; S31-K34 PolarHBondContact O-N 2.84Å; S31-A35 WeakPolarHBondContact O-CB 3.3Å; S31-A35 PolarHBondContact O-N 3.47Å
32	L	89.5	Confident	81.9	Confident	75 Å²	75	85.1 Å²	85.1	39%	0.393	46%	0.458	S	S	.	.	H	α-helix	trans	-64.8	-42.5	175.1	-74.6	168.7	0	0	0	112.2	R28 Q29 E30 A35 Q36 F62 L81	R28-L32 HydrophobicContact CG-CD1 4.45Å; R28-L32 VanDerWaalsContact O-CG 3.3Å; R28-L32 WeakPolarHBondContact O-CG 3.41Å; R28-L32 PolarHBondContact O-N 3.01Å; R28-L32 VanDerWaalsContact O-N 3.12Å; Q29-L32 PolarHBondContact O-N 3Å; E30-L32 VanDerWaalsContact C-N 3.29Å; E30-L32 PolarHBondContact O-N 2.8Å; L32-A35 PolarHBondContact O-N 3.12Å; L32-Q36 WeakPolarHBondContact O-CB 3.38Å; L32-Q36 PolarHBondContact O-N 2.68Å; L32-F62 HydrophobicContact CD2-CZ 4.49Å; L32-L81 HydrophobicContact CD2-CD2 3.85Å; L32-L81 HydrophobicContact CG-CD2 4.4Å
33	S	88.4	Confident	83.6	Confident	55 Å²	55	77.2 Å²	77.2	39%	0.385	42%	0.419	S	S	.	.	H	α-helix	trans	-64.8	-39.9	177.6	62.8	0	0	0	0	112.5	Q29 E30 Q36 N37	Q29-S33 PolarHBondContact O-N 3.01Å; Q29-S33 PolarHBondContact O-OG 3.24Å; E30-S33 PolarHBondContact O-N 3.48Å; E30-S33 VanDerWaalsContact O-N 3.13Å; E30-S33 PolarHBondContact O-OG 3.24Å; S33-Q36 PolarHBondContact O-N 2.61Å; S33-N37 PolarHBondContact O-N 3.15Å
34	K	90.4	Very high	84.7	Confident	123 Å²	123	72.9 Å²	72.9	54%	0.535	39%	0.392	S	S	.	.	H	α-helix	trans	-62.9	-47.9	175.5	-75.4	174.2	168.3	171.2	0	111.3	E30 S31 Q36 N37 Y38	E30-K34 HydrophobicContact CG-CD 4.41Å; E30-K34 PolarHBondContact O-N 3.06Å; E30-K34 WeakPolarHBondContact OE1-CE 3.46Å; E30-K34 IonicContact OE1-NZ 2.79Å; E30-K34 PolarHBondContact OE1-NZ 2.73Å; S31-K34 PolarHBondContact O-N 2.84Å; K34-Q36 VanDerWaalsContact C-N 3.3Å; K34-Q36 PolarHBondContact O-N 3.12Å; K34-N37 PolarHBondContact O-N 3.24Å; K34-Y38 WeakPolarHBondContact O-CB 3.28Å; K34-Y38 PolarHBondContact O-N 2.98Å
35	A	92.7	Very high	84.9	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.008	38%	0.381	C	S	.	.	H	α-helix	trans	-61.4	-39.6	176.5	0	0	0	0	0	112.1	S31 L32 Y38 L39 F62 L81 M89	S31-A35 WeakPolarHBondContact O-CB 3.3Å; S31-A35 PolarHBondContact O-N 3.47Å; L32-A35 PolarHBondContact O-N 3.12Å; A35-Y38 PolarHBondContact O-N 3.49Å; A35-L39 VanDerWaalsContact O-CG 3.28Å; A35-L39 WeakPolarHBondContact O-CG 3.35Å; A35-L39 PolarHBondContact O-N 3.06Å; A35-F62 HydrophobicContact CB-CE2 4.18Å; A35-F62 HydrophobicContact CB-CZ 4.06Å; A35-L81 HydrophobicContact CB-CD1 3.66Å; A35-L81 HydrophobicContact CB-CD2 3.67Å; A35-L81 HydrophobicContact CB-CG 4.34Å; A35-M89 HydrophobicContact CB-CE 4.42Å; A35-M89 HydrophobicContact CB-SD 3.8Å
36	Q	90.9	Very high	84.1	Confident	124 Å²	124	74 Å²	74	58%	0.579	39%	0.387	S	S	*	.	H	α-helix	trans	-65.2	-40.9	177.9	-173.2	166.7	4.3	0	0	112.2	L32 S33 K34 S40 F62	L32-Q36 WeakPolarHBondContact O-CB 3.38Å; L32-Q36 PolarHBondContact O-N 2.68Å; S33-Q36 PolarHBondContact O-N 2.61Å; K34-Q36 VanDerWaalsContact C-N 3.3Å; K34-Q36 PolarHBondContact O-N 3.12Å; Q36-S40 VanDerWaalsContact O-CB 3.29Å; Q36-S40 WeakPolarHBondContact O-CB 3.47Å; Q36-S40 PolarHBondContact O-N 2.94Å; Q36-F62 HydrophobicContact CB-CD2 4.49Å; Q36-F62 HydrophobicContact CB-CE2 4.29Å
37	N	89.6	Confident	82.1	Confident	108 Å²	108	73.6 Å²	73.6	58%	0.578	39%	0.393	S	S	*	.	H	α-helix	trans	-63.8	-46.5	174.3	-69.4	-11.1	0	0	0	111.1	S33 K34 L39 S40 Q41	S33-N37 PolarHBondContact O-N 3.15Å; K34-N37 PolarHBondContact O-N 3.24Å; N37-L39 PolarHBondContact O-N 3.16Å; N37-S40 PolarHBondContact O-N 2.92Å; N37-Q41 WeakPolarHBondContact O-CB 3.45Å; N37-Q41 PolarHBondContact O-N 3.32Å
38	Y	93.3	Very high	80.1	Confident	18 Å²	18	75.2 Å²	75.2	7%	0.071	40%	0.4	C	S	.	.	H	α-helix	trans	-55.1	-52.9	176.9	-175	-79.6	0	0	0	111.7	K34 A35 S40 Q41 F42 F43 M69 M89 R93	K34-Y38 WeakPolarHBondContact O-CB 3.28Å; K34-Y38 PolarHBondContact O-N 2.98Å; A35-Y38 PolarHBondContact O-N 3.49Å; Y38-S40 VanDerWaalsContact C-N 3.31Å; Y38-S40 PolarHBondContact O-N 3.33Å; Y38-Q41 PolarHBondContact O-N 3.03Å; Y38-F42 AromaticContact CD1-CD2 3.88Å; Y38-F42 HydrophobicContact CD1-CD2 3.88Å; Y38-F42 AromaticContact CD2-CD2 3.67Å; Y38-F42 HydrophobicContact CD2-CD2 3.67Å; Y38-F42 AromaticContact CD2-CE2 3.6Å; Y38-F42 HydrophobicContact CD2-CE2 3.6Å; Y38-F42 AromaticContact CE1-CD2 3.87Å; Y38-F42 HydrophobicContact CE1-CD2 3.87Å; Y38-F42 AromaticContact CE2-CD2 3.68Å; Y38-F42 HydrophobicContact CE2-CD2 3.68Å; Y38-F42 AromaticContact CE2-CE2 3.73Å; Y38-F42 HydrophobicContact CE2-CE2 3.73Å; Y38-F42 AromaticContact CG-CD2 3.76Å; Y38-F42 HydrophobicContact CG-CD2 3.76Å; Y38-F42 HydrophobicContact CG-CE2 4.07Å; Y38-F42 AromaticContact CZ-CD2 3.78Å; Y38-F42 WeakPolarHBondContact O-CD2 3.27Å; Y38-F42 PolarHBondContact O-N 3.33Å; Y38-F43 HydrophobicContact CE1-CD2 4.17Å; Y38-F43 AromaticContact CE1-CE2 3.87Å; Y38-F43 HydrophobicContact CE1-CE2 3.87Å; Y38-M69 HydrophobicContact CE1-CE 3.96Å; Y38-M69 HydrophobicContact CE1-CG 4.05Å; Y38-M89 HydrophobicContact CD1-CE 3.85Å; Y38-M89 HydrophobicContact CD1-CG 3.81Å; Y38-M89 HydrophobicContact CD1-SD 4.15Å; Y38-M89 HydrophobicContact CD2-CB 3.93Å; Y38-M89 HydrophobicContact CD2-CG 4.04Å; Y38-M89 HydrophobicContact CE1-CE 4.34Å; Y38-M89 HydrophobicContact CE1-CG 3.92Å; Y38-M89 HydrophobicContact CE2-CB 4.05Å; Y38-M89 HydrophobicContact CE2-CG 4.14Å; Y38-M89 HydrophobicContact CG-CB 4.22Å; Y38-M89 HydrophobicContact CG-CE 4.46Å; Y38-M89 HydrophobicContact CG-CG 3.88Å; Y38-M89 HydrophobicContact CG-SD 4.19Å; Y38-R93 PolarHBondContact OH-NH1 2.98Å
39	L	92.7	Very high	77.7	Confident	8 Å²	8	70.2 Å²	70.2	4%	0.042	40%	0.401	C	S	.	.	H	α-helix	trans	-64	-37.5	179.5	-65.7	176.8	0	0	0	112	A35 N37 Q41 F43 S44 F62 T65 L66 M69 M89	A35-L39 VanDerWaalsContact O-CG 3.28Å; A35-L39 WeakPolarHBondContact O-CG 3.35Å; A35-L39 PolarHBondContact O-N 3.06Å; N37-L39 PolarHBondContact O-N 3.16Å; L39-Q41 VanDerWaalsContact C-N 3.3Å; L39-Q41 PolarHBondContact O-N 3.47Å; L39-F43 HydrophobicContact CD2-CB 4.43Å; L39-F43 HydrophobicContact CD2-CD2 4.24Å; L39-F43 HydrophobicContact CD2-CG 4.45Å; L39-F43 CarbonylContact O-C 3.37Å; L39-F43 WeakPolarHBondContact O-CA 3.48Å; L39-F43 WeakPolarHBondContact O-CB 2.98Å; L39-F43 PolarHBondContact O-N 3.43Å; L39-S44 PolarHBondContact O-N 2.92Å; L39-F62 HydrophobicContact CD1-CD2 3.73Å; L39-F62 HydrophobicContact CD1-CE2 3.55Å; L39-F62 HydrophobicContact CD1-CG 4.45Å; L39-F62 HydrophobicContact CD1-CZ 4.12Å; L39-T65 HydrophobicContact CB-CG2 3.97Å; L39-T65 HydrophobicContact CD1-CG2 4.44Å; L39-T65 HydrophobicContact CD2-CG2 4.16Å; L39-T65 HydrophobicContact CG-CG2 4.41Å; L39-L66 HydrophobicContact CD1-CB 4.13Å; L39-L66 HydrophobicContact CD1-CD1 4.2Å; L39-L66 HydrophobicContact CD2-CD1 4.25Å; L39-M69 HydrophobicContact CD2-CB 3.68Å; L39-M69 HydrophobicContact CD2-CG 4.06Å; L39-M89 HydrophobicContact CD2-CE 3.79Å; L39-M89 HydrophobicContact CG-CE 4.09Å
40	S	88.1	Confident	75.2	Confident	79 Å²	79	69.7 Å²	69.7	55%	0.552	41%	0.412	S	S	*	.	H	α-helix	trans	-64.6	-36.2	176.7	-173.7	0	0	0	0	112.3	Q36 N37 Y38 S44	Q36-S40 VanDerWaalsContact O-CB 3.29Å; Q36-S40 WeakPolarHBondContact O-CB 3.47Å; Q36-S40 PolarHBondContact O-N 2.94Å; N37-S40 PolarHBondContact O-N 2.92Å; Y38-S40 VanDerWaalsContact C-N 3.31Å; Y38-S40 PolarHBondContact O-N 3.33Å; S40-S44 WeakPolarHBondContact O-CB 3.45Å; S40-S44 PolarHBondContact O-OG 2.64Å
41	Q	87.9	Confident	73.1	Confident	76 Å²	76	71 Å²	71	36%	0.355	43%	0.428	S	S	.	.	H	α-helix	trans	-78.4	-49	-177.7	-172.7	170.7	-6.1	0	0	111.5	N37 Y38 L39 N97	N37-Q41 WeakPolarHBondContact O-CB 3.45Å; N37-Q41 PolarHBondContact O-N 3.32Å; Y38-Q41 PolarHBondContact O-N 3.03Å; L39-Q41 VanDerWaalsContact C-N 3.3Å; L39-Q41 PolarHBondContact O-N 3.47Å; Q41-N97 PolarHBondContact O-ND2 3.05Å
42	F	92.4	Very high	70.7	Confident	6 Å²	6	74.4 Å²	74.4	3%	0.026	45%	0.451	C	S	.	.	H	α-helix	trans	-101.7	-20.2	-168.4	-52.3	-62.2	0	0	0	114.7	Y38 R93 N97 D98 V182	Y38-F42 AromaticContact CD1-CD2 3.88Å; Y38-F42 HydrophobicContact CD1-CD2 3.88Å; Y38-F42 AromaticContact CD2-CD2 3.67Å; Y38-F42 HydrophobicContact CD2-CD2 3.67Å; Y38-F42 AromaticContact CD2-CE2 3.6Å; Y38-F42 HydrophobicContact CD2-CE2 3.6Å; Y38-F42 AromaticContact CE1-CD2 3.87Å; Y38-F42 HydrophobicContact CE1-CD2 3.87Å; Y38-F42 AromaticContact CE2-CD2 3.68Å; Y38-F42 HydrophobicContact CE2-CD2 3.68Å; Y38-F42 AromaticContact CE2-CE2 3.73Å; Y38-F42 HydrophobicContact CE2-CE2 3.73Å; Y38-F42 AromaticContact CG-CD2 3.76Å; Y38-F42 HydrophobicContact CG-CD2 3.76Å; Y38-F42 HydrophobicContact CG-CE2 4.07Å; Y38-F42 AromaticContact CZ-CD2 3.78Å; Y38-F42 WeakPolarHBondContact O-CD2 3.27Å; Y38-F42 PolarHBondContact O-N 3.33Å; F42-R93 VanDerWaalsContact CD1-CZ 3.45Å; F42-R93 VanDerWaalsContact CG-NH1 3.25Å; F42-R93 HydrophobicContact CZ-CG 4.33Å; F42-N97 CarbonylContact O-C 3.6Å; F42-N97 VanDerWaalsContact O-CG 3.27Å; F42-N97 PolarHBondContact O-OD1 3.44Å; F42-N97 VanDerWaalsContact O-OD1 3.12Å; F42-D98 PolarHBondContact O-N 3.14Å; F42-V182 HydrophobicContact CE1-CG2 4.23Å; F42-V182 HydrophobicContact CZ-CG2 3.76Å
43	F	89.4	Confident	68.3	Low	2 Å²	2	76.2 Å²	76.2	1%	0.009	47%	0.471	C	S	.	.	S	Bend	trans	-123	7.1	-173.7	-73.8	-91.3	0	0	0	114.2	Y38 L39 T65 K68 M69 F72 F73 D98 M99	Y38-F43 HydrophobicContact CE1-CD2 4.17Å; Y38-F43 AromaticContact CE1-CE2 3.87Å; Y38-F43 HydrophobicContact CE1-CE2 3.87Å; L39-F43 HydrophobicContact CD2-CB 4.43Å; L39-F43 HydrophobicContact CD2-CD2 4.24Å; L39-F43 HydrophobicContact CD2-CG 4.45Å; L39-F43 CarbonylContact O-C 3.37Å; L39-F43 WeakPolarHBondContact O-CA 3.48Å; L39-F43 WeakPolarHBondContact O-CB 2.98Å; L39-F43 PolarHBondContact O-N 3.43Å; F43-T65 HydrophobicContact CB-CG2 3.52Å; F43-K68 HydrophobicContact CD1-CB 4.41Å; F43-M69 HydrophobicContact CD1-CB 4.04Å; F43-M69 HydrophobicContact CD2-CB 3.93Å; F43-M69 HydrophobicContact CD2-CG 3.94Å; F43-M69 VanDerWaalsContact CE1-CA 3.4Å; F43-M69 HydrophobicContact CE1-CB 3.85Å; F43-M69 HydrophobicContact CE1-CG 4.29Å; F43-M69 HydrophobicContact CE2-CB 3.73Å; F43-M69 HydrophobicContact CE2-CG 3.4Å; F43-M69 HydrophobicContact CG-CB 4.1Å; F43-M69 HydrophobicContact CZ-CB 3.7Å; F43-M69 HydrophobicContact CZ-CG 3.61Å; F43-F72 HydrophobicContact CE1-CB 3.84Å; F43-F72 HydrophobicContact CE1-CD2 4.47Å; F43-F72 HydrophobicContact CE1-CG 4.16Å; F43-F72 HydrophobicContact CZ-CB 3.99Å; F43-F72 HydrophobicContact CZ-CD1 4.41Å; F43-F72 HydrophobicContact CZ-CG 4.11Å; F43-F73 HydrophobicContact CE2-CE2 4.13Å; F43-F73 HydrophobicContact CZ-CD2 4.31Å; F43-F73 AromaticContact CZ-CE2 3.93Å; F43-F73 HydrophobicContact CZ-CE2 3.93Å; F43-D98 HydrophobicContact CD1-CB 4.38Å; F43-D98 HydrophobicContact CE1-CB 3.78Å; F43-D98 HydrophobicContact CE2-CB 3.99Å; F43-D98 WeakPolarHBondContact CE2-OD2 3.44Å; F43-D98 HydrophobicContact CZ-CB 3.56Å; F43-D98 WeakPolarHBondContact CZ-OD2 3.37Å; F43-M99 HydrophobicContact CB-CG 4.13Å; F43-M99 HydrophobicContact CD1-CG 3.61Å; F43-M99 HydrophobicContact CD1-SD 3.82Å; F43-M99 HydrophobicContact CE1-CG 4.37Å; F43-M99 HydrophobicContact CE1-SD 4.24Å; F43-M99 HydrophobicContact CG-CG 4.23Å
44	S	75.9	Confident	65.7	Low	39 Å²	39	80.4 Å²	80.4	27%	0.273	49%	0.493	S	S	.	.			trans	-72.7	133.7	171.3	61.3	0	0	0	0	109.8	L39 S40 V46 N97	L39-S44 PolarHBondContact O-N 2.92Å; S40-S44 WeakPolarHBondContact O-CB 3.45Å; S40-S44 PolarHBondContact O-OG 2.64Å; S44-V46 PolarHBondContact O-N 3.22Å; S44-N97 PolarHBondContact O-ND2 3.42Å
45	E	63.3	Low	63	Low	128 Å²	128	82.2 Å²	82.2	60%	0.598	51%	0.506	S	S	*	.	S	Bend	trans	-70.4	14.6	179.7	-64.5	-167.2	164.8	0	0	113.7	K68	E45-K68 IonicContact OE1-NZ 2.87Å; E45-K68 PolarHBondContact OE1-NZ 3.28Å
46	V	49	Very low	60.4	Low	101 Å²	101	93.7 Å²	93.7	61%	0.612	55%	0.549	S	S	*	.			trans	-119.8	85.5	-176.5	-161.5	0	0	0	0	108.6	S44 V48	S44-V46 PolarHBondContact O-N 3.22Å; V46-V48 PolarHBondContact O-N 3.31Å
47	G	38	Very low	57.9	Low	58 Å²	58	91.8 Å²	91.8	60%	0.598	55%	0.549	S	S	*	.			trans	-54.2	129.1	162.4	0	0	0	0	0	109.1	A49	G47-A49 PolarHBondContact O-N 3.15Å
48	V	34.8	Very low	55.8	Low	131 Å²	131	91.3 Å²	91.3	79%	0.794	55%	0.554	S	S	*	*	S	Bend	trans	-71	95.6	-169.2	-163.6	0	0	0	0	109.8	V46	V46-V48 PolarHBondContact O-N 3.31Å
49	A	29.4	Very low	54.1	Low	92 Å²	92	97.5 Å²	97.5	76%	0.76	59%	0.587	S	S	*	*			trans	-138.8	103.1	160	0	0	0	0	0	110.2	G47	G47-A49 PolarHBondContact O-N 3.15Å
50	S	28.6	Very low	52.9	Low	119 Å²	119	99.7 Å²	99.7	83%	0.832	60%	0.599	S	S	*	*			trans	83.6	134.1	162.1	-126.2	0	0	0	0	119.7
51	P	41.3	Very low	52.7	Low	109 Å²	109	98.6 Å²	98.6	71%	0.708	59%	0.592	S	S	*	*	S	Bend	trans	-79.6	143.9	175.7	33.2	-31.1	0	0	0	110.3
52	S	38.6	Very low	52.7	Low	110 Å²	110	97.8 Å²	97.8	77%	0.769	59%	0.587	S	S	*	*	S	Bend	trans	90.7	119.5	170.2	-31.2	0	0	0	0	115.2
53	S	39	Very low	52.7	Low	114 Å²	114	101.6 Å²	101.6	80%	0.797	61%	0.608	S	S	*	*			trans	93.6	59.9	150.7	-27.8	0	0	0	0	118.2
54	V	34.5	Very low	52.7	Low	142 Å²	142	104.9 Å²	104.9	86%	0.861	63%	0.626	S	S	*	*			trans	-140.2	135.5	149.7	-169.5	0	0	0	0	110.3	R56	V54-R56 PolarHBondContact O-N 2.66Å
55	M	33.4	Very low	53.4	Low	161 Å²	161	104 Å²	104	79%	0.793	62%	0.618	S	S	*	*			trans	-43.1	123.5	-179.9	-85.9	169.7	74.3	0	0	113	S57	M55-S57 PolarHBondContact O-N 2.73Å
56	R	39.1	Very low	54.9	Low	243 Å²	243	97.9 Å²	97.9	92%	0.917	59%	0.59	S	S	*	*			trans	-68.1	65	166.3	-76.3	179.7	164.8	170.7	-4.6	111.4	V54	V54-R56 PolarHBondContact O-N 2.66Å
57	S	37.4	Very low	57	Low	84 Å²	84	97.7 Å²	97.7	59%	0.587	58%	0.578	S	S	*	*			trans	-130.1	73.9	179.5	59.7	0	0	0	0	111	M55	M55-S57 PolarHBondContact O-N 2.73Å
58	S	45.3	Very low	59.6	Low	97 Å²	97	97.3 Å²	97.3	68%	0.678	56%	0.56	S	S	*	*			trans	151.2	64.2	150.8	-173.8	0	0	0	0	109.1	D60	S58-D60 PolarHBondContact O-N 3.48Å
59	L	56.8	Low	62.5	Low	148 Å²	148	91.1 Å²	91.1	78%	0.775	52%	0.522	S	S	*	.	P	Polyproline II helix	trans	-79.7	117	167	-67.7	175.8	0	0	0	106.8
60	D	67.8	Low	65.8	Low	54 Å²	54	86.7 Å²	86.7	29%	0.289	49%	0.486	S	S	.	.	P	Polyproline II helix	trans	-47.2	144.5	166.9	-76.1	-22.5	0	0	0	110.3	S58 D64 T65 K68	S58-D60 PolarHBondContact O-N 3.48Å; D60-D64 HydrophobicContact CB-CB 4.04Å; D60-T65 WeakPolarHBondContact CB-OG1 3.26Å; D60-K68 IonicContact OD1-NZ 2.7Å; D60-K68 WeakPolarHBondContact OD2-CE 3.29Å; D60-K68 IonicContact OD2-NZ 3.83Å; D60-K68 PolarHBondContact OD2-NZ 3.11Å
61	S	84.6	Confident	68.9	Low	56 Å²	56	87.1 Å²	87.1	39%	0.392	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-66.1	157.1	170.4	78.6	0	0	0	0	109.8	N63 D64 T65	S61-N63 PolarHBondContact O-N 3.22Å; S61-N63 VanDerWaalsContact O-N 3.1Å; S61-D64 VanDerWaalsContact CB-OD2 3.31Å; S61-D64 WeakPolarHBondContact CB-OD2 3.5Å; S61-D64 PolarHBondContact N-OD2 2.91Å; S61-D64 PolarHBondContact O-N 3.06Å; S61-D64 PolarHBondContact OG-N 2.94Å; S61-D64 PolarHBondContact OG-OD2 2.82Å; S61-T65 PolarHBondContact O-N 3.23Å; S61-T65 PolarHBondContact O-OG1 2.93Å
62	F	88.6	Confident	71.5	Confident	60 Å²	60	82.6 Å²	82.6	26%	0.263	44%	0.444	S	S	.	.	H	α-helix	trans	-48	-42.3	174.4	172.7	-90	0	0	0	112.2	L32 A35 Q36 L39 L66	L32-F62 HydrophobicContact CD2-CZ 4.49Å; A35-F62 HydrophobicContact CB-CE2 4.18Å; A35-F62 HydrophobicContact CB-CZ 4.06Å; Q36-F62 HydrophobicContact CB-CD2 4.49Å; Q36-F62 HydrophobicContact CB-CE2 4.29Å; L39-F62 HydrophobicContact CD1-CD2 3.73Å; L39-F62 HydrophobicContact CD1-CE2 3.55Å; L39-F62 HydrophobicContact CD1-CG 4.45Å; L39-F62 HydrophobicContact CD1-CZ 4.12Å; F62-L66 HydrophobicContact CE1-CD2 3.88Å; F62-L66 HydrophobicContact CZ-CD2 4.32Å; F62-L66 VanDerWaalsContact O-CB 3.24Å; F62-L66 WeakPolarHBondContact O-CB 3.36Å; F62-L66 PolarHBondContact O-N 2.77Å
63	N	91.3	Very high	74.2	Confident	85 Å²	85	77.8 Å²	77.8	46%	0.455	41%	0.409	S	S	.	.	H	α-helix	trans	-68.8	-34.5	-179.8	-66.5	-8.6	0	0	0	112.3	S61 L66 R67 G79	S61-N63 PolarHBondContact O-N 3.22Å; S61-N63 VanDerWaalsContact O-N 3.1Å; N63-L66 PolarHBondContact O-N 2.94Å; N63-R67 VanDerWaalsContact O-CG 3.3Å; N63-R67 WeakPolarHBondContact O-CG 3.48Å; N63-R67 PolarHBondContact O-N 3.39Å; N63-G79 PolarHBondContact OD1-O 3.21Å
64	D	90.1	Very high	76.9	Confident	72 Å²	72	75.6 Å²	75.6	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-71.2	-43.9	178.5	-58.9	-40.6	0	0	0	110.5	D60 S61 L66 R67 K68	D60-D64 HydrophobicContact CB-CB 4.04Å; S61-D64 VanDerWaalsContact CB-OD2 3.31Å; S61-D64 WeakPolarHBondContact CB-OD2 3.5Å; S61-D64 PolarHBondContact N-OD2 2.91Å; S61-D64 PolarHBondContact O-N 3.06Å; S61-D64 PolarHBondContact OG-N 2.94Å; S61-D64 PolarHBondContact OG-OD2 2.82Å; D64-L66 VanDerWaalsContact C-N 3.29Å; D64-L66 PolarHBondContact O-N 3.18Å; D64-R67 WeakPolarHBondContact O-CB 3.34Å; D64-R67 PolarHBondContact O-N 3.14Å; D64-K68 PolarHBondContact O-N 3.34Å
65	T	90.4	Very high	79.8	Confident	20 Å²	20	70.7 Å²	70.7	12%	0.123	37%	0.374	C	S	.	.	H	α-helix	trans	-63.1	-37.8	173.2	-44.9	0	0	0	0	111.4	L39 F43 D60 S61 R67 K68 M69	L39-T65 HydrophobicContact CB-CG2 3.97Å; L39-T65 HydrophobicContact CD1-CG2 4.44Å; L39-T65 HydrophobicContact CD2-CG2 4.16Å; L39-T65 HydrophobicContact CG-CG2 4.41Å; F43-T65 HydrophobicContact CB-CG2 3.52Å; D60-T65 WeakPolarHBondContact CB-OG1 3.26Å; S61-T65 PolarHBondContact O-N 3.23Å; S61-T65 PolarHBondContact O-OG1 2.93Å; T65-R67 VanDerWaalsContact C-N 3.35Å; T65-R67 PolarHBondContact O-N 2.97Å; T65-K68 WeakPolarHBondContact O-CB 3.3Å; T65-K68 PolarHBondContact O-N 3.29Å; T65-M69 PolarHBondContact O-N 3.49Å
66	L	93.9	Very high	82.9	Confident	0 Å²	0	70.5 Å²	70.5	0%	0	37%	0.37	C	S	.	.	H	α-helix	trans	-64.8	-38	175.1	-169.9	61.2	0	0	0	112.1	L39 F62 N63 D64 M69 Q70 Q80 L81 T85 M89	L39-L66 HydrophobicContact CD1-CB 4.13Å; L39-L66 HydrophobicContact CD1-CD1 4.2Å; L39-L66 HydrophobicContact CD2-CD1 4.25Å; F62-L66 HydrophobicContact CE1-CD2 3.88Å; F62-L66 HydrophobicContact CZ-CD2 4.32Å; F62-L66 VanDerWaalsContact O-CB 3.24Å; F62-L66 WeakPolarHBondContact O-CB 3.36Å; F62-L66 PolarHBondContact O-N 2.77Å; N63-L66 PolarHBondContact O-N 2.94Å; D64-L66 VanDerWaalsContact C-N 3.29Å; D64-L66 PolarHBondContact O-N 3.18Å; L66-M69 PolarHBondContact O-N 3.36Å; L66-Q70 WeakPolarHBondContact O-CB 3.48Å; L66-Q70 VanDerWaalsContact O-CG 3.31Å; L66-Q70 WeakPolarHBondContact O-CG 3.44Å; L66-Q70 PolarHBondContact O-N 3.25Å; L66-Q80 VanDerWaalsContact CD2-C 3.47Å; L66-L81 HydrophobicContact CD2-CB 4.31Å; L66-T85 HydrophobicContact CD1-CG2 3.69Å; L66-M89 HydrophobicContact CD1-CE 3.5Å
67	R	94.4	Very high	85.6	Confident	97 Å²	97	62 Å²	62	37%	0.366	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-42	173.2	-74.2	176	-171.9	-67.1	-10.1	111.8	N63 D64 T65 M69 Q70 E71 V77 T78	N63-R67 VanDerWaalsContact O-CG 3.3Å; N63-R67 WeakPolarHBondContact O-CG 3.48Å; N63-R67 PolarHBondContact O-N 3.39Å; D64-R67 WeakPolarHBondContact O-CB 3.34Å; D64-R67 PolarHBondContact O-N 3.14Å; T65-R67 VanDerWaalsContact C-N 3.35Å; T65-R67 PolarHBondContact O-N 2.97Å; R67-M69 VanDerWaalsContact C-N 3.32Å; R67-M69 PolarHBondContact O-N 3.24Å; R67-Q70 PolarHBondContact O-N 3.13Å; R67-E71 WeakPolarHBondContact O-CB 3.19Å; R67-E71 PolarHBondContact O-N 2.95Å; R67-V77 HydrophobicContact CB-CG1 3.66Å; R67-V77 HydrophobicContact CG-CG1 3.72Å; R67-V77 PolarHBondContact NH1-O 2.68Å; R67-T78 VanDerWaalsContact CZ-O 3.31Å; R67-T78 VanDerWaalsContact NH1-C 3.34Å; R67-T78 PolarHBondContact NH1-O 3.5Å; R67-T78 PolarHBondContact NH2-O 2.87Å
68	K	93.2	Very high	88.4	Confident	50 Å²	50	59.5 Å²	59.5	22%	0.217	33%	0.327	C	S	.	.	H	α-helix	trans	-60.6	-42.5	174.7	-68.9	177.6	172.7	-177.9	0	111.5	F43 E45 D60 D64 T65 E71 F72 M99	F43-K68 HydrophobicContact CD1-CB 4.41Å; E45-K68 IonicContact OE1-NZ 2.87Å; E45-K68 PolarHBondContact OE1-NZ 3.28Å; D60-K68 IonicContact OD1-NZ 2.7Å; D60-K68 WeakPolarHBondContact OD2-CE 3.29Å; D60-K68 IonicContact OD2-NZ 3.83Å; D60-K68 PolarHBondContact OD2-NZ 3.11Å; D64-K68 PolarHBondContact O-N 3.34Å; T65-K68 WeakPolarHBondContact O-CB 3.3Å; T65-K68 PolarHBondContact O-N 3.29Å; K68-E71 PolarHBondContact O-N 3.45Å; K68-F72 WeakPolarHBondContact O-CB 3.36Å; K68-F72 PolarHBondContact O-N 3.02Å; K68-M99 HydrophobicContact CB-SD 4.38Å; K68-M99 HydrophobicContact CD-CE 3.9Å; K68-M99 HydrophobicContact CD-SD 4.4Å
69	M	95.8	Very high	90.8	Very high	0 Å²	0	55 Å²	55	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.1	-47.3	175.2	-178.1	-88.3	175.5	0	0	112.2	Y38 L39 F43 T65 L66 R67 E71 F72 F73 T85 V88 M89	Y38-M69 HydrophobicContact CE1-CE 3.96Å; Y38-M69 HydrophobicContact CE1-CG 4.05Å; L39-M69 HydrophobicContact CD2-CB 3.68Å; L39-M69 HydrophobicContact CD2-CG 4.06Å; F43-M69 HydrophobicContact CD1-CB 4.04Å; F43-M69 HydrophobicContact CD2-CB 3.93Å; F43-M69 HydrophobicContact CD2-CG 3.94Å; F43-M69 VanDerWaalsContact CE1-CA 3.4Å; F43-M69 HydrophobicContact CE1-CB 3.85Å; F43-M69 HydrophobicContact CE1-CG 4.29Å; F43-M69 HydrophobicContact CE2-CB 3.73Å; F43-M69 HydrophobicContact CE2-CG 3.4Å; F43-M69 HydrophobicContact CG-CB 4.1Å; F43-M69 HydrophobicContact CZ-CB 3.7Å; F43-M69 HydrophobicContact CZ-CG 3.61Å; T65-M69 PolarHBondContact O-N 3.49Å; L66-M69 PolarHBondContact O-N 3.36Å; R67-M69 VanDerWaalsContact C-N 3.32Å; R67-M69 PolarHBondContact O-N 3.24Å; M69-E71 VanDerWaalsContact C-N 3.32Å; M69-E71 PolarHBondContact O-N 3.49Å; M69-F72 PolarHBondContact O-N 3.23Å; M69-F73 HydrophobicContact CE-CD2 3.51Å; M69-F73 HydrophobicContact CE-CE2 3.77Å; M69-F73 HydrophobicContact CE-CG 4.25Å; M69-F73 HydrophobicContact CG-CD2 4.02Å; M69-F73 HydrophobicContact CG-CE2 4.24Å; M69-F73 WeakPolarHBondContact O-CD2 3.47Å; M69-F73 PolarHBondContact O-N 2.87Å; M69-F73 VanDerWaalsContact O-N 3.08Å; M69-F73 HydrophobicContact SD-CD2 4.11Å; M69-T85 HydrophobicContact SD-CG2 3.99Å; M69-V88 HydrophobicContact CE-CB 4.16Å; M69-V88 HydrophobicContact CE-CG1 3.66Å; M69-M89 HydrophobicContact CE-CE 4.09Å; M69-M89 HydrophobicContact CE-CG 3.65Å; M69-M89 HydrophobicContact CG-CE 4.19Å; M69-M89 HydrophobicContact SD-CE 3.77Å
70	Q	97.1	Very high	92.6	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-59.5	-43.5	176.4	-74	172	-27	0	0	111.8	L66 R67 F73 G74 L75 E76 V77 T78 Q80 T85	L66-Q70 WeakPolarHBondContact O-CB 3.48Å; L66-Q70 VanDerWaalsContact O-CG 3.31Å; L66-Q70 WeakPolarHBondContact O-CG 3.44Å; L66-Q70 PolarHBondContact O-N 3.25Å; R67-Q70 PolarHBondContact O-N 3.13Å; Q70-F73 PolarHBondContact O-N 3.42Å; Q70-G74 PolarHBondContact O-N 3.07Å; Q70-G74 VanDerWaalsContact O-N 3.15Å; Q70-L75 HydrophobicContact CB-CB 4.04Å; Q70-L75 HydrophobicContact CG-CB 4.25Å; Q70-L75 HydrophobicContact CG-CD1 4.32Å; Q70-L75 PolarHBondContact O-N 3.49Å; Q70-E76 PolarHBondContact OE1-O 3.21Å; Q70-V77 HydrophobicContact CB-CG2 4.43Å; Q70-T78 PolarHBondContact NE2-OG1 3.07Å; Q70-T78 VanDerWaalsContact NE2-OG1 3.15Å; Q70-Q80 PolarHBondContact NE2-O 3.17Å; Q70-T85 HydrophobicContact CG-CG2 4.4Å; Q70-T85 PolarHBondContact NE2-OG1 2.88Å
71	E	95.2	Very high	93.8	Very high	127 Å²	127	54 Å²	54	59%	0.593	29%	0.287	S	S	*	.	H	α-helix	trans	-62	-44.2	175.7	-177.4	176.8	-164.7	0	0	111.7	R67 K68 M69 F73 G74 V77	R67-E71 WeakPolarHBondContact O-CB 3.19Å; R67-E71 PolarHBondContact O-N 2.95Å; K68-E71 PolarHBondContact O-N 3.45Å; M69-E71 VanDerWaalsContact C-N 3.32Å; M69-E71 PolarHBondContact O-N 3.49Å; E71-F73 VanDerWaalsContact C-N 3.32Å; E71-F73 PolarHBondContact O-N 3.2Å; E71-G74 PolarHBondContact O-N 3.25Å; E71-G74 VanDerWaalsContact O-N 3.17Å; E71-V77 HydrophobicContact CB-CG2 4.1Å
72	F	94.8	Very high	94.3	Very high	14 Å²	14	53.6 Å²	53.6	6%	0.061	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-43.2	179.1	-174.3	-77.5	0	0	0	112.4	F43 K68 M69 G74 D98 H230 S231 Q232 P240	F43-F72 HydrophobicContact CE1-CB 3.84Å; F43-F72 HydrophobicContact CE1-CD2 4.47Å; F43-F72 HydrophobicContact CE1-CG 4.16Å; F43-F72 HydrophobicContact CZ-CB 3.99Å; F43-F72 HydrophobicContact CZ-CD1 4.41Å; F43-F72 HydrophobicContact CZ-CG 4.11Å; K68-F72 WeakPolarHBondContact O-CB 3.36Å; K68-F72 PolarHBondContact O-N 3.02Å; M69-F72 PolarHBondContact O-N 3.23Å; F72-G74 VanDerWaalsContact C-N 3.31Å; F72-G74 PolarHBondContact O-N 3.28Å; F72-D98 HydrophobicContact CD2-CB 4.13Å; F72-D98 HydrophobicContact CE2-CB 3.96Å; F72-D98 HydrophobicContact CG-CB 4.48Å; F72-D98 HydrophobicContact CZ-CB 4.2Å; F72-H230 HydrophobicContact CZ-CB 3.84Å; F72-S231 WeakPolarHBondContact CZ-O 3.16Å; F72-Q232 HydrophobicContact CD1-CG 4.49Å; F72-Q232 HydrophobicContact CD2-CG 3.86Å; F72-Q232 HydrophobicContact CE1-CG 4.37Å; F72-Q232 HydrophobicContact CE2-CG 3.77Å; F72-Q232 HydrophobicContact CG-CG 4.21Å; F72-Q232 HydrophobicContact CZ-CG 4.02Å; F72-P240 HydrophobicContact CE1-CG 3.65Å; F72-P240 HydrophobicContact CZ-CG 4.3Å
73	F	96	Very high	94.6	Very high	10 Å²	10	55 Å²	55	4%	0.044	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	10.1	-179.5	-76	-80	0	0	0	113.7	F43 M69 Q70 E71 L75 V88 F239 P240 T241	F43-F73 HydrophobicContact CE2-CE2 4.13Å; F43-F73 HydrophobicContact CZ-CD2 4.31Å; F43-F73 AromaticContact CZ-CE2 3.93Å; F43-F73 HydrophobicContact CZ-CE2 3.93Å; M69-F73 HydrophobicContact CE-CD2 3.51Å; M69-F73 HydrophobicContact CE-CE2 3.77Å; M69-F73 HydrophobicContact CE-CG 4.25Å; M69-F73 HydrophobicContact CG-CD2 4.02Å; M69-F73 HydrophobicContact CG-CE2 4.24Å; M69-F73 WeakPolarHBondContact O-CD2 3.47Å; M69-F73 PolarHBondContact O-N 2.87Å; M69-F73 VanDerWaalsContact O-N 3.08Å; M69-F73 HydrophobicContact SD-CD2 4.11Å; Q70-F73 PolarHBondContact O-N 3.42Å; E71-F73 VanDerWaalsContact C-N 3.32Å; E71-F73 PolarHBondContact O-N 3.2Å; F73-L75 HydrophobicContact CB-CD1 4.39Å; F73-L75 HydrophobicContact CB-CG 4.09Å; F73-L75 PolarHBondContact O-N 2.94Å; F73-V88 HydrophobicContact CB-CG1 4.22Å; F73-V88 HydrophobicContact CD1-CG1 3.52Å; F73-V88 HydrophobicContact CD2-CG1 4.08Å; F73-V88 HydrophobicContact CE1-CG1 3.81Å; F73-V88 HydrophobicContact CE2-CG1 4.32Å; F73-V88 HydrophobicContact CG-CG1 3.67Å; F73-V88 HydrophobicContact CZ-CG1 4.2Å; F73-F239 HydrophobicContact CD1-CE1 4.41Å; F73-F239 HydrophobicContact CD1-CE2 4.38Å; F73-F239 AromaticContact CD1-CZ 3.68Å; F73-F239 HydrophobicContact CD1-CZ 3.68Å; F73-F239 HydrophobicContact CE1-CE1 4.25Å; F73-F239 AromaticContact CE1-CZ 3.85Å; F73-F239 HydrophobicContact CE1-CZ 3.85Å; F73-P240 HydrophobicContact CE1-CG 3.74Å; F73-P240 HydrophobicContact CZ-CB 4.48Å; F73-P240 HydrophobicContact CZ-CG 3.62Å; F73-T241 HydrophobicContact CE1-CG2 3.71Å; F73-T241 HydrophobicContact CZ-CG2 4.2Å
74	G	95.3	Very high	94.8	Very high	68 Å²	68	55.4 Å²	55.4	70%	0.701	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.5	21.6	178.7	0	0	0	0	0	114.8	Q70 E71 F72	Q70-G74 PolarHBondContact O-N 3.07Å; Q70-G74 VanDerWaalsContact O-N 3.15Å; E71-G74 PolarHBondContact O-N 3.25Å; E71-G74 VanDerWaalsContact O-N 3.17Å; F72-G74 VanDerWaalsContact C-N 3.31Å; F72-G74 PolarHBondContact O-N 3.28Å
75	L	96.3	Very high	95.1	Very high	39 Å²	39	52 Å²	52	20%	0.204	28%	0.281	C	S	.	.			trans	-79.3	166.4	176.8	-57.7	-179.6	0	0	0	111.6	Q70 F73 V77 V88	Q70-L75 HydrophobicContact CB-CB 4.04Å; Q70-L75 HydrophobicContact CG-CB 4.25Å; Q70-L75 HydrophobicContact CG-CD1 4.32Å; Q70-L75 PolarHBondContact O-N 3.49Å; F73-L75 HydrophobicContact CB-CD1 4.39Å; F73-L75 HydrophobicContact CB-CG 4.09Å; F73-L75 PolarHBondContact O-N 2.94Å; L75-V77 PolarHBondContact O-N 3.03Å; L75-V88 HydrophobicContact CD1-CB 4.49Å; L75-V88 HydrophobicContact CD1-CG2 4.19Å; L75-V88 HydrophobicContact CD2-CG2 4.19Å
76	E	96.7	Very high	95.4	Very high	156 Å²	156	53.8 Å²	53.8	73%	0.729	29%	0.289	S	S	*	.			trans	-63.3	121.1	168.7	-169.5	-179.1	171.1	0	0	109.9	Q70 T78	Q70-E76 PolarHBondContact OE1-O 3.21Å; E76-T78 VanDerWaalsContact C-N 3.29Å; E76-T78 HydrophobicContact CB-CG2 4.2Å; E76-T78 HydrophobicContact CG-CG2 3.8Å; E76-T78 PolarHBondContact O-N 2.96Å
77	V	97.6	Very high	95.5	Very high	66 Å²	66	59 Å²	59	40%	0.4	31%	0.314	S	S	.	.			trans	-79.8	76.7	-174.2	-172.9	0	0	0	0	110.6	R67 Q70 E71 L75	R67-V77 HydrophobicContact CB-CG1 3.66Å; R67-V77 HydrophobicContact CG-CG1 3.72Å; R67-V77 PolarHBondContact NH1-O 2.68Å; Q70-V77 HydrophobicContact CB-CG2 4.43Å; E71-V77 HydrophobicContact CB-CG2 4.1Å; L75-V77 PolarHBondContact O-N 3.03Å
78	T	96.2	Very high	95.6	Very high	30 Å²	30	54.8 Å²	54.8	18%	0.184	30%	0.299	C	S	.	.			trans	-90.8	-25.8	-177.3	64.8	0	0	0	0	112.9	R67 Q70 E76 Q80 D82	R67-T78 VanDerWaalsContact CZ-O 3.31Å; R67-T78 VanDerWaalsContact NH1-C 3.34Å; R67-T78 PolarHBondContact NH1-O 3.5Å; R67-T78 PolarHBondContact NH2-O 2.87Å; Q70-T78 PolarHBondContact NE2-OG1 3.07Å; Q70-T78 VanDerWaalsContact NE2-OG1 3.15Å; E76-T78 VanDerWaalsContact C-N 3.29Å; E76-T78 HydrophobicContact CB-CG2 4.2Å; E76-T78 HydrophobicContact CG-CG2 3.8Å; E76-T78 PolarHBondContact O-N 2.96Å; T78-Q80 PolarHBondContact O-N 3.41Å; T78-Q80 PolarHBondContact OG1-N 2.91Å; T78-Q80 VanDerWaalsContact OG1-N 3.09Å; T78-Q80 PolarHBondContact OG1-O 3.28Å; T78-D82 PolarHBondContact OG1-OD2 3.02Å
79	G	93.9	Very high	95.7	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.031	29%	0.294	C	S	.	.	S	Bend	trans	64.6	19.2	-166.9	0	0	0	0	0	113	N63	N63-G79 PolarHBondContact OD1-O 3.21Å
80	Q	94.7	Very high	95.7	Very high	139 Å²	139	57.1 Å²	57.1	65%	0.65	32%	0.324	S	S	*	.	S	Bend	trans	-116.3	143.1	178.4	-59.6	-175.5	36.8	0	0	110.1	L66 Q70 T78 D82	L66-Q80 VanDerWaalsContact CD2-C 3.47Å; Q70-Q80 PolarHBondContact NE2-O 3.17Å; T78-Q80 PolarHBondContact O-N 3.41Å; T78-Q80 PolarHBondContact OG1-N 2.91Å; T78-Q80 VanDerWaalsContact OG1-N 3.09Å; T78-Q80 PolarHBondContact OG1-O 3.28Å; Q80-D82 VanDerWaalsContact C-N 3.29Å; Q80-D82 PolarHBondContact O-N 3.39Å
81	L	94.6	Very high	95.7	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.22	34%	0.34	C	S	.	.			trans	-79.9	79.8	176.7	-170	64.6	0	0	0	109.9	L32 A35 L66 T85 L86 M89	L32-L81 HydrophobicContact CD2-CD2 3.85Å; L32-L81 HydrophobicContact CG-CD2 4.4Å; A35-L81 HydrophobicContact CB-CD1 3.66Å; A35-L81 HydrophobicContact CB-CD2 3.67Å; A35-L81 HydrophobicContact CB-CG 4.34Å; L66-L81 HydrophobicContact CD2-CB 4.31Å; L81-T85 HydrophobicContact CD1-CG2 4.1Å; L81-L86 HydrophobicContact CD1-CD2 3.7Å; L81-L86 HydrophobicContact CD1-CG 3.87Å; L81-L86 HydrophobicContact CD2-CD2 4Å; L81-L86 HydrophobicContact CD2-CG 4.5Å; L81-L86 HydrophobicContact CG-CD1 4.25Å; L81-L86 HydrophobicContact CG-CD2 3.86Å; L81-L86 HydrophobicContact CG-CG 3.89Å; L81-M89 HydrophobicContact CD1-SD 4.14Å
82	D	94	Very high	95.8	Very high	48 Å²	48	57.1 Å²	57.1	26%	0.257	32%	0.323	S	S	.	.			trans	-87.2	175.2	176.1	59.6	45.1	0	0	0	112.8	T78 Q80 N84 T85 L86	T78-D82 PolarHBondContact OG1-OD2 3.02Å; Q80-D82 VanDerWaalsContact C-N 3.29Å; Q80-D82 PolarHBondContact O-N 3.39Å; D82-N84 VanDerWaalsContact C-N 3.34Å; D82-N84 PolarHBondContact O-N 3.44Å; D82-N84 PolarHBondContact OD1-N 2.79Å; D82-T85 PolarHBondContact O-N 3.46Å; D82-T85 WeakPolarHBondContact OD1-CB 3.39Å; D82-T85 PolarHBondContact OD1-N 3.3Å; D82-T85 PolarHBondContact OD1-OG1 3.04Å; D82-L86 WeakPolarHBondContact O-CG 3.16Å; D82-L86 PolarHBondContact O-N 3.01Å
83	S	95.2	Very high	96	Very high	88 Å²	88	56.6 Å²	56.6	62%	0.615	32%	0.321	S	S	*	.	H	α-helix	trans	-63.6	-36.9	-176.9	51.9	0	0	0	0	113.1	L86 E87	S83-L86 PolarHBondContact O-N 2.95Å; S83-E87 WeakPolarHBondContact O-CB 3.5Å; S83-E87 PolarHBondContact O-N 3.33Å
84	N	95.8	Very high	96.1	Very high	95 Å²	95	56.4 Å²	56.4	51%	0.508	32%	0.32	S	S	.	.	H	α-helix	trans	-69	-41.2	-179.2	-64.7	-3.7	0	0	0	110.1	D82 E87 V88	D82-N84 VanDerWaalsContact C-N 3.34Å; D82-N84 PolarHBondContact O-N 3.44Å; D82-N84 PolarHBondContact OD1-N 2.79Å; N84-E87 PolarHBondContact O-N 2.78Å; N84-V88 PolarHBondContact O-N 3.45Å; N84-V88 VanDerWaalsContact O-N 3.1Å
85	T	96.4	Very high	96.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-45.4	175.8	-54.6	0	0	0	0	111.3	L66 M69 Q70 L81 D82 E87 V88 M89	L66-T85 HydrophobicContact CD1-CG2 3.69Å; M69-T85 HydrophobicContact SD-CG2 3.99Å; Q70-T85 HydrophobicContact CG-CG2 4.4Å; Q70-T85 PolarHBondContact NE2-OG1 2.88Å; L81-T85 HydrophobicContact CD1-CG2 4.1Å; D82-T85 PolarHBondContact O-N 3.46Å; D82-T85 WeakPolarHBondContact OD1-CB 3.39Å; D82-T85 PolarHBondContact OD1-N 3.3Å; D82-T85 PolarHBondContact OD1-OG1 3.04Å; T85-E87 VanDerWaalsContact C-N 3.34Å; T85-E87 PolarHBondContact O-N 3.45Å; T85-V88 PolarHBondContact O-N 3.06Å; T85-M89 HydrophobicContact CG2-CE 3.91Å; T85-M89 HydrophobicContact CG2-SD 4.34Å; T85-M89 WeakPolarHBondContact O-CG 3.41Å; T85-M89 PolarHBondContact O-N 3.35Å
86	L	96.2	Very high	95.9	Very high	57 Å²	57	53.4 Å²	53.4	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-64.3	-36.7	176.4	-75.9	169.9	0	0	0	112.9	L81 D82 S83 M89 A90	L81-L86 HydrophobicContact CD1-CD2 3.7Å; L81-L86 HydrophobicContact CD1-CG 3.87Å; L81-L86 HydrophobicContact CD2-CD2 4Å; L81-L86 HydrophobicContact CD2-CG 4.5Å; L81-L86 HydrophobicContact CG-CD1 4.25Å; L81-L86 HydrophobicContact CG-CD2 3.86Å; L81-L86 HydrophobicContact CG-CG 3.89Å; D82-L86 WeakPolarHBondContact O-CG 3.16Å; D82-L86 PolarHBondContact O-N 3.01Å; S83-L86 PolarHBondContact O-N 2.95Å; L86-M89 PolarHBondContact O-N 2.77Å; L86-A90 WeakPolarHBondContact O-CB 3.33Å; L86-A90 PolarHBondContact O-N 3.3Å; L86-A90 VanDerWaalsContact O-N 3.13Å
87	E	95.8	Very high	95.6	Very high	110 Å²	110	47.2 Å²	47.2	51%	0.514	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-45.7	176.6	-169	-167.9	135.9	0	0	111.1	S83 N84 T85 A90 R91	S83-E87 WeakPolarHBondContact O-CB 3.5Å; S83-E87 PolarHBondContact O-N 3.33Å; N84-E87 PolarHBondContact O-N 2.78Å; T85-E87 VanDerWaalsContact C-N 3.34Å; T85-E87 PolarHBondContact O-N 3.45Å; E87-A90 PolarHBondContact O-N 3.1Å; E87-R91 IonicContact OE1-CZ 2.67Å; E87-R91 IonicContact OE1-NH2 3.4Å; E87-R91 PolarHBondContact OE1-NH2 3.34Å
88	V	96.6	Very high	95.3	Very high	9 Å²	9	44.6 Å²	44.6	6%	0.055	25%	0.246	C	C	.	.	H	α-helix	trans	-64.4	-44	176.8	173.8	0	0	0	0	111.5	M69 F73 L75 N84 T85 A90 R91	M69-V88 HydrophobicContact CE-CB 4.16Å; M69-V88 HydrophobicContact CE-CG1 3.66Å; F73-V88 HydrophobicContact CB-CG1 4.22Å; F73-V88 HydrophobicContact CD1-CG1 3.52Å; F73-V88 HydrophobicContact CD2-CG1 4.08Å; F73-V88 HydrophobicContact CE1-CG1 3.81Å; F73-V88 HydrophobicContact CE2-CG1 4.32Å; F73-V88 HydrophobicContact CG-CG1 3.67Å; F73-V88 HydrophobicContact CZ-CG1 4.2Å; L75-V88 HydrophobicContact CD1-CB 4.49Å; L75-V88 HydrophobicContact CD1-CG2 4.19Å; L75-V88 HydrophobicContact CD2-CG2 4.19Å; N84-V88 PolarHBondContact O-N 3.45Å; N84-V88 VanDerWaalsContact O-N 3.1Å; T85-V88 PolarHBondContact O-N 3.06Å; V88-A90 PolarHBondContact O-N 3.03Å; V88-R91 PolarHBondContact O-N 2.68Å; V88-R91 VanDerWaalsContact O-N 3.14Å
89	M	95.9	Very high	94.7	Very high	24 Å²	24	44.5 Å²	44.5	12%	0.118	24%	0.244	C	C	.	.	H	α-helix	trans	-62.8	-21.4	177.8	-72.6	-176.6	173.1	0	0	113.7	A35 Y38 L39 L66 M69 L81 T85 L86	A35-M89 HydrophobicContact CB-CE 4.42Å; A35-M89 HydrophobicContact CB-SD 3.8Å; Y38-M89 HydrophobicContact CD1-CE 3.85Å; Y38-M89 HydrophobicContact CD1-CG 3.81Å; Y38-M89 HydrophobicContact CD1-SD 4.15Å; Y38-M89 HydrophobicContact CD2-CB 3.93Å; Y38-M89 HydrophobicContact CD2-CG 4.04Å; Y38-M89 HydrophobicContact CE1-CE 4.34Å; Y38-M89 HydrophobicContact CE1-CG 3.92Å; Y38-M89 HydrophobicContact CE2-CB 4.05Å; Y38-M89 HydrophobicContact CE2-CG 4.14Å; Y38-M89 HydrophobicContact CG-CB 4.22Å; Y38-M89 HydrophobicContact CG-CE 4.46Å; Y38-M89 HydrophobicContact CG-CG 3.88Å; Y38-M89 HydrophobicContact CG-SD 4.19Å; L39-M89 HydrophobicContact CD2-CE 3.79Å; L39-M89 HydrophobicContact CG-CE 4.09Å; L66-M89 HydrophobicContact CD1-CE 3.5Å; M69-M89 HydrophobicContact CE-CE 4.09Å; M69-M89 HydrophobicContact CE-CG 3.65Å; M69-M89 HydrophobicContact CG-CE 4.19Å; M69-M89 HydrophobicContact SD-CE 3.77Å; L81-M89 HydrophobicContact CD1-SD 4.14Å; T85-M89 HydrophobicContact CG2-CE 3.91Å; T85-M89 HydrophobicContact CG2-SD 4.34Å; T85-M89 WeakPolarHBondContact O-CG 3.41Å; T85-M89 PolarHBondContact O-N 3.35Å; L86-M89 PolarHBondContact O-N 2.77Å
90	A	95.5	Very high	93.7	Very high	75 Å²	75	45.9 Å²	45.9	62%	0.62	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-3.8	179.7	0	0	0	0	0	113.6	L86 E87 V88	L86-A90 WeakPolarHBondContact O-CB 3.33Å; L86-A90 PolarHBondContact O-N 3.3Å; L86-A90 VanDerWaalsContact O-N 3.13Å; E87-A90 PolarHBondContact O-N 3.1Å; V88-A90 PolarHBondContact O-N 3.03Å
91	R	96.8	Very high	92.3	Very high	92 Å²	92	47.7 Å²	47.7	35%	0.347	26%	0.256	S	S	.	.	S	Bend	trans	-76.2	138	177.8	-68.5	176.3	-174.3	174.3	2.2	109.9	E87 V88 T241	E87-R91 IonicContact OE1-CZ 2.67Å; E87-R91 IonicContact OE1-NH2 3.4Å; E87-R91 PolarHBondContact OE1-NH2 3.34Å; V88-R91 PolarHBondContact O-N 2.68Å; V88-R91 VanDerWaalsContact O-N 3.14Å; R91-T241 HydrophobicContact CB-CG2 3.98Å
92	P	97.8	Very high	90.3	Very high	34 Å²	34	47.9 Å²	47.9	22%	0.221	25%	0.254	C	S	.	.			trans	-56.6	144.1	172	-19.9	29.8	0	0	0	110.5	N180 G181 L183 T241 Y242	P92-N180 HydrophobicContact CG-CB 4.41Å; P92-G181 CarbonylContact C-O 3.59Å; P92-G181 VanDerWaalsContact CA-O 3.23Å; P92-G181 WeakPolarHBondContact CA-O 3.42Å; P92-L183 HydrophobicContact CB-CD1 4.2Å; P92-L183 HydrophobicContact CB-CD2 3.91Å; P92-L183 HydrophobicContact CB-CG 4.06Å; P92-T241 CarbonylContact O-C 3.48Å; P92-T241 WeakPolarHBondContact O-CA 3.4Å; P92-Y242 WeakPolarHBondContact O-CB 3.27Å; P92-Y242 PolarHBondContact O-N 2.93Å
93	R	98.3	Very high	87.9	Confident	4 Å²	4	49.5 Å²	49.5	2%	0.015	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	171.1	-171	63.5	161.2	-65.7	162.1	8	113.7	Y38 F42 F96 D98 G181 V182 L183 H230 P240 T241	Y38-R93 PolarHBondContact OH-NH1 2.98Å; F42-R93 VanDerWaalsContact CD1-CZ 3.45Å; F42-R93 VanDerWaalsContact CG-NH1 3.25Å; F42-R93 HydrophobicContact CZ-CG 4.33Å; R93-F96 PolarHBondContact NH2-O 3.25Å; R93-D98 IonicContact CZ-OD1 3.19Å; R93-D98 IonicContact CZ-OD2 2.79Å; R93-D98 IonicContact NH1-OD1 3.41Å; R93-D98 IonicContact NH1-OD2 3.61Å; R93-D98 PolarHBondContact NH1-OD2 3.37Å; R93-D98 IonicContact NH2-OD1 3.47Å; R93-D98 PolarHBondContact NH2-OD1 2.96Å; R93-D98 IonicContact NH2-OD2 3.86Å; R93-D98 PolarHBondContact NH2-OD2 3.4Å; R93-G181 PolarHBondContact N-O 3.37Å; R93-V182 WeakPolarHBondContact O-CA 3.25Å; R93-L183 PolarHBondContact O-N 2.89Å; R93-H230 PolarHBondContact NH2-CE1 3.49Å; R93-P240 CarbonylContact C-O 3.52Å; R93-P240 WeakPolarHBondContact CA-O 3.39Å; R93-P240 WeakPolarHBondContact CB-O 3.38Å; R93-P240 VanDerWaalsContact NH2-CB 3.31Å; R93-T241 HydrophobicContact CB-CG2 4.38Å
94	C	98.3	Very high	85.2	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.034	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	145	166.3	175.7	0	0	0	0	111.3	F96 H220 E221 H230 P240	C94-F96 VanDerWaalsContact C-N 3.27Å; C94-F96 PolarHBondContact O-N 2.91Å; C94-F96 VanDerWaalsContact SG-CB 3.55Å; C94-F96 PolarHBondContact SG-N 2.69Å; C94-H220 VanDerWaalsContact CB-NE2 3.31Å; C94-H220 WeakPolarHBondContact CB-NE2 3.04Å; C94-E221 PolarHBondContact SG-OE1 3.19Å; C94-E221 PolarHBondContact SG-OE2 3.47Å; C94-E221 VanDerWaalsContact SG-OE2 3.37Å; C94-H230 WeakPolarHBondContact CB-NE2 3.15Å; C94-P240 PolarHBondContact N-O 3.48Å
95	G	95.9	Very high	82.5	Confident	16 Å²	16	56.3 Å²	56.3	17%	0.165	30%	0.299	C	S	.	.	S	Bend	trans	-75.9	-7.6	179.9	0	0	0	0	0	114.9	V182 A184	G95-V182 VanDerWaalsContact CA-CG1 3.41Å; G95-A184 PolarHBondContact N-O 3.27Å
96	F	92	Very high	79.9	Confident	29 Å²	29	65.2 Å²	65.2	13%	0.127	35%	0.346	C	S	.	.	S	Bend	trans	-71.4	152.4	-178.5	-161.9	-88.6	0	0	0	112.3	R93 C94 A100 A186 H224 V229 H230	R93-F96 PolarHBondContact NH2-O 3.25Å; C94-F96 VanDerWaalsContact C-N 3.27Å; C94-F96 PolarHBondContact O-N 2.91Å; C94-F96 VanDerWaalsContact SG-CB 3.55Å; C94-F96 PolarHBondContact SG-N 2.69Å; F96-A100 HydrophobicContact CE1-CB 3.62Å; F96-A100 HydrophobicContact CZ-CB 4.25Å; F96-A186 VanDerWaalsContact CD2-O 3.25Å; F96-A186 WeakPolarHBondContact CD2-O 3.23Å; F96-H224 WeakPolarHBondContact CB-NE2 3.43Å; F96-H224 AromaticContact CD1-CE1 3.58Å; F96-H224 AromaticContact CD1-ND1 3.94Å; F96-H224 HydrophobicContact CD2-CB 4.4Å; F96-H224 AromaticContact CD2-CG 3.95Å; F96-H224 AromaticContact CD2-ND1 3.99Å; F96-H224 HydrophobicContact CE2-CB 4.5Å; F96-H224 AromaticContact CG-CE1 3.6Å; F96-H224 AromaticContact CG-ND1 3.88Å; F96-H224 AromaticContact CG-NE2 3.69Å; F96-V229 HydrophobicContact CE1-CG1 4.02Å; F96-H230 PolarHBondContact O-CE1 2.8Å
97	N	90.6	Very high	77.8	Confident	25 Å²	25	65.2 Å²	65.2	13%	0.134	36%	0.36	C	S	.	.			trans	-81.2	128.9	-176.3	-177	-60.1	0	0	0	112	Q41 F42 S44 M99 A100	Q41-N97 PolarHBondContact O-ND2 3.05Å; F42-N97 CarbonylContact O-C 3.6Å; F42-N97 VanDerWaalsContact O-CG 3.27Å; F42-N97 PolarHBondContact O-OD1 3.44Å; F42-N97 VanDerWaalsContact O-OD1 3.12Å; S44-N97 PolarHBondContact O-ND2 3.42Å; N97-M99 VanDerWaalsContact C-N 3.31Å; N97-M99 PolarHBondContact O-N 2.88Å; N97-M99 WeakPolarHBondContact OD1-CA 3.39Å; N97-M99 WeakPolarHBondContact OD1-CB 3.36Å; N97-M99 PolarHBondContact OD1-N 2.9Å; N97-A100 WeakPolarHBondContact O-CB 3.49Å; N97-A100 PolarHBondContact O-N 2.92Å; N97-A100 PolarHBondContact OD1-N 3.49Å
98	D	91.1	Very high	76.5	Confident	12 Å²	12	67.4 Å²	67.4	6%	0.064	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-19.1	-175.8	-61.8	-26.2	0	0	0	113.6	F42 F43 F72 R93 H230	F42-D98 PolarHBondContact O-N 3.14Å; F43-D98 HydrophobicContact CD1-CB 4.38Å; F43-D98 HydrophobicContact CE1-CB 3.78Å; F43-D98 HydrophobicContact CE2-CB 3.99Å; F43-D98 WeakPolarHBondContact CE2-OD2 3.44Å; F43-D98 HydrophobicContact CZ-CB 3.56Å; F43-D98 WeakPolarHBondContact CZ-OD2 3.37Å; F72-D98 HydrophobicContact CD2-CB 4.13Å; F72-D98 HydrophobicContact CE2-CB 3.96Å; F72-D98 HydrophobicContact CG-CB 4.48Å; F72-D98 HydrophobicContact CZ-CB 4.2Å; R93-D98 IonicContact CZ-OD1 3.19Å; R93-D98 IonicContact CZ-OD2 2.79Å; R93-D98 IonicContact NH1-OD1 3.41Å; R93-D98 IonicContact NH1-OD2 3.61Å; R93-D98 PolarHBondContact NH1-OD2 3.37Å; R93-D98 IonicContact NH2-OD1 3.47Å; R93-D98 PolarHBondContact NH2-OD1 2.96Å; R93-D98 IonicContact NH2-OD2 3.86Å; R93-D98 PolarHBondContact NH2-OD2 3.4Å; D98-H230 IonicContact OD1-CE1 2.58Å; D98-H230 PolarHBondContact OD1-CE1 3.41Å; D98-H230 IonicContact OD1-CG 3.26Å; D98-H230 IonicContact OD1-ND1 3.06Å; D98-H230 PolarHBondContact OD1-ND1 3.35Å
99	M	83.5	Confident	75.8	Confident	28 Å²	28	68.4 Å²	68.4	14%	0.138	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	1.7	179.5	-66.6	-63	-59.1	0	0	113.1	F43 K68 N97 R101	F43-M99 HydrophobicContact CB-CG 4.13Å; F43-M99 HydrophobicContact CD1-CG 3.61Å; F43-M99 HydrophobicContact CD1-SD 3.82Å; F43-M99 HydrophobicContact CE1-CG 4.37Å; F43-M99 HydrophobicContact CE1-SD 4.24Å; F43-M99 HydrophobicContact CG-CG 4.23Å; K68-M99 HydrophobicContact CB-SD 4.38Å; K68-M99 HydrophobicContact CD-CE 3.9Å; K68-M99 HydrophobicContact CD-SD 4.4Å; N97-M99 VanDerWaalsContact C-N 3.31Å; N97-M99 PolarHBondContact O-N 2.88Å; N97-M99 WeakPolarHBondContact OD1-CA 3.39Å; N97-M99 WeakPolarHBondContact OD1-CB 3.36Å; N97-M99 PolarHBondContact OD1-N 2.9Å; M99-R101 VanDerWaalsContact C-N 3.34Å; M99-R101 PolarHBondContact O-N 2.86Å
100	A	73.2	Confident	75.6	Confident	31 Å²	31	71.6 Å²	71.6	26%	0.256	38%	0.384	S	S	.	.			trans	-62.3	93.1	174.9	0	0	0	0	0	110.6	F96 N97 V229	F96-A100 HydrophobicContact CE1-CB 3.62Å; F96-A100 HydrophobicContact CZ-CB 4.25Å; N97-A100 WeakPolarHBondContact O-CB 3.49Å; N97-A100 PolarHBondContact O-N 2.92Å; N97-A100 PolarHBondContact OD1-N 3.49Å; A100-V229 HydrophobicContact CB-CG1 4.12Å; A100-V229 VanDerWaalsContact O-CG1 3.29Å; A100-V229 WeakPolarHBondContact O-CG1 3.48Å
101	R	64.6	Low	75.6	Confident	177 Å²	177	69.2 Å²	69.2	67%	0.668	36%	0.359	S	S	*	.			trans	-102.5	109.8	173.6	-65.3	-176.8	179.9	-163	-0.4	108.4	M99 G103 H104	M99-R101 VanDerWaalsContact C-N 3.34Å; M99-R101 PolarHBondContact O-N 2.86Å; R101-G103 PolarHBondContact O-N 3Å; R101-H104 PolarHBondContact O-N 3.13Å
102	Y	54	Low	75.5	Confident	46 Å²	46	71.8 Å²	71.8	18%	0.18	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-64.5	5.9	175.5	-59.5	-60.2	0	0	0	114.5	H104 P109 S188 G227 V229	Y102-H104 PolarHBondContact O-N 3.1Å; Y102-P109 VanDerWaalsContact CD1-CD 3.43Å; Y102-P109 HydrophobicContact CD1-CG 3.81Å; Y102-P109 HydrophobicContact CE1-CG 3.35Å; Y102-P109 HydrophobicContact CE2-CG 4.4Å; Y102-S188 PolarHBondContact OH-OG 3.11Å; Y102-G227 WeakPolarHBondContact CE2-O 3.42Å; Y102-V229 HydrophobicContact CD2-CG1 3.79Å; Y102-V229 HydrophobicContact CE1-CG1 4.44Å; Y102-V229 HydrophobicContact CE2-CB 4.24Å; Y102-V229 HydrophobicContact CE2-CG1 3.11Å; Y102-V229 HydrophobicContact CE2-CG2 4.41Å; Y102-V229 VanDerWaalsContact CZ-CG1 3.49Å
103	G	42.6	Very low	75.3	Confident	82 Å²	82	73.7 Å²	73.7	85%	0.845	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-68.1	-8.2	171.3	0	0	0	0	0	114.5	R101	R101-G103 PolarHBondContact O-N 3Å
104	H	37.6	Very low	75.1	Confident	173 Å²	173	76.4 Å²	76.4	80%	0.801	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-107.3	-6.9	-179.2	-142.6	72.4	0	0	0	114.9	R101 Y102	R101-H104 PolarHBondContact O-N 3.13Å; Y102-H104 PolarHBondContact O-N 3.1Å
105	F	40.8	Very low	75.1	Confident	154 Å²	154	79.2 Å²	79.2	68%	0.675	43%	0.425	S	S	*	.	S	Bend	trans	-113.9	127.3	171.4	-62	-79.6	0	0	0	108.7	G107	F105-G107 VanDerWaalsContact C-N 3.29Å; F105-G107 PolarHBondContact O-N 3.19Å
106	D	41.3	Very low	75.2	Confident	187 Å²	187	78.5 Å²	78.5	100%	1	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	96.3	162.6	-87.8	-26.1	0	0	0	107.3
107	G	52.4	Low	75.5	Confident	57 Å²	57	78.6 Å²	78.6	59%	0.588	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-176.7	-63.6	-175.4	0	0	0	0	0	118.3	F105	F105-G107 VanDerWaalsContact C-N 3.29Å; F105-G107 PolarHBondContact O-N 3.19Å
108	R	67.6	Low	75.9	Confident	156 Å²	156	78 Å²	78	59%	0.589	42%	0.416	S	S	*	.			trans	42.8	76.4	-153.9	-65.9	-175.2	-177.4	-170.9	-2	109.5	K110 L263	R108-K110 PolarHBondContact O-N 3.19Å; R108-L263 HydrophobicContact CB-CD2 3.87Å
109	P	82.8	Confident	76.3	Confident	30 Å²	30	81 Å²	81	20%	0.195	43%	0.426	C	S	.	.			trans	-51.3	120.4	-167.7	22.6	-32.8	0	0	0	109.9	Y102 P189 G227	Y102-P109 VanDerWaalsContact CD1-CD 3.43Å; Y102-P109 HydrophobicContact CD1-CG 3.81Å; Y102-P109 HydrophobicContact CE1-CG 3.35Å; Y102-P109 HydrophobicContact CE2-CG 4.4Å; P109-P189 HydrophobicContact CB-CB 4.42Å; P109-P189 WeakPolarHBondContact O-CG 3.2Å; P109-G227 VanDerWaalsContact O-CA 3.31Å; P109-G227 WeakPolarHBondContact O-CA 3.41Å
110	K	92.1	Very high	77	Confident	91 Å²	91	80.2 Å²	80.2	40%	0.396	42%	0.422	S	S	.	.			trans	-146.2	154.8	-177.3	74.7	175.5	-169.3	173.8	0	110.4	R108 N112 L263 Y264	R108-K110 PolarHBondContact O-N 3.19Å; K110-N112 PolarHBondContact O-N 2.99Å; K110-L263 WeakPolarHBondContact CD-O 3.47Å; K110-L263 PolarHBondContact NZ-O 2.71Å; K110-L263 VanDerWaalsContact NZ-O 3.08Å; K110-Y264 HydrophobicContact CB-CE1 4.03Å
111	W	95.5	Very high	78	Confident	24 Å²	24	81 Å²	81	9%	0.091	42%	0.424	C	S	.	.			trans	-72.6	125.2	172.9	-63.3	115.4	0	0	0	111.3	K113 V116 D160 I161 P189 G190 G194 A225 Y264	W111-K113 VanDerWaalsContact C-N 3.32Å; W111-K113 HydrophobicContact CB-CG 4.26Å; W111-K113 VanDerWaalsContact CE3-CE 3.42Å; W111-K113 PolarHBondContact O-N 3.42Å; W111-V116 HydrophobicContact CB-CG2 3.96Å; W111-V116 HydrophobicContact CD2-CG2 4.46Å; W111-V116 HydrophobicContact CG-CG2 3.81Å; W111-D160 HydrophobicContact CH2-CB 3.99Å; W111-D160 WeakPolarHBondContact CH2-O 3.33Å; W111-D160 HydrophobicContact CZ2-CB 4.19Å; W111-D160 HydrophobicContact CZ3-CB 4.36Å; W111-I161 HydrophobicContact CZ2-CG1 4.31Å; W111-P189 HydrophobicContact CD2-CB 3.95Å; W111-P189 HydrophobicContact CE3-CB 4.41Å; W111-P189 HydrophobicContact CG-CB 4.27Å; W111-P189 HydrophobicContact CZ2-CB 4.18Å; W111-G190 WeakPolarHBondContact CH2-O 3.12Å; W111-G194 WeakPolarHBondContact CH2-O 3.33Å; W111-A225 PolarHBondContact NE1-O 3.45Å; W111-Y264 HydrophobicContact CB-CE1 4.2Å; W111-Y264 PolarHBondContact N-OH 3.12Å; W111-Y264 VanDerWaalsContact N-OH 3.17Å
112	N	93.8	Very high	79.6	Confident	146 Å²	146	75 Å²	75	78%	0.781	41%	0.405	S	S	*	.			trans	-96.5	51.7	174.7	-66.3	-45.1	0	0	0	111.3	K110	K110-N112 PolarHBondContact O-N 2.99Å
113	K	94	Very high	81.7	Confident	74 Å²	74	75.8 Å²	75.8	32%	0.322	41%	0.408	S	S	.	.	S	Bend	trans	-150.5	162.1	-179.6	68.8	-170.8	97.6	-174.9	0	110	W111 V115 V116 L149 D160	W111-K113 VanDerWaalsContact C-N 3.32Å; W111-K113 HydrophobicContact CB-CG 4.26Å; W111-K113 VanDerWaalsContact CE3-CE 3.42Å; W111-K113 PolarHBondContact O-N 3.42Å; K113-V115 WeakPolarHBondContact CD-O 3.36Å; K113-V115 WeakPolarHBondContact CG-O 3.37Å; K113-V116 HydrophobicContact CD-CG2 4.19Å; K113-V116 HydrophobicContact CG-CG2 4.01Å; K113-L149 WeakPolarHBondContact O-CD2 3.19Å; K113-D160 IonicContact NZ-OD1 2.73Å; K113-D160 PolarHBondContact NZ-OD1 2.87Å; K113-D160 IonicContact NZ-OD2 2.77Å; K113-D160 PolarHBondContact NZ-OD2 2.87Å
114	A	94.3	Very high	84.3	Confident	62 Å²	62	72 Å²	72	51%	0.512	37%	0.369	S	S	.	.	S	Bend	trans	-88.8	-31.2	178.3	0	0	0	0	0	113.2	L149 D150	A114-L149 WeakPolarHBondContact O-CA 3.07Å; A114-D150 PolarHBondContact O-N 2.92Å
115	V	97.9	Very high	87.2	Confident	64 Å²	64	69 Å²	69	39%	0.388	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	120.4	179.1	-176.7	0	0	0	0	108.5	K113 D150 Q152	K113-V115 WeakPolarHBondContact CD-O 3.36Å; K113-V115 WeakPolarHBondContact CG-O 3.37Å; V115-D150 CarbonylContact C-O 3.56Å; V115-D150 WeakPolarHBondContact CA-O 3.34Å; V115-D150 HydrophobicContact CG2-CB 4.42Å; V115-Q152 HydrophobicContact CG1-CB 4.05Å
116	V	98.4	Very high	90	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	125	173.6	-179.7	0	0	0	0	108	W111 K113 L149 D150 F151 Q152 D160 I161	W111-V116 HydrophobicContact CB-CG2 3.96Å; W111-V116 HydrophobicContact CD2-CG2 4.46Å; W111-V116 HydrophobicContact CG-CG2 3.81Å; K113-V116 HydrophobicContact CD-CG2 4.19Å; K113-V116 HydrophobicContact CG-CG2 4.01Å; V116-L149 HydrophobicContact CG2-CD1 4.13Å; V116-L149 HydrophobicContact CG2-CD2 4.48Å; V116-D150 PolarHBondContact N-O 3.32Å; V116-F151 HydrophobicContact CB-CD1 3.86Å; V116-F151 HydrophobicContact CB-CE1 3.94Å; V116-F151 HydrophobicContact CG1-CD1 4.25Å; V116-F151 HydrophobicContact CG1-CE1 4.26Å; V116-F151 HydrophobicContact CG2-CE1 4.4Å; V116-F151 WeakPolarHBondContact O-CA 3.1Å; V116-Q152 PolarHBondContact O-N 3.19Å; V116-D160 HydrophobicContact CG1-CB 3.76Å; V116-I161 HydrophobicContact CG1-CD1 3.78Å; V116-I161 HydrophobicContact CG1-CG1 4.15Å
117	T	98.5	Very high	92.7	Very high	32 Å²	32	57.5 Å²	57.5	20%	0.196	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	142.9	179.5	55.9	0	0	0	0	110.8	Q152 D160 I161	T117-Q152 CarbonylContact C-O 3.57Å; T117-Q152 VanDerWaalsContact CA-O 3.27Å; T117-Q152 WeakPolarHBondContact CA-O 3.33Å; T117-D160 PolarHBondContact N-OD2 2.99Å; T117-D160 WeakPolarHBondContact O-CA 3.29Å; T117-D160 VanDerWaalsContact O-CB 3.3Å; T117-D160 WeakPolarHBondContact O-CB 3.46Å; T117-D160 PolarHBondContact O-N 2.81Å; T117-D160 PolarHBondContact OG1-N 3.18Å; T117-D160 VanDerWaalsContact OG1-N 3.11Å; T117-D160 PolarHBondContact OG1-OD2 2.93Å; T117-D160 VanDerWaalsContact OG1-OD2 3.1Å; T117-I161 PolarHBondContact O-N 3.45Å
118	Y	98.7	Very high	94.8	Very high	13 Å²	13	57.4 Å²	57.4	5%	0.051	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	157.6	172.1	71.4	-90	0	0	0	111.5	I136 F140 F151 Q152 Q153 S154 I161 I163	Y118-I136 HydrophobicContact CD2-CG2 4.08Å; Y118-I136 HydrophobicContact CE2-CG2 3.69Å; Y118-F140 AromaticContact CD1-CD2 3.73Å; Y118-F140 HydrophobicContact CD1-CD2 3.73Å; Y118-F140 AromaticContact CD1-CE2 3.51Å; Y118-F140 HydrophobicContact CD1-CE2 3.51Å; Y118-F140 HydrophobicContact CD1-CZ 4.25Å; Y118-F140 HydrophobicContact CD2-CD2 4.42Å; Y118-F140 AromaticContact CD2-CE2 3.8Å; Y118-F140 HydrophobicContact CD2-CE2 3.8Å; Y118-F140 AromaticContact CE1-CD2 3.72Å; Y118-F140 HydrophobicContact CE1-CD2 3.72Å; Y118-F140 AromaticContact CE1-CE2 3.94Å; Y118-F140 HydrophobicContact CE1-CE2 3.94Å; Y118-F140 HydrophobicContact CE2-CD2 4.43Å; Y118-F140 HydrophobicContact CE2-CE2 4.22Å; Y118-F140 HydrophobicContact CG-CD2 4.09Å; Y118-F140 AromaticContact CG-CE2 3.42Å; Y118-F140 HydrophobicContact CG-CE2 3.42Å; Y118-F140 VanDerWaalsContact CG-CE2 3.42Å; Y118-F140 HydrophobicContact CG-CZ 4.1Å; Y118-F151 HydrophobicContact CD1-CB 4.17Å; Y118-F151 HydrophobicContact CE1-CB 4.17Å; Y118-Q152 PolarHBondContact N-O 3.27Å; Y118-Q153 HydrophobicContact CD2-CB 4.38Å; Y118-Q153 HydrophobicContact CD2-CG 4.18Å; Y118-Q153 HydrophobicContact CE1-CB 4.05Å; Y118-Q153 VanDerWaalsContact CE1-N 3.33Å; Y118-Q153 HydrophobicContact CE2-CB 3.72Å; Y118-Q153 HydrophobicContact CE2-CG 3.64Å; Y118-Q153 CarbonylContact O-C 3.5Å; Y118-Q153 WeakPolarHBondContact O-CA 3.18Å; Y118-S154 PolarHBondContact O-N 3.27Å; Y118-I161 CarbonylContact C-O 3.52Å; Y118-I161 WeakPolarHBondContact CA-O 3.44Å; Y118-I163 HydrophobicContact CD2-CD1 3.91Å; Y118-I163 HydrophobicContact CG-CD1 4.49Å
119	R	98.3	Very high	96.3	Very high	74 Å²	74	56 Å²	56	28%	0.279	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145	132.4	175.2	179.8	169.3	-178	-151.8	-0.2	111	T121 S156 E157 A159 I161 M162 I163	R119-T121 HydrophobicContact CG-CG2 4.18Å; R119-S156 WeakPolarHBondContact CD-O 3.3Å; R119-S156 VanDerWaalsContact CZ-O 3.32Å; R119-S156 PolarHBondContact NE-O 3.39Å; R119-S156 PolarHBondContact NH1-O 2.87Å; R119-E157 VanDerWaalsContact NH1-C 3.26Å; R119-E157 PolarHBondContact NH1-O 2.96Å; R119-A159 HydrophobicContact CB-CB 3.81Å; R119-I161 PolarHBondContact N-O 2.9Å; R119-M162 HydrophobicContact CB-CE 4.49Å; R119-M162 HydrophobicContact CB-SD 4.1Å; R119-M162 WeakPolarHBondContact O-CA 3.44Å; R119-I163 PolarHBondContact O-N 3.2Å
120	I	98.4	Very high	97.1	Very high	11 Å²	11	63.9 Å²	63.9	6%	0.056	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	116.7	170.8	-53.3	162.1	0	0	0	107.6	D122 Y123 V132 D133 I136 I163	I120-D122 VanDerWaalsContact CG2-O 3.29Å; I120-D122 WeakPolarHBondContact CG2-O 3.36Å; I120-Y123 HydrophobicContact CB-CE1 4.33Å; I120-Y123 HydrophobicContact CB-CE2 4.05Å; I120-Y123 HydrophobicContact CD1-CE1 4.17Å; I120-Y123 HydrophobicContact CG2-CD1 4.05Å; I120-Y123 HydrophobicContact CG2-CD2 3.89Å; I120-Y123 HydrophobicContact CG2-CE1 3.73Å; I120-Y123 HydrophobicContact CG2-CE2 3.55Å; I120-Y123 HydrophobicContact CG2-CG 4.12Å; I120-Y123 VanDerWaalsContact CG2-CZ 3.46Å; I120-V132 HydrophobicContact CD1-CG1 4.35Å; I120-D133 WeakPolarHBondContact CD1-OD1 3.43Å; I120-I136 HydrophobicContact CD1-CB 4.15Å; I120-I136 HydrophobicContact CD1-CG1 3.95Å; I120-I136 HydrophobicContact CD1-CG2 4.19Å; I120-I136 HydrophobicContact CG1-CG2 4.5Å; I120-I163 WeakPolarHBondContact CA-O 3.18Å; I120-I163 HydrophobicContact CB-CB 4.5Å; I120-I163 HydrophobicContact CG1-CB 4.09Å; I120-I163 HydrophobicContact CG1-CD1 4.09Å; I120-I163 HydrophobicContact CG1-CG2 4.21Å; I120-I163 HydrophobicContact CG2-CG2 4.37Å
121	T	95.6	Very high	97.4	Very high	49 Å²	49	62.4 Å²	62.4	30%	0.301	32%	0.323	S	S	.	.			trans	-99.5	-30.8	-178.6	56.6	0	0	0	0	113.3	R119 M162 I163 K164	R119-T121 HydrophobicContact CG-CG2 4.18Å; T121-M162 HydrophobicContact CG2-CE 3.44Å; T121-M162 VanDerWaalsContact CG2-CE 3.44Å; T121-I163 PolarHBondContact N-O 2.91Å; T121-I163 PolarHBondContact OG1-O 3.45Å; T121-K164 WeakPolarHBondContact OG1-CG 3.47Å
122	D	96.5	Very high	97.5	Very high	49 Å²	49	61.3 Å²	61.3	26%	0.262	32%	0.318	S	S	.	.	S	Bend	trans	-129	142.3	-179.4	-58.4	-90.3	0	0	0	107.5	I120 K164 F165 K166	I120-D122 VanDerWaalsContact CG2-O 3.29Å; I120-D122 WeakPolarHBondContact CG2-O 3.36Å; D122-K164 HydrophobicContact CB-CB 4.47Å; D122-F165 VanDerWaalsContact O-CD2 3.25Å; D122-F165 WeakPolarHBondContact O-CD2 3.33Å; D122-K166 VanDerWaalsContact CG-CE 3.46Å; D122-K166 IonicContact OD1-NZ 2.72Å; D122-K166 PolarHBondContact OD1-NZ 3.08Å; D122-K166 VanDerWaalsContact OD2-CE 3.24Å; D122-K166 WeakPolarHBondContact OD2-CE 3.21Å; D122-K166 IonicContact OD2-NZ 3.6Å; D122-K166 PolarHBondContact OD2-NZ 2.9Å
123	Y	98.4	Very high	97.8	Very high	63 Å²	63	56.4 Å²	56.4	25%	0.247	29%	0.292	C	S	.	.			trans	-124.2	141.5	-178.9	-73.4	-101	0	0	0	109.4	I120 Q129 V132 D133	I120-Y123 HydrophobicContact CB-CE1 4.33Å; I120-Y123 HydrophobicContact CB-CE2 4.05Å; I120-Y123 HydrophobicContact CD1-CE1 4.17Å; I120-Y123 HydrophobicContact CG2-CD1 4.05Å; I120-Y123 HydrophobicContact CG2-CD2 3.89Å; I120-Y123 HydrophobicContact CG2-CE1 3.73Å; I120-Y123 HydrophobicContact CG2-CE2 3.55Å; I120-Y123 HydrophobicContact CG2-CG 4.12Å; I120-Y123 VanDerWaalsContact CG2-CZ 3.46Å; Y123-Q129 HydrophobicContact CD1-CB 3.99Å; Y123-Q129 HydrophobicContact CD1-CG 3.74Å; Y123-Q129 HydrophobicContact CD2-CG 4.38Å; Y123-Q129 HydrophobicContact CE1-CB 3.93Å; Y123-Q129 HydrophobicContact CE1-CG 4.06Å; Y123-Q129 HydrophobicContact CG-CG 3.91Å; Y123-V132 HydrophobicContact CD1-CB 3.79Å; Y123-V132 HydrophobicContact CD1-CG1 3.68Å; Y123-V132 HydrophobicContact CD1-CG2 4.19Å; Y123-V132 HydrophobicContact CE1-CB 4.02Å; Y123-V132 HydrophobicContact CE1-CG1 3.85Å; Y123-D133 PolarHBondContact OH-OD1 3.04Å
124	T	98.5	Very high	98	Very high	4 Å²	4	56 Å²	56	3%	0.025	30%	0.298	C	S	.	.			trans	-65.5	140.7	168.2	178.8	0	0	0	0	111.6	D126 M127 V132 F165 E201 W205	T124-D126 VanDerWaalsContact C-N 3.25Å; T124-D126 WeakPolarHBondContact OG1-CB 3.28Å; T124-D126 PolarHBondContact OG1-N 3.47Å; T124-M127 HydrophobicContact CG2-CB 4.48Å; T124-V132 HydrophobicContact CG2-CG2 4.05Å; T124-F165 HydrophobicContact CG2-CD1 4.05Å; T124-F165 HydrophobicContact CG2-CE1 3.74Å; T124-F165 HydrophobicContact CG2-CZ 4.11Å; T124-E201 WeakPolarHBondContact CA-OE1 3.26Å; T124-E201 WeakPolarHBondContact CA-OE2 3.39Å; T124-E201 VanDerWaalsContact CB-OE1 3.24Å; T124-E201 WeakPolarHBondContact CB-OE1 3.47Å; T124-E201 WeakPolarHBondContact CB-OE2 3.42Å; T124-E201 PolarHBondContact OG1-OE1 2.72Å; T124-W205 HydrophobicContact CG2-CB 4.11Å; T124-W205 HydrophobicContact CG2-CG 4.32Å
125	P	98.3	Very high	98.2	Very high	110 Å²	110	53.3 Å²	53.3	71%	0.714	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-7.9	172.5	34.4	-31	0	0	0	112.9	M127 E201	P125-M127 PolarHBondContact O-N 3.21Å; P125-E201 WeakPolarHBondContact CD-OE1 3.48Å
126	D	98.4	Very high	98.2	Very high	74 Å²	74	50.3 Å²	50.3	40%	0.396	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-22.6	-178.8	-65.6	-14.9	0	0	0	112.6	T124 W205	T124-D126 VanDerWaalsContact C-N 3.25Å; T124-D126 WeakPolarHBondContact OG1-CB 3.28Å; T124-D126 PolarHBondContact OG1-N 3.47Å; D126-W205 HydrophobicContact CB-CB 4.26Å; D126-W205 PolarHBondContact OD2-N 3.17Å
127	M	97.7	Very high	98.3	Very high	25 Å²	25	52.2 Å²	52.2	12%	0.123	27%	0.274	C	S	.	.	S	Bend	trans	-135.8	158.4	-175	-64.7	179.4	50.1	0	0	111.5	T124 P125 D131 V132 W205 L207 L214	T124-M127 HydrophobicContact CG2-CB 4.48Å; P125-M127 PolarHBondContact O-N 3.21Å; M127-D131 HydrophobicContact CE-CB 3.64Å; M127-V132 HydrophobicContact CB-CG2 4.07Å; M127-W205 HydrophobicContact SD-CB 4.38Å; M127-L207 HydrophobicContact CE-CD1 3.92Å; M127-L207 HydrophobicContact CE-CD2 3.43Å; M127-L207 VanDerWaalsContact CE-CD2 3.43Å; M127-L207 HydrophobicContact CE-CG 3.41Å; M127-L207 VanDerWaalsContact CE-CG 3.41Å; M127-L207 HydrophobicContact SD-CD2 4.48Å; M127-L207 HydrophobicContact SD-CG 4.31Å; M127-L214 HydrophobicContact CE-CD2 4.43Å; M127-L214 HydrophobicContact SD-CD2 4.37Å
128	S	98.5	Very high	98.3	Very high	55 Å²	55	55.1 Å²	55.1	39%	0.385	28%	0.284	S	S	.	.			trans	-69.3	147.1	173.4	82.3	0	0	0	0	110.5	R130 D131 V132	S128-R130 PolarHBondContact O-N 3.36Å; S128-R130 VanDerWaalsContact O-N 3.15Å; S128-D131 WeakPolarHBondContact CB-OD2 3.12Å; S128-D131 PolarHBondContact O-N 2.9Å; S128-D131 PolarHBondContact OG-N 2.97Å; S128-D131 PolarHBondContact OG-OD2 2.87Å; S128-V132 PolarHBondContact O-N 3.31Å
129	Q	98.3	Very high	98.3	Very high	125 Å²	125	54.5 Å²	54.5	58%	0.584	28%	0.281	S	S	*	.	H	α-helix	trans	-54.2	-37	176.4	-68.2	-175.1	3.8	0	0	112.1	Y123 D131 V132 D133	Y123-Q129 HydrophobicContact CD1-CB 3.99Å; Y123-Q129 HydrophobicContact CD1-CG 3.74Å; Y123-Q129 HydrophobicContact CD2-CG 4.38Å; Y123-Q129 HydrophobicContact CE1-CB 3.93Å; Y123-Q129 HydrophobicContact CE1-CG 4.06Å; Y123-Q129 HydrophobicContact CG-CG 3.91Å; Q129-D131 VanDerWaalsContact C-N 3.33Å; Q129-D131 PolarHBondContact O-N 3.38Å; Q129-V132 PolarHBondContact O-N 3.08Å; Q129-D133 WeakPolarHBondContact O-CB 3.36Å; Q129-D133 VanDerWaalsContact O-CG 3.28Å; Q129-D133 PolarHBondContact O-N 2.84Å
130	R	98.4	Very high	98.3	Very high	197 Å²	197	51.1 Å²	51.1	74%	0.743	27%	0.269	S	S	*	.	H	α-helix	trans	-59.9	-43.2	175.1	180	-172.2	-66.2	167.6	0.1	112	S128 S134	S128-R130 PolarHBondContact O-N 3.36Å; S128-R130 VanDerWaalsContact O-N 3.15Å; R130-S134 VanDerWaalsContact O-CB 3.29Å; R130-S134 WeakPolarHBondContact O-CB 3.37Å; R130-S134 PolarHBondContact O-N 3.46Å; R130-S134 PolarHBondContact O-OG 3.25Å
131	D	98.6	Very high	98.3	Very high	60 Å²	60	55.6 Å²	55.6	32%	0.321	29%	0.287	S	S	.	.	H	α-helix	trans	-67.9	-42	-179.8	-62.2	-38.1	0	0	0	110.1	M127 S128 Q129 S134 T135 L207	M127-D131 HydrophobicContact CE-CB 3.64Å; S128-D131 WeakPolarHBondContact CB-OD2 3.12Å; S128-D131 PolarHBondContact O-N 2.9Å; S128-D131 PolarHBondContact OG-N 2.97Å; S128-D131 PolarHBondContact OG-OD2 2.87Å; Q129-D131 VanDerWaalsContact C-N 3.33Å; Q129-D131 PolarHBondContact O-N 3.38Å; D131-S134 PolarHBondContact O-N 3.05Å; D131-S134 PolarHBondContact O-OG 2.57Å; D131-T135 WeakPolarHBondContact O-CB 3.17Å; D131-T135 PolarHBondContact O-N 2.97Å; D131-T135 PolarHBondContact O-OG1 3.47Å; D131-L207 HydrophobicContact CB-CD1 4.35Å
132	V	98.8	Very high	98.4	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-58.9	-54.9	172.8	177.8	0	0	0	0	110.6	I120 Y123 T124 M127 S128 Q129 S134 T135 I136 F165 L214	I120-V132 HydrophobicContact CD1-CG1 4.35Å; Y123-V132 HydrophobicContact CD1-CB 3.79Å; Y123-V132 HydrophobicContact CD1-CG1 3.68Å; Y123-V132 HydrophobicContact CD1-CG2 4.19Å; Y123-V132 HydrophobicContact CE1-CB 4.02Å; Y123-V132 HydrophobicContact CE1-CG1 3.85Å; T124-V132 HydrophobicContact CG2-CG2 4.05Å; M127-V132 HydrophobicContact CB-CG2 4.07Å; S128-V132 PolarHBondContact O-N 3.31Å; Q129-V132 PolarHBondContact O-N 3.08Å; V132-S134 VanDerWaalsContact C-N 3.33Å; V132-S134 PolarHBondContact O-N 2.83Å; V132-T135 WeakPolarHBondContact O-CB 3.22Å; V132-T135 PolarHBondContact O-N 3.17Å; V132-I136 HydrophobicContact CG1-CG1 4.18Å; V132-I136 WeakPolarHBondContact O-CG1 3.46Å; V132-I136 PolarHBondContact O-N 3.21Å; V132-F165 HydrophobicContact CG1-CE2 4.08Å; V132-F165 HydrophobicContact CG1-CZ 4.2Å; V132-L214 HydrophobicContact CB-CD2 4.44Å; V132-L214 HydrophobicContact CG1-CD2 4.24Å; V132-L214 HydrophobicContact CG2-CD2 4.19Å
133	D	98.7	Very high	98.5	Very high	44 Å²	44	51.8 Å²	51.8	24%	0.235	27%	0.265	C	S	.	.	H	α-helix	trans	-52.2	-50.2	178.2	-77.8	-37.7	0	0	0	111.8	I120 Y123 Q129 T135 I136 A137 Q153	I120-D133 WeakPolarHBondContact CD1-OD1 3.43Å; Y123-D133 PolarHBondContact OH-OD1 3.04Å; Q129-D133 WeakPolarHBondContact O-CB 3.36Å; Q129-D133 VanDerWaalsContact O-CG 3.28Å; Q129-D133 PolarHBondContact O-N 2.84Å; D133-T135 VanDerWaalsContact C-N 3.3Å; D133-T135 PolarHBondContact O-N 3.38Å; D133-I136 PolarHBondContact O-N 3.46Å; D133-A137 WeakPolarHBondContact O-CB 3.42Å; D133-A137 PolarHBondContact O-N 3.26Å; D133-Q153 PolarHBondContact OD1-NE2 3.38Å
134	S	98.6	Very high	98.4	Very high	64 Å²	64	49.7 Å²	49.7	45%	0.448	26%	0.26	S	S	.	.	H	α-helix	trans	-65.5	-34.8	-179.2	72.8	0	0	0	0	112.4	R130 D131 V132 K138	R130-S134 VanDerWaalsContact O-CB 3.29Å; R130-S134 WeakPolarHBondContact O-CB 3.37Å; R130-S134 PolarHBondContact O-N 3.46Å; R130-S134 PolarHBondContact O-OG 3.25Å; D131-S134 PolarHBondContact O-N 3.05Å; D131-S134 PolarHBondContact O-OG 2.57Å; V132-S134 VanDerWaalsContact C-N 3.33Å; V132-S134 PolarHBondContact O-N 2.83Å; S134-K138 VanDerWaalsContact O-CB 3.3Å; S134-K138 WeakPolarHBondContact O-CB 3.44Å; S134-K138 PolarHBondContact O-N 3.36Å
135	T	98.7	Very high	98.3	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.043	28%	0.279	C	S	.	.	H	α-helix	trans	-71.8	-46.2	179.6	-62.8	0	0	0	0	111.3	D131 V132 D133 K138 A139 L207 L214 F215	D131-T135 WeakPolarHBondContact O-CB 3.17Å; D131-T135 PolarHBondContact O-N 2.97Å; D131-T135 PolarHBondContact O-OG1 3.47Å; V132-T135 WeakPolarHBondContact O-CB 3.22Å; V132-T135 PolarHBondContact O-N 3.17Å; D133-T135 VanDerWaalsContact C-N 3.3Å; D133-T135 PolarHBondContact O-N 3.38Å; T135-K138 WeakPolarHBondContact O-CB 2.96Å; T135-K138 PolarHBondContact O-N 3.17Å; T135-A139 PolarHBondContact O-N 2.71Å; T135-L207 HydrophobicContact CG2-CD2 4.46Å; T135-L207 WeakPolarHBondContact OG1-CD2 3.22Å; T135-L214 HydrophobicContact CG2-CB 4.07Å; T135-L214 HydrophobicContact CG2-CD2 4.03Å; T135-L214 HydrophobicContact CG2-CG 3.8Å; T135-F215 VanDerWaalsContact CG2-CA 3.49Å; T135-F215 HydrophobicContact CG2-CB 3.74Å
136	I	98.8	Very high	98.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-60.7	-46	175.2	-66.6	-53.2	0	0	0	110.5	Y118 I120 V132 D133 K138 A139 F140 I163 A218 F222	Y118-I136 HydrophobicContact CD2-CG2 4.08Å; Y118-I136 HydrophobicContact CE2-CG2 3.69Å; I120-I136 HydrophobicContact CD1-CB 4.15Å; I120-I136 HydrophobicContact CD1-CG1 3.95Å; I120-I136 HydrophobicContact CD1-CG2 4.19Å; I120-I136 HydrophobicContact CG1-CG2 4.5Å; V132-I136 HydrophobicContact CG1-CG1 4.18Å; V132-I136 WeakPolarHBondContact O-CG1 3.46Å; V132-I136 PolarHBondContact O-N 3.21Å; D133-I136 PolarHBondContact O-N 3.46Å; I136-K138 VanDerWaalsContact C-N 3.32Å; I136-K138 PolarHBondContact O-N 3.45Å; I136-A139 PolarHBondContact O-N 3.23Å; I136-F140 HydrophobicContact CG2-CD2 3.95Å; I136-F140 HydrophobicContact CG2-CE2 3.81Å; I136-F140 WeakPolarHBondContact O-CD2 3.5Å; I136-F140 PolarHBondContact O-N 3.41Å; I136-I163 HydrophobicContact CD1-CG2 4.48Å; I136-I163 HydrophobicContact CG2-CD1 3.57Å; I136-A218 HydrophobicContact CD1-CB 3.79Å; I136-F222 HydrophobicContact CD1-CE2 4.36Å; I136-F222 HydrophobicContact CD1-CZ 3.96Å; I136-F222 HydrophobicContact CG2-CE2 4.04Å; I136-F222 HydrophobicContact CG2-CZ 3.9Å
137	A	98.8	Very high	98.1	Very high	41 Å²	41	45.7 Å²	45.7	34%	0.339	23%	0.232	S	C	.	.	H	α-helix	trans	-61	-41	175.3	0	0	0	0	0	111.9	D133 F140 K141	D133-A137 WeakPolarHBondContact O-CB 3.42Å; D133-A137 PolarHBondContact O-N 3.26Å; A137-F140 PolarHBondContact O-N 2.89Å; A137-K141 WeakPolarHBondContact O-CB 3.26Å; A137-K141 PolarHBondContact O-N 3.12Å
138	K	98.6	Very high	98.1	Very high	93 Å²	93	47.3 Å²	47.3	40%	0.404	24%	0.244	S	C	.	.	H	α-helix	trans	-63.7	-40.1	175.8	-168.3	-170.2	173.6	-170.5	0	111.7	S134 T135 I136 K141 L142 F215 T247	S134-K138 VanDerWaalsContact O-CB 3.3Å; S134-K138 WeakPolarHBondContact O-CB 3.44Å; S134-K138 PolarHBondContact O-N 3.36Å; T135-K138 WeakPolarHBondContact O-CB 2.96Å; T135-K138 PolarHBondContact O-N 3.17Å; I136-K138 VanDerWaalsContact C-N 3.32Å; I136-K138 PolarHBondContact O-N 3.45Å; K138-K141 WeakPolarHBondContact O-CB 3.23Å; K138-K141 PolarHBondContact O-N 3Å; K138-L142 PolarHBondContact O-N 2.94Å; K138-F215 HydrophobicContact CB-CD2 4.19Å; K138-F215 HydrophobicContact CB-CE2 4.1Å; K138-F215 HydrophobicContact CD-CD2 3.84Å; K138-F215 HydrophobicContact CD-CE2 3.67Å; K138-F215 HydrophobicContact CD-CZ 4.21Å; K138-F215 HydrophobicContact CG-CD2 4.03Å; K138-F215 HydrophobicContact CG-CE2 3.59Å; K138-F215 HydrophobicContact CG-CZ 4.35Å; K138-T247 PolarHBondContact NZ-O 2.93Å
139	A	98.8	Very high	98	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-64.8	-45.8	177.4	0	0	0	0	0	111.8	T135 I136 K141 L142 F215 A218 A219 F222	T135-A139 PolarHBondContact O-N 2.71Å; I136-A139 PolarHBondContact O-N 3.23Å; A139-K141 VanDerWaalsContact C-N 3.26Å; A139-K141 PolarHBondContact O-N 3.07Å; A139-L142 WeakPolarHBondContact O-CB 3.33Å; A139-L142 PolarHBondContact O-N 3.14Å; A139-F215 HydrophobicContact CB-CD2 4.25Å; A139-F215 HydrophobicContact CB-CE2 4.46Å; A139-A218 HydrophobicContact CB-CB 4.03Å; A139-A219 HydrophobicContact CB-CB 4.14Å; A139-F222 HydrophobicContact CB-CD2 3.8Å; A139-F222 HydrophobicContact CB-CE2 3.79Å
140	F	98.8	Very high	98	Very high	3 Å²	3	42.5 Å²	42.5	1%	0.013	22%	0.218	C	C	.	.	H	α-helix	trans	-62.1	-34.6	172	-80.8	-55.9	0	0	0	112.9	Y118 I136 A137 L142 Y143 S144 F151 I161 I163 F222	Y118-F140 AromaticContact CD1-CD2 3.73Å; Y118-F140 HydrophobicContact CD1-CD2 3.73Å; Y118-F140 AromaticContact CD1-CE2 3.51Å; Y118-F140 HydrophobicContact CD1-CE2 3.51Å; Y118-F140 HydrophobicContact CD1-CZ 4.25Å; Y118-F140 HydrophobicContact CD2-CD2 4.42Å; Y118-F140 AromaticContact CD2-CE2 3.8Å; Y118-F140 HydrophobicContact CD2-CE2 3.8Å; Y118-F140 AromaticContact CE1-CD2 3.72Å; Y118-F140 HydrophobicContact CE1-CD2 3.72Å; Y118-F140 AromaticContact CE1-CE2 3.94Å; Y118-F140 HydrophobicContact CE1-CE2 3.94Å; Y118-F140 HydrophobicContact CE2-CD2 4.43Å; Y118-F140 HydrophobicContact CE2-CE2 4.22Å; Y118-F140 HydrophobicContact CG-CD2 4.09Å; Y118-F140 AromaticContact CG-CE2 3.42Å; Y118-F140 HydrophobicContact CG-CE2 3.42Å; Y118-F140 VanDerWaalsContact CG-CE2 3.42Å; Y118-F140 HydrophobicContact CG-CZ 4.1Å; I136-F140 HydrophobicContact CG2-CD2 3.95Å; I136-F140 HydrophobicContact CG2-CE2 3.81Å; I136-F140 WeakPolarHBondContact O-CD2 3.5Å; I136-F140 PolarHBondContact O-N 3.41Å; A137-F140 PolarHBondContact O-N 2.89Å; F140-L142 VanDerWaalsContact C-N 3.27Å; F140-L142 PolarHBondContact O-N 3.13Å; F140-Y143 PolarHBondContact O-N 3.41Å; F140-Y143 VanDerWaalsContact O-N 3.13Å; F140-S144 PolarHBondContact O-N 3.06Å; F140-F151 HydrophobicContact CB-CB 3.88Å; F140-F151 HydrophobicContact CB-CD2 3.68Å; F140-F151 HydrophobicContact CB-CE2 4.39Å; F140-F151 HydrophobicContact CB-CG 3.77Å; F140-F151 HydrophobicContact CD1-CB 4.19Å; F140-F151 AromaticContact CD1-CD1 3.4Å; F140-F151 HydrophobicContact CD1-CD1 3.4Å; F140-F151 AromaticContact CD1-CD2 3.89Å; F140-F151 HydrophobicContact CD1-CD2 3.89Å; F140-F151 AromaticContact CD1-CE1 3.65Å; F140-F151 HydrophobicContact CD1-CE1 3.65Å; F140-F151 HydrophobicContact CD1-CE2 4.12Å; F140-F151 AromaticContact CD1-CG 3.54Å; F140-F151 HydrophobicContact CD1-CG 3.54Å; F140-F151 HydrophobicContact CD1-CZ 4.01Å; F140-F151 HydrophobicContact CD2-CB 4.39Å; F140-F151 AromaticContact CE1-CD1 3.72Å; F140-F151 HydrophobicContact CE1-CD1 3.72Å; F140-F151 AromaticContact CE1-CE1 3.9Å; F140-F151 HydrophobicContact CE1-CE1 3.9Å; F140-F151 HydrophobicContact CE1-CG 4.29Å; F140-F151 HydrophobicContact CG-CB 3.91Å; F140-F151 HydrophobicContact CG-CD1 4.02Å; F140-F151 HydrophobicContact CG-CD2 4.08Å; F140-F151 AromaticContact CG-CG 3.72Å; F140-F151 HydrophobicContact CG-CG 3.72Å; F140-I161 HydrophobicContact CE1-CD1 3.81Å; F140-I161 HydrophobicContact CZ-CD1 3.94Å; F140-I161 HydrophobicContact CZ-CG2 4.15Å; F140-I163 HydrophobicContact CE2-CD1 4.04Å; F140-I163 HydrophobicContact CZ-CD1 4.4Å; F140-F222 HydrophobicContact CD1-CB 4.35Å; F140-F222 AromaticContact CD1-CD2 3.65Å; F140-F222 HydrophobicContact CD1-CD2 3.65Å; F140-F222 HydrophobicContact CD1-CE2 4.1Å; F140-F222 HydrophobicContact CD1-CG 4.01Å; F140-F222 HydrophobicContact CD2-CD2 4.05Å; F140-F222 AromaticContact CD2-CE2 3.63Å; F140-F222 HydrophobicContact CD2-CE2 3.63Å; F140-F222 HydrophobicContact CD2-CZ 4.17Å; F140-F222 HydrophobicContact CE1-CB 4.05Å; F140-F222 AromaticContact CE1-CD1 3.87Å; F140-F222 HydrophobicContact CE1-CD1 3.87Å; F140-F222 AromaticContact CE1-CD2 3.57Å; F140-F222 HydrophobicContact CE1-CD2 3.57Å; F140-F222 HydrophobicContact CE1-CE1 4.2Å; F140-F222 AromaticContact CE1-CE2 3.92Å; F140-F222 HydrophobicContact CE1-CE2 3.92Å; F140-F222 AromaticContact CE1-CG 3.55Å; F140-F222 HydrophobicContact CE1-CG 3.55Å; F140-F222 HydrophobicContact CE1-CZ 4.23Å; F140-F222 AromaticContact CE2-CD2 3.99Å; F140-F222 HydrophobicContact CE2-CD2 3.99Å; F140-F222 HydrophobicContact CE2-CE1 4.08Å; F140-F222 AromaticContact CE2-CE2 3.44Å; F140-F222 HydrophobicContact CE2-CE2 3.44Å; F140-F222 VanDerWaalsContact CE2-CE2 3.44Å; F140-F222 AromaticContact CE2-CZ 3.51Å; F140-F222 HydrophobicContact CE2-CZ 3.51Å; F140-F222 AromaticContact CG-CD2 3.88Å; F140-F222 HydrophobicContact CG-CD2 3.88Å; F140-F222 AromaticContact CG-CE2 3.95Å; F140-F222 HydrophobicContact CG-CE2 3.95Å; F140-F222 AromaticContact CZ-CD1 3.76Å; F140-F222 HydrophobicContact CZ-CD1 3.76Å; F140-F222 AromaticContact CZ-CD2 3.74Å; F140-F222 HydrophobicContact CZ-CD2 3.74Å; F140-F222 AromaticContact CZ-CE1 3.62Å; F140-F222 HydrophobicContact CZ-CE1 3.62Å; F140-F222 AromaticContact CZ-CE2 3.59Å; F140-F222 HydrophobicContact CZ-CE2 3.59Å; F140-F222 AromaticContact CZ-CG 3.83Å; F140-F222 HydrophobicContact CZ-CG 3.83Å; F140-F222 AromaticContact CZ-CZ 3.53Å; F140-F222 HydrophobicContact CZ-CZ 3.53Å
141	K	97.8	Very high	98	Very high	104 Å²	104	34.7 Å²	34.7	45%	0.452	19%	0.19	S	C	.	.	H	α-helix	trans	-60.9	-34.2	178.7	-166.1	-175.6	-170.1	-43.1	0	112.8	A137 K138 A139 Y143 S144 D145	A137-K141 WeakPolarHBondContact O-CB 3.26Å; A137-K141 PolarHBondContact O-N 3.12Å; K138-K141 WeakPolarHBondContact O-CB 3.23Å; K138-K141 PolarHBondContact O-N 3Å; A139-K141 VanDerWaalsContact C-N 3.26Å; A139-K141 PolarHBondContact O-N 3.07Å; K141-Y143 PolarHBondContact O-N 2.84Å; K141-S144 WeakPolarHBondContact CA-OG 3.4Å; K141-S144 PolarHBondContact O-N 3.5Å; K141-S144 PolarHBondContact O-OG 3.36Å; K141-D145 IonicContact NZ-OD1 3.37Å; K141-D145 PolarHBondContact NZ-OD1 2.94Å; K141-D145 IonicContact NZ-OD2 3.48Å; K141-D145 PolarHBondContact NZ-OD2 3.02Å; K141-D145 VanDerWaalsContact O-CB 3.26Å; K141-D145 WeakPolarHBondContact O-CB 3.19Å; K141-D145 PolarHBondContact O-N 2.78Å
142	L	97.9	Very high	97.9	Very high	18 Å²	18	37.6 Å²	37.6	9%	0.094	20%	0.202	C	C	.	.	H	α-helix	trans	-53.2	-42.1	174.8	-75.1	175.9	0	0	0	112	K138 A139 F140 F215 A219 Y250 L252	K138-L142 PolarHBondContact O-N 2.94Å; A139-L142 WeakPolarHBondContact O-CB 3.33Å; A139-L142 PolarHBondContact O-N 3.14Å; F140-L142 VanDerWaalsContact C-N 3.27Å; F140-L142 PolarHBondContact O-N 3.13Å; L142-F215 HydrophobicContact CD1-CE1 4.42Å; L142-F215 HydrophobicContact CD1-CE2 3.88Å; L142-F215 HydrophobicContact CD1-CZ 3.56Å; L142-F215 HydrophobicContact CD2-CZ 4.19Å; L142-F215 HydrophobicContact CG-CE2 4.18Å; L142-F215 HydrophobicContact CG-CZ 3.96Å; L142-A219 HydrophobicContact CD1-CB 3.68Å; L142-Y250 HydrophobicContact CD1-CD1 4.11Å; L142-Y250 HydrophobicContact CD1-CE1 4.1Å; L142-Y250 HydrophobicContact CD2-CD1 4.18Å; L142-Y250 WeakPolarHBondContact CD2-O 3.22Å; L142-L252 HydrophobicContact CB-CD1 4.21Å; L142-L252 HydrophobicContact CB-CD2 4.48Å; L142-L252 HydrophobicContact CB-CG 4.07Å; L142-L252 HydrophobicContact CD1-CD2 4.46Å; L142-L252 WeakPolarHBondContact O-CD1 3.39Å
143	Y	98.4	Very high	97.9	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-80	-50.1	179	-65	-77.1	0	0	0	111.5	F140 K141 D145 I146 I147 A219 F222 G223 L226 L228 L252 V260	F140-Y143 PolarHBondContact O-N 3.41Å; F140-Y143 VanDerWaalsContact O-N 3.13Å; K141-Y143 PolarHBondContact O-N 2.84Å; Y143-D145 PolarHBondContact O-N 3.14Å; Y143-D145 VanDerWaalsContact O-N 3.14Å; Y143-I146 WeakPolarHBondContact O-CG1 3.24Å; Y143-I146 PolarHBondContact O-N 3.01Å; Y143-I147 WeakPolarHBondContact O-CG1 3.1Å; Y143-I147 PolarHBondContact O-N 2.93Å; Y143-A219 VanDerWaalsContact CE2-O 3.26Å; Y143-A219 WeakPolarHBondContact CE2-O 3.04Å; Y143-A219 PolarHBondContact OH-O 3.22Å; Y143-F222 HydrophobicContact CD2-CB 4.41Å; Y143-F222 HydrophobicContact CE2-CB 3.99Å; Y143-G223 VanDerWaalsContact OH-CA 3.23Å; Y143-G223 WeakPolarHBondContact OH-CA 3.34Å; Y143-G223 PolarHBondContact OH-N 2.58Å; Y143-L226 HydrophobicContact CD1-CD1 3.61Å; Y143-L226 HydrophobicContact CD2-CD1 3.9Å; Y143-L226 HydrophobicContact CE1-CD1 4.15Å; Y143-L226 HydrophobicContact CE2-CD1 4.4Å; Y143-L226 HydrophobicContact CG-CD1 3.46Å; Y143-L226 VanDerWaalsContact CG-CD1 3.46Å; Y143-L228 HydrophobicContact CE1-CD1 4.31Å; Y143-L252 HydrophobicContact CD1-CD1 3.69Å; Y143-L252 HydrophobicContact CE1-CD1 3.8Å; Y143-L252 HydrophobicContact CE1-CD2 4.13Å; Y143-L252 HydrophobicContact CG-CD1 4.26Å; Y143-V260 HydrophobicContact CD1-CB 4.38Å; Y143-V260 HydrophobicContact CD1-CG1 4.19Å; Y143-V260 HydrophobicContact CD1-CG2 4.01Å; Y143-V260 HydrophobicContact CE1-CG2 4.45Å
144	S	97.6	Very high	97.8	Very high	19 Å²	19	40.2 Å²	40.2	13%	0.133	22%	0.215	C	C	.	.	H	α-helix	trans	-61.7	-27.3	-177.4	63.4	0	0	0	0	112.4	F140 K141 I146 L149 R267	F140-S144 PolarHBondContact O-N 3.06Å; K141-S144 WeakPolarHBondContact CA-OG 3.4Å; K141-S144 PolarHBondContact O-N 3.5Å; K141-S144 PolarHBondContact O-OG 3.36Å; S144-I146 PolarHBondContact O-N 3.04Å; S144-L149 WeakPolarHBondContact CA-O 3.36Å; S144-L149 WeakPolarHBondContact CB-O 3.27Å; S144-R267 PolarHBondContact O-NE 3.35Å; S144-R267 PolarHBondContact O-NH2 3.01Å
145	D	95.9	Very high	97.4	Very high	80 Å²	80	44.8 Å²	44.8	43%	0.428	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.8	174.4	-78.7	-8.7	0	0	0	113.9	K141 Y143 I270	K141-D145 IonicContact NZ-OD1 3.37Å; K141-D145 PolarHBondContact NZ-OD1 2.94Å; K141-D145 IonicContact NZ-OD2 3.48Å; K141-D145 PolarHBondContact NZ-OD2 3.02Å; K141-D145 VanDerWaalsContact O-CB 3.26Å; K141-D145 WeakPolarHBondContact O-CB 3.19Å; K141-D145 PolarHBondContact O-N 2.78Å; Y143-D145 PolarHBondContact O-N 3.14Å; Y143-D145 VanDerWaalsContact O-N 3.14Å; D145-I270 WeakPolarHBondContact O-CD1 3.3Å
146	I	96.3	Very high	97.2	Very high	25 Å²	25	47.6 Å²	47.6	13%	0.128	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	-16	-172.5	60.5	156	0	0	0	115.3	Y143 S144 L252 R257 V260 Q261 R267 I270	Y143-I146 WeakPolarHBondContact O-CG1 3.24Å; Y143-I146 PolarHBondContact O-N 3.01Å; S144-I146 PolarHBondContact O-N 3.04Å; I146-L252 HydrophobicContact CD1-CD1 3.49Å; I146-L252 VanDerWaalsContact CD1-CD1 3.49Å; I146-L252 HydrophobicContact CG1-CD1 4.21Å; I146-R257 HydrophobicContact CD1-CB 4.05Å; I146-R257 HydrophobicContact CD1-CG 3.68Å; I146-V260 HydrophobicContact CD1-CG1 3.6Å; I146-Q261 PolarHBondContact O-NE2 3.2Å; I146-Q261 VanDerWaalsContact O-NE2 3.11Å; I146-R267 PolarHBondContact O-N 2.79Å; I146-I270 HydrophobicContact CB-CD1 4.49Å
147	I	96.5	Very high	96.9	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.292	C	S	.	.	S	Bend	trans	-122.6	158.1	179.5	74	-170.6	0	0	0	111.9	Y143 L149 L226 V260 Q261 Y264 R267	Y143-I147 WeakPolarHBondContact O-CG1 3.1Å; Y143-I147 PolarHBondContact O-N 2.93Å; I147-L149 HydrophobicContact CD1-CB 4.13Å; I147-L149 HydrophobicContact CD1-CD1 3.97Å; I147-L149 HydrophobicContact CD1-CG 4.1Å; I147-L149 HydrophobicContact CG1-CB 3.99Å; I147-L149 HydrophobicContact CG1-CG 4.22Å; I147-L149 PolarHBondContact O-N 2.89Å; I147-L226 HydrophobicContact CD1-CD1 4.3Å; I147-V260 HydrophobicContact CD1-CG2 3.79Å; I147-V260 HydrophobicContact CG2-CB 4.4Å; I147-V260 HydrophobicContact CG2-CG1 3.72Å; I147-V260 HydrophobicContact CG2-CG2 4.05Å; I147-Q261 HydrophobicContact CG2-CG 4.04Å; I147-Y264 HydrophobicContact CD1-CD2 3.97Å; I147-Y264 HydrophobicContact CD1-CG 4.26Å; I147-R267 PolarHBondContact O-NE 3.34Å; I147-R267 PolarHBondContact O-NH2 3.13Å
148	P	96.4	Very high	96.8	Very high	59 Å²	59	58.8 Å²	58.8	38%	0.383	31%	0.307	S	S	.	.	S	Bend	trans	-80.5	41.2	-179.8	35.6	-38.4	0	0	0	113.2	Y264 G265	P148-Y264 WeakPolarHBondContact CD-O 3.42Å; P148-Y264 WeakPolarHBondContact CG-O 3.46Å; P148-G265 VanDerWaalsContact CD-O 3.28Å; P148-G265 WeakPolarHBondContact CD-O 3.37Å
149	L	97.4	Very high	96.7	Very high	4 Å²	4	55.2 Å²	55.2	2%	0.021	30%	0.295	C	S	.	.			trans	-114	137.3	168.8	-65.6	-173.1	0	0	0	110.1	K113 A114 V116 S144 I147 F151 L226 Y264 R267	K113-L149 WeakPolarHBondContact O-CD2 3.19Å; A114-L149 WeakPolarHBondContact O-CA 3.07Å; V116-L149 HydrophobicContact CG2-CD1 4.13Å; V116-L149 HydrophobicContact CG2-CD2 4.48Å; S144-L149 WeakPolarHBondContact CA-O 3.36Å; S144-L149 WeakPolarHBondContact CB-O 3.27Å; I147-L149 HydrophobicContact CD1-CB 4.13Å; I147-L149 HydrophobicContact CD1-CD1 3.97Å; I147-L149 HydrophobicContact CD1-CG 4.1Å; I147-L149 HydrophobicContact CG1-CB 3.99Å; I147-L149 HydrophobicContact CG1-CG 4.22Å; I147-L149 PolarHBondContact O-N 2.89Å; L149-F151 HydrophobicContact CB-CE2 4.41Å; L149-F151 HydrophobicContact CB-CZ 4.2Å; L149-F151 HydrophobicContact CD1-CZ 4.33Å; L149-L226 HydrophobicContact CD1-CD2 3.76Å; L149-Y264 HydrophobicContact CD1-CD1 3.75Å; L149-Y264 HydrophobicContact CD1-CD2 4.46Å; L149-Y264 HydrophobicContact CD1-CE1 3.51Å; L149-Y264 HydrophobicContact CD1-CE2 4.27Å; L149-Y264 HydrophobicContact CD1-CG 4.2Å; L149-Y264 HydrophobicContact CD2-CD1 4.16Å; L149-Y264 HydrophobicContact CD2-CE1 4.31Å; L149-Y264 HydrophobicContact CG-CD1 3.93Å; L149-Y264 HydrophobicContact CG-CE1 4.16Å; L149-Y264 HydrophobicContact CG-CG 4.36Å; L149-R267 PolarHBondContact O-NH2 3.05Å
150	D	97.6	Very high	96.7	Very high	75 Å²	75	57 Å²	57	40%	0.401	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	144.3	167.1	-62.7	-45.9	0	0	0	109.9	A114 V115 V116 R267	A114-D150 PolarHBondContact O-N 2.92Å; V115-D150 CarbonylContact C-O 3.56Å; V115-D150 WeakPolarHBondContact CA-O 3.34Å; V115-D150 HydrophobicContact CG2-CB 4.42Å; V116-D150 PolarHBondContact N-O 3.32Å; D150-R267 IonicContact OD1-CZ 3.48Å; D150-R267 IonicContact OD1-NH1 3.24Å; D150-R267 PolarHBondContact OD1-NH1 2.91Å; D150-R267 IonicContact OD1-NH2 2.66Å; D150-R267 PolarHBondContact OD1-NH2 3.47Å
151	F	98.6	Very high	96.6	Very high	33 Å²	33	56.9 Å²	56.9	15%	0.145	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112	132.1	178.3	-59.1	-81.4	0	0	0	110.1	V116 Y118 F140 L149 L226	V116-F151 HydrophobicContact CB-CD1 3.86Å; V116-F151 HydrophobicContact CB-CE1 3.94Å; V116-F151 HydrophobicContact CG1-CD1 4.25Å; V116-F151 HydrophobicContact CG1-CE1 4.26Å; V116-F151 HydrophobicContact CG2-CE1 4.4Å; V116-F151 WeakPolarHBondContact O-CA 3.1Å; Y118-F151 HydrophobicContact CD1-CB 4.17Å; Y118-F151 HydrophobicContact CE1-CB 4.17Å; F140-F151 HydrophobicContact CB-CB 3.88Å; F140-F151 HydrophobicContact CB-CD2 3.68Å; F140-F151 HydrophobicContact CB-CE2 4.39Å; F140-F151 HydrophobicContact CB-CG 3.77Å; F140-F151 HydrophobicContact CD1-CB 4.19Å; F140-F151 AromaticContact CD1-CD1 3.4Å; F140-F151 HydrophobicContact CD1-CD1 3.4Å; F140-F151 AromaticContact CD1-CD2 3.89Å; F140-F151 HydrophobicContact CD1-CD2 3.89Å; F140-F151 AromaticContact CD1-CE1 3.65Å; F140-F151 HydrophobicContact CD1-CE1 3.65Å; F140-F151 HydrophobicContact CD1-CE2 4.12Å; F140-F151 AromaticContact CD1-CG 3.54Å; F140-F151 HydrophobicContact CD1-CG 3.54Å; F140-F151 HydrophobicContact CD1-CZ 4.01Å; F140-F151 HydrophobicContact CD2-CB 4.39Å; F140-F151 AromaticContact CE1-CD1 3.72Å; F140-F151 HydrophobicContact CE1-CD1 3.72Å; F140-F151 AromaticContact CE1-CE1 3.9Å; F140-F151 HydrophobicContact CE1-CE1 3.9Å; F140-F151 HydrophobicContact CE1-CG 4.29Å; F140-F151 HydrophobicContact CG-CB 3.91Å; F140-F151 HydrophobicContact CG-CD1 4.02Å; F140-F151 HydrophobicContact CG-CD2 4.08Å; F140-F151 AromaticContact CG-CG 3.72Å; F140-F151 HydrophobicContact CG-CG 3.72Å; L149-F151 HydrophobicContact CB-CE2 4.41Å; L149-F151 HydrophobicContact CB-CZ 4.2Å; L149-F151 HydrophobicContact CD1-CZ 4.33Å; F151-L226 HydrophobicContact CE1-CD2 3.89Å; F151-L226 HydrophobicContact CZ-CD1 4Å; F151-L226 HydrophobicContact CZ-CD2 3.76Å; F151-L226 HydrophobicContact CZ-CG 4.4Å
152	Q	98.3	Very high	96.7	Very high	121 Å²	121	53.1 Å²	53.1	57%	0.565	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.8	-177.9	-178	170.9	52.3	0	0	110.9	V115 V116 T117 Y118 S154	V115-Q152 HydrophobicContact CG1-CB 4.05Å; V116-Q152 PolarHBondContact O-N 3.19Å; T117-Q152 CarbonylContact C-O 3.57Å; T117-Q152 VanDerWaalsContact CA-O 3.27Å; T117-Q152 WeakPolarHBondContact CA-O 3.33Å; Y118-Q152 PolarHBondContact N-O 3.27Å; Q152-S154 PolarHBondContact O-N 2.84Å
153	Q	98	Very high	96.7	Very high	76 Å²	76	52.2 Å²	52.2	36%	0.355	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	133.3	169.3	-161.7	165.4	3.2	0	0	109.4	Y118 D133	Y118-Q153 HydrophobicContact CD2-CB 4.38Å; Y118-Q153 HydrophobicContact CD2-CG 4.18Å; Y118-Q153 HydrophobicContact CE1-CB 4.05Å; Y118-Q153 VanDerWaalsContact CE1-N 3.33Å; Y118-Q153 HydrophobicContact CE2-CB 3.72Å; Y118-Q153 HydrophobicContact CE2-CG 3.64Å; Y118-Q153 CarbonylContact O-C 3.5Å; Y118-Q153 WeakPolarHBondContact O-CA 3.18Å; D133-Q153 PolarHBondContact OD1-NE2 3.38Å
154	S	95.3	Very high	96.7	Very high	22 Å²	22	54.2 Å²	54.2	15%	0.154	29%	0.292	C	S	.	.			trans	-123	137.9	-178.8	-177.6	0	0	0	0	110.8	Y118 Q152 S156	Y118-S154 PolarHBondContact O-N 3.27Å; Q152-S154 PolarHBondContact O-N 2.84Å; S154-S156 VanDerWaalsContact C-N 3.26Å; S154-S156 VanDerWaalsContact OG-CB 3.27Å; S154-S156 WeakPolarHBondContact OG-CB 3.27Å; S154-S156 PolarHBondContact OG-N 2.89Å; S154-S156 PolarHBondContact OG-OG 3.48Å
155	D	92.1	Very high	96.7	Very high	160 Å²	160	53.6 Å²	53.6	86%	0.856	29%	0.287	S	S	*	.			trans	-86.1	2.4	171.3	-63	-40.1	0	0	0	112.7
156	S	93.9	Very high	96.8	Very high	67 Å²	67	53.2 Å²	53.2	47%	0.469	28%	0.281	S	S	.	.	S	Bend	trans	-66.7	156.7	179.7	-58.5	0	0	0	0	111.6	R119 S154 T158	R119-S156 WeakPolarHBondContact CD-O 3.3Å; R119-S156 VanDerWaalsContact CZ-O 3.32Å; R119-S156 PolarHBondContact NE-O 3.39Å; R119-S156 PolarHBondContact NH1-O 2.87Å; S154-S156 VanDerWaalsContact C-N 3.26Å; S154-S156 VanDerWaalsContact OG-CB 3.27Å; S154-S156 WeakPolarHBondContact OG-CB 3.27Å; S154-S156 PolarHBondContact OG-N 2.89Å; S154-S156 PolarHBondContact OG-OG 3.48Å; S156-T158 WeakPolarHBondContact CB-O 3.44Å; S156-T158 PolarHBondContact O-N 2.82Å
157	E	92.8	Very high	96.8	Very high	170 Å²	170	54.5 Å²	54.5	79%	0.794	29%	0.293	S	S	*	.	S	Bend	trans	-54.2	-39.8	179.7	-170.9	172	-175.9	0	0	112.5	R119	R119-E157 VanDerWaalsContact NH1-C 3.26Å; R119-E157 PolarHBondContact NH1-O 2.96Å
158	T	94.9	Very high	96.8	Very high	106 Å²	106	55.5 Å²	55.5	65%	0.65	30%	0.303	S	S	*	.			trans	-123.3	155.8	176.9	58	0	0	0	0	111.2	S156	S156-T158 WeakPolarHBondContact CB-O 3.44Å; S156-T158 PolarHBondContact O-N 2.82Å
159	A	97.4	Very high	96.8	Very high	18 Å²	18	58.9 Å²	58.9	15%	0.149	32%	0.318	C	S	.	.			trans	-139.6	174.5	172.6	0	0	0	0	0	108.9	R119 I161 M162	R119-A159 HydrophobicContact CB-CB 3.81Å; A159-I161 VanDerWaalsContact C-N 3.3Å; A159-M162 HydrophobicContact CB-SD 3.9Å; A159-M162 PolarHBondContact N-SD 3.04Å
160	D	97.9	Very high	96.7	Very high	38 Å²	38	60.3 Å²	60.3	20%	0.203	33%	0.325	C	S	.	.	S	Bend	trans	-71.3	-28.9	176.3	-57	-51.6	0	0	0	112.6	W111 K113 V116 T117 G194	W111-D160 HydrophobicContact CH2-CB 3.99Å; W111-D160 WeakPolarHBondContact CH2-O 3.33Å; W111-D160 HydrophobicContact CZ2-CB 4.19Å; W111-D160 HydrophobicContact CZ3-CB 4.36Å; K113-D160 IonicContact NZ-OD1 2.73Å; K113-D160 PolarHBondContact NZ-OD1 2.87Å; K113-D160 IonicContact NZ-OD2 2.77Å; K113-D160 PolarHBondContact NZ-OD2 2.87Å; V116-D160 HydrophobicContact CG1-CB 3.76Å; T117-D160 PolarHBondContact N-OD2 2.99Å; T117-D160 WeakPolarHBondContact O-CA 3.29Å; T117-D160 VanDerWaalsContact O-CB 3.3Å; T117-D160 WeakPolarHBondContact O-CB 3.46Å; T117-D160 PolarHBondContact O-N 2.81Å; T117-D160 PolarHBondContact OG1-N 3.18Å; T117-D160 VanDerWaalsContact OG1-N 3.11Å; T117-D160 PolarHBondContact OG1-OD2 2.93Å; T117-D160 VanDerWaalsContact OG1-OD2 3.1Å; D160-G194 VanDerWaalsContact O-O 3.12Å
161	I	98.6	Very high	96.4	Very high	0 Å²	0	59.9 Å²	59.9	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	109.2	177.6	-63.9	171.8	0	0	0	108	W111 V116 T117 Y118 R119 F140 A159 I163 G195 A225	W111-I161 HydrophobicContact CZ2-CG1 4.31Å; V116-I161 HydrophobicContact CG1-CD1 3.78Å; V116-I161 HydrophobicContact CG1-CG1 4.15Å; T117-I161 PolarHBondContact O-N 3.45Å; Y118-I161 CarbonylContact C-O 3.52Å; Y118-I161 WeakPolarHBondContact CA-O 3.44Å; R119-I161 PolarHBondContact N-O 2.9Å; F140-I161 HydrophobicContact CE1-CD1 3.81Å; F140-I161 HydrophobicContact CZ-CD1 3.94Å; F140-I161 HydrophobicContact CZ-CG2 4.15Å; A159-I161 VanDerWaalsContact C-N 3.3Å; I161-I163 HydrophobicContact CG2-CD1 4.47Å; I161-I163 HydrophobicContact CG2-CG1 4.03Å; I161-G195 VanDerWaalsContact CG2-O 3.25Å; I161-G195 WeakPolarHBondContact CG2-O 3.35Å; I161-A225 HydrophobicContact CD1-CB 3.92Å; I161-A225 HydrophobicContact CG1-CB 4.33Å
162	M	98.4	Very high	96	Very high	24 Å²	24	59 Å²	59	12%	0.118	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	129.1	170.9	-49.1	-68.5	-75	0	0	109.7	R119 T121 A159 D196 A197	R119-M162 HydrophobicContact CB-CE 4.49Å; R119-M162 HydrophobicContact CB-SD 4.1Å; R119-M162 WeakPolarHBondContact O-CA 3.44Å; T121-M162 HydrophobicContact CG2-CE 3.44Å; T121-M162 VanDerWaalsContact CG2-CE 3.44Å; A159-M162 HydrophobicContact CB-SD 3.9Å; A159-M162 PolarHBondContact N-SD 3.04Å; M162-D196 WeakPolarHBondContact CA-OD1 3.41Å; M162-D196 WeakPolarHBondContact CB-OD1 3.24Å; M162-D196 WeakPolarHBondContact CB-OD2 3.16Å; M162-D196 VanDerWaalsContact CG-OD1 3.26Å; M162-D196 WeakPolarHBondContact CG-OD1 3.39Å; M162-D196 PolarHBondContact N-OD1 3.26Å; M162-D196 WeakPolarHBondContact O-CA 3.46Å; M162-A197 PolarHBondContact O-N 2.67Å
163	I	98.8	Very high	95.5	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	121.8	-178.2	-64.4	161.7	0	0	0	108.7	Y118 R119 I120 T121 I136 F140 I161 F165 A197 F199 F222	Y118-I163 HydrophobicContact CD2-CD1 3.91Å; Y118-I163 HydrophobicContact CG-CD1 4.49Å; R119-I163 PolarHBondContact O-N 3.2Å; I120-I163 WeakPolarHBondContact CA-O 3.18Å; I120-I163 HydrophobicContact CB-CB 4.5Å; I120-I163 HydrophobicContact CG1-CB 4.09Å; I120-I163 HydrophobicContact CG1-CD1 4.09Å; I120-I163 HydrophobicContact CG1-CG2 4.21Å; I120-I163 HydrophobicContact CG2-CG2 4.37Å; T121-I163 PolarHBondContact N-O 2.91Å; T121-I163 PolarHBondContact OG1-O 3.45Å; I136-I163 HydrophobicContact CD1-CG2 4.48Å; I136-I163 HydrophobicContact CG2-CD1 3.57Å; F140-I163 HydrophobicContact CE2-CD1 4.04Å; F140-I163 HydrophobicContact CZ-CD1 4.4Å; I161-I163 HydrophobicContact CG2-CD1 4.47Å; I161-I163 HydrophobicContact CG2-CG1 4.03Å; I163-F165 HydrophobicContact CG2-CE2 4.44Å; I163-A197 WeakPolarHBondContact CA-O 3.29Å; I163-F199 HydrophobicContact CG2-CD2 4.11Å; I163-F199 HydrophobicContact CG2-CE2 3.75Å; I163-F222 HydrophobicContact CD1-CE1 3.87Å; I163-F222 HydrophobicContact CD1-CZ 3.57Å; I163-F222 HydrophobicContact CG1-CE1 4.06Å; I163-F222 HydrophobicContact CG1-CZ 4.22Å
164	K	97.9	Very high	95.1	Very high	42 Å²	42	60 Å²	60	18%	0.183	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.7	-175.6	-37.2	-165	-173	89.7	0	110.5	T121 D122 K166 D196 A197 H198 F199	T121-K164 WeakPolarHBondContact OG1-CG 3.47Å; D122-K164 HydrophobicContact CB-CB 4.47Å; K164-K166 HydrophobicContact CB-CG 4.21Å; K164-D196 IonicContact NZ-OD2 3.59Å; K164-D196 PolarHBondContact NZ-OD2 3.25Å; K164-A197 PolarHBondContact N-O 3.45Å; K164-H198 PolarHBondContact NZ-NE2 2.77Å; K164-H198 CarbonylContact O-C 3.6Å; K164-H198 VanDerWaalsContact O-CA 3.3Å; K164-H198 WeakPolarHBondContact O-CA 3.24Å; K164-F199 PolarHBondContact O-N 3.25Å
165	F	98.6	Very high	95.1	Very high	6 Å²	6	62.2 Å²	62.2	3%	0.026	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.9	165	-61.5	-110.7	0	0	0	108.6	D122 T124 V132 I163 F199 E201 W205 L214	D122-F165 VanDerWaalsContact O-CD2 3.25Å; D122-F165 WeakPolarHBondContact O-CD2 3.33Å; T124-F165 HydrophobicContact CG2-CD1 4.05Å; T124-F165 HydrophobicContact CG2-CE1 3.74Å; T124-F165 HydrophobicContact CG2-CZ 4.11Å; V132-F165 HydrophobicContact CG1-CE2 4.08Å; V132-F165 HydrophobicContact CG1-CZ 4.2Å; I163-F165 HydrophobicContact CG2-CE2 4.44Å; F165-F199 CarbonylContact C-O 3.43Å; F165-F199 VanDerWaalsContact CA-O 3.31Å; F165-F199 WeakPolarHBondContact CA-O 3.46Å; F165-F199 HydrophobicContact CD1-CB 3.56Å; F165-F199 HydrophobicContact CD1-CG 4.32Å; F165-F199 HydrophobicContact CE1-CB 3.8Å; F165-F199 HydrophobicContact CE1-CG 4.11Å; F165-F199 HydrophobicContact CG-CB 4.01Å; F165-F199 HydrophobicContact CZ-CB 4.45Å; F165-F199 HydrophobicContact CZ-CG 4.35Å; F165-E201 HydrophobicContact CB-CB 4.43Å; F165-E201 WeakPolarHBondContact CB-OE2 3.2Å; F165-W205 AromaticContact CD1-CD1 3.96Å; F165-W205 HydrophobicContact CD1-CG 4.47Å; F165-W205 AromaticContact CD1-NE1 3.71Å; F165-W205 HydrophobicContact CE1-CD2 4.09Å; F165-W205 HydrophobicContact CE1-CG 4.08Å; F165-W205 AromaticContact CE1-NE1 3.97Å; F165-L214 HydrophobicContact CE1-CD1 3.89Å; F165-L214 HydrophobicContact CZ-CD1 3.72Å; F165-L214 HydrophobicContact CZ-CD2 4.07Å
166	K	97.8	Very high	95.3	Very high	71 Å²	71	55.2 Å²	55.2	31%	0.309	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	151	-173.7	-64.9	-66.2	174.5	-165.5	0	110.3	D122 K164 H170 F176 F199 D200 E201	D122-K166 VanDerWaalsContact CG-CE 3.46Å; D122-K166 IonicContact OD1-NZ 2.72Å; D122-K166 PolarHBondContact OD1-NZ 3.08Å; D122-K166 VanDerWaalsContact OD2-CE 3.24Å; D122-K166 WeakPolarHBondContact OD2-CE 3.21Å; D122-K166 IonicContact OD2-NZ 3.6Å; D122-K166 PolarHBondContact OD2-NZ 2.9Å; K164-K166 HydrophobicContact CB-CG 4.21Å; K166-H170 HydrophobicContact CB-CB 3.55Å; K166-H170 HydrophobicContact CG-CB 3.9Å; K166-F176 WeakPolarHBondContact O-CD2 3.33Å; K166-F176 WeakPolarHBondContact O-CE2 3.18Å; K166-F199 PolarHBondContact N-O 2.94Å; K166-D200 WeakPolarHBondContact O-CA 3.3Å; K166-E201 PolarHBondContact O-N 3.27Å
167	S	96.6	Very high	95.2	Very high	52 Å²	52	56 Å²	56	36%	0.364	32%	0.318	S	S	.	.			trans	-104.7	150.2	173	-52.6	0	0	0	0	111.4	D202	S167-D202 VanDerWaalsContact CB-OD1 3.22Å; S167-D202 WeakPolarHBondContact CB-OD1 3.43Å; S167-D202 PolarHBondContact OG-OD1 2.87Å
168	G	95.8	Very high	95.1	Very high	22 Å²	22	56.7 Å²	56.7	23%	0.227	31%	0.313	C	S	.	.	S	Bend	trans	57.2	-135.7	167.9	0	0	0	0	0	113.8	H170 P175 F176	G168-H170 PolarHBondContact O-N 3.22Å; G168-H170 PolarHBondContact O-ND1 3.25Å; G168-P175 CarbonylContact O-C 3.6Å; G168-P175 VanDerWaalsContact O-CA 3.28Å; G168-P175 WeakPolarHBondContact O-CA 3.46Å; G168-F176 PolarHBondContact O-N 3.29Å
169	D	96	Very high	94.9	Very high	130 Å²	130	57 Å²	57	70%	0.695	31%	0.307	S	S	*	.			trans	-73.2	120	174.4	-177.5	8.8	0	0	0	111.1	G171 P175	D169-G171 PolarHBondContact OD1-N 3.4Å; D169-P175 HydrophobicContact CB-CB 4.26Å
170	H	95.5	Very high	94.5	Very high	34 Å²	34	61 Å²	61	16%	0.157	33%	0.326	C	S	.	.			trans	-131.2	24.4	-174.2	54.6	-87.7	0	0	0	113.5	K166 G168 D172 A174 F176 H185 H198	K166-H170 HydrophobicContact CB-CB 3.55Å; K166-H170 HydrophobicContact CG-CB 3.9Å; G168-H170 PolarHBondContact O-N 3.22Å; G168-H170 PolarHBondContact O-ND1 3.25Å; H170-D172 IonicContact CD2-OD1 2.74Å; H170-D172 IonicContact CD2-OD2 3.59Å; H170-D172 PolarHBondContact CD2-OD2 3.22Å; H170-D172 IonicContact CE1-OD1 2.57Å; H170-D172 IonicContact NE2-OD1 2.7Å; H170-D172 PolarHBondContact NE2-OD1 3.21Å; H170-D172 IonicContact NE2-OD2 3.96Å; H170-D172 PolarHBondContact NE2-OD2 2.68Å; H170-A174 PolarHBondContact CE1-O 2.88Å; H170-F176 AromaticContact CE1-CD2 3.3Å; H170-F176 WeakPolarHBondContact CE1-CD2 3.3Å; H170-F176 AromaticContact CE1-CE2 3.27Å; H170-F176 WeakPolarHBondContact CE1-CE2 3.15Å; H170-F176 AromaticContact CE1-CG 3.86Å; H170-F176 AromaticContact CE1-CZ 3.78Å; H170-F176 AromaticContact ND1-CD2 3.6Å; H170-F176 AromaticContact ND1-CE2 3.82Å; H170-F176 AromaticContact NE2-CE2 3.69Å; H170-F176 AromaticContact NE2-CZ 3.98Å; H170-H185 AromaticContact CE1-CE1 3.58Å; H170-H185 AromaticContact NE2-CE1 3.2Å; H170-H185 PolarHBondContact NE2-CE1 3.37Å; H170-H185 AromaticContact NE2-NE2 3.37Å; H170-H185 PolarHBondContact NE2-NE2 3.33Å; H170-H198 AromaticContact CD2-ND1 3.42Å; H170-H198 PolarHBondContact CD2-ND1 3.42Å; H170-H198 AromaticContact NE2-ND1 3.47Å; H170-H198 PolarHBondContact NE2-ND1 2.8Å
171	G	92	Very high	94.3	Very high	65 Å²	65	60 Å²	60	67%	0.67	32%	0.324	S	S	*	.	S	Bend	trans	88.1	12.6	162.4	0	0	0	0	0	116.3	D169	D169-G171 PolarHBondContact OD1-N 3.4Å
172	D	89.6	Confident	94.3	Very high	15 Å²	15	60.1 Å²	60.1	8%	0.08	33%	0.325	C	S	.	.	S	Bend	trans	-120.4	8.4	178.1	68.7	-1.5	0	0	0	114	H170 A174 H185 F187 H198	H170-D172 IonicContact CD2-OD1 2.74Å; H170-D172 IonicContact CD2-OD2 3.59Å; H170-D172 PolarHBondContact CD2-OD2 3.22Å; H170-D172 IonicContact CE1-OD1 2.57Å; H170-D172 IonicContact NE2-OD1 2.7Å; H170-D172 PolarHBondContact NE2-OD1 3.21Å; H170-D172 IonicContact NE2-OD2 3.96Å; H170-D172 PolarHBondContact NE2-OD2 2.68Å; D172-A174 PolarHBondContact O-N 3.39Å; D172-A174 PolarHBondContact OD1-N 3.41Å; D172-H185 IonicContact OD2-CD2 3.25Å; D172-H185 IonicContact OD2-CE1 2.91Å; D172-H185 IonicContact OD2-NE2 3.63Å; D172-H185 PolarHBondContact OD2-NE2 2.9Å; D172-F187 HydrophobicContact CB-CE2 4.37Å; D172-F187 HydrophobicContact CB-CZ 3.88Å; D172-H198 IonicContact OD2-CE1 3.67Å; D172-H198 PolarHBondContact OD2-CE1 2.69Å; D172-H198 VanDerWaalsContact OD2-CE1 3.25Å; D172-H198 IonicContact OD2-ND1 3.91Å; D172-H198 PolarHBondContact OD2-ND1 2.98Å
173	F	88.6	Confident	94.3	Very high	182 Å²	182	59.2 Å²	59.2	80%	0.798	32%	0.321	S	S	*	.	S	Bend	trans	65.4	12.7	-177.7	-48.7	-82.3	0	0	0	115.3	P175	F173-P175 VanDerWaalsContact C-CD 3.45Å; F173-P175 WeakPolarHBondContact O-CD 3.41Å
174	A	89.3	Confident	94.3	Very high	36 Å²	36	59.2 Å²	59.2	30%	0.298	32%	0.321	S	S	.	.			trans	-118.3	68.5	172.3	0	0	0	0	0	110	H170 D172 F176 H185	H170-A174 PolarHBondContact CE1-O 2.88Å; D172-A174 PolarHBondContact O-N 3.39Å; D172-A174 PolarHBondContact OD1-N 3.41Å; A174-F176 PolarHBondContact O-N 2.85Å; A174-H185 PolarHBondContact O-CE1 2.98Å; A174-H185 VanDerWaalsContact O-CE1 3.25Å
175	P	94.3	Very high	94.3	Very high	69 Å²	69	57.9 Å²	57.9	45%	0.448	32%	0.315	S	S	.	.			trans	-63.5	140.2	-176.6	28.8	-35.9	0	0	0	111.5	G168 D169 F173	G168-P175 CarbonylContact O-C 3.6Å; G168-P175 VanDerWaalsContact O-CA 3.28Å; G168-P175 WeakPolarHBondContact O-CA 3.46Å; D169-P175 HydrophobicContact CB-CB 4.26Å; F173-P175 VanDerWaalsContact C-CD 3.45Å; F173-P175 WeakPolarHBondContact O-CD 3.41Å
176	F	96.1	Very high	94.2	Very high	13 Å²	13	57.7 Å²	57.7	6%	0.057	32%	0.315	C	S	.	.			trans	-70.9	153.5	172.2	-66.6	-56	0	0	0	112.1	K166 G168 H170 A174 V182 H185 H198 D200	K166-F176 WeakPolarHBondContact O-CD2 3.33Å; K166-F176 WeakPolarHBondContact O-CE2 3.18Å; G168-F176 PolarHBondContact O-N 3.29Å; H170-F176 AromaticContact CE1-CD2 3.3Å; H170-F176 WeakPolarHBondContact CE1-CD2 3.3Å; H170-F176 AromaticContact CE1-CE2 3.27Å; H170-F176 WeakPolarHBondContact CE1-CE2 3.15Å; H170-F176 AromaticContact CE1-CG 3.86Å; H170-F176 AromaticContact CE1-CZ 3.78Å; H170-F176 AromaticContact ND1-CD2 3.6Å; H170-F176 AromaticContact ND1-CE2 3.82Å; H170-F176 AromaticContact NE2-CE2 3.69Å; H170-F176 AromaticContact NE2-CZ 3.98Å; A174-F176 PolarHBondContact O-N 2.85Å; F176-V182 HydrophobicContact CD1-CB 4.21Å; F176-V182 HydrophobicContact CD1-CG1 3.74Å; F176-V182 HydrophobicContact CE1-CG1 3.81Å; F176-H185 AromaticContact CE1-CE1 3.7Å; F176-H185 AromaticContact CE1-ND1 3.38Å; F176-H185 WeakPolarHBondContact CE1-ND1 3.48Å; F176-H185 AromaticContact CZ-CE1 3.72Å; F176-H185 AromaticContact CZ-ND1 3.76Å; F176-H198 HydrophobicContact CE2-CB 4.25Å; F176-H198 HydrophobicContact CZ-CB 3.91Å; F176-D200 HydrophobicContact CB-CB 4.06Å; F176-D200 VanDerWaalsContact CB-CG 3.46Å; F176-D200 WeakPolarHBondContact CB-OD2 3.46Å; F176-D200 HydrophobicContact CD1-CB 3.82Å; F176-D200 HydrophobicContact CD2-CB 3.7Å; F176-D200 HydrophobicContact CE1-CB 4.18Å; F176-D200 HydrophobicContact CE2-CB 4.05Å; F176-D200 HydrophobicContact CG-CB 3.6Å; F176-D200 HydrophobicContact CZ-CB 4.29Å
177	D	92.6	Very high	94	Very high	84 Å²	84	57.1 Å²	57.1	45%	0.449	31%	0.313	S	S	.	.			trans	-103.3	14.6	-173.1	62.3	-22.1	0	0	0	113.8	V182	D177-V182 WeakPolarHBondContact OD1-CB 3.35Å; D177-V182 PolarHBondContact OD1-N 2.91Å
178	R	90.8	Very high	93.9	Very high	184 Å²	184	56 Å²	56	69%	0.694	31%	0.305	S	S	*	.			trans	73.5	-173.3	-176	-43.1	170.6	-179.2	173.3	-0.2	111.4	D202	R178-D202 HydrophobicContact CB-CB 4.35Å
179	Q	90.4	Very high	93.8	Very high	113 Å²	113	55.6 Å²	55.6	53%	0.528	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	137.7	-173.3	-153.1	178.2	44.2	0	0	116.6	G181 D202 E203	Q179-G181 VanDerWaalsContact C-N 3.34Å; Q179-D202 WeakPolarHBondContact CG-O 3.3Å; Q179-E203 WeakPolarHBondContact CA-OE1 3.49Å; Q179-E203 WeakPolarHBondContact CG-OE2 3.18Å
180	N	89	Confident	93.6	Very high	100 Å²	100	51.1 Å²	51.1	54%	0.535	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	68	19.3	177.3	-50.6	-75.8	0	0	0	115.8	P92 E203	P92-N180 HydrophobicContact CG-CB 4.41Å; N180-E203 PolarHBondContact N-OE1 3.04Å; N180-E203 PolarHBondContact N-OE2 2.81Å
181	G	94	Very high	93.3	Very high	17 Å²	17	58.7 Å²	58.7	18%	0.175	32%	0.318	C	S	.	.	S	Bend	trans	-108.5	-108.1	175.6	0	0	0	0	0	111.5	P92 R93 Q179	P92-G181 CarbonylContact C-O 3.59Å; P92-G181 VanDerWaalsContact CA-O 3.23Å; P92-G181 WeakPolarHBondContact CA-O 3.42Å; R93-G181 PolarHBondContact N-O 3.37Å; Q179-G181 VanDerWaalsContact C-N 3.34Å
182	V	97.6	Very high	93.2	Very high	3 Å²	3	59.1 Å²	59.1	2%	0.018	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	116.1	172.1	175.9	0	0	0	0	109.6	F42 R93 G95 F176 D177	F42-V182 HydrophobicContact CE1-CG2 4.23Å; F42-V182 HydrophobicContact CZ-CG2 3.76Å; R93-V182 WeakPolarHBondContact O-CA 3.25Å; G95-V182 VanDerWaalsContact CA-CG1 3.41Å; F176-V182 HydrophobicContact CD1-CB 4.21Å; F176-V182 HydrophobicContact CD1-CG1 3.74Å; F176-V182 HydrophobicContact CE1-CG1 3.81Å; D177-V182 WeakPolarHBondContact OD1-CB 3.35Å; D177-V182 PolarHBondContact OD1-N 2.91Å
183	L	98.6	Very high	93.2	Very high	6 Å²	6	62.4 Å²	62.4	3%	0.031	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	-37.5	-178.7	-58.6	-175.7	0	0	0	112.9	P92 R93 D200 E203 W205 A212 V217 Y242	P92-L183 HydrophobicContact CB-CD1 4.2Å; P92-L183 HydrophobicContact CB-CD2 3.91Å; P92-L183 HydrophobicContact CB-CG 4.06Å; R93-L183 PolarHBondContact O-N 2.89Å; L183-D200 PolarHBondContact O-N 3.42Å; L183-E203 VanDerWaalsContact CD2-CD 3.43Å; L183-E203 HydrophobicContact CD2-CG 3.77Å; L183-E203 WeakPolarHBondContact CD2-OE1 3.36Å; L183-W205 HydrophobicContact CB-CH2 4.41Å; L183-W205 WeakPolarHBondContact O-CH2 3.5Å; L183-W205 WeakPolarHBondContact O-CZ2 3.5Å; L183-A212 HydrophobicContact CD2-CB 4.41Å; L183-V217 HydrophobicContact CB-CG1 4.33Å; L183-V217 HydrophobicContact CD1-CG2 3.94Å; L183-Y242 VanDerWaalsContact CD1-CB 3.45Å; L183-Y242 HydrophobicContact CD1-CD1 4.05Å; L183-Y242 HydrophobicContact CD1-CD2 3.73Å; L183-Y242 HydrophobicContact CD1-CG 3.46Å; L183-Y242 VanDerWaalsContact CD1-CG 3.46Å
184	A	98.6	Very high	93.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.2	166.9	-174.8	0	0	0	0	0	109.9	G95 H198 F199 V217 E221	G95-A184 PolarHBondContact N-O 3.27Å; A184-H198 CarbonylContact C-O 3.56Å; A184-H198 WeakPolarHBondContact CA-O 3.25Å; A184-H198 WeakPolarHBondContact CB-O 3.19Å; A184-F199 HydrophobicContact CB-CD1 3.86Å; A184-F199 HydrophobicContact CB-CE1 4.28Å; A184-F199 HydrophobicContact CB-CG 4.3Å; A184-V217 HydrophobicContact CB-CG1 3.52Å; A184-E221 HydrophobicContact CB-CG 3.56Å
185	H	98.1	Very high	93.7	Very high	13 Å²	13	52.5 Å²	52.5	6%	0.06	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	156	163.8	57	-113	0	0	0	111.1	H170 D172 A174 F176 H198 E221	H170-H185 AromaticContact CE1-CE1 3.58Å; H170-H185 AromaticContact NE2-CE1 3.2Å; H170-H185 PolarHBondContact NE2-CE1 3.37Å; H170-H185 AromaticContact NE2-NE2 3.37Å; H170-H185 PolarHBondContact NE2-NE2 3.33Å; D172-H185 IonicContact OD2-CD2 3.25Å; D172-H185 IonicContact OD2-CE1 2.91Å; D172-H185 IonicContact OD2-NE2 3.63Å; D172-H185 PolarHBondContact OD2-NE2 2.9Å; A174-H185 PolarHBondContact O-CE1 2.98Å; A174-H185 VanDerWaalsContact O-CE1 3.25Å; F176-H185 AromaticContact CE1-CE1 3.7Å; F176-H185 AromaticContact CE1-ND1 3.38Å; F176-H185 WeakPolarHBondContact CE1-ND1 3.48Å; F176-H185 AromaticContact CZ-CE1 3.72Å; F176-H185 AromaticContact CZ-ND1 3.76Å; H185-H198 PolarHBondContact N-O 3.47Å; H185-H198 AromaticContact NE2-CG 3.96Å; H185-H198 AromaticContact NE2-ND1 3.45Å; H185-H198 PolarHBondContact NE2-ND1 2.87Å; H185-H198 PolarHBondContact O-N 2.79Å; H185-E221 WeakPolarHBondContact CA-OE2 3.43Å
186	A	96.9	Very high	93.9	Very high	3 Å²	3	49.5 Å²	49.5	3%	0.025	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	152.6	170.9	0	0	0	0	0	112.9	F96 D196 A197 E221 H224	F96-A186 VanDerWaalsContact CD2-O 3.25Å; F96-A186 WeakPolarHBondContact CD2-O 3.23Å; A186-D196 CarbonylContact C-O 3.48Å; A186-D196 WeakPolarHBondContact CA-O 3.31Å; A186-D196 WeakPolarHBondContact CB-O 3.39Å; A186-A197 HydrophobicContact CB-CB 3.93Å; A186-E221 HydrophobicContact CB-CB 3.91Å; A186-E221 VanDerWaalsContact CB-O 3.24Å; A186-E221 WeakPolarHBondContact CB-O 3.24Å; A186-E221 PolarHBondContact N-OE2 3.5Å; A186-H224 HydrophobicContact CB-CB 3.97Å
187	F	94.3	Very high	94	Very high	58 Å²	58	48.9 Å²	48.9	25%	0.254	27%	0.27	S	S	.	.	P	Polyproline II helix	trans	-87.9	147.3	174.5	-62.2	-81.2	0	0	0	110.7	D172 N193 G195 D196 A225	D172-F187 HydrophobicContact CB-CE2 4.37Å; D172-F187 HydrophobicContact CB-CZ 3.88Å; F187-N193 VanDerWaalsContact CB-O 3.27Å; F187-N193 WeakPolarHBondContact CB-O 3.34Å; F187-N193 HydrophobicContact CD2-CB 4.23Å; F187-N193 WeakPolarHBondContact CD2-O 3.49Å; F187-N193 HydrophobicContact CE2-CB 4.41Å; F187-G195 VanDerWaalsContact O-CA 3.27Å; F187-G195 WeakPolarHBondContact O-CA 3.41Å; F187-G195 PolarHBondContact O-N 3.18Å; F187-D196 HydrophobicContact CD2-CB 3.98Å; F187-D196 PolarHBondContact N-O 2.89Å; F187-A225 WeakPolarHBondContact O-CA 3.07Å
188	S	93.6	Very high	94.3	Very high	29 Å²	29	45 Å²	45	20%	0.203	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-62.2	159.5	171.4	-55.3	0	0	0	0	112.2	Y102 G190 G194 G195 H224	Y102-S188 PolarHBondContact OH-OG 3.11Å; S188-G190 PolarHBondContact O-N 3.03Å; S188-G194 CarbonylContact O-C 3.56Å; S188-G194 VanDerWaalsContact O-CA 3.23Å; S188-G194 WeakPolarHBondContact O-CA 3.39Å; S188-G195 PolarHBondContact O-N 3.23Å; S188-H224 WeakPolarHBondContact CA-O 3.31Å
189	P	94.9	Very high	94.7	Very high	14 Å²	14	36.3 Å²	36.3	9%	0.091	22%	0.216	C	C	.	.	S	Bend	trans	-50.6	132.5	176.8	-28.6	33.3	0	0	0	112.9	P109 W111 A225 G227	P109-P189 HydrophobicContact CB-CB 4.42Å; P109-P189 WeakPolarHBondContact O-CG 3.2Å; W111-P189 HydrophobicContact CD2-CB 3.95Å; W111-P189 HydrophobicContact CE3-CB 4.41Å; W111-P189 HydrophobicContact CG-CB 4.27Å; W111-P189 HydrophobicContact CZ2-CB 4.18Å; P189-A225 WeakPolarHBondContact CG-O 3.48Å; P189-G227 VanDerWaalsContact CD-N 3.35Å
190	G	91.4	Very high	95.1	Very high	35 Å²	35	30.9 Å²	30.9	36%	0.361	19%	0.191	S	C	.	.			trans	177.3	-174.8	-178.4	0	0	0	0	0	113.5	W111 S188	W111-G190 WeakPolarHBondContact CH2-O 3.12Å; S188-G190 PolarHBondContact O-N 3.03Å
191	E	88.2	Confident	95.6	Very high	194 Å²	194	28.1 Å²	28.1	91%	0.907	18%	0.175	S	C	*	.	S	Bend	trans	-82.7	162.4	171.7	-62.8	-174	166.6	0	0	111.2	N193 G194	E191-N193 PolarHBondContact O-N 3.28Å; E191-G194 PolarHBondContact O-N 2.94Å
192	G	90.5	Very high	95.7	Very high	73 Å²	73	30.1 Å²	30.1	75%	0.753	18%	0.182	S	C	*	.	T	Hydrogen-bonded Turn	trans	68.6	-116.4	178.3	0	0	0	0	0	111.4	G194	G192-G194 PolarHBondContact O-N 3.42Å
193	N	90.4	Very high	95.8	Very high	85 Å²	85	30.5 Å²	30.5	46%	0.455	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-0.7	177.7	-60.4	-6	0	0	0	112.7	F187 E191 G195 D196	F187-N193 VanDerWaalsContact CB-O 3.27Å; F187-N193 WeakPolarHBondContact CB-O 3.34Å; F187-N193 HydrophobicContact CD2-CB 4.23Å; F187-N193 WeakPolarHBondContact CD2-O 3.49Å; F187-N193 HydrophobicContact CE2-CB 4.41Å; E191-N193 PolarHBondContact O-N 3.28Å; N193-G195 PolarHBondContact O-N 2.91Å; N193-D196 WeakPolarHBondContact O-CB 3.46Å; N193-D196 PolarHBondContact O-N 2.75Å
194	G	93.1	Very high	95.7	Very high	10 Å²	10	33.6 Å²	33.6	10%	0.103	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61	122.2	-179.5	0	0	0	0	0	111.4	W111 D160 S188 E191 G192	W111-G194 WeakPolarHBondContact CH2-O 3.33Å; D160-G194 VanDerWaalsContact O-O 3.12Å; S188-G194 CarbonylContact O-C 3.56Å; S188-G194 VanDerWaalsContact O-CA 3.23Å; S188-G194 WeakPolarHBondContact O-CA 3.39Å; E191-G194 PolarHBondContact O-N 2.94Å; G192-G194 PolarHBondContact O-N 3.42Å
195	G	95.4	Very high	95.7	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-17.9	-174	0	0	0	0	0	115.2	I161 F187 S188 N193 A225	I161-G195 VanDerWaalsContact CG2-O 3.25Å; I161-G195 WeakPolarHBondContact CG2-O 3.35Å; F187-G195 VanDerWaalsContact O-CA 3.27Å; F187-G195 WeakPolarHBondContact O-CA 3.41Å; F187-G195 PolarHBondContact O-N 3.18Å; S188-G195 PolarHBondContact O-N 3.23Å; N193-G195 PolarHBondContact O-N 2.91Å; G195-A225 VanDerWaalsContact O-CB 3.29Å; G195-A225 WeakPolarHBondContact O-CB 3.39Å
196	D	98.1	Very high	95.7	Very high	5 Å²	5	34 Å²	34	3%	0.027	20%	0.203	C	C	.	.			trans	-59.4	140.9	-179.3	-80.5	11.6	0	0	0	111	M162 K164 A186 F187 N193	M162-D196 WeakPolarHBondContact CA-OD1 3.41Å; M162-D196 WeakPolarHBondContact CB-OD1 3.24Å; M162-D196 WeakPolarHBondContact CB-OD2 3.16Å; M162-D196 VanDerWaalsContact CG-OD1 3.26Å; M162-D196 WeakPolarHBondContact CG-OD1 3.39Å; M162-D196 PolarHBondContact N-OD1 3.26Å; M162-D196 WeakPolarHBondContact O-CA 3.46Å; K164-D196 IonicContact NZ-OD2 3.59Å; K164-D196 PolarHBondContact NZ-OD2 3.25Å; A186-D196 CarbonylContact C-O 3.48Å; A186-D196 WeakPolarHBondContact CA-O 3.31Å; A186-D196 WeakPolarHBondContact CB-O 3.39Å; F187-D196 HydrophobicContact CD2-CB 3.98Å; F187-D196 PolarHBondContact N-O 2.89Å; N193-D196 WeakPolarHBondContact O-CB 3.46Å; N193-D196 PolarHBondContact O-N 2.75Å
197	A	98.4	Very high	95.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	124.4	177.7	0	0	0	0	0	109.8	M162 I163 K164 A186 F199 E221 F222	M162-A197 PolarHBondContact O-N 2.67Å; I163-A197 WeakPolarHBondContact CA-O 3.29Å; K164-A197 PolarHBondContact N-O 3.45Å; A186-A197 HydrophobicContact CB-CB 3.93Å; A197-F199 HydrophobicContact CB-CE2 3.94Å; A197-F199 HydrophobicContact CB-CZ 4.46Å; A197-E221 HydrophobicContact CB-CB 4.32Å; A197-F222 HydrophobicContact CB-CD1 4.4Å; A197-F222 HydrophobicContact CB-CE1 4.06Å
198	H	98.7	Very high	95.8	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.019	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	134.4	-179.5	-60.3	161.4	0	0	0	109.7	K164 H170 D172 F176 A184 H185	K164-H198 PolarHBondContact NZ-NE2 2.77Å; K164-H198 CarbonylContact O-C 3.6Å; K164-H198 VanDerWaalsContact O-CA 3.3Å; K164-H198 WeakPolarHBondContact O-CA 3.24Å; H170-H198 AromaticContact CD2-ND1 3.42Å; H170-H198 PolarHBondContact CD2-ND1 3.42Å; H170-H198 AromaticContact NE2-ND1 3.47Å; H170-H198 PolarHBondContact NE2-ND1 2.8Å; D172-H198 IonicContact OD2-CE1 3.67Å; D172-H198 PolarHBondContact OD2-CE1 2.69Å; D172-H198 VanDerWaalsContact OD2-CE1 3.25Å; D172-H198 IonicContact OD2-ND1 3.91Å; D172-H198 PolarHBondContact OD2-ND1 2.98Å; F176-H198 HydrophobicContact CE2-CB 4.25Å; F176-H198 HydrophobicContact CZ-CB 3.91Å; A184-H198 CarbonylContact C-O 3.56Å; A184-H198 WeakPolarHBondContact CA-O 3.25Å; A184-H198 WeakPolarHBondContact CB-O 3.19Å; H185-H198 PolarHBondContact N-O 3.47Å; H185-H198 AromaticContact NE2-CG 3.96Å; H185-H198 AromaticContact NE2-ND1 3.45Å; H185-H198 PolarHBondContact NE2-ND1 2.87Å; H185-H198 PolarHBondContact O-N 2.79Å
199	F	98.8	Very high	95.9	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	133.2	-178.7	-64	-96.8	0	0	0	108.5	I163 K164 F165 K166 A184 A197 E201 W205 L214 V217 A218 E221	I163-F199 HydrophobicContact CG2-CD2 4.11Å; I163-F199 HydrophobicContact CG2-CE2 3.75Å; K164-F199 PolarHBondContact O-N 3.25Å; F165-F199 CarbonylContact C-O 3.43Å; F165-F199 VanDerWaalsContact CA-O 3.31Å; F165-F199 WeakPolarHBondContact CA-O 3.46Å; F165-F199 HydrophobicContact CD1-CB 3.56Å; F165-F199 HydrophobicContact CD1-CG 4.32Å; F165-F199 HydrophobicContact CE1-CB 3.8Å; F165-F199 HydrophobicContact CE1-CG 4.11Å; F165-F199 HydrophobicContact CG-CB 4.01Å; F165-F199 HydrophobicContact CZ-CB 4.45Å; F165-F199 HydrophobicContact CZ-CG 4.35Å; K166-F199 PolarHBondContact N-O 2.94Å; A184-F199 HydrophobicContact CB-CD1 3.86Å; A184-F199 HydrophobicContact CB-CE1 4.28Å; A184-F199 HydrophobicContact CB-CG 4.3Å; A197-F199 HydrophobicContact CB-CE2 3.94Å; A197-F199 HydrophobicContact CB-CZ 4.46Å; F199-E201 PolarHBondContact O-N 2.98Å; F199-W205 HydrophobicContact CB-CH2 4.19Å; F199-W205 HydrophobicContact CB-CZ2 3.69Å; F199-W205 AromaticContact CD1-CH2 3.73Å; F199-W205 HydrophobicContact CD1-CH2 3.73Å; F199-W205 HydrophobicContact CD1-CZ2 4.11Å; F199-W205 HydrophobicContact CD1-CZ3 4.16Å; F199-W205 HydrophobicContact CG-CH2 4.46Å; F199-W205 HydrophobicContact CG-CZ2 4.41Å; F199-L214 HydrophobicContact CD1-CD1 3.96Å; F199-L214 HydrophobicContact CE1-CD1 3.94Å; F199-V217 HydrophobicContact CD1-CG1 4.15Å; F199-V217 HydrophobicContact CE1-CG1 4.03Å; F199-A218 HydrophobicContact CE1-CB 3.85Å; F199-A218 HydrophobicContact CZ-CB 3.74Å; F199-E221 HydrophobicContact CE1-CG 4.37Å; F199-E221 HydrophobicContact CZ-CB 4.48Å; F199-E221 HydrophobicContact CZ-CG 4.44Å
200	D	98.6	Very high	95.8	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	115.9	179.8	-170.7	3.9	0	0	0	110.3	K166 F176 L183 D202 E203 W205	K166-D200 WeakPolarHBondContact O-CA 3.3Å; F176-D200 HydrophobicContact CB-CB 4.06Å; F176-D200 VanDerWaalsContact CB-CG 3.46Å; F176-D200 WeakPolarHBondContact CB-OD2 3.46Å; F176-D200 HydrophobicContact CD1-CB 3.82Å; F176-D200 HydrophobicContact CD2-CB 3.7Å; F176-D200 HydrophobicContact CE1-CB 4.18Å; F176-D200 HydrophobicContact CE2-CB 4.05Å; F176-D200 HydrophobicContact CG-CB 3.6Å; F176-D200 HydrophobicContact CZ-CB 4.29Å; L183-D200 PolarHBondContact O-N 3.42Å; D200-D202 PolarHBondContact O-N 2.97Å; D200-D202 WeakPolarHBondContact OD1-CB 3.35Å; D200-D202 PolarHBondContact OD1-N 2.83Å; D200-E203 HydrophobicContact CB-CG 4.05Å; D200-E203 WeakPolarHBondContact O-CB 3.35Å; D200-E203 PolarHBondContact O-N 2.74Å; D200-W205 WeakPolarHBondContact O-CZ2 3.42Å; D200-W205 PolarHBondContact O-NE1 3.5Å
201	E	98.3	Very high	96	Very high	41 Å²	41	46.9 Å²	46.9	19%	0.192	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.3	178.8	-170.3	64.3	-115.3	0	0	112.6	T124 P125 F165 K166 F199 E203	T124-E201 WeakPolarHBondContact CA-OE1 3.26Å; T124-E201 WeakPolarHBondContact CA-OE2 3.39Å; T124-E201 VanDerWaalsContact CB-OE1 3.24Å; T124-E201 WeakPolarHBondContact CB-OE1 3.47Å; T124-E201 WeakPolarHBondContact CB-OE2 3.42Å; T124-E201 PolarHBondContact OG1-OE1 2.72Å; P125-E201 WeakPolarHBondContact CD-OE1 3.48Å; F165-E201 HydrophobicContact CB-CB 4.43Å; F165-E201 WeakPolarHBondContact CB-OE2 3.2Å; K166-E201 PolarHBondContact O-N 3.27Å; F199-E201 PolarHBondContact O-N 2.98Å; E201-E203 PolarHBondContact O-N 3.22Å
202	D	98.1	Very high	96.5	Very high	60 Å²	60	37.9 Å²	37.9	32%	0.321	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-9.1	170.7	-69.2	-11.7	0	0	0	112.5	S167 R178 Q179 D200	S167-D202 VanDerWaalsContact CB-OD1 3.22Å; S167-D202 WeakPolarHBondContact CB-OD1 3.43Å; S167-D202 PolarHBondContact OG-OD1 2.87Å; R178-D202 HydrophobicContact CB-CB 4.35Å; Q179-D202 WeakPolarHBondContact CG-O 3.3Å; D200-D202 PolarHBondContact O-N 2.97Å; D200-D202 WeakPolarHBondContact OD1-CB 3.35Å; D200-D202 PolarHBondContact OD1-N 2.83Å
203	E	98.3	Very high	96.8	Very high	10 Å²	10	34.5 Å²	34.5	5%	0.047	20%	0.196	C	C	.	.	S	Bend	trans	-81.6	154.4	173.2	-61.8	-62.3	168.5	0	0	112.6	Q179 N180 L183 D200 E201 W205 A212	Q179-E203 WeakPolarHBondContact CA-OE1 3.49Å; Q179-E203 WeakPolarHBondContact CG-OE2 3.18Å; N180-E203 PolarHBondContact N-OE1 3.04Å; N180-E203 PolarHBondContact N-OE2 2.81Å; L183-E203 VanDerWaalsContact CD2-CD 3.43Å; L183-E203 HydrophobicContact CD2-CG 3.77Å; L183-E203 WeakPolarHBondContact CD2-OE1 3.36Å; D200-E203 HydrophobicContact CB-CG 4.05Å; D200-E203 WeakPolarHBondContact O-CB 3.35Å; D200-E203 PolarHBondContact O-N 2.74Å; E201-E203 PolarHBondContact O-N 3.22Å; E203-W205 HydrophobicContact CB-CZ2 4.09Å; E203-W205 HydrophobicContact CG-CZ2 4.45Å; E203-W205 PolarHBondContact O-N 3.15Å; E203-A212 HydrophobicContact CB-CB 4.41Å
204	N	97.7	Very high	97.2	Very high	72 Å²	72	30.4 Å²	30.4	39%	0.385	18%	0.175	S	C	.	.			trans	-89.2	101.4	171.4	178.5	46.4	0	0	0	109.6	E210 A212	N204-E210 PolarHBondContact ND2-O 2.74Å; N204-E210 VanDerWaalsContact ND2-O 3.08Å; N204-A212 PolarHBondContact O-N 2.7Å
205	W	98.5	Very high	97.5	Very high	2 Å²	2	30.2 Å²	30.2	1%	0.008	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	127.2	-177.3	-66.5	101.1	0	0	0	111.9	T124 D126 M127 F165 L183 F199 D200 E203 A212 L214 V217	T124-W205 HydrophobicContact CG2-CB 4.11Å; T124-W205 HydrophobicContact CG2-CG 4.32Å; D126-W205 HydrophobicContact CB-CB 4.26Å; D126-W205 PolarHBondContact OD2-N 3.17Å; M127-W205 HydrophobicContact SD-CB 4.38Å; F165-W205 AromaticContact CD1-CD1 3.96Å; F165-W205 HydrophobicContact CD1-CG 4.47Å; F165-W205 AromaticContact CD1-NE1 3.71Å; F165-W205 HydrophobicContact CE1-CD2 4.09Å; F165-W205 HydrophobicContact CE1-CG 4.08Å; F165-W205 AromaticContact CE1-NE1 3.97Å; L183-W205 HydrophobicContact CB-CH2 4.41Å; L183-W205 WeakPolarHBondContact O-CH2 3.5Å; L183-W205 WeakPolarHBondContact O-CZ2 3.5Å; F199-W205 HydrophobicContact CB-CH2 4.19Å; F199-W205 HydrophobicContact CB-CZ2 3.69Å; F199-W205 AromaticContact CD1-CH2 3.73Å; F199-W205 HydrophobicContact CD1-CH2 3.73Å; F199-W205 HydrophobicContact CD1-CZ2 4.11Å; F199-W205 HydrophobicContact CD1-CZ3 4.16Å; F199-W205 HydrophobicContact CG-CH2 4.46Å; F199-W205 HydrophobicContact CG-CZ2 4.41Å; D200-W205 WeakPolarHBondContact O-CZ2 3.42Å; D200-W205 PolarHBondContact O-NE1 3.5Å; E203-W205 HydrophobicContact CB-CZ2 4.09Å; E203-W205 HydrophobicContact CG-CZ2 4.45Å; E203-W205 PolarHBondContact O-N 3.15Å; W205-A212 HydrophobicContact CD2-CB 4.47Å; W205-A212 HydrophobicContact CE3-CB 3.82Å; W205-A212 HydrophobicContact CH2-CB 4.28Å; W205-A212 HydrophobicContact CZ3-CB 3.73Å; W205-L214 HydrophobicContact CD2-CD1 4.43Å; W205-L214 HydrophobicContact CE3-CB 4.05Å; W205-L214 HydrophobicContact CE3-CD1 3.9Å; W205-L214 HydrophobicContact CZ3-CD1 4.19Å; W205-V217 HydrophobicContact CH2-CB 4.28Å; W205-V217 HydrophobicContact CH2-CG1 3.94Å; W205-V217 HydrophobicContact CH2-CG2 4.41Å; W205-V217 HydrophobicContact CZ3-CB 3.88Å; W205-V217 HydrophobicContact CZ3-CG1 4.07Å; W205-V217 HydrophobicContact CZ3-CG2 3.93Å
206	T	98.3	Very high	97.7	Very high	19 Å²	19	30.7 Å²	30.7	12%	0.117	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	168.7	-177.2	74	0	0	0	0	112.9	T208 E210 A212 N213 L214	T206-T208 PolarHBondContact OG1-N 3.45Å; T206-T208 PolarHBondContact OG1-O 3.08Å; T206-E210 WeakPolarHBondContact CG2-O 3.44Å; T206-A212 PolarHBondContact N-O 3.37Å; T206-N213 WeakPolarHBondContact O-CA 3.4Å; T206-L214 PolarHBondContact O-N 3.43Å
207	L	97.3	Very high	97.7	Very high	79 Å²	79	30.8 Å²	30.8	41%	0.414	17%	0.174	S	C	.	.	S	Bend	trans	-96.8	-1	168	-64.9	177.3	0	0	0	113	M127 D131 T135 N213	M127-L207 HydrophobicContact CE-CD1 3.92Å; M127-L207 HydrophobicContact CE-CD2 3.43Å; M127-L207 VanDerWaalsContact CE-CD2 3.43Å; M127-L207 HydrophobicContact CE-CG 3.41Å; M127-L207 VanDerWaalsContact CE-CG 3.41Å; M127-L207 HydrophobicContact SD-CD2 4.48Å; M127-L207 HydrophobicContact SD-CG 4.31Å; D131-L207 HydrophobicContact CB-CD1 4.35Å; T135-L207 HydrophobicContact CG2-CD2 4.46Å; T135-L207 WeakPolarHBondContact OG1-CD2 3.22Å; L207-N213 PolarHBondContact O-ND2 3.39Å
208	T	95.8	Very high	97.7	Very high	68 Å²	68	30.8 Å²	30.8	42%	0.417	17%	0.174	S	C	.	.	S	Bend	trans	-115.8	-165	-173.8	69.5	0	0	0	0	109.9	T206 E210 N213 Y244	T206-T208 PolarHBondContact OG1-N 3.45Å; T206-T208 PolarHBondContact OG1-O 3.08Å; T208-E210 VanDerWaalsContact C-N 3.33Å; T208-E210 PolarHBondContact OG1-N 2.93Å; T208-N213 PolarHBondContact N-ND2 2.8Å; T208-N213 PolarHBondContact O-ND2 3.42Å; T208-Y244 WeakPolarHBondContact O-CE2 3.3Å
209	S	95.2	Very high	97.7	Very high	76 Å²	76	30.6 Å²	30.6	53%	0.531	17%	0.173	S	C	.	.	S	Bend	trans	-86.6	-0.6	171.4	59.4	0	0	0	0	113.5	G211	S209-G211 VanDerWaalsContact C-N 3.26Å; S209-G211 PolarHBondContact O-N 3.21Å
210	E	93.2	Very high	97.7	Very high	157 Å²	157	31.2 Å²	31.2	73%	0.734	18%	0.176	S	C	*	.	S	Bend	trans	-90.7	45.1	-173.9	-62.2	-175.9	172	0	0	112.4	N204 T206 T208	N204-E210 PolarHBondContact ND2-O 2.74Å; N204-E210 VanDerWaalsContact ND2-O 3.08Å; T206-E210 WeakPolarHBondContact CG2-O 3.44Å; T208-E210 VanDerWaalsContact C-N 3.33Å; T208-E210 PolarHBondContact OG1-N 2.93Å
211	G	94.9	Very high	97.8	Very high	29 Å²	29	31.3 Å²	31.3	30%	0.299	18%	0.176	S	C	.	.	S	Bend	trans	153.2	-159.7	-177.2	0	0	0	0	0	111.3	S209 N213	S209-G211 VanDerWaalsContact C-N 3.26Å; S209-G211 PolarHBondContact O-N 3.21Å; G211-N213 PolarHBondContact O-N 2.72Å
212	A	97.9	Very high	97.8	Very high	6 Å²	6	29.3 Å²	29.3	5%	0.05	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	114	171.6	0	0	0	0	0	109.1	L183 E203 N204 W205 T206 L214	L183-A212 HydrophobicContact CD2-CB 4.41Å; E203-A212 HydrophobicContact CB-CB 4.41Å; N204-A212 PolarHBondContact O-N 2.7Å; W205-A212 HydrophobicContact CD2-CB 4.47Å; W205-A212 HydrophobicContact CE3-CB 3.82Å; W205-A212 HydrophobicContact CH2-CB 4.28Å; W205-A212 HydrophobicContact CZ3-CB 3.73Å; T206-A212 PolarHBondContact N-O 3.37Å; A212-L214 PolarHBondContact O-N 3.38Å
213	N	98.6	Very high	97.8	Very high	1 Å²	1	26.5 Å²	26.5	1%	0.005	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	109.6	178.5	-171.2	-83.2	0	0	0	110.5	T206 L207 T208 G211 F215 L216 V217 Y242 Y244	T206-N213 WeakPolarHBondContact O-CA 3.4Å; L207-N213 PolarHBondContact O-ND2 3.39Å; T208-N213 PolarHBondContact N-ND2 2.8Å; T208-N213 PolarHBondContact O-ND2 3.42Å; G211-N213 PolarHBondContact O-N 2.72Å; N213-F215 VanDerWaalsContact C-N 3.25Å; N213-F215 PolarHBondContact O-N 3.1Å; N213-F215 WeakPolarHBondContact OD1-CB 3.37Å; N213-F215 PolarHBondContact OD1-N 3.45Å; N213-L216 HydrophobicContact CB-CB 4.39Å; N213-L216 HydrophobicContact CB-CD1 4.13Å; N213-L216 HydrophobicContact CB-CG 4.34Å; N213-L216 PolarHBondContact O-N 3.48Å; N213-L216 PolarHBondContact OD1-N 2.93Å; N213-V217 PolarHBondContact O-N 3Å; N213-V217 VanDerWaalsContact O-N 3.13Å; N213-Y242 WeakPolarHBondContact CB-OH 3.18Å; N213-Y242 PolarHBondContact N-OH 3.46Å; N213-Y244 HydrophobicContact CB-CD2 4.08Å; N213-Y244 HydrophobicContact CB-CE2 4.3Å
214	L	98.8	Very high	97.7	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-59.5	-35.2	-173.7	178.5	61.2	0	0	0	112.6	M127 V132 T135 F165 F199 W205 T206 A212 A218	M127-L214 HydrophobicContact CE-CD2 4.43Å; M127-L214 HydrophobicContact SD-CD2 4.37Å; V132-L214 HydrophobicContact CB-CD2 4.44Å; V132-L214 HydrophobicContact CG1-CD2 4.24Å; V132-L214 HydrophobicContact CG2-CD2 4.19Å; T135-L214 HydrophobicContact CG2-CB 4.07Å; T135-L214 HydrophobicContact CG2-CD2 4.03Å; T135-L214 HydrophobicContact CG2-CG 3.8Å; F165-L214 HydrophobicContact CE1-CD1 3.89Å; F165-L214 HydrophobicContact CZ-CD1 3.72Å; F165-L214 HydrophobicContact CZ-CD2 4.07Å; F199-L214 HydrophobicContact CD1-CD1 3.96Å; F199-L214 HydrophobicContact CE1-CD1 3.94Å; W205-L214 HydrophobicContact CD2-CD1 4.43Å; W205-L214 HydrophobicContact CE3-CB 4.05Å; W205-L214 HydrophobicContact CE3-CD1 3.9Å; W205-L214 HydrophobicContact CZ3-CD1 4.19Å; T206-L214 PolarHBondContact O-N 3.43Å; A212-L214 PolarHBondContact O-N 3.38Å; L214-A218 HydrophobicContact CD1-CB 4.49Å; L214-A218 WeakPolarHBondContact O-CB 3.37Å; L214-A218 PolarHBondContact O-N 3.4Å
215	F	98.8	Very high	97.8	Very high	6 Å²	6	22.6 Å²	22.6	3%	0.026	13%	0.131	C	C	.	.	H	α-helix	trans	-62.9	-47.8	179	170.6	-110.3	0	0	0	111.8	T135 K138 A139 L142 N213 A219 T247 Y250	T135-F215 VanDerWaalsContact CG2-CA 3.49Å; T135-F215 HydrophobicContact CG2-CB 3.74Å; K138-F215 HydrophobicContact CB-CD2 4.19Å; K138-F215 HydrophobicContact CB-CE2 4.1Å; K138-F215 HydrophobicContact CD-CD2 3.84Å; K138-F215 HydrophobicContact CD-CE2 3.67Å; K138-F215 HydrophobicContact CD-CZ 4.21Å; K138-F215 HydrophobicContact CG-CD2 4.03Å; K138-F215 HydrophobicContact CG-CE2 3.59Å; K138-F215 HydrophobicContact CG-CZ 4.35Å; A139-F215 HydrophobicContact CB-CD2 4.25Å; A139-F215 HydrophobicContact CB-CE2 4.46Å; L142-F215 HydrophobicContact CD1-CE1 4.42Å; L142-F215 HydrophobicContact CD1-CE2 3.88Å; L142-F215 HydrophobicContact CD1-CZ 3.56Å; L142-F215 HydrophobicContact CD2-CZ 4.19Å; L142-F215 HydrophobicContact CG-CE2 4.18Å; L142-F215 HydrophobicContact CG-CZ 3.96Å; N213-F215 VanDerWaalsContact C-N 3.25Å; N213-F215 PolarHBondContact O-N 3.1Å; N213-F215 WeakPolarHBondContact OD1-CB 3.37Å; N213-F215 PolarHBondContact OD1-N 3.45Å; F215-A219 WeakPolarHBondContact O-CB 3.39Å; F215-A219 PolarHBondContact O-N 3.14Å; F215-T247 HydrophobicContact CD1-CG2 3.73Å; F215-T247 HydrophobicContact CE1-CG2 4.27Å; F215-Y250 AromaticContact CE1-CD1 3.68Å; F215-Y250 HydrophobicContact CE1-CD1 3.68Å; F215-Y250 HydrophobicContact CE1-CE1 4.47Å; F215-Y250 HydrophobicContact CE1-CG 4.11Å; F215-Y250 AromaticContact CZ-CD1 3.98Å; F215-Y250 HydrophobicContact CZ-CD1 3.98Å
216	L	98.8	Very high	97.7	Very high	9 Å²	9	22.5 Å²	22.5	5%	0.047	13%	0.131	C	C	.	.	H	α-helix	trans	-66.9	-45.9	-179.1	-66.8	175.7	0	0	0	111.5	N213 A219 H220 Y242 Y244 V245 T247 Y250	N213-L216 HydrophobicContact CB-CB 4.39Å; N213-L216 HydrophobicContact CB-CD1 4.13Å; N213-L216 HydrophobicContact CB-CG 4.34Å; N213-L216 PolarHBondContact O-N 3.48Å; N213-L216 PolarHBondContact OD1-N 2.93Å; L216-A219 PolarHBondContact O-N 3.31Å; L216-H220 PolarHBondContact O-N 3.05Å; L216-Y242 HydrophobicContact CB-CE2 4.36Å; L216-Y244 HydrophobicContact CD1-CD2 4.16Å; L216-V245 HydrophobicContact CD1-CG2 3.88Å; L216-V245 HydrophobicContact CD2-CG2 3.68Å; L216-V245 HydrophobicContact CG-CG2 4.46Å; L216-T247 HydrophobicContact CD1-CG2 4.17Å; L216-T247 HydrophobicContact CD2-CG2 4.07Å; L216-T247 HydrophobicContact CG-CG2 3.94Å; L216-Y250 HydrophobicContact CD2-CE1 4.38Å; L216-Y250 HydrophobicContact CD2-CE2 4.41Å
217	V	98.9	Very high	97.5	Very high	8 Å²	8	21.7 Å²	21.7	5%	0.048	13%	0.127	C	C	.	.	H	α-helix	trans	-65.9	-46.5	179.7	-178.2	0	0	0	0	110.5	L183 A184 F199 W205 N213 A219 H220 E221 Y242	L183-V217 HydrophobicContact CB-CG1 4.33Å; L183-V217 HydrophobicContact CD1-CG2 3.94Å; A184-V217 HydrophobicContact CB-CG1 3.52Å; F199-V217 HydrophobicContact CD1-CG1 4.15Å; F199-V217 HydrophobicContact CE1-CG1 4.03Å; W205-V217 HydrophobicContact CH2-CB 4.28Å; W205-V217 HydrophobicContact CH2-CG1 3.94Å; W205-V217 HydrophobicContact CH2-CG2 4.41Å; W205-V217 HydrophobicContact CZ3-CB 3.88Å; W205-V217 HydrophobicContact CZ3-CG1 4.07Å; W205-V217 HydrophobicContact CZ3-CG2 3.93Å; N213-V217 PolarHBondContact O-N 3Å; N213-V217 VanDerWaalsContact O-N 3.13Å; V217-A219 VanDerWaalsContact C-N 3.32Å; V217-A219 PolarHBondContact O-N 3.06Å; V217-H220 WeakPolarHBondContact O-CB 3.46Å; V217-H220 PolarHBondContact O-N 3.25Å; V217-H220 VanDerWaalsContact O-N 3.14Å; V217-E221 HydrophobicContact CG1-CG 4.27Å; V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.37Å; V217-Y242 HydrophobicContact CG2-CD2 3.89Å; V217-Y242 HydrophobicContact CG2-CE2 3.87Å
218	A	98.9	Very high	97.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-62.6	-39.5	177.9	0	0	0	0	0	112.4	I136 A139 F199 L214 H220 E221 F222	I136-A218 HydrophobicContact CD1-CB 3.79Å; A139-A218 HydrophobicContact CB-CB 4.03Å; F199-A218 HydrophobicContact CE1-CB 3.85Å; F199-A218 HydrophobicContact CZ-CB 3.74Å; L214-A218 HydrophobicContact CD1-CB 4.49Å; L214-A218 WeakPolarHBondContact O-CB 3.37Å; L214-A218 PolarHBondContact O-N 3.4Å; A218-H220 VanDerWaalsContact C-N 3.3Å; A218-H220 PolarHBondContact O-N 3.13Å; A218-E221 PolarHBondContact O-N 3.46Å; A218-F222 HydrophobicContact CB-CE2 4.1Å; A218-F222 HydrophobicContact CB-CZ 4.25Å; A218-F222 WeakPolarHBondContact O-CB 3.41Å; A218-F222 VanDerWaalsContact O-CD2 3.24Å; A218-F222 WeakPolarHBondContact O-CD2 3.31Å; A218-F222 WeakPolarHBondContact O-CG 3.25Å; A218-F222 PolarHBondContact O-N 3.18Å
219	A	98.8	Very high	97.2	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-62.2	-39.1	176	0	0	0	0	0	111.9	A139 L142 Y143 F215 L216 V217 G223 L237	A139-A219 HydrophobicContact CB-CB 4.14Å; L142-A219 HydrophobicContact CD1-CB 3.68Å; Y143-A219 VanDerWaalsContact CE2-O 3.26Å; Y143-A219 WeakPolarHBondContact CE2-O 3.04Å; Y143-A219 PolarHBondContact OH-O 3.22Å; F215-A219 WeakPolarHBondContact O-CB 3.39Å; F215-A219 PolarHBondContact O-N 3.14Å; L216-A219 PolarHBondContact O-N 3.31Å; V217-A219 VanDerWaalsContact C-N 3.32Å; V217-A219 PolarHBondContact O-N 3.06Å; A219-G223 PolarHBondContact O-N 3.19Å; A219-L237 HydrophobicContact CB-CD1 4.32Å; A219-L237 HydrophobicContact CB-CD2 3.68Å
220	H	98.9	Very high	97.2	Very high	13 Å²	13	14.7 Å²	14.7	6%	0.06	8%	0.083	C	C	.	.	H	α-helix	trans	-63.4	-53.6	173.8	-178.4	107.8	0	0	0	111.4	C94 L216 V217 A218 F222 G223 H224 H230 L237 F239	C94-H220 VanDerWaalsContact CB-NE2 3.31Å; C94-H220 WeakPolarHBondContact CB-NE2 3.04Å; L216-H220 PolarHBondContact O-N 3.05Å; V217-H220 WeakPolarHBondContact O-CB 3.46Å; V217-H220 PolarHBondContact O-N 3.25Å; V217-H220 VanDerWaalsContact O-N 3.14Å; A218-H220 VanDerWaalsContact C-N 3.3Å; A218-H220 PolarHBondContact O-N 3.13Å; H220-F222 PolarHBondContact O-N 3.25Å; H220-G223 WeakPolarHBondContact O-CA 2.95Å; H220-G223 PolarHBondContact O-N 3.2Å; H220-H224 AromaticContact CD2-CD2 3.89Å; H220-H224 AromaticContact CD2-NE2 3.77Å; H220-H224 AromaticContact NE2-CD2 3.9Å; H220-H224 AromaticContact NE2-NE2 3.29Å; H220-H224 PolarHBondContact NE2-NE2 3.24Å; H220-H224 PolarHBondContact O-N 2.79Å; H220-H230 AromaticContact CE1-CD2 3.57Å; H220-H230 AromaticContact CE1-NE2 3.74Å; H220-H230 AromaticContact NE2-CD2 3.39Å; H220-H230 PolarHBondContact NE2-CD2 3.07Å; H220-H230 AromaticContact NE2-NE2 3.22Å; H220-H230 PolarHBondContact NE2-NE2 3.34Å; H220-L237 HydrophobicContact CB-CD1 4.23Å; H220-L237 HydrophobicContact CB-CG 4.32Å; H220-L237 PolarHBondContact ND1-O 2.98Å; H220-F239 PolarHBondContact CE1-O 2.95Å; H220-F239 VanDerWaalsContact CE1-O 3.26Å
221	E	98.8	Very high	97.3	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.005	5%	0.052	C	C	.	.	H	α-helix	trans	-61.3	-33.7	-178.9	-62.1	-42.5	139.4	0	0	112.6	C94 A184 H185 A186 A197 F199 V217 A218 G223 H224 A225	C94-E221 PolarHBondContact SG-OE1 3.19Å; C94-E221 PolarHBondContact SG-OE2 3.47Å; C94-E221 VanDerWaalsContact SG-OE2 3.37Å; A184-E221 HydrophobicContact CB-CG 3.56Å; H185-E221 WeakPolarHBondContact CA-OE2 3.43Å; A186-E221 HydrophobicContact CB-CB 3.91Å; A186-E221 VanDerWaalsContact CB-O 3.24Å; A186-E221 WeakPolarHBondContact CB-O 3.24Å; A186-E221 PolarHBondContact N-OE2 3.5Å; A197-E221 HydrophobicContact CB-CB 4.32Å; F199-E221 HydrophobicContact CE1-CG 4.37Å; F199-E221 HydrophobicContact CZ-CB 4.48Å; F199-E221 HydrophobicContact CZ-CG 4.44Å; V217-E221 HydrophobicContact CG1-CG 4.27Å; V217-E221 WeakPolarHBondContact O-CG 3.41Å; V217-E221 PolarHBondContact O-N 3.37Å; A218-E221 PolarHBondContact O-N 3.46Å; E221-G223 VanDerWaalsContact C-N 3.27Å; E221-G223 PolarHBondContact O-N 2.97Å; E221-H224 WeakPolarHBondContact O-CB 3.22Å; E221-H224 PolarHBondContact O-N 3.41Å; E221-H224 VanDerWaalsContact O-N 3.14Å; E221-H224 IonicContact OE2-CD2 2.68Å; E221-A225 PolarHBondContact O-N 2.73Å
222	F	98.8	Very high	97.2	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-70	-24.3	174.2	-62.9	-18.9	0	0	0	113.1	I136 A139 F140 Y143 I163 A197 A218 H220 H224 A225 L226	I136-F222 HydrophobicContact CD1-CE2 4.36Å; I136-F222 HydrophobicContact CD1-CZ 3.96Å; I136-F222 HydrophobicContact CG2-CE2 4.04Å; I136-F222 HydrophobicContact CG2-CZ 3.9Å; A139-F222 HydrophobicContact CB-CD2 3.8Å; A139-F222 HydrophobicContact CB-CE2 3.79Å; F140-F222 HydrophobicContact CD1-CB 4.35Å; F140-F222 AromaticContact CD1-CD2 3.65Å; F140-F222 HydrophobicContact CD1-CD2 3.65Å; F140-F222 HydrophobicContact CD1-CE2 4.1Å; F140-F222 HydrophobicContact CD1-CG 4.01Å; F140-F222 HydrophobicContact CD2-CD2 4.05Å; F140-F222 AromaticContact CD2-CE2 3.63Å; F140-F222 HydrophobicContact CD2-CE2 3.63Å; F140-F222 HydrophobicContact CD2-CZ 4.17Å; F140-F222 HydrophobicContact CE1-CB 4.05Å; F140-F222 AromaticContact CE1-CD1 3.87Å; F140-F222 HydrophobicContact CE1-CD1 3.87Å; F140-F222 AromaticContact CE1-CD2 3.57Å; F140-F222 HydrophobicContact CE1-CD2 3.57Å; F140-F222 HydrophobicContact CE1-CE1 4.2Å; F140-F222 AromaticContact CE1-CE2 3.92Å; F140-F222 HydrophobicContact CE1-CE2 3.92Å; F140-F222 AromaticContact CE1-CG 3.55Å; F140-F222 HydrophobicContact CE1-CG 3.55Å; F140-F222 HydrophobicContact CE1-CZ 4.23Å; F140-F222 AromaticContact CE2-CD2 3.99Å; F140-F222 HydrophobicContact CE2-CD2 3.99Å; F140-F222 HydrophobicContact CE2-CE1 4.08Å; F140-F222 AromaticContact CE2-CE2 3.44Å; F140-F222 HydrophobicContact CE2-CE2 3.44Å; F140-F222 VanDerWaalsContact CE2-CE2 3.44Å; F140-F222 AromaticContact CE2-CZ 3.51Å; F140-F222 HydrophobicContact CE2-CZ 3.51Å; F140-F222 AromaticContact CG-CD2 3.88Å; F140-F222 HydrophobicContact CG-CD2 3.88Å; F140-F222 AromaticContact CG-CE2 3.95Å; F140-F222 HydrophobicContact CG-CE2 3.95Å; F140-F222 AromaticContact CZ-CD1 3.76Å; F140-F222 HydrophobicContact CZ-CD1 3.76Å; F140-F222 AromaticContact CZ-CD2 3.74Å; F140-F222 HydrophobicContact CZ-CD2 3.74Å; F140-F222 AromaticContact CZ-CE1 3.62Å; F140-F222 HydrophobicContact CZ-CE1 3.62Å; F140-F222 AromaticContact CZ-CE2 3.59Å; F140-F222 HydrophobicContact CZ-CE2 3.59Å; F140-F222 AromaticContact CZ-CG 3.83Å; F140-F222 HydrophobicContact CZ-CG 3.83Å; F140-F222 AromaticContact CZ-CZ 3.53Å; F140-F222 HydrophobicContact CZ-CZ 3.53Å; Y143-F222 HydrophobicContact CD2-CB 4.41Å; Y143-F222 HydrophobicContact CE2-CB 3.99Å; I163-F222 HydrophobicContact CD1-CE1 3.87Å; I163-F222 HydrophobicContact CD1-CZ 3.57Å; I163-F222 HydrophobicContact CG1-CE1 4.06Å; I163-F222 HydrophobicContact CG1-CZ 4.22Å; A197-F222 HydrophobicContact CB-CD1 4.4Å; A197-F222 HydrophobicContact CB-CE1 4.06Å; A218-F222 HydrophobicContact CB-CE2 4.1Å; A218-F222 HydrophobicContact CB-CZ 4.25Å; A218-F222 WeakPolarHBondContact O-CB 3.41Å; A218-F222 VanDerWaalsContact O-CD2 3.24Å; A218-F222 WeakPolarHBondContact O-CD2 3.31Å; A218-F222 WeakPolarHBondContact O-CG 3.25Å; A218-F222 PolarHBondContact O-N 3.18Å; H220-F222 PolarHBondContact O-N 3.25Å; F222-H224 VanDerWaalsContact C-N 3.34Å; F222-A225 PolarHBondContact O-N 3.42Å; F222-L226 WeakPolarHBondContact O-CB 3.47Å; F222-L226 WeakPolarHBondContact O-CG 3.23Å; F222-L226 PolarHBondContact O-N 2.85Å
223	G	98.3	Very high	97.1	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-59.9	-46	167.1	0	0	0	0	0	111.1	Y143 A219 H220 E221 L226 G227 L228	Y143-G223 VanDerWaalsContact OH-CA 3.23Å; Y143-G223 WeakPolarHBondContact OH-CA 3.34Å; Y143-G223 PolarHBondContact OH-N 2.58Å; A219-G223 PolarHBondContact O-N 3.19Å; H220-G223 WeakPolarHBondContact O-CA 2.95Å; H220-G223 PolarHBondContact O-N 3.2Å; E221-G223 VanDerWaalsContact C-N 3.27Å; E221-G223 PolarHBondContact O-N 2.97Å; G223-L226 CarbonylContact O-C 3.55Å; G223-L226 WeakPolarHBondContact O-CA 3.44Å; G223-L226 PolarHBondContact O-N 2.88Å; G223-L226 VanDerWaalsContact O-N 3.12Å; G223-G227 PolarHBondContact O-N 3.06Å; G223-G227 VanDerWaalsContact O-N 3.13Å; G223-L228 VanDerWaalsContact O-CB 3.3Å; G223-L228 WeakPolarHBondContact O-CB 3.49Å; G223-L228 PolarHBondContact O-N 3.41Å
224	H	97.6	Very high	96.9	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-62.7	-44.6	173.1	-68.1	-46.8	0	0	0	112.8	F96 A186 S188 H220 E221 F222 L226 G227 L228 H230 M238	F96-H224 WeakPolarHBondContact CB-NE2 3.43Å; F96-H224 AromaticContact CD1-CE1 3.58Å; F96-H224 AromaticContact CD1-ND1 3.94Å; F96-H224 HydrophobicContact CD2-CB 4.4Å; F96-H224 AromaticContact CD2-CG 3.95Å; F96-H224 AromaticContact CD2-ND1 3.99Å; F96-H224 HydrophobicContact CE2-CB 4.5Å; F96-H224 AromaticContact CG-CE1 3.6Å; F96-H224 AromaticContact CG-ND1 3.88Å; F96-H224 AromaticContact CG-NE2 3.69Å; A186-H224 HydrophobicContact CB-CB 3.97Å; S188-H224 WeakPolarHBondContact CA-O 3.31Å; H220-H224 AromaticContact CD2-CD2 3.89Å; H220-H224 AromaticContact CD2-NE2 3.77Å; H220-H224 AromaticContact NE2-CD2 3.9Å; H220-H224 AromaticContact NE2-NE2 3.29Å; H220-H224 PolarHBondContact NE2-NE2 3.24Å; H220-H224 PolarHBondContact O-N 2.79Å; E221-H224 WeakPolarHBondContact O-CB 3.22Å; E221-H224 PolarHBondContact O-N 3.41Å; E221-H224 VanDerWaalsContact O-N 3.14Å; E221-H224 IonicContact OE2-CD2 2.68Å; F222-H224 VanDerWaalsContact C-N 3.34Å; H224-L226 PolarHBondContact O-N 2.9Å; H224-G227 PolarHBondContact O-N 2.86Å; H224-L228 WeakPolarHBondContact CA-O 3.45Å; H224-L228 PolarHBondContact ND1-O 3.47Å; H224-H230 AromaticContact CE1-CD2 3.52Å; H224-H230 AromaticContact CE1-NE2 3.76Å; H224-H230 AromaticContact NE2-CD2 3.41Å; H224-H230 PolarHBondContact NE2-CD2 3.26Å; H224-H230 AromaticContact NE2-NE2 3.25Å; H224-H230 PolarHBondContact NE2-NE2 3.45Å; H224-M238 WeakPolarHBondContact CE1-CE 3.39Å; H224-M238 WeakPolarHBondContact ND1-CE 3.23Å; H224-M238 WeakPolarHBondContact NE2-CE 3.13Å
225	A	97.8	Very high	96.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-63.6	-12	175.4	0	0	0	0	0	113.6	W111 I161 F187 P189 G195 E221 F222	W111-A225 PolarHBondContact NE1-O 3.45Å; I161-A225 HydrophobicContact CD1-CB 3.92Å; I161-A225 HydrophobicContact CG1-CB 4.33Å; F187-A225 WeakPolarHBondContact O-CA 3.07Å; P189-A225 WeakPolarHBondContact CG-O 3.48Å; G195-A225 VanDerWaalsContact O-CB 3.29Å; G195-A225 WeakPolarHBondContact O-CB 3.39Å; E221-A225 PolarHBondContact O-N 2.73Å; F222-A225 PolarHBondContact O-N 3.42Å
226	L	97	Very high	96.6	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-1.3	172.2	-68.1	175.2	0	0	0	113.4	Y143 I147 L149 F151 F222 G223 H224 V260 L263 Y264	Y143-L226 HydrophobicContact CD1-CD1 3.61Å; Y143-L226 HydrophobicContact CD2-CD1 3.9Å; Y143-L226 HydrophobicContact CE1-CD1 4.15Å; Y143-L226 HydrophobicContact CE2-CD1 4.4Å; Y143-L226 HydrophobicContact CG-CD1 3.46Å; Y143-L226 VanDerWaalsContact CG-CD1 3.46Å; I147-L226 HydrophobicContact CD1-CD1 4.3Å; L149-L226 HydrophobicContact CD1-CD2 3.76Å; F151-L226 HydrophobicContact CE1-CD2 3.89Å; F151-L226 HydrophobicContact CZ-CD1 4Å; F151-L226 HydrophobicContact CZ-CD2 3.76Å; F151-L226 HydrophobicContact CZ-CG 4.4Å; F222-L226 WeakPolarHBondContact O-CB 3.47Å; F222-L226 WeakPolarHBondContact O-CG 3.23Å; F222-L226 PolarHBondContact O-N 2.85Å; G223-L226 CarbonylContact O-C 3.55Å; G223-L226 WeakPolarHBondContact O-CA 3.44Å; G223-L226 PolarHBondContact O-N 2.88Å; G223-L226 VanDerWaalsContact O-N 3.12Å; H224-L226 PolarHBondContact O-N 2.9Å; L226-V260 HydrophobicContact CD1-CG2 4.31Å; L226-L263 WeakPolarHBondContact O-CD1 3.47Å; L226-Y264 HydrophobicContact CB-CE2 4.09Å; L226-Y264 HydrophobicContact CD2-CE2 4.32Å; L226-Y264 VanDerWaalsContact O-CE2 3.25Å; L226-Y264 WeakPolarHBondContact O-CE2 3.39Å; L226-Y264 PolarHBondContact O-OH 3.48Å
227	G	94.1	Very high	96.6	Very high	3 Å²	3	25.8 Å²	25.8	3%	0.031	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	95.6	12.6	175.4	0	0	0	0	0	115.1	Y102 P109 P189 G223 H224	Y102-G227 WeakPolarHBondContact CE2-O 3.42Å; P109-G227 VanDerWaalsContact O-CA 3.31Å; P109-G227 WeakPolarHBondContact O-CA 3.41Å; P189-G227 VanDerWaalsContact CD-N 3.35Å; G223-G227 PolarHBondContact O-N 3.06Å; G223-G227 VanDerWaalsContact O-N 3.13Å; H224-G227 PolarHBondContact O-N 2.86Å
228	L	94.3	Very high	96.5	Very high	14 Å²	14	25.5 Å²	25.5	7%	0.073	14%	0.136	C	C	.	.			trans	-75	153.9	166.7	-57.1	-177.3	0	0	0	110.8	Y143 G223 H224 M238 V260 L263	Y143-L228 HydrophobicContact CE1-CD1 4.31Å; G223-L228 VanDerWaalsContact O-CB 3.3Å; G223-L228 WeakPolarHBondContact O-CB 3.49Å; G223-L228 PolarHBondContact O-N 3.41Å; H224-L228 WeakPolarHBondContact CA-O 3.45Å; H224-L228 PolarHBondContact ND1-O 3.47Å; L228-M238 HydrophobicContact CB-CE 4.15Å; L228-M238 HydrophobicContact CB-CG 4.17Å; L228-M238 HydrophobicContact CB-SD 4.37Å; L228-M238 HydrophobicContact CD1-CG 3.79Å; L228-M238 HydrophobicContact CD1-SD 4.22Å; L228-V260 HydrophobicContact CD1-CB 4.21Å; L228-V260 HydrophobicContact CD2-CB 4.21Å; L228-L263 HydrophobicContact CD2-CD1 3.99Å
229	V	93.2	Very high	96.5	Very high	47 Å²	47	26.2 Å²	26.2	29%	0.285	14%	0.139	S	C	.	.			trans	-113.5	171	169.1	-77.4	0	0	0	0	109	F96 A100 Y102 S231	F96-V229 HydrophobicContact CE1-CG1 4.02Å; A100-V229 HydrophobicContact CB-CG1 4.12Å; A100-V229 VanDerWaalsContact O-CG1 3.29Å; A100-V229 WeakPolarHBondContact O-CG1 3.48Å; Y102-V229 HydrophobicContact CD2-CG1 3.79Å; Y102-V229 HydrophobicContact CE1-CG1 4.44Å; Y102-V229 HydrophobicContact CE2-CB 4.24Å; Y102-V229 HydrophobicContact CE2-CG1 3.11Å; Y102-V229 HydrophobicContact CE2-CG2 4.41Å; Y102-V229 VanDerWaalsContact CZ-CG1 3.49Å; V229-S231 PolarHBondContact O-N 3.26Å
230	H	95.4	Very high	96.4	Very high	15 Å²	15	26.3 Å²	26.3	7%	0.069	14%	0.14	C	C	.	.			trans	-57.5	138.3	174.5	-68.6	148.6	0	0	0	112.3	F72 R93 C94 F96 D98 H220 H224 M238	F72-H230 HydrophobicContact CZ-CB 3.84Å; R93-H230 PolarHBondContact NH2-CE1 3.49Å; C94-H230 WeakPolarHBondContact CB-NE2 3.15Å; F96-H230 PolarHBondContact O-CE1 2.8Å; D98-H230 IonicContact OD1-CE1 2.58Å; D98-H230 PolarHBondContact OD1-CE1 3.41Å; D98-H230 IonicContact OD1-CG 3.26Å; D98-H230 IonicContact OD1-ND1 3.06Å; D98-H230 PolarHBondContact OD1-ND1 3.35Å; H220-H230 AromaticContact CE1-CD2 3.57Å; H220-H230 AromaticContact CE1-NE2 3.74Å; H220-H230 AromaticContact NE2-CD2 3.39Å; H220-H230 PolarHBondContact NE2-CD2 3.07Å; H220-H230 AromaticContact NE2-NE2 3.22Å; H220-H230 PolarHBondContact NE2-NE2 3.34Å; H224-H230 AromaticContact CE1-CD2 3.52Å; H224-H230 AromaticContact CE1-NE2 3.76Å; H224-H230 AromaticContact NE2-CD2 3.41Å; H224-H230 PolarHBondContact NE2-CD2 3.26Å; H224-H230 AromaticContact NE2-NE2 3.25Å; H224-H230 PolarHBondContact NE2-NE2 3.45Å; H230-M238 CarbonylContact C-O 3.56Å; H230-M238 WeakPolarHBondContact CA-O 3.33Å; H230-M238 PolarHBondContact CD2-O 2.82Å
231	S	95.1	Very high	96.4	Very high	14 Å²	14	26.3 Å²	26.3	10%	0.098	14%	0.141	C	C	.	.			trans	-87.7	154.6	171.4	-172.5	0	0	0	0	110.9	F72 V229 D233 M238 F239 D255	F72-S231 WeakPolarHBondContact CZ-O 3.16Å; V229-S231 PolarHBondContact O-N 3.26Å; S231-D233 PolarHBondContact OG-N 2.72Å; S231-M238 PolarHBondContact N-O 2.85Å; S231-F239 WeakPolarHBondContact O-CD2 3.16Å; S231-D255 WeakPolarHBondContact CB-OD2 3.14Å; S231-D255 PolarHBondContact OG-OD2 2.82Å
232	Q	93.4	Very high	96.3	Very high	109 Å²	109	28.8 Å²	28.8	51%	0.509	15%	0.151	S	C	.	.	S	Bend	trans	-91.2	-6.8	168.1	-65.8	-177.4	-31.4	0	0	112	F72 E234	F72-Q232 HydrophobicContact CD1-CG 4.49Å; F72-Q232 HydrophobicContact CD2-CG 3.86Å; F72-Q232 HydrophobicContact CE1-CG 4.37Å; F72-Q232 HydrophobicContact CE2-CG 3.77Å; F72-Q232 HydrophobicContact CG-CG 4.21Å; F72-Q232 HydrophobicContact CZ-CG 4.02Å; Q232-E234 PolarHBondContact O-N 3.43Å
233	D	94.3	Very high	96.1	Very high	66 Å²	66	36.2 Å²	36.2	35%	0.353	18%	0.183	S	C	.	.			trans	-79.7	113.3	174.2	-174.2	-19.5	0	0	0	109.8	S231 T235 A236 F239	S231-D233 PolarHBondContact OG-N 2.72Å; D233-T235 VanDerWaalsContact CG-OG1 3.3Å; D233-T235 PolarHBondContact O-N 3.02Å; D233-T235 WeakPolarHBondContact OD1-CB 3.25Å; D233-T235 PolarHBondContact OD1-N 2.97Å; D233-T235 PolarHBondContact OD1-OG1 3.15Å; D233-T235 PolarHBondContact OD2-OG1 3.07Å; D233-A236 HydrophobicContact CB-CB 4.11Å; D233-A236 WeakPolarHBondContact O-CB 3.45Å; D233-A236 PolarHBondContact O-N 3.09Å; D233-F239 WeakPolarHBondContact O-CB 3.17Å; D233-F239 WeakPolarHBondContact O-CD2 3.27Å
234	E	94.3	Very high	96.1	Very high	122 Å²	122	40.1 Å²	40.1	57%	0.57	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-13.3	179.1	-57.2	-166.1	165.7	0	0	114.3	Q232 F239	Q232-E234 PolarHBondContact O-N 3.43Å; E234-F239 HydrophobicContact CB-CD2 4.49Å; E234-F239 HydrophobicContact CB-CE1 4.37Å; E234-F239 HydrophobicContact CB-CE2 4.35Å; E234-F239 HydrophobicContact CB-CZ 4.28Å; E234-F239 HydrophobicContact CG-CD2 4.43Å; E234-F239 HydrophobicContact CG-CE1 4.15Å; E234-F239 HydrophobicContact CG-CE2 3.83Å; E234-F239 HydrophobicContact CG-CZ 3.66Å
235	T	94.6	Very high	96	Very high	104 Å²	104	42.8 Å²	42.8	64%	0.638	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-11.7	177.9	72.8	0	0	0	0	113.4	D233 P253	D233-T235 VanDerWaalsContact CG-OG1 3.3Å; D233-T235 PolarHBondContact O-N 3.02Å; D233-T235 WeakPolarHBondContact OD1-CB 3.25Å; D233-T235 PolarHBondContact OD1-N 2.97Å; D233-T235 PolarHBondContact OD1-OG1 3.15Å; D233-T235 PolarHBondContact OD2-OG1 3.07Å; T235-P253 WeakPolarHBondContact O-CG 3.4Å
236	A	97.3	Very high	95.8	Very high	8 Å²	8	48.1 Å²	48.1	7%	0.066	24%	0.243	C	C	.	.	S	Bend	trans	-71.8	147.2	176	0	0	0	0	0	111.2	D233 M238 F239 D255 D256	D233-A236 HydrophobicContact CB-CB 4.11Å; D233-A236 WeakPolarHBondContact O-CB 3.45Å; D233-A236 PolarHBondContact O-N 3.09Å; A236-M238 PolarHBondContact O-N 2.85Å; A236-F239 WeakPolarHBondContact O-CB 3.3Å; A236-F239 PolarHBondContact O-N 3.3Å; A236-D255 HydrophobicContact CB-CB 4.15Å; A236-D256 WeakPolarHBondContact CA-OD2 3.27Å
237	L	98.2	Very high	95.8	Very high	17 Å²	17	49.1 Å²	49.1	9%	0.089	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-40.7	169.3	175.4	64.5	0	0	0	110	A219 H220 F239 L252 D256	A219-L237 HydrophobicContact CB-CD1 4.32Å; A219-L237 HydrophobicContact CB-CD2 3.68Å; H220-L237 HydrophobicContact CB-CD1 4.23Å; H220-L237 HydrophobicContact CB-CG 4.32Å; H220-L237 PolarHBondContact ND1-O 2.98Å; L237-F239 PolarHBondContact O-N 3.12Å; L237-F239 VanDerWaalsContact O-N 3.17Å; L237-L252 HydrophobicContact CD2-CD2 3.47Å; L237-L252 VanDerWaalsContact CD2-CD2 3.47Å; L237-D256 WeakPolarHBondContact CB-OD2 3.17Å; L237-D256 PolarHBondContact N-OD1 3.42Å; L237-D256 PolarHBondContact N-OD2 3.43Å
238	M	98	Very high	95.7	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.4	8.9	178.6	-64.7	-49.7	-59	0	0	114	H224 L228 H230 S231 A236 D256	H224-M238 WeakPolarHBondContact CE1-CE 3.39Å; H224-M238 WeakPolarHBondContact ND1-CE 3.23Å; H224-M238 WeakPolarHBondContact NE2-CE 3.13Å; L228-M238 HydrophobicContact CB-CE 4.15Å; L228-M238 HydrophobicContact CB-CG 4.17Å; L228-M238 HydrophobicContact CB-SD 4.37Å; L228-M238 HydrophobicContact CD1-CG 3.79Å; L228-M238 HydrophobicContact CD1-SD 4.22Å; H230-M238 CarbonylContact C-O 3.56Å; H230-M238 WeakPolarHBondContact CA-O 3.33Å; H230-M238 PolarHBondContact CD2-O 2.82Å; S231-M238 PolarHBondContact N-O 2.85Å; A236-M238 PolarHBondContact O-N 2.85Å; M238-D256 VanDerWaalsContact CB-OD1 3.3Å; M238-D256 WeakPolarHBondContact CB-OD1 3.37Å; M238-D256 WeakPolarHBondContact CG-OD1 3.32Å; M238-D256 PolarHBondContact N-OD1 3.2Å
239	F	97.9	Very high	95.6	Very high	15 Å²	15	58.3 Å²	58.3	7%	0.066	31%	0.313	C	S	.	.			trans	-66.8	134.9	168.5	-167	-110.8	0	0	0	110.2	F73 H220 S231 D233 E234 A236 L237 T241	F73-F239 HydrophobicContact CD1-CE1 4.41Å; F73-F239 HydrophobicContact CD1-CE2 4.38Å; F73-F239 AromaticContact CD1-CZ 3.68Å; F73-F239 HydrophobicContact CD1-CZ 3.68Å; F73-F239 HydrophobicContact CE1-CE1 4.25Å; F73-F239 AromaticContact CE1-CZ 3.85Å; F73-F239 HydrophobicContact CE1-CZ 3.85Å; H220-F239 PolarHBondContact CE1-O 2.95Å; H220-F239 VanDerWaalsContact CE1-O 3.26Å; S231-F239 WeakPolarHBondContact O-CD2 3.16Å; D233-F239 WeakPolarHBondContact O-CB 3.17Å; D233-F239 WeakPolarHBondContact O-CD2 3.27Å; E234-F239 HydrophobicContact CB-CD2 4.49Å; E234-F239 HydrophobicContact CB-CE1 4.37Å; E234-F239 HydrophobicContact CB-CE2 4.35Å; E234-F239 HydrophobicContact CB-CZ 4.28Å; E234-F239 HydrophobicContact CG-CD2 4.43Å; E234-F239 HydrophobicContact CG-CE1 4.15Å; E234-F239 HydrophobicContact CG-CE2 3.83Å; E234-F239 HydrophobicContact CG-CZ 3.66Å; A236-F239 WeakPolarHBondContact O-CB 3.3Å; A236-F239 PolarHBondContact O-N 3.3Å; L237-F239 PolarHBondContact O-N 3.12Å; L237-F239 VanDerWaalsContact O-N 3.17Å; F239-T241 WeakPolarHBondContact CD1-OG1 3.26Å; F239-T241 WeakPolarHBondContact CE1-OG1 3.35Å; F239-T241 PolarHBondContact O-N 2.88Å
240	P	97.6	Very high	95.8	Very high	2 Å²	2	58.2 Å²	58.2	1%	0.013	31%	0.307	C	S	.	.	S	Bend	trans	-68.2	-33.6	-166.5	21.6	-32.5	0	0	0	114.5	F72 F73 R93 C94	F72-P240 HydrophobicContact CE1-CG 3.65Å; F72-P240 HydrophobicContact CZ-CG 4.3Å; F73-P240 HydrophobicContact CE1-CG 3.74Å; F73-P240 HydrophobicContact CZ-CB 4.48Å; F73-P240 HydrophobicContact CZ-CG 3.62Å; R93-P240 CarbonylContact C-O 3.52Å; R93-P240 WeakPolarHBondContact CA-O 3.39Å; R93-P240 WeakPolarHBondContact CB-O 3.38Å; R93-P240 VanDerWaalsContact NH2-CB 3.31Å; C94-P240 PolarHBondContact N-O 3.48Å
241	T	97.9	Very high	95.8	Very high	13 Å²	13	62.4 Å²	62.4	8%	0.08	33%	0.334	C	S	.	.	B	Isolated β-bridge	trans	-84.4	134.7	-177.8	61.6	0	0	0	0	111.1	F73 R91 P92 R93 F239 K243	F73-T241 HydrophobicContact CE1-CG2 3.71Å; F73-T241 HydrophobicContact CZ-CG2 4.2Å; R91-T241 HydrophobicContact CB-CG2 3.98Å; P92-T241 CarbonylContact O-C 3.48Å; P92-T241 WeakPolarHBondContact O-CA 3.4Å; R93-T241 HydrophobicContact CB-CG2 4.38Å; F239-T241 WeakPolarHBondContact CD1-OG1 3.26Å; F239-T241 WeakPolarHBondContact CE1-OG1 3.35Å; F239-T241 PolarHBondContact O-N 2.88Å; T241-K243 PolarHBondContact O-N 3.39Å
242	Y	97.6	Very high	95.8	Very high	54 Å²	54	62.1 Å²	62.1	21%	0.212	33%	0.332	C	S	.	.			trans	-66.6	133.1	178.2	178.8	-106.2	0	0	0	111.9	P92 L183 N213 L216 V217	P92-Y242 WeakPolarHBondContact O-CB 3.27Å; P92-Y242 PolarHBondContact O-N 2.93Å; L183-Y242 VanDerWaalsContact CD1-CB 3.45Å; L183-Y242 HydrophobicContact CD1-CD1 4.05Å; L183-Y242 HydrophobicContact CD1-CD2 3.73Å; L183-Y242 HydrophobicContact CD1-CG 3.46Å; L183-Y242 VanDerWaalsContact CD1-CG 3.46Å; N213-Y242 WeakPolarHBondContact CB-OH 3.18Å; N213-Y242 PolarHBondContact N-OH 3.46Å; L216-Y242 HydrophobicContact CB-CE2 4.36Å; V217-Y242 HydrophobicContact CG2-CD2 3.89Å; V217-Y242 HydrophobicContact CG2-CE2 3.87Å
243	K	94.7	Very high	96	Very high	156 Å²	156	58.2 Å²	58.2	68%	0.678	32%	0.316	S	S	*	.			trans	-143.7	126.5	169.8	-177.8	178.8	176.5	-175.7	0	108.7	T241 V245	T241-K243 PolarHBondContact O-N 3.39Å; K243-V245 PolarHBondContact O-N 2.95Å
244	Y	97.1	Very high	96	Very high	82 Å²	82	59.8 Å²	59.8	32%	0.322	32%	0.324	S	S	.	.			trans	-65.4	134.6	171.9	-179	-93.4	0	0	0	110.6	T208 N213 L216	T208-Y244 WeakPolarHBondContact O-CE2 3.3Å; N213-Y244 HydrophobicContact CB-CD2 4.08Å; N213-Y244 HydrophobicContact CB-CE2 4.3Å; L216-Y244 HydrophobicContact CD1-CD2 4.16Å
245	V	95.9	Very high	96.1	Very high	55 Å²	55	57.2 Å²	57.2	33%	0.333	31%	0.314	S	S	.	.			trans	-129.8	156.4	168	-62.4	0	0	0	0	108.6	L216 K243 T247 Y250	L216-V245 HydrophobicContact CD1-CG2 3.88Å; L216-V245 HydrophobicContact CD2-CG2 3.68Å; L216-V245 HydrophobicContact CG-CG2 4.46Å; K243-V245 PolarHBondContact O-N 2.95Å; V245-T247 WeakPolarHBondContact O-CG2 3.49Å; V245-T247 PolarHBondContact O-N 3.47Å; V245-Y250 HydrophobicContact CG2-CD2 3.96Å; V245-Y250 HydrophobicContact CG2-CE2 3.6Å
246	D	94.9	Very high	96.2	Very high	112 Å²	112	52.4 Å²	52.4	60%	0.599	29%	0.285	S	S	*	.			trans	-60	130.9	175.2	-166.7	-10.3	0	0	0	109.9	D248	D246-D248 PolarHBondContact OD1-N 3.2Å
247	T	95.3	Very high	96.2	Very high	22 Å²	22	55.3 Å²	55.3	14%	0.135	29%	0.294	C	S	.	.			trans	-100.4	-3.7	-174.8	66.5	0	0	0	0	112.7	K138 F215 L216 V245 G249 Y250	K138-T247 PolarHBondContact NZ-O 2.93Å; F215-T247 HydrophobicContact CD1-CG2 3.73Å; F215-T247 HydrophobicContact CE1-CG2 4.27Å; L216-T247 HydrophobicContact CD1-CG2 4.17Å; L216-T247 HydrophobicContact CD2-CG2 4.07Å; L216-T247 HydrophobicContact CG-CG2 3.94Å; V245-T247 WeakPolarHBondContact O-CG2 3.49Å; V245-T247 PolarHBondContact O-N 3.47Å; T247-G249 PolarHBondContact O-N 3.36Å; T247-Y250 PolarHBondContact O-N 3.44Å
248	D	93.4	Very high	96	Very high	144 Å²	144	60.4 Å²	60.4	77%	0.77	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72	123.7	172.1	-168.5	20.8	0	0	0	110.2	D246 Y250	D246-D248 PolarHBondContact OD1-N 3.2Å; D248-Y250 PolarHBondContact O-N 2.98Å; D248-Y250 VanDerWaalsContact O-N 3.12Å
249	G	92.4	Very high	95.8	Very high	65 Å²	65	61.7 Å²	61.7	67%	0.67	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	15.4	-174.7	0	0	0	0	0	115.4	T247 T251	T247-G249 PolarHBondContact O-N 3.36Å; G249-T251 PolarHBondContact O-N 3.4Å
250	Y	96.1	Very high	95.7	Very high	45 Å²	45	61 Å²	61	18%	0.176	33%	0.328	C	S	.	.			trans	-60.6	135.4	-177.2	-175.4	-94.9	0	0	0	112.4	L142 F215 L216 V245 T247 D248	L142-Y250 HydrophobicContact CD1-CD1 4.11Å; L142-Y250 HydrophobicContact CD1-CE1 4.1Å; L142-Y250 HydrophobicContact CD2-CD1 4.18Å; L142-Y250 WeakPolarHBondContact CD2-O 3.22Å; F215-Y250 AromaticContact CE1-CD1 3.68Å; F215-Y250 HydrophobicContact CE1-CD1 3.68Å; F215-Y250 HydrophobicContact CE1-CE1 4.47Å; F215-Y250 HydrophobicContact CE1-CG 4.11Å; F215-Y250 AromaticContact CZ-CD1 3.98Å; F215-Y250 HydrophobicContact CZ-CD1 3.98Å; L216-Y250 HydrophobicContact CD2-CE1 4.38Å; L216-Y250 HydrophobicContact CD2-CE2 4.41Å; V245-Y250 HydrophobicContact CG2-CD2 3.96Å; V245-Y250 HydrophobicContact CG2-CE2 3.6Å; T247-Y250 PolarHBondContact O-N 3.44Å; D248-Y250 PolarHBondContact O-N 2.98Å; D248-Y250 VanDerWaalsContact O-N 3.12Å
251	T	95.7	Very high	95.6	Very high	103 Å²	103	63 Å²	63	63%	0.632	34%	0.337	S	S	*	.			trans	-130.8	155	176.8	57	0	0	0	0	109.6	G249 P253	G249-T251 PolarHBondContact O-N 3.4Å; T251-P253 WeakPolarHBondContact O-CD 3.29Å
252	L	95.6	Very high	95.4	Very high	9 Å²	9	65.5 Å²	65.5	5%	0.047	36%	0.359	C	S	.	.			trans	-57.4	128.6	176	-74.4	169.4	0	0	0	111.3	L142 Y143 I146 L237 D256 R257	L142-L252 HydrophobicContact CB-CD1 4.21Å; L142-L252 HydrophobicContact CB-CD2 4.48Å; L142-L252 HydrophobicContact CB-CG 4.07Å; L142-L252 HydrophobicContact CD1-CD2 4.46Å; L142-L252 WeakPolarHBondContact O-CD1 3.39Å; Y143-L252 HydrophobicContact CD1-CD1 3.69Å; Y143-L252 HydrophobicContact CE1-CD1 3.8Å; Y143-L252 HydrophobicContact CE1-CD2 4.13Å; Y143-L252 HydrophobicContact CG-CD1 4.26Å; I146-L252 HydrophobicContact CD1-CD1 3.49Å; I146-L252 VanDerWaalsContact CD1-CD1 3.49Å; I146-L252 HydrophobicContact CG1-CD1 4.21Å; L237-L252 HydrophobicContact CD2-CD2 3.47Å; L237-L252 VanDerWaalsContact CD2-CD2 3.47Å; L252-D256 HydrophobicContact CD2-CB 4.13Å; L252-R257 HydrophobicContact CB-CB 4.44Å; L252-R257 PolarHBondContact O-NH1 2.74Å
253	P	96.5	Very high	95.1	Very high	27 Å²	27	63.8 Å²	63.8	18%	0.175	35%	0.354	C	S	.	.			trans	-55.5	162.3	168.5	-22.4	31	0	0	0	112.6	T235 T251 D255 D256 R257	T235-P253 WeakPolarHBondContact O-CG 3.4Å; T251-P253 WeakPolarHBondContact O-CD 3.29Å; P253-D255 PolarHBondContact O-N 2.8Å; P253-D256 VanDerWaalsContact CB-OD2 3.22Å; P253-D256 WeakPolarHBondContact CB-OD2 3.38Å; P253-D256 WeakPolarHBondContact CD-OD2 3.38Å; P253-D256 VanDerWaalsContact CG-OD2 3.22Å; P253-D256 WeakPolarHBondContact CG-OD2 3.42Å; P253-D256 PolarHBondContact O-N 3.35Å; P253-R257 WeakPolarHBondContact O-CB 3.33Å; P253-R257 PolarHBondContact O-N 3.27Å
254	D	95.9	Very high	95.1	Very high	99 Å²	99	57.8 Å²	57.8	53%	0.529	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-43.4	-171.8	-70.2	-1.9	0	0	0	112.2	D256 R257 E258	D254-D256 PolarHBondContact O-N 2.93Å; D254-R257 PolarHBondContact O-N 3.3Å; D254-R257 IonicContact OD1-CZ 2.68Å; D254-R257 IonicContact OD1-NH1 3.74Å; D254-R257 PolarHBondContact OD1-NH1 3.47Å; D254-R257 IonicContact OD1-NH2 3.11Å; D254-R257 PolarHBondContact OD1-NH2 2.96Å; D254-R257 IonicContact OD2-NH2 2.61Å; D254-E258 WeakPolarHBondContact O-CB 3.38Å; D254-E258 VanDerWaalsContact O-CG 3.3Å; D254-E258 WeakPolarHBondContact O-CG 3.35Å; D254-E258 PolarHBondContact O-N 2.95Å
255	D	95.2	Very high	94.9	Very high	67 Å²	67	55.4 Å²	55.4	36%	0.358	33%	0.327	S	S	.	.	H	α-helix	trans	-58.6	-46.3	177.7	-173.2	65.4	0	0	0	112	S231 A236 P253 G259	S231-D255 WeakPolarHBondContact CB-OD2 3.14Å; S231-D255 PolarHBondContact OG-OD2 2.82Å; A236-D255 HydrophobicContact CB-CB 4.15Å; P253-D255 PolarHBondContact O-N 2.8Å; D255-G259 PolarHBondContact O-N 2.7Å
256	D	97.3	Very high	94.8	Very high	3 Å²	3	55.7 Å²	55.7	2%	0.016	33%	0.329	C	S	.	.	H	α-helix	trans	-67.3	-43.2	179.3	-49.6	-75.1	0	0	0	111.9	A236 L237 M238 L252 P253 D254 G259 V260	A236-D256 WeakPolarHBondContact CA-OD2 3.27Å; L237-D256 WeakPolarHBondContact CB-OD2 3.17Å; L237-D256 PolarHBondContact N-OD1 3.42Å; L237-D256 PolarHBondContact N-OD2 3.43Å; M238-D256 VanDerWaalsContact CB-OD1 3.3Å; M238-D256 WeakPolarHBondContact CB-OD1 3.37Å; M238-D256 WeakPolarHBondContact CG-OD1 3.32Å; M238-D256 PolarHBondContact N-OD1 3.2Å; L252-D256 HydrophobicContact CD2-CB 4.13Å; P253-D256 VanDerWaalsContact CB-OD2 3.22Å; P253-D256 WeakPolarHBondContact CB-OD2 3.38Å; P253-D256 WeakPolarHBondContact CD-OD2 3.38Å; P253-D256 VanDerWaalsContact CG-OD2 3.22Å; P253-D256 WeakPolarHBondContact CG-OD2 3.42Å; P253-D256 PolarHBondContact O-N 3.35Å; D254-D256 PolarHBondContact O-N 2.93Å; D256-G259 PolarHBondContact O-N 3.47Å; D256-V260 WeakPolarHBondContact O-CG1 2.98Å; D256-V260 PolarHBondContact O-N 2.89Å
257	R	96.5	Very high	94.6	Very high	70 Å²	70	52.7 Å²	52.7	26%	0.264	31%	0.309	S	S	.	.	H	α-helix	trans	-62.2	-47.6	178.4	177.4	174.9	71.9	-110.6	-0.1	111	I146 L252 P253 D254 V260 Q261	I146-R257 HydrophobicContact CD1-CB 4.05Å; I146-R257 HydrophobicContact CD1-CG 3.68Å; L252-R257 HydrophobicContact CB-CB 4.44Å; L252-R257 PolarHBondContact O-NH1 2.74Å; P253-R257 WeakPolarHBondContact O-CB 3.33Å; P253-R257 PolarHBondContact O-N 3.27Å; D254-R257 PolarHBondContact O-N 3.3Å; D254-R257 IonicContact OD1-CZ 2.68Å; D254-R257 IonicContact OD1-NH1 3.74Å; D254-R257 PolarHBondContact OD1-NH1 3.47Å; D254-R257 IonicContact OD1-NH2 3.11Å; D254-R257 PolarHBondContact OD1-NH2 2.96Å; D254-R257 IonicContact OD2-NH2 2.61Å; R257-V260 WeakPolarHBondContact O-CG1 3.47Å; R257-Q261 VanDerWaalsContact O-CB 3.26Å; R257-Q261 WeakPolarHBondContact O-CB 3.46Å; R257-Q261 WeakPolarHBondContact O-CG 3.37Å; R257-Q261 PolarHBondContact O-N 2.57Å
258	E	94.6	Very high	93.7	Very high	124 Å²	124	55.8 Å²	55.8	58%	0.579	33%	0.332	S	S	*	.	H	α-helix	trans	-64.4	-42.2	177.7	-72.6	-178.8	-168.6	0	0	111.1	D254 Q261 A262	D254-E258 WeakPolarHBondContact O-CB 3.38Å; D254-E258 VanDerWaalsContact O-CG 3.3Å; D254-E258 WeakPolarHBondContact O-CG 3.35Å; D254-E258 PolarHBondContact O-N 2.95Å; E258-Q261 PolarHBondContact O-N 3.18Å; E258-A262 WeakPolarHBondContact O-CB 3.46Å; E258-A262 PolarHBondContact O-N 3.49Å
259	G	94.2	Very high	92.4	Very high	28 Å²	28	55.9 Å²	55.9	29%	0.289	33%	0.332	S	S	.	.	H	α-helix	trans	-56.8	-51.5	176.5	0	0	0	0	0	112.5	D255 D256 A262	D255-G259 PolarHBondContact O-N 2.7Å; D256-G259 PolarHBondContact O-N 3.47Å; G259-A262 WeakPolarHBondContact O-CB 3.35Å; G259-A262 PolarHBondContact O-N 3.37Å
260	V	95.5	Very high	90.9	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-73.5	-34.5	-177.1	74.3	0	0	0	0	111.9	Y143 I146 I147 L226 L228 D256 R257 A262 L263 Y264	Y143-V260 HydrophobicContact CD1-CB 4.38Å; Y143-V260 HydrophobicContact CD1-CG1 4.19Å; Y143-V260 HydrophobicContact CD1-CG2 4.01Å; Y143-V260 HydrophobicContact CE1-CG2 4.45Å; I146-V260 HydrophobicContact CD1-CG1 3.6Å; I147-V260 HydrophobicContact CD1-CG2 3.79Å; I147-V260 HydrophobicContact CG2-CB 4.4Å; I147-V260 HydrophobicContact CG2-CG1 3.72Å; I147-V260 HydrophobicContact CG2-CG2 4.05Å; L226-V260 HydrophobicContact CD1-CG2 4.31Å; L228-V260 HydrophobicContact CD1-CB 4.21Å; L228-V260 HydrophobicContact CD2-CB 4.21Å; D256-V260 WeakPolarHBondContact O-CG1 2.98Å; D256-V260 PolarHBondContact O-N 2.89Å; R257-V260 WeakPolarHBondContact O-CG1 3.47Å; V260-A262 VanDerWaalsContact C-N 3.3Å; V260-A262 PolarHBondContact O-N 3.25Å; V260-L263 WeakPolarHBondContact O-CB 3.32Å; V260-L263 PolarHBondContact O-N 2.99Å; V260-L263 VanDerWaalsContact O-N 3.1Å; V260-Y264 HydrophobicContact CG2-CD2 3.78Å; V260-Y264 HydrophobicContact CG2-CE2 4.11Å; V260-Y264 WeakPolarHBondContact O-CD2 3.31Å; V260-Y264 PolarHBondContact O-N 2.91Å
261	Q	95.4	Very high	88.7	Confident	44 Å²	44	59.6 Å²	59.6	21%	0.206	34%	0.339	C	S	.	.	H	α-helix	trans	-68.9	-28.5	174.1	-73	179.2	-20.7	0	0	112.2	I146 I147 R257 E258 L263 G265 V266	I146-Q261 PolarHBondContact O-NE2 3.2Å; I146-Q261 VanDerWaalsContact O-NE2 3.11Å; I147-Q261 HydrophobicContact CG2-CG 4.04Å; R257-Q261 VanDerWaalsContact O-CB 3.26Å; R257-Q261 WeakPolarHBondContact O-CB 3.46Å; R257-Q261 WeakPolarHBondContact O-CG 3.37Å; R257-Q261 PolarHBondContact O-N 2.57Å; E258-Q261 PolarHBondContact O-N 3.18Å; Q261-L263 PolarHBondContact O-N 2.91Å; Q261-G265 WeakPolarHBondContact O-CA 3.39Å; Q261-G265 PolarHBondContact O-N 2.97Å; Q261-V266 HydrophobicContact CG-CG2 4.31Å
262	A	93.1	Very high	86.5	Confident	66 Å²	66	60.4 Å²	60.4	55%	0.545	35%	0.345	S	S	.	.	H	α-helix	trans	-65.8	-21.5	171.7	0	0	0	0	0	113	E258 G259 V260	E258-A262 WeakPolarHBondContact O-CB 3.46Å; E258-A262 PolarHBondContact O-N 3.49Å; G259-A262 WeakPolarHBondContact O-CB 3.35Å; G259-A262 PolarHBondContact O-N 3.37Å; V260-A262 VanDerWaalsContact C-N 3.3Å; V260-A262 PolarHBondContact O-N 3.25Å
263	L	92.4	Very high	84.3	Confident	19 Å²	19	68.9 Å²	68.9	10%	0.099	38%	0.382	C	S	.	.	H	α-helix	trans	-89.3	-44.2	176.3	-64.6	176.2	0	0	0	112.7	R108 K110 L226 L228 V260 Q261	R108-L263 HydrophobicContact CB-CD2 3.87Å; K110-L263 WeakPolarHBondContact CD-O 3.47Å; K110-L263 PolarHBondContact NZ-O 2.71Å; K110-L263 VanDerWaalsContact NZ-O 3.08Å; L226-L263 WeakPolarHBondContact O-CD1 3.47Å; L228-L263 HydrophobicContact CD2-CD1 3.99Å; V260-L263 WeakPolarHBondContact O-CB 3.32Å; V260-L263 PolarHBondContact O-N 2.99Å; V260-L263 VanDerWaalsContact O-N 3.1Å; Q261-L263 PolarHBondContact O-N 2.91Å
264	Y	94.3	Very high	81.9	Confident	29 Å²	29	73.5 Å²	73.5	11%	0.114	41%	0.412	C	S	.	.	H	α-helix	trans	-113.9	-13.5	-167.4	-63.5	-75.8	0	0	0	114.7	K110 W111 I147 P148 L149 L226 V260	K110-Y264 HydrophobicContact CB-CE1 4.03Å; W111-Y264 HydrophobicContact CB-CE1 4.2Å; W111-Y264 PolarHBondContact N-OH 3.12Å; W111-Y264 VanDerWaalsContact N-OH 3.17Å; I147-Y264 HydrophobicContact CD1-CD2 3.97Å; I147-Y264 HydrophobicContact CD1-CG 4.26Å; P148-Y264 WeakPolarHBondContact CD-O 3.42Å; P148-Y264 WeakPolarHBondContact CG-O 3.46Å; L149-Y264 HydrophobicContact CD1-CD1 3.75Å; L149-Y264 HydrophobicContact CD1-CD2 4.46Å; L149-Y264 HydrophobicContact CD1-CE1 3.51Å; L149-Y264 HydrophobicContact CD1-CE2 4.27Å; L149-Y264 HydrophobicContact CD1-CG 4.2Å; L149-Y264 HydrophobicContact CD2-CD1 4.16Å; L149-Y264 HydrophobicContact CD2-CE1 4.31Å; L149-Y264 HydrophobicContact CG-CD1 3.93Å; L149-Y264 HydrophobicContact CG-CE1 4.16Å; L149-Y264 HydrophobicContact CG-CG 4.36Å; L226-Y264 HydrophobicContact CB-CE2 4.09Å; L226-Y264 HydrophobicContact CD2-CE2 4.32Å; L226-Y264 VanDerWaalsContact O-CE2 3.25Å; L226-Y264 WeakPolarHBondContact O-CE2 3.39Å; L226-Y264 PolarHBondContact O-OH 3.48Å; V260-Y264 HydrophobicContact CG2-CD2 3.78Å; V260-Y264 HydrophobicContact CG2-CE2 4.11Å; V260-Y264 WeakPolarHBondContact O-CD2 3.31Å; V260-Y264 PolarHBondContact O-N 2.91Å
265	G	93.1	Very high	79.7	Confident	32 Å²	32	77 Å²	77	33%	0.33	43%	0.425	S	S	.	.			trans	79.8	-179.2	-170	0	0	0	0	0	113	P148 Q261	P148-G265 VanDerWaalsContact CD-O 3.28Å; P148-G265 WeakPolarHBondContact CD-O 3.37Å; Q261-G265 WeakPolarHBondContact O-CA 3.39Å; Q261-G265 PolarHBondContact O-N 2.97Å
266	V	94.1	Very high	77.7	Confident	62 Å²	62	79.5 Å²	79.5	38%	0.376	45%	0.445	S	S	.	.			trans	-92.4	138.8	179.6	-174.7	0	0	0	0	109.7	Q261 S268	Q261-V266 HydrophobicContact CG-CG2 4.31Å; V266-S268 PolarHBondContact O-N 3.46Å
267	R	90.8	Very high	75.5	Confident	48 Å²	48	87.9 Å²	87.9	18%	0.181	48%	0.484	C	S	.	.			trans	-63	123.9	171.3	-179.6	174.6	-74	-126.4	1.8	110.4	S144 I146 I147 L149 D150 D269 I270	S144-R267 PolarHBondContact O-NE 3.35Å; S144-R267 PolarHBondContact O-NH2 3.01Å; I146-R267 PolarHBondContact O-N 2.79Å; I147-R267 PolarHBondContact O-NE 3.34Å; I147-R267 PolarHBondContact O-NH2 3.13Å; L149-R267 PolarHBondContact O-NH2 3.05Å; D150-R267 IonicContact OD1-CZ 3.48Å; D150-R267 IonicContact OD1-NH1 3.24Å; D150-R267 PolarHBondContact OD1-NH1 2.91Å; D150-R267 IonicContact OD1-NH2 2.66Å; D150-R267 PolarHBondContact OD1-NH2 3.47Å; R267-D269 HydrophobicContact CG-CB 4.37Å; R267-D269 PolarHBondContact O-N 3.05Å; R267-D269 VanDerWaalsContact O-N 3.12Å; R267-I270 HydrophobicContact CB-CD1 3.94Å; R267-I270 HydrophobicContact CB-CG1 4.25Å; R267-I270 WeakPolarHBondContact O-CB 3.28Å; R267-I270 PolarHBondContact O-N 3.08Å
268	S	75.8	Confident	73.3	Confident	87 Å²	87	90 Å²	90	61%	0.608	51%	0.507	S	S	*	.	G	3₁₀ helix	trans	-58.4	-27.3	-174.7	-55.3	0	0	0	0	114.6	V266 I270 L271	V266-S268 PolarHBondContact O-N 3.46Å; S268-I270 PolarHBondContact O-N 3.05Å; S268-L271 WeakPolarHBondContact O-CB 3.45Å; S268-L271 PolarHBondContact O-N 3.47Å; S268-L271 VanDerWaalsContact O-N 3.15Å
269	D	66.7	Low	71.1	Confident	146 Å²	146	90.9 Å²	90.9	78%	0.781	52%	0.521	S	S	*	.	G	3₁₀ helix	trans	-69.8	-12.9	179.5	-61.3	-29	0	0	0	113.4	R267	R267-D269 HydrophobicContact CG-CB 4.37Å; R267-D269 PolarHBondContact O-N 3.05Å; R267-D269 VanDerWaalsContact O-N 3.12Å
270	I	61	Low	69.1	Low	87 Å²	87	94.8 Å²	94.8	45%	0.446	54%	0.544	S	S	.	.	G	3₁₀ helix	trans	-92.1	-20.7	175.8	-49.7	171.3	0	0	0	111.2	D145 I146 R267 S268	D145-I270 WeakPolarHBondContact O-CD1 3.3Å; I146-I270 HydrophobicContact CB-CD1 4.49Å; R267-I270 HydrophobicContact CB-CD1 3.94Å; R267-I270 HydrophobicContact CB-CG1 4.25Å; R267-I270 WeakPolarHBondContact O-CB 3.28Å; R267-I270 PolarHBondContact O-N 3.08Å; S268-I270 PolarHBondContact O-N 3.05Å
271	L	49.9	Very low	67.4	Low	102 Å²	102	97.2 Å²	97.2	53%	0.534	57%	0.569	S	S	.	*	S	Bend	trans	-67.8	129.3	174.4	-65.7	174.8	0	0	0	108.1	S268 K273	S268-L271 WeakPolarHBondContact O-CB 3.45Å; S268-L271 PolarHBondContact O-N 3.47Å; S268-L271 VanDerWaalsContact O-N 3.15Å; L271-K273 PolarHBondContact O-N 2.86Å
272	P	49.1	Very low	65.8	Low	119 Å²	119	100.8 Å²	100.8	77%	0.773	60%	0.596	S	S	*	*	P	Polyproline II helix	trans	-50.5	121.9	165.9	-20.4	29.8	0	0	0	107.1	P274	P272-P274 VanDerWaalsContact O-N 3.16Å
273	K	49.2	Very low	64.3	Low	187 Å²	187	103.7 Å²	103.7	81%	0.813	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-46.8	130.7	169.8	-81.6	178.3	179.9	170.5	0	106.5	L271 Q275	L271-K273 PolarHBondContact O-N 2.86Å; K273-Q275 PolarHBondContact O-N 2.96Å
274	P	47.1	Very low	63.1	Low	125 Å²	125	107 Å²	107	81%	0.812	63%	0.626	S	S	*	*			trans	-49.6	111.7	171.4	-21.8	30	0	0	0	106.3	P272	P272-P274 VanDerWaalsContact O-N 3.16Å
275	Q	49.5	Very low	62.4	Low	173 Å²	173	110.3 Å²	110.3	81%	0.808	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-56.6	132.9	167.7	-86.4	179.2	-24.7	0	0	104.7	K273 E277	K273-Q275 PolarHBondContact O-N 2.96Å; Q275-E277 PolarHBondContact O-N 2.69Å
276	P	51.7	Low	61.6	Low	118 Å²	118	119.5 Å²	119.5	77%	0.766	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-50.7	122.9	169.6	21	-29.7	0	0	0	106.3	P278	P276-P278 VanDerWaalsContact O-N 3.13Å
277	E	51.1	Low	60.9	Low	179 Å²	179	121.8 Å²	121.8	84%	0.836	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-47.3	127.8	175.7	-77.3	-170.6	157.8	0	0	107.1	Q275 T279	Q275-E277 PolarHBondContact O-N 2.69Å; E277-T279 PolarHBondContact O-N 2.61Å
278	P	50.5	Low	60.5	Low	116 Å²	116	123.3 Å²	123.3	75%	0.753	70%	0.7	S	S	*	*	P	Polyproline II helix	trans	-50.3	123.1	168.1	-19.3	28.8	0	0	0	105.7	P276 S280	P276-P278 VanDerWaalsContact O-N 3.13Å; P278-S280 VanDerWaalsContact C-N 3.26Å; P278-S280 PolarHBondContact O-N 3.28Å
279	T	49.2	Very low	60.8	Low	141 Å²	141	130.9 Å²	130.9	87%	0.865	72%	0.715	S	S	*	*			trans	-57.5	100.9	175.8	-43.9	0	0	0	0	105.5	E277 G281	E277-T279 PolarHBondContact O-N 2.61Å; T279-G281 VanDerWaalsContact C-N 3.35Å; T279-G281 PolarHBondContact O-N 3.43Å
280	S	51.3	Low	61.6	Low	110 Å²	110	130.3 Å²	130.3	77%	0.769	71%	0.712	S	S	*	*			trans	-61.2	107.1	179.3	54.3	0	0	0	0	105	P278	P278-S280 VanDerWaalsContact C-N 3.26Å; P278-S280 PolarHBondContact O-N 3.28Å
281	G	60.1	Low	62.6	Low	51 Å²	51	128 Å²	128	53%	0.526	70%	0.701	S	S	.	*	P	Polyproline II helix	trans	-52.1	159.7	168.7	0	0	0	0	0	109.2	T279	T279-G281 VanDerWaalsContact C-N 3.35Å; T279-G281 PolarHBondContact O-N 3.43Å
282	P	62.6	Low	64.4	Low	120 Å²	120	128.2 Å²	128.2	78%	0.779	71%	0.706	S	S	*	*	S	Bend	trans	-48.9	141.3	176.3	20.3	-31.1	0	0	0	110	L284	P282-L284 PolarHBondContact O-N 3.3Å
283	P	61.6	Low	66.1	Low	127 Å²	127	126.7 Å²	126.7	83%	0.825	69%	0.687	S	S	*	*	P	Polyproline II helix	trans	-48.5	129.7	-178.2	-26.2	32	0	0	0	111.1	D285	P283-D285 PolarHBondContact O-N 2.92Å
284	L	65.8	Low	67.9	Low	87 Å²	87	122.6 Å²	122.6	46%	0.455	67%	0.674	S	S	.	*			trans	-52.9	113.9	177.8	-89	149.1	0	0	0	110.5	P282 R286 L291 K307	P282-L284 PolarHBondContact O-N 3.3Å; L284-R286 PolarHBondContact O-N 3.1Å; L284-R286 VanDerWaalsContact O-N 3.13Å; L284-L291 HydrophobicContact CD2-CD1 3.57Å; L284-K307 HydrophobicContact CD1-CB 4.03Å; L284-K307 HydrophobicContact CD1-CG 3.85Å; L284-K307 HydrophobicContact CD2-CB 4.48Å; L284-K307 HydrophobicContact CD2-CG 3.68Å; L284-K307 HydrophobicContact CG-CG 4.44Å
285	D	80.2	Confident	69.8	Low	99 Å²	99	119 Å²	119	53%	0.529	66%	0.655	S	S	.	*			trans	-71.9	104.8	171	-179.7	4.7	0	0	0	109.2	P283 C287 N288	P283-D285 PolarHBondContact O-N 2.92Å; D285-C287 PolarHBondContact O-N 3.01Å; D285-C287 VanDerWaalsContact O-N 3.12Å; D285-C287 PolarHBondContact OD1-N 2.99Å; D285-N288 HydrophobicContact CB-CB 4.26Å; D285-N288 WeakPolarHBondContact O-CB 3.2Å; D285-N288 PolarHBondContact O-N 3.36Å; D285-N288 VanDerWaalsContact O-N 3.12Å
286	R	77.3	Confident	71.8	Confident	226 Å²	226	114.3 Å²	114.3	85%	0.853	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-16.9	179.8	-61.9	-178.1	-178.8	-176.1	-0.3	113.5	L284	L284-R286 PolarHBondContact O-N 3.1Å; L284-R286 VanDerWaalsContact O-N 3.13Å
287	C	79.3	Confident	73.7	Confident	110 Å²	110	111.8 Å²	111.8	74%	0.743	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.6	2.6	-179.5	-62.2	0	0	0	0	113	D285 R289	D285-C287 PolarHBondContact O-N 3.01Å; D285-C287 VanDerWaalsContact O-N 3.12Å; D285-C287 PolarHBondContact OD1-N 2.99Å; C287-R289 PolarHBondContact O-N 2.84Å
288	N	81.4	Confident	75.6	Confident	80 Å²	80	107.5 Å²	107.5	43%	0.428	61%	0.606	S	S	.	*			trans	-64.2	123.8	175.1	-175	-5.5	0	0	0	110.1	D285 D290 L291	D285-N288 HydrophobicContact CB-CB 4.26Å; D285-N288 WeakPolarHBondContact O-CB 3.2Å; D285-N288 PolarHBondContact O-N 3.36Å; D285-N288 VanDerWaalsContact O-N 3.12Å; N288-D290 PolarHBondContact O-N 2.86Å; N288-D290 PolarHBondContact OD1-N 2.91Å; N288-L291 HydrophobicContact CB-CB 4.35Å; N288-L291 WeakPolarHBondContact O-CB 3.24Å; N288-L291 PolarHBondContact O-N 2.88Å; N288-L291 VanDerWaalsContact O-N 3.13Å
289	R	81.8	Confident	77.4	Confident	245 Å²	245	106.9 Å²	106.9	93%	0.925	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-18.7	179.9	-67	-174.1	68.4	172	1.1	113.2	C287	C287-R289 PolarHBondContact O-N 2.84Å
290	D	84.1	Confident	79.3	Confident	135 Å²	135	104.1 Å²	104.1	72%	0.722	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	8.6	177.8	-56.6	-35.4	0	0	0	112.2	N288 V292	N288-D290 PolarHBondContact O-N 2.86Å; N288-D290 PolarHBondContact OD1-N 2.91Å; D290-V292 PolarHBondContact O-N 2.92Å
291	L	82.7	Confident	81	Confident	39 Å²	39	102.4 Å²	102.4	20%	0.204	60%	0.595	C	S	.	*			trans	-67.3	117.9	178.5	-177.2	60.9	0	0	0	110.9	L284 N288 F293 K307	L284-L291 HydrophobicContact CD2-CD1 3.57Å; N288-L291 HydrophobicContact CB-CB 4.35Å; N288-L291 WeakPolarHBondContact O-CB 3.24Å; N288-L291 PolarHBondContact O-N 2.88Å; N288-L291 VanDerWaalsContact O-N 3.13Å; L291-F293 HydrophobicContact CD2-CE1 3.64Å; L291-F293 HydrophobicContact CD2-CE2 4.49Å; L291-F293 HydrophobicContact CD2-CZ 3.56Å; L291-F293 HydrophobicContact CG-CE1 3.98Å; L291-F293 HydrophobicContact CG-CZ 3.97Å; L291-K307 HydrophobicContact CD1-CG 4.44Å
292	V	86.1	Confident	82.1	Confident	105 Å²	105	107 Å²	107	64%	0.636	60%	0.601	S	S	*	*			trans	-109	132.8	173.8	-176.4	0	0	0	0	108.6	D290 K307	D290-V292 PolarHBondContact O-N 2.92Å; V292-K307 WeakPolarHBondContact O-CD 3.28Å; V292-K307 VanDerWaalsContact O-CE 3.29Å; V292-K307 WeakPolarHBondContact O-CE 3.21Å
293	F	85.5	Confident	83.5	Confident	87 Å²	87	106.1 Å²	106.1	38%	0.382	59%	0.589	S	S	.	*			trans	-96.2	143.5	177.9	-58.3	-72.6	0	0	0	111	L291 V296 F305 K307	L291-F293 HydrophobicContact CD2-CE1 3.64Å; L291-F293 HydrophobicContact CD2-CE2 4.49Å; L291-F293 HydrophobicContact CD2-CZ 3.56Å; L291-F293 HydrophobicContact CG-CE1 3.98Å; L291-F293 HydrophobicContact CG-CZ 3.97Å; F293-V296 HydrophobicContact CB-CG2 4.21Å; F293-F305 HydrophobicContact CD1-CB 3.6Å; F293-F305 HydrophobicContact CD1-CD1 4.26Å; F293-F305 HydrophobicContact CD1-CG 4.35Å; F293-F305 AromaticContact CD2-CD1 3.64Å; F293-F305 HydrophobicContact CD2-CD1 3.64Å; F293-F305 HydrophobicContact CD2-CE1 4.34Å; F293-F305 HydrophobicContact CD2-CG 4.48Å; F293-F305 HydrophobicContact CE1-CB 3.64Å; F293-F305 HydrophobicContact CE1-CD1 4.24Å; F293-F305 HydrophobicContact CE1-CG 4.19Å; F293-F305 AromaticContact CE2-CD1 3.63Å; F293-F305 HydrophobicContact CE2-CD1 3.63Å; F293-F305 HydrophobicContact CE2-CE1 4.15Å; F293-F305 HydrophobicContact CE2-CG 4.33Å; F293-F305 HydrophobicContact CG-CB 4.05Å; F293-F305 AromaticContact CG-CD1 3.95Å; F293-F305 HydrophobicContact CG-CD1 3.95Å; F293-F305 HydrophobicContact CG-CG 4.48Å; F293-F305 HydrophobicContact CZ-CB 4.14Å; F293-F305 AromaticContact CZ-CD1 3.94Å; F293-F305 HydrophobicContact CZ-CD1 3.94Å; F293-F305 HydrophobicContact CZ-CG 4.18Å; F293-K307 HydrophobicContact CD1-CB 4.49Å
294	D	87	Confident	84.8	Confident	102 Å²	102	104.2 Å²	104.2	55%	0.545	57%	0.568	S	S	.	*	S	Bend	trans	-79.8	-33.8	178	-55.5	-40.1	0	0	0	110.9	F306 K307 D308	D294-F306 PolarHBondContact N-O 3.06Å; D294-K307 IonicContact OD1-NZ 3.48Å; D294-K307 PolarHBondContact OD1-NZ 3.36Å; D294-K307 WeakPolarHBondContact OD2-CA 3.31Å; D294-K307 WeakPolarHBondContact OD2-CD 3.36Å; D294-K307 IonicContact OD2-NZ 3.8Å; D294-D308 PolarHBondContact OD2-N 3.37Å
295	A	87.9	Confident	85.8	Confident	48 Å²	48	105.2 Å²	105.2	40%	0.397	57%	0.568	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-149.9	154.7	175.3	0	0	0	0	0	112.5	F306	A295-F306 HydrophobicContact CB-CB 4.25Å; A295-F306 HydrophobicContact CB-CD2 4.17Å; A295-F306 PolarHBondContact N-O 3.27Å; A295-F306 PolarHBondContact O-N 3.31Å
296	V	90.7	Very high	86	Confident	76 Å²	76	105 Å²	105	46%	0.461	56%	0.563	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-137.6	132.3	172.7	-175.5	0	0	0	0	108.9	F293 L303 F304 F305	F293-V296 HydrophobicContact CB-CG2 4.21Å; V296-L303 HydrophobicContact CG1-CD1 3.82Å; V296-L303 HydrophobicContact CG1-CD2 4.41Å; V296-L303 HydrophobicContact CG1-CG 4.01Å; V296-F304 CarbonylContact C-O 3.59Å; V296-F304 VanDerWaalsContact CA-O 3.3Å; V296-F304 WeakPolarHBondContact CA-O 3.41Å; V296-F304 WeakPolarHBondContact CG1-O 3.37Å; V296-F305 HydrophobicContact CB-CD1 4.38Å; V296-F305 HydrophobicContact CG1-CD1 3.96Å; V296-F305 HydrophobicContact CG1-CE1 3.95Å; V296-F305 HydrophobicContact CG1-CG 4.48Å; V296-F305 HydrophobicContact CG1-CZ 4.48Å; V296-F305 HydrophobicContact CG2-CD1 3.52Å; V296-F305 HydrophobicContact CG2-CE1 4.01Å; V296-F305 HydrophobicContact CG2-CG 4.36Å
297	T	91.6	Very high	86	Confident	65 Å²	65	97.8 Å²	97.8	40%	0.399	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	163.8	177.9	-162.8	0	0	0	0	112.8	I299 F304 F306	T297-I299 HydrophobicContact CG2-CD1 4.02Å; T297-I299 HydrophobicContact CG2-CG1 3.93Å; T297-F304 HydrophobicContact CG2-CB 4.47Å; T297-F304 PolarHBondContact N-O 3.4Å; T297-F304 PolarHBondContact O-N 2.97Å; T297-F306 HydrophobicContact CG2-CE2 3.69Å; T297-F306 HydrophobicContact CG2-CZ 4.2Å
298	T	91.4	Very high	85.6	Confident	88 Å²	88	97.6 Å²	97.6	54%	0.54	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	123.6	175.7	-55.4	0	0	0	0	110	K302 L303	T298-K302 CarbonylContact C-O 3.55Å; T298-K302 VanDerWaalsContact CA-O 3.28Å; T298-K302 WeakPolarHBondContact CA-O 3.29Å; T298-L303 WeakPolarHBondContact OG1-CD1 3.3Å
299	I	88.8	Confident	84.2	Confident	103 Å²	103	100.9 Å²	100.9	53%	0.528	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-127.1	121.6	177.4	-51.5	176.2	0	0	0	108.1	T297 G301 K302 F304	T297-I299 HydrophobicContact CG2-CD1 4.02Å; T297-I299 HydrophobicContact CG2-CG1 3.93Å; I299-G301 VanDerWaalsContact C-N 3.25Å; I299-G301 PolarHBondContact O-N 3.12Å; I299-K302 PolarHBondContact N-O 3.35Å; I299-K302 PolarHBondContact O-N 3.16Å; I299-K302 VanDerWaalsContact O-N 3.08Å; I299-F304 HydrophobicContact CB-CD2 4.08Å; I299-F304 HydrophobicContact CB-CE2 3.82Å; I299-F304 HydrophobicContact CD1-CD2 4.39Å; I299-F304 HydrophobicContact CG1-CD2 4.19Å; I299-F304 HydrophobicContact CG1-CE2 4.4Å
300	G	87.8	Confident	84.3	Confident	83 Å²	83	93.7 Å²	93.7	86%	0.856	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	58.6	34.2	-179.8	0	0	0	0	0	114	K302	G300-K302 VanDerWaalsContact C-N 3.27Å; G300-K302 PolarHBondContact O-N 3.37Å
301	G	87.1	Confident	84.3	Confident	74 Å²	74	91.5 Å²	91.5	76%	0.763	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	76.5	5.6	-178.3	0	0	0	0	0	115.2	I299	I299-G301 VanDerWaalsContact C-N 3.25Å; I299-G301 PolarHBondContact O-N 3.12Å
302	K	83.4	Confident	84.4	Confident	149 Å²	149	94.4 Å²	94.4	65%	0.648	58%	0.577	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.7	139.4	174.1	-64.8	-179.4	-178.5	178.1	0	110.5	T298 I299 G300 F304	T298-K302 CarbonylContact C-O 3.55Å; T298-K302 VanDerWaalsContact CA-O 3.28Å; T298-K302 WeakPolarHBondContact CA-O 3.29Å; I299-K302 PolarHBondContact N-O 3.35Å; I299-K302 PolarHBondContact O-N 3.16Å; I299-K302 VanDerWaalsContact O-N 3.08Å; G300-K302 VanDerWaalsContact C-N 3.27Å; G300-K302 PolarHBondContact O-N 3.37Å; K302-F304 HydrophobicContact CB-CD2 4.47Å; K302-F304 HydrophobicContact CB-CE2 3.74Å; K302-F304 HydrophobicContact CB-CZ 4.27Å; K302-F304 VanDerWaalsContact O-CD2 3.27Å; K302-F304 WeakPolarHBondContact O-CD2 3.44Å; K302-F304 WeakPolarHBondContact O-CE2 3.49Å
303	L	91.5	Very high	84.3	Confident	100 Å²	100	93.8 Å²	93.8	52%	0.524	57%	0.573	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-88.9	128.9	179.2	-164	70.4	0	0	0	110.1	V296 T298 F305	V296-L303 HydrophobicContact CG1-CD1 3.82Å; V296-L303 HydrophobicContact CG1-CD2 4.41Å; V296-L303 HydrophobicContact CG1-CG 4.01Å; T298-L303 WeakPolarHBondContact OG1-CD1 3.3Å; L303-F305 HydrophobicContact CB-CE2 4.49Å; L303-F305 HydrophobicContact CD2-CE1 4.31Å; L303-F305 HydrophobicContact CD2-CE2 3.77Å; L303-F305 HydrophobicContact CD2-CZ 3.43Å; L303-F305 VanDerWaalsContact CD2-CZ 3.43Å; L303-F305 HydrophobicContact CG-CE2 3.99Å; L303-F305 HydrophobicContact CG-CZ 4.05Å
304	F	88.8	Confident	84.3	Confident	87 Å²	87	94.3 Å²	94.3	38%	0.382	59%	0.585	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.8	138	-180	-67.7	-96.5	0	0	0	109.9	V296 T297 I299 K302 F306	V296-F304 CarbonylContact C-O 3.59Å; V296-F304 VanDerWaalsContact CA-O 3.3Å; V296-F304 WeakPolarHBondContact CA-O 3.41Å; V296-F304 WeakPolarHBondContact CG1-O 3.37Å; T297-F304 HydrophobicContact CG2-CB 4.47Å; T297-F304 PolarHBondContact N-O 3.4Å; T297-F304 PolarHBondContact O-N 2.97Å; I299-F304 HydrophobicContact CB-CD2 4.08Å; I299-F304 HydrophobicContact CB-CE2 3.82Å; I299-F304 HydrophobicContact CD1-CD2 4.39Å; I299-F304 HydrophobicContact CG1-CD2 4.19Å; I299-F304 HydrophobicContact CG1-CE2 4.4Å; K302-F304 HydrophobicContact CB-CD2 4.47Å; K302-F304 HydrophobicContact CB-CE2 3.74Å; K302-F304 HydrophobicContact CB-CZ 4.27Å; K302-F304 VanDerWaalsContact O-CD2 3.27Å; K302-F304 WeakPolarHBondContact O-CD2 3.44Å; K302-F304 WeakPolarHBondContact O-CE2 3.49Å; F304-F306 HydrophobicContact CB-CE2 3.76Å; F304-F306 HydrophobicContact CB-CZ 3.9Å
305	F	88.1	Confident	84.1	Confident	108 Å²	108	93.7 Å²	93.7	47%	0.474	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.7	134	178.3	-58	-100	0	0	0	108.7	F293 V296 L303	F293-F305 HydrophobicContact CD1-CB 3.6Å; F293-F305 HydrophobicContact CD1-CD1 4.26Å; F293-F305 HydrophobicContact CD1-CG 4.35Å; F293-F305 AromaticContact CD2-CD1 3.64Å; F293-F305 HydrophobicContact CD2-CD1 3.64Å; F293-F305 HydrophobicContact CD2-CE1 4.34Å; F293-F305 HydrophobicContact CD2-CG 4.48Å; F293-F305 HydrophobicContact CE1-CB 3.64Å; F293-F305 HydrophobicContact CE1-CD1 4.24Å; F293-F305 HydrophobicContact CE1-CG 4.19Å; F293-F305 AromaticContact CE2-CD1 3.63Å; F293-F305 HydrophobicContact CE2-CD1 3.63Å; F293-F305 HydrophobicContact CE2-CE1 4.15Å; F293-F305 HydrophobicContact CE2-CG 4.33Å; F293-F305 HydrophobicContact CG-CB 4.05Å; F293-F305 AromaticContact CG-CD1 3.95Å; F293-F305 HydrophobicContact CG-CD1 3.95Å; F293-F305 HydrophobicContact CG-CG 4.48Å; F293-F305 HydrophobicContact CZ-CB 4.14Å; F293-F305 AromaticContact CZ-CD1 3.94Å; F293-F305 HydrophobicContact CZ-CD1 3.94Å; F293-F305 HydrophobicContact CZ-CG 4.18Å; V296-F305 HydrophobicContact CB-CD1 4.38Å; V296-F305 HydrophobicContact CG1-CD1 3.96Å; V296-F305 HydrophobicContact CG1-CE1 3.95Å; V296-F305 HydrophobicContact CG1-CG 4.48Å; V296-F305 HydrophobicContact CG1-CZ 4.48Å; V296-F305 HydrophobicContact CG2-CD1 3.52Å; V296-F305 HydrophobicContact CG2-CE1 4.01Å; V296-F305 HydrophobicContact CG2-CG 4.36Å; L303-F305 HydrophobicContact CB-CE2 4.49Å; L303-F305 HydrophobicContact CD2-CE1 4.31Å; L303-F305 HydrophobicContact CD2-CE2 3.77Å; L303-F305 HydrophobicContact CD2-CZ 3.43Å; L303-F305 VanDerWaalsContact CD2-CZ 3.43Å; L303-F305 HydrophobicContact CG-CE2 3.99Å; L303-F305 HydrophobicContact CG-CZ 4.05Å
306	F	83.8	Confident	83.8	Confident	96 Å²	96	97 Å²	97	42%	0.421	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-118.6	136.9	-176.2	-57.8	-94.8	0	0	0	110.1	D294 A295 T297 F304	D294-F306 PolarHBondContact N-O 3.06Å; A295-F306 HydrophobicContact CB-CB 4.25Å; A295-F306 HydrophobicContact CB-CD2 4.17Å; A295-F306 PolarHBondContact N-O 3.27Å; A295-F306 PolarHBondContact O-N 3.31Å; T297-F306 HydrophobicContact CG2-CE2 3.69Å; T297-F306 HydrophobicContact CG2-CZ 4.2Å; F304-F306 HydrophobicContact CB-CE2 3.76Å; F304-F306 HydrophobicContact CB-CZ 3.9Å
307	K	77.9	Confident	83.3	Confident	73 Å²	73	98.6 Å²	98.6	32%	0.317	61%	0.612	S	S	.	*			trans	-147.7	130.4	178	-176.4	49.9	177.1	134.2	0	109.9	L284 L291 V292 F293 D294	L284-K307 HydrophobicContact CD1-CB 4.03Å; L284-K307 HydrophobicContact CD1-CG 3.85Å; L284-K307 HydrophobicContact CD2-CB 4.48Å; L284-K307 HydrophobicContact CD2-CG 3.68Å; L284-K307 HydrophobicContact CG-CG 4.44Å; L291-K307 HydrophobicContact CD1-CG 4.44Å; V292-K307 WeakPolarHBondContact O-CD 3.28Å; V292-K307 VanDerWaalsContact O-CE 3.29Å; V292-K307 WeakPolarHBondContact O-CE 3.21Å; F293-K307 HydrophobicContact CD1-CB 4.49Å; D294-K307 IonicContact OD1-NZ 3.48Å; D294-K307 PolarHBondContact OD1-NZ 3.36Å; D294-K307 WeakPolarHBondContact OD2-CA 3.31Å; D294-K307 WeakPolarHBondContact OD2-CD 3.36Å; D294-K307 IonicContact OD2-NZ 3.8Å
308	D	69.4	Low	82.6	Confident	107 Å²	107	101.4 Å²	101.4	57%	0.572	63%	0.63	S	S	*	*			trans	62.5	76.6	179.5	-52.1	-37.7	0	0	0	112.6	D294	D294-D308 PolarHBondContact OD2-N 3.37Å
309	G	53	Low	81.8	Confident	149 Å²	149	102.6 Å²	102.6	100%	1.536	64%	0.638	S	S	*	*			trans	-64.5	0	-177.7	0	0	0	0	0	115.9

Retrieved 309 of 309 residues in 1071.1 ms (Link to these results)

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