A0A077Z820_TRITR Loading...

non-specific serine/threonine protein kinase

AlphaFold DB , UniProt , Accession A0A077Z820, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 495 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	38.7	Very low	40.4	Very low	231 Å²	231	130.4 Å²	130.4	100%	1.138	81%	0.81	S	S	*	*				0	89.3	0	-70.6	176.2	173	0	0	105.7
2	T	38.3	Very low	40.8	Very low	116 Å²	116	128.7 Å²	128.7	71%	0.712	81%	0.806	S	S	*	*				81.7	96.9	112.7	47.9	0	0	0	0	110.4
3	E	35.4	Very low	40.3	Very low	197 Å²	197	130.1 Å²	130.1	92%	0.921	81%	0.814	S	S	*	*				69.5	133.2	90.5	-73.2	-178.8	178.1	0	0	111.4
4	G	40	Very low	40.5	Very low	76 Å²	76	127.1 Å²	127.1	78%	0.784	81%	0.808	S	S	*	*			cis	171.2	178.9	7.1	0	0	0	0	0	111.1
5	G	41.5	Very low	40.3	Very low	75 Å²	75	125.8 Å²	125.8	77%	0.773	80%	0.804	S	S	*	*			trans	68	145.3	157.5	0	0	0	0	0	118.5
6	D	42.4	Very low	40.2	Very low	152 Å²	152	125.6 Å²	125.6	81%	0.813	81%	0.806	S	S	*	*			cis	-159.8	147.8	18.9	-124.4	-24.9	0	0	0	114.2
7	C	40.8	Very low	40.3	Very low	109 Å²	109	126.4 Å²	126.4	74%	0.736	80%	0.802	S	S	*	*			trans	3.1	141.7	149.9	-57.5	0	0	0	0	120.1
8	S	43.4	Very low	40.3	Very low	102 Å²	102	123.7 Å²	123.7	71%	0.713	80%	0.803	S	S	*	*				174.5	156.1	63.2	38.8	0	0	0	0	112.8
9	N	42.2	Very low	40.4	Very low	154 Å²	154	129 Å²	129	82%	0.824	81%	0.805	S	S	*	*			trans	95.4	91.6	155.6	-65	-13.4	0	0	0	121.5
10	S	39.3	Very low	40.5	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	81%	0.809	S	S	*	*			trans	-47.2	177.7	154.5	51.6	0	0	0	0	116.8
11	P	41.9	Very low	40.7	Very low	114 Å²	114	129.3 Å²	129.3	74%	0.74	80%	0.803	S	S	*	*			cis	-144.2	176.5	16.6	37.5	-14.8	0	0	0	118.6
12	S	45.2	Very low	41.4	Very low	110 Å²	110	127.3 Å²	127.3	77%	0.769	79%	0.791	S	S	*	*			trans	94.2	105	150.2	75.1	0	0	0	0	118.7	A14	S12-A14 PolarHBondContact O-N 3.18Å
13	T	35.2	Very low	42.6	Very low	147 Å²	147	128.1 Å²	128.1	90%	0.902	80%	0.796	S	S	*	*			trans	-59.1	106.6	171.1	44.8	0	0	0	0	112.2
14	A	42.6	Very low	44	Very low	89 Å²	89	124.4 Å²	124.4	74%	0.736	79%	0.791	S	S	*	*			trans	-91.2	112.3	163	0	0	0	0	0	109.4	S12 C16	S12-A14 PolarHBondContact O-N 3.18Å; A14-C16 PolarHBondContact O-N 3.38Å; A14-C16 VanDerWaalsContact O-N 3.1Å
15	S	37.8	Very low	45.7	Very low	107 Å²	107	125.9 Å²	125.9	75%	0.748	78%	0.779	S	S	*	*			trans	-56.6	105.9	168.1	176.2	0	0	0	0	110.3	N17	S15-N17 PolarHBondContact O-N 3.22Å; S15-N17 VanDerWaalsContact O-N 3.16Å
16	C	38.2	Very low	47.6	Very low	123 Å²	123	125.1 Å²	125.1	83%	0.831	76%	0.762	S	S	*	*			trans	-81.5	88.8	168.3	-71.6	0	0	0	0	109	A14 G18	A14-C16 PolarHBondContact O-N 3.38Å; A14-C16 VanDerWaalsContact O-N 3.1Å; C16-G18 PolarHBondContact O-N 3.3Å
17	N	42.1	Very low	49.4	Very low	138 Å²	138	125.1 Å²	125.1	74%	0.738	75%	0.751	S	S	*	*			trans	-49.7	104.9	157.4	-88	-26.5	0	0	0	109	S15 R19	S15-N17 PolarHBondContact O-N 3.22Å; S15-N17 VanDerWaalsContact O-N 3.16Å; N17-R19 VanDerWaalsContact C-N 3.27Å; N17-R19 PolarHBondContact O-N 3.05Å
18	G	40.1	Very low	51.1	Low	79 Å²	79	127.3 Å²	127.3	81%	0.814	74%	0.744	S	S	*	*			trans	-63.3	85.6	172.2	0	0	0	0	0	110.4	C16 N20	C16-G18 PolarHBondContact O-N 3.3Å; G18-N20 PolarHBondContact O-N 2.92Å; G18-N20 VanDerWaalsContact O-N 3.1Å
19	R	42	Very low	53.1	Low	224 Å²	224	125.6 Å²	125.6	85%	0.845	73%	0.73	S	S	*	*			trans	-62	109.2	169.6	-77.2	178	174.9	170.1	-1.1	108.1	N17 S21	N17-R19 VanDerWaalsContact C-N 3.27Å; N17-R19 PolarHBondContact O-N 3.05Å; R19-S21 PolarHBondContact O-N 3.12Å
20	N	42.5	Very low	54.8	Low	166 Å²	166	123.4 Å²	123.4	89%	0.888	71%	0.713	S	S	*	*			trans	-57.2	82.6	159.6	-110.9	-13	0	0	0	108.5	G18 Q22	G18-N20 PolarHBondContact O-N 2.92Å; G18-N20 VanDerWaalsContact O-N 3.1Å; N20-Q22 VanDerWaalsContact C-N 3.28Å; N20-Q22 PolarHBondContact O-N 2.93Å
21	S	45.3	Very low	56.5	Low	98 Å²	98	122.1 Å²	122.1	69%	0.685	70%	0.695	S	S	*	*			trans	-76.2	85	172.6	-61.9	0	0	0	0	107.6	R19 V23	R19-S21 PolarHBondContact O-N 3.12Å; S21-V23 PolarHBondContact O-N 3.16Å
22	Q	54.1	Low	58.3	Low	190 Å²	190	122.2 Å²	122.2	89%	0.888	68%	0.684	S	S	*	*			trans	-51.2	112.5	161.7	-95.5	-177	-19.3	0	0	107.3	N20 S24	N20-Q22 VanDerWaalsContact C-N 3.28Å; N20-Q22 PolarHBondContact O-N 2.93Å; Q22-S24 VanDerWaalsContact C-N 3.34Å; Q22-S24 PolarHBondContact O-N 3.47Å
23	V	62.1	Low	60.1	Low	133 Å²	133	119.6 Å²	119.6	81%	0.806	67%	0.669	S	S	*	*			trans	-59.8	100.5	174.1	177.9	0	0	0	0	107.4	S21 M25	S21-V23 PolarHBondContact O-N 3.16Å; V23-M25 VanDerWaalsContact C-N 3.33Å; V23-M25 PolarHBondContact O-N 3.47Å
24	S	64.9	Low	62.1	Low	118 Å²	118	116.9 Å²	116.9	83%	0.825	65%	0.649	S	S	*	*			trans	-69.3	90.6	175.9	174.1	0	0	0	0	108.4	Q22 S26	Q22-S24 VanDerWaalsContact C-N 3.34Å; Q22-S24 PolarHBondContact O-N 3.47Å; S24-S26 PolarHBondContact O-N 2.92Å
25	M	76.1	Confident	63.6	Low	108 Å²	108	116.9 Å²	116.9	53%	0.532	63%	0.63	S	S	.	*			trans	-64.1	127.7	173.8	-69.2	-168.4	-66.8	0	0	109.8	V23 K30	V23-M25 VanDerWaalsContact C-N 3.33Å; V23-M25 PolarHBondContact O-N 3.47Å; M25-K30 HydrophobicContact CB-CG 4.19Å; M25-K30 HydrophobicContact CE-CG 4.33Å
26	S	82	Confident	65.6	Low	59 Å²	59	115 Å²	115	41%	0.413	61%	0.614	S	S	.	*			trans	-59.6	147.6	177.4	72.9	0	0	0	0	111.2	S24 Y28 T29 K30	S24-S26 PolarHBondContact O-N 2.92Å; S26-Y28 PolarHBondContact O-N 2.75Å; S26-T29 WeakPolarHBondContact O-CB 3.35Å; S26-T29 PolarHBondContact O-N 3.11Å; S26-T29 PolarHBondContact OG-N 3.39Å; S26-T29 PolarHBondContact OG-OG1 2.71Å; S26-K30 PolarHBondContact O-N 3.14Å; S26-K30 VanDerWaalsContact O-N 3.09Å
27	R	79.6	Confident	67.8	Low	152 Å²	152	114.8 Å²	114.8	57%	0.574	60%	0.596	S	S	*	*	H	α-helix	trans	-52.2	-45.2	176.2	-178.6	-179.3	179.1	177.8	5.5	111.7	T29 K30 E31 D466	R27-T29 VanDerWaalsContact C-N 3.3Å; R27-T29 PolarHBondContact O-N 3.47Å; R27-K30 PolarHBondContact O-N 3.2Å; R27-K30 VanDerWaalsContact O-N 3.13Å; R27-E31 HydrophobicContact CG-CG 4.5Å; R27-E31 WeakPolarHBondContact CG-OE1 3.25Å; R27-E31 IonicContact CZ-OE1 3.7Å; R27-E31 IonicContact NE-OE1 3.74Å; R27-E31 PolarHBondContact NE-OE1 2.72Å; R27-E31 WeakPolarHBondContact O-CG 3.41Å; R27-E31 PolarHBondContact O-N 2.8Å; R27-D466 IonicContact CZ-OD1 2.79Å; R27-D466 IonicContact CZ-OD2 2.79Å; R27-D466 IonicContact NH2-OD1 3.75Å; R27-D466 PolarHBondContact NH2-OD1 3.06Å; R27-D466 IonicContact NH2-OD2 2.93Å; R27-D466 PolarHBondContact NH2-OD2 3.41Å
28	Y	77.3	Confident	69.4	Low	154 Å²	154	111 Å²	111	60%	0.604	58%	0.575	S	S	*	*	H	α-helix	trans	-54.2	-42.9	174.3	176.6	-99.1	0	0	0	113	S26 E31 K32	S26-Y28 PolarHBondContact O-N 2.75Å; Y28-E31 PolarHBondContact O-N 3.19Å; Y28-K32 HydrophobicContact CE1-CD 4.16Å; Y28-K32 VanDerWaalsContact O-CB 3.28Å; Y28-K32 WeakPolarHBondContact O-CB 3.28Å; Y28-K32 PolarHBondContact O-N 3.09Å
29	T	83.8	Confident	71.2	Confident	66 Å²	66	110.9 Å²	110.9	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-67.5	-41.7	178.9	-54.5	0	0	0	0	111.3	S26 R27 K32 A33	S26-T29 WeakPolarHBondContact O-CB 3.35Å; S26-T29 PolarHBondContact O-N 3.11Å; S26-T29 PolarHBondContact OG-N 3.39Å; S26-T29 PolarHBondContact OG-OG1 2.71Å; R27-T29 VanDerWaalsContact C-N 3.3Å; R27-T29 PolarHBondContact O-N 3.47Å; T29-K32 PolarHBondContact O-N 2.6Å; T29-A33 WeakPolarHBondContact O-CB 3.5Å; T29-A33 PolarHBondContact O-N 3.18Å
30	K	79.2	Confident	73.3	Confident	109 Å²	109	104.6 Å²	104.6	47%	0.474	54%	0.538	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.1	-66.9	-178.9	-178.1	177.9	0	111.8	M25 S26 R27 A33 N34	M25-K30 HydrophobicContact CB-CG 4.19Å; M25-K30 HydrophobicContact CE-CG 4.33Å; S26-K30 PolarHBondContact O-N 3.14Å; S26-K30 VanDerWaalsContact O-N 3.09Å; R27-K30 PolarHBondContact O-N 3.2Å; R27-K30 VanDerWaalsContact O-N 3.13Å; K30-A33 PolarHBondContact O-N 3.49Å; K30-N34 WeakPolarHBondContact O-CB 3.22Å; K30-N34 PolarHBondContact O-N 3.14Å; K30-N34 PolarHBondContact O-ND2 3.39Å
31	E	75	Confident	75.1	Confident	80 Å²	80	100.7 Å²	100.7	37%	0.374	51%	0.514	S	S	.	.	H	α-helix	trans	-64.1	-45.2	176.3	-74.2	167.4	-172.4	0	0	111.6	R27 Y28 A33 N34 R35	R27-E31 HydrophobicContact CG-CG 4.5Å; R27-E31 WeakPolarHBondContact CG-OE1 3.25Å; R27-E31 IonicContact CZ-OE1 3.7Å; R27-E31 IonicContact NE-OE1 3.74Å; R27-E31 PolarHBondContact NE-OE1 2.72Å; R27-E31 WeakPolarHBondContact O-CG 3.41Å; R27-E31 PolarHBondContact O-N 2.8Å; Y28-E31 PolarHBondContact O-N 3.19Å; E31-A33 PolarHBondContact O-N 2.69Å; E31-N34 PolarHBondContact O-N 2.92Å; E31-R35 WeakPolarHBondContact O-CB 3.14Å; E31-R35 PolarHBondContact O-N 2.87Å
32	K	79.2	Confident	76.5	Confident	116 Å²	116	97.5 Å²	97.5	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-63.2	-39.6	176.4	-170.6	175.3	-178.4	178.1	0	112.3	Y28 T29 R35 T36	Y28-K32 HydrophobicContact CE1-CD 4.16Å; Y28-K32 VanDerWaalsContact O-CB 3.28Å; Y28-K32 WeakPolarHBondContact O-CB 3.28Å; Y28-K32 PolarHBondContact O-N 3.09Å; T29-K32 PolarHBondContact O-N 2.6Å; K32-R35 PolarHBondContact O-N 2.97Å; K32-T36 WeakPolarHBondContact O-CB 3.35Å; K32-T36 PolarHBondContact O-N 3.4Å; K32-T36 PolarHBondContact O-OG1 3.4Å
33	A	83.5	Confident	77.7	Confident	56 Å²	56	95.1 Å²	95.1	46%	0.463	48%	0.475	S	S	.	.	H	α-helix	trans	-64.4	-46.1	174.8	0	0	0	0	0	111.4	T29 K30 E31 R35 T36 R37	T29-A33 WeakPolarHBondContact O-CB 3.5Å; T29-A33 PolarHBondContact O-N 3.18Å; K30-A33 PolarHBondContact O-N 3.49Å; E31-A33 PolarHBondContact O-N 2.69Å; A33-R35 PolarHBondContact O-N 3.09Å; A33-T36 PolarHBondContact O-N 3.32Å; A33-R37 PolarHBondContact O-N 3.15Å
34	N	77.3	Confident	79	Confident	90 Å²	90	95.7 Å²	95.7	48%	0.481	46%	0.464	S	S	.	.	H	α-helix	trans	-61.1	-42.5	175.5	-77.9	-29.5	0	0	0	112.4	K30 E31 T36 R37 L38	K30-N34 WeakPolarHBondContact O-CB 3.22Å; K30-N34 PolarHBondContact O-N 3.14Å; K30-N34 PolarHBondContact O-ND2 3.39Å; E31-N34 PolarHBondContact O-N 2.92Å; N34-T36 VanDerWaalsContact C-N 3.33Å; N34-T36 PolarHBondContact O-N 3.08Å; N34-R37 PolarHBondContact O-N 3.3Å; N34-L38 WeakPolarHBondContact O-CG 3.42Å; N34-L38 PolarHBondContact O-N 3.15Å
35	R	73.5	Confident	79.7	Confident	89 Å²	89	95.2 Å²	95.2	34%	0.336	45%	0.452	S	S	.	.	H	α-helix	trans	-57.9	-46.2	172.7	173.5	173.3	-167.9	156.9	4.4	111.4	E31 K32 A33 L38 L39 D468 L471	E31-R35 WeakPolarHBondContact O-CB 3.14Å; E31-R35 PolarHBondContact O-N 2.87Å; K32-R35 PolarHBondContact O-N 2.97Å; A33-R35 PolarHBondContact O-N 3.09Å; R35-L38 PolarHBondContact O-N 3.15Å; R35-L39 HydrophobicContact CG-CD1 3.91Å; R35-L39 HydrophobicContact CG-CG 4.45Å; R35-L39 WeakPolarHBondContact O-CB 3.49Å; R35-L39 VanDerWaalsContact O-CG 3.28Å; R35-L39 WeakPolarHBondContact O-CG 3.23Å; R35-L39 PolarHBondContact O-N 3.33Å; R35-D468 IonicContact CZ-OD2 3.42Å; R35-D468 IonicContact NH1-OD2 3.75Å; R35-D468 PolarHBondContact NH1-OD2 3.12Å; R35-D468 IonicContact NH2-OD2 2.65Å; R35-L471 HydrophobicContact CB-CD2 3.94Å; R35-L471 HydrophobicContact CG-CD2 3.51Å
36	T	79.4	Confident	79.8	Confident	68 Å²	68	93.7 Å²	93.7	42%	0.417	45%	0.446	S	S	.	.	H	α-helix	trans	-63.4	-44	-180	-54.7	0	0	0	0	111.1	K32 A33 N34 L39 L40	K32-T36 WeakPolarHBondContact O-CB 3.35Å; K32-T36 PolarHBondContact O-N 3.4Å; K32-T36 PolarHBondContact O-OG1 3.4Å; A33-T36 PolarHBondContact O-N 3.32Å; N34-T36 VanDerWaalsContact C-N 3.33Å; N34-T36 PolarHBondContact O-N 3.08Å; T36-L39 PolarHBondContact O-N 3.07Å; T36-L40 HydrophobicContact CG2-CD1 4.22Å; T36-L40 WeakPolarHBondContact O-CG 3.49Å; T36-L40 PolarHBondContact O-N 3.03Å
37	R	85.4	Confident	79.9	Confident	117 Å²	117	94.8 Å²	94.8	44%	0.442	45%	0.447	S	S	.	.	H	α-helix	trans	-57	-51.7	174.9	-176.1	-171.8	65.6	80.5	5.1	111.6	A33 N34 L39 L40 E41	A33-R37 PolarHBondContact O-N 3.15Å; N34-R37 PolarHBondContact O-N 3.3Å; R37-L39 VanDerWaalsContact C-N 3.33Å; R37-L39 PolarHBondContact O-N 3.19Å; R37-L40 PolarHBondContact O-N 3.42Å; R37-E41 WeakPolarHBondContact CG-OE1 3.31Å; R37-E41 IonicContact CZ-OE1 2.82Å; R37-E41 IonicContact CZ-OE2 3.23Å; R37-E41 IonicContact NH1-OE1 3.84Å; R37-E41 PolarHBondContact NH1-OE1 3Å; R37-E41 IonicContact NH1-OE2 3.8Å; R37-E41 PolarHBondContact NH1-OE2 2.99Å; R37-E41 WeakPolarHBondContact O-CG 3.44Å; R37-E41 PolarHBondContact O-N 3.45Å
38	L	76.1	Confident	80.3	Confident	58 Å²	58	90.5 Å²	90.5	30%	0.304	44%	0.443	S	S	.	.	H	α-helix	trans	-60.6	-41.6	179.4	-71.4	171.8	0	0	0	112	N34 R35 L40 E41 V42 M474	N34-L38 WeakPolarHBondContact O-CG 3.42Å; N34-L38 PolarHBondContact O-N 3.15Å; R35-L38 PolarHBondContact O-N 3.15Å; L38-L40 VanDerWaalsContact C-N 3.34Å; L38-L40 PolarHBondContact O-N 3.29Å; L38-E41 PolarHBondContact O-N 3.17Å; L38-V42 WeakPolarHBondContact O-CB 3.28Å; L38-V42 VanDerWaalsContact O-CG2 3.29Å; L38-V42 WeakPolarHBondContact O-CG2 3.33Å; L38-V42 PolarHBondContact O-N 3.16Å; L38-M474 HydrophobicContact CB-CE 4.34Å; L38-M474 HydrophobicContact CD1-CE 4.45Å
39	L	77.5	Confident	80.6	Confident	78 Å²	78	86.8 Å²	86.8	41%	0.408	44%	0.437	S	S	.	.	H	α-helix	trans	-62.1	-40.4	176.4	-75.9	171.1	0	0	0	112.2	R35 T36 R37 Y43 M474	R35-L39 HydrophobicContact CG-CD1 3.91Å; R35-L39 HydrophobicContact CG-CG 4.45Å; R35-L39 WeakPolarHBondContact O-CB 3.49Å; R35-L39 VanDerWaalsContact O-CG 3.28Å; R35-L39 WeakPolarHBondContact O-CG 3.23Å; R35-L39 PolarHBondContact O-N 3.33Å; T36-L39 PolarHBondContact O-N 3.07Å; R37-L39 VanDerWaalsContact C-N 3.33Å; R37-L39 PolarHBondContact O-N 3.19Å; L39-Y43 WeakPolarHBondContact O-CB 3.32Å; L39-Y43 PolarHBondContact O-N 3.39Å; L39-M474 HydrophobicContact CD2-CG 4.2Å; L39-M474 HydrophobicContact CD2-SD 3.54Å; L39-M474 VanDerWaalsContact CD2-SD 3.54Å; L39-M474 HydrophobicContact CG-SD 3.88Å
40	L	85.3	Confident	80.5	Confident	91 Å²	91	85.5 Å²	85.5	48%	0.476	43%	0.426	S	S	.	.	H	α-helix	trans	-67.7	-44.2	177.3	-72.1	171.1	0	0	0	111.8	T36 R37 L38 Y43 Y44	T36-L40 HydrophobicContact CG2-CD1 4.22Å; T36-L40 WeakPolarHBondContact O-CG 3.49Å; T36-L40 PolarHBondContact O-N 3.03Å; R37-L40 PolarHBondContact O-N 3.42Å; L38-L40 VanDerWaalsContact C-N 3.34Å; L38-L40 PolarHBondContact O-N 3.29Å; L40-Y43 PolarHBondContact O-N 3.35Å; L40-Y44 HydrophobicContact CD2-CE2 4.4Å; L40-Y44 VanDerWaalsContact O-CD2 3.29Å; L40-Y44 WeakPolarHBondContact O-CD2 3.28Å; L40-Y44 PolarHBondContact O-N 2.79Å
41	E	79.8	Confident	81	Confident	84 Å²	84	86.6 Å²	86.6	39%	0.393	43%	0.431	S	S	.	.	H	α-helix	trans	-58.6	-50	176.5	-75.6	170.3	-173.8	0	0	111.3	R37 L38 Y43 Y44 N45	R37-E41 WeakPolarHBondContact CG-OE1 3.31Å; R37-E41 IonicContact CZ-OE1 2.82Å; R37-E41 IonicContact CZ-OE2 3.23Å; R37-E41 IonicContact NH1-OE1 3.84Å; R37-E41 PolarHBondContact NH1-OE1 3Å; R37-E41 IonicContact NH1-OE2 3.8Å; R37-E41 PolarHBondContact NH1-OE2 2.99Å; R37-E41 WeakPolarHBondContact O-CG 3.44Å; R37-E41 PolarHBondContact O-N 3.45Å; L38-E41 PolarHBondContact O-N 3.17Å; E41-Y43 VanDerWaalsContact C-N 3.32Å; E41-Y43 PolarHBondContact O-N 3.04Å; E41-Y44 PolarHBondContact O-N 3.43Å; E41-N45 VanDerWaalsContact O-CB 3.3Å; E41-N45 WeakPolarHBondContact O-CB 3.24Å; E41-N45 PolarHBondContact O-N 3.23Å; E41-N45 PolarHBondContact O-ND2 3.3Å
42	V	74.9	Confident	81.7	Confident	32 Å²	32	85.4 Å²	85.4	19%	0.194	44%	0.435	C	S	.	.	H	α-helix	trans	-59	-44.5	175.5	166.7	0	0	0	0	111.2	L38 N46 N475	L38-V42 WeakPolarHBondContact O-CB 3.28Å; L38-V42 VanDerWaalsContact O-CG2 3.29Å; L38-V42 WeakPolarHBondContact O-CG2 3.33Å; L38-V42 PolarHBondContact O-N 3.16Å; V42-N46 WeakPolarHBondContact CG1-ND2 3.47Å; V42-N46 WeakPolarHBondContact O-CB 3.33Å; V42-N46 PolarHBondContact O-N 3.2Å; V42-N46 PolarHBondContact O-ND2 3.28Å; V42-N475 WeakPolarHBondContact CG1-OD1 3.37Å; V42-N475 WeakPolarHBondContact CG2-ND2 3.37Å; V42-N475 WeakPolarHBondContact CG2-OD1 3.45Å
43	Y	80.9	Confident	82	Confident	139 Å²	139	83.8 Å²	83.8	55%	0.545	43%	0.429	S	S	.	.	H	α-helix	trans	-60.2	-50.4	-178.2	175.7	-95.6	0	0	0	111.8	L39 L40 E41 N46 L47	L39-Y43 WeakPolarHBondContact O-CB 3.32Å; L39-Y43 PolarHBondContact O-N 3.39Å; L40-Y43 PolarHBondContact O-N 3.35Å; E41-Y43 VanDerWaalsContact C-N 3.32Å; E41-Y43 PolarHBondContact O-N 3.04Å; Y43-N46 PolarHBondContact O-N 2.47Å; Y43-L47 HydrophobicContact CE1-CD2 4.46Å; Y43-L47 WeakPolarHBondContact O-CB 3.47Å; Y43-L47 PolarHBondContact O-N 3.39Å
44	Y	88	Confident	82.2	Confident	146 Å²	146	86.4 Å²	86.4	57%	0.573	43%	0.427	S	S	*	.	H	α-helix	trans	-71.6	-36.4	-178.6	-77.7	-69.4	0	0	0	112.7	L40 E41 L47 A48	L40-Y44 HydrophobicContact CD2-CE2 4.4Å; L40-Y44 VanDerWaalsContact O-CD2 3.29Å; L40-Y44 WeakPolarHBondContact O-CD2 3.28Å; L40-Y44 PolarHBondContact O-N 2.79Å; E41-Y44 PolarHBondContact O-N 3.43Å; Y44-L47 HydrophobicContact CD1-CD2 4.37Å; Y44-L47 PolarHBondContact O-N 2.87Å; Y44-A48 PolarHBondContact O-N 3.26Å
45	N	80.2	Confident	82.8	Confident	107 Å²	107	87.4 Å²	87.4	57%	0.572	43%	0.429	S	S	*	.	H	α-helix	trans	-61.4	-49.2	173	-74.3	-16.7	0	0	0	111.1	E41 L47 A48 T49	E41-N45 VanDerWaalsContact O-CB 3.3Å; E41-N45 WeakPolarHBondContact O-CB 3.24Å; E41-N45 PolarHBondContact O-N 3.23Å; E41-N45 PolarHBondContact O-ND2 3.3Å; N45-L47 VanDerWaalsContact C-N 3.29Å; N45-L47 PolarHBondContact O-N 3.17Å; N45-A48 WeakPolarHBondContact O-CB 3.43Å; N45-A48 PolarHBondContact O-N 3.48Å; N45-A48 VanDerWaalsContact O-N 3.16Å; N45-T49 PolarHBondContact O-N 3.26Å; N45-T49 PolarHBondContact O-OG1 2.92Å
46	N	77.9	Confident	83.7	Confident	76 Å²	76	89.1 Å²	89.1	41%	0.406	44%	0.439	S	S	.	.	H	α-helix	trans	-58.4	-42.5	176.3	-77.6	-21.9	0	0	0	111.6	V42 Y43 A48 T49 Q50	V42-N46 WeakPolarHBondContact CG1-ND2 3.47Å; V42-N46 WeakPolarHBondContact O-CB 3.33Å; V42-N46 PolarHBondContact O-N 3.2Å; V42-N46 PolarHBondContact O-ND2 3.28Å; Y43-N46 PolarHBondContact O-N 2.47Å; N46-A48 VanDerWaalsContact C-N 3.33Å; N46-A48 PolarHBondContact O-N 3.01Å; N46-T49 PolarHBondContact O-N 3.46Å; N46-Q50 WeakPolarHBondContact O-CB 3.31Å; N46-Q50 WeakPolarHBondContact O-CG 3.49Å; N46-Q50 PolarHBondContact O-N 2.92Å; N46-Q50 PolarHBondContact O-NE2 3.17Å; N46-Q50 PolarHBondContact O-OE1 3.48Å
47	L	85.3	Confident	84.2	Confident	83 Å²	83	88.3 Å²	88.3	44%	0.435	43%	0.428	S	S	.	.	H	α-helix	trans	-61.7	-40.8	178	-173.5	66.5	0	0	0	112	Y43 Y44 N45 K51	Y43-L47 HydrophobicContact CE1-CD2 4.46Å; Y43-L47 WeakPolarHBondContact O-CB 3.47Å; Y43-L47 PolarHBondContact O-N 3.39Å; Y44-L47 HydrophobicContact CD1-CD2 4.37Å; Y44-L47 PolarHBondContact O-N 2.87Å; N45-L47 VanDerWaalsContact C-N 3.29Å; N45-L47 PolarHBondContact O-N 3.17Å; L47-K51 PolarHBondContact O-N 3.12Å; L47-K51 VanDerWaalsContact O-N 3.13Å
48	A	87.7	Confident	84.4	Confident	61 Å²	61	86.3 Å²	86.3	50%	0.504	43%	0.426	S	S	.	.	H	α-helix	trans	-65.3	-49.2	176.2	0	0	0	0	0	111.8	Y44 N45 N46 Q50 K51 A52	Y44-A48 PolarHBondContact O-N 3.26Å; N45-A48 WeakPolarHBondContact O-CB 3.43Å; N45-A48 PolarHBondContact O-N 3.48Å; N45-A48 VanDerWaalsContact O-N 3.16Å; N46-A48 VanDerWaalsContact C-N 3.33Å; N46-A48 PolarHBondContact O-N 3.01Å; A48-Q50 VanDerWaalsContact C-N 3.3Å; A48-Q50 PolarHBondContact O-N 3.34Å; A48-K51 WeakPolarHBondContact O-CB 3.07Å; A48-K51 PolarHBondContact O-N 3.08Å; A48-A52 PolarHBondContact O-N 2.72Å
49	T	83.3	Confident	85.2	Confident	76 Å²	76	91 Å²	91	47%	0.466	44%	0.444	S	S	.	.	H	α-helix	trans	-56.6	-44.4	176.6	-55.1	0	0	0	0	111.4	N45 N46 K51 A52 E53	N45-T49 PolarHBondContact O-N 3.26Å; N45-T49 PolarHBondContact O-OG1 2.92Å; N46-T49 PolarHBondContact O-N 3.46Å; T49-K51 VanDerWaalsContact C-N 3.34Å; T49-K51 PolarHBondContact O-N 3.19Å; T49-A52 WeakPolarHBondContact O-CB 3.2Å; T49-A52 PolarHBondContact O-N 3.3Å; T49-E53 HydrophobicContact CG2-CG 4.33Å; T49-E53 WeakPolarHBondContact O-CG 3.17Å; T49-E53 PolarHBondContact O-N 3.01Å
50	Q	82.2	Confident	85.8	Confident	39 Å²	39	90.3 Å²	90.3	18%	0.182	44%	0.44	C	S	.	.	H	α-helix	trans	-65.2	-36.3	179.9	-72.8	146	25.3	0	0	113.6	N46 A48 R54	N46-Q50 WeakPolarHBondContact O-CB 3.31Å; N46-Q50 WeakPolarHBondContact O-CG 3.49Å; N46-Q50 PolarHBondContact O-N 2.92Å; N46-Q50 PolarHBondContact O-NE2 3.17Å; N46-Q50 PolarHBondContact O-OE1 3.48Å; A48-Q50 VanDerWaalsContact C-N 3.3Å; A48-Q50 PolarHBondContact O-N 3.34Å; Q50-R54 VanDerWaalsContact O-CB 3.27Å; Q50-R54 WeakPolarHBondContact O-CB 3.49Å; Q50-R54 PolarHBondContact O-N 2.8Å
51	K	88.8	Confident	86.1	Confident	133 Å²	133	87.8 Å²	87.8	58%	0.578	43%	0.427	S	S	*	.	H	α-helix	trans	-63.1	-48.2	173.8	-179.1	-177	169.8	-174	0	109.7	L47 A48 T49 R54 E55	L47-K51 PolarHBondContact O-N 3.12Å; L47-K51 VanDerWaalsContact O-N 3.13Å; A48-K51 WeakPolarHBondContact O-CB 3.07Å; A48-K51 PolarHBondContact O-N 3.08Å; T49-K51 VanDerWaalsContact C-N 3.34Å; T49-K51 PolarHBondContact O-N 3.19Å; K51-R54 PolarHBondContact O-N 2.93Å; K51-E55 WeakPolarHBondContact CE-OE1 3.35Å; K51-E55 IonicContact NZ-OE1 2.71Å; K51-E55 WeakPolarHBondContact O-CG 3.45Å; K51-E55 PolarHBondContact O-N 2.93Å
52	A	89.4	Confident	86.7	Confident	55 Å²	55	86 Å²	86	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-60.9	-46.7	178.8	0	0	0	0	0	112.1	A48 T49 R54 E55 F56	A48-A52 PolarHBondContact O-N 2.72Å; T49-A52 WeakPolarHBondContact O-CB 3.2Å; T49-A52 PolarHBondContact O-N 3.3Å; A52-R54 VanDerWaalsContact C-N 3.32Å; A52-R54 PolarHBondContact O-N 3.27Å; A52-E55 PolarHBondContact O-N 3.27Å; A52-F56 WeakPolarHBondContact O-CB 3.23Å; A52-F56 PolarHBondContact O-N 3.01Å
53	E	85.7	Confident	87.5	Confident	82 Å²	82	89.9 Å²	89.9	38%	0.383	43%	0.433	S	S	.	.	H	α-helix	trans	-60.5	-39.8	176.3	-72.4	174.2	-173	0	0	112.6	T49 F56 R57	T49-E53 HydrophobicContact CG2-CG 4.33Å; T49-E53 WeakPolarHBondContact O-CG 3.17Å; T49-E53 PolarHBondContact O-N 3.01Å; E53-F56 PolarHBondContact O-N 2.95Å; E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 3.38Å; E53-R57 IonicContact OE2-NH1 3.61Å
54	R	87.1	Confident	87.9	Confident	111 Å²	111	86.3 Å²	86.3	42%	0.419	43%	0.426	S	S	.	.	H	α-helix	trans	-66.4	-43.4	178.2	177.7	172.5	-178.7	-165.1	1.7	111.8	Q50 K51 A52 F56 L58 E86	Q50-R54 VanDerWaalsContact O-CB 3.27Å; Q50-R54 WeakPolarHBondContact O-CB 3.49Å; Q50-R54 PolarHBondContact O-N 2.8Å; K51-R54 PolarHBondContact O-N 2.93Å; A52-R54 VanDerWaalsContact C-N 3.32Å; A52-R54 PolarHBondContact O-N 3.27Å; R54-F56 VanDerWaalsContact C-N 3.32Å; R54-L58 PolarHBondContact O-N 3.24Å; R54-E86 WeakPolarHBondContact CD-OE2 3.4Å; R54-E86 HydrophobicContact CG-CG 4.38Å; R54-E86 WeakPolarHBondContact CG-OE2 3.43Å; R54-E86 IonicContact NE-OE2 3.97Å
55	E	91.4	Very high	88	Confident	110 Å²	110	79.5 Å²	79.5	51%	0.514	40%	0.399	S	S	.	.	H	α-helix	trans	-63.8	-40.5	174.7	-72.5	172	176.9	0	0	110.9	K51 A52 L58 K59	K51-E55 WeakPolarHBondContact CE-OE1 3.35Å; K51-E55 IonicContact NZ-OE1 2.71Å; K51-E55 WeakPolarHBondContact O-CG 3.45Å; K51-E55 PolarHBondContact O-N 2.93Å; A52-E55 PolarHBondContact O-N 3.27Å; E55-L58 PolarHBondContact O-N 3.21Å; E55-K59 WeakPolarHBondContact O-CB 3.24Å; E55-K59 PolarHBondContact O-N 3.47Å
56	F	90.5	Very high	88.6	Confident	125 Å²	125	81.3 Å²	81.3	55%	0.548	40%	0.404	S	S	.	.	H	α-helix	trans	-63.3	-46.4	176.6	-176.3	-106.4	0	0	0	112.6	A52 E53 R54 L58 K59 N60	A52-F56 WeakPolarHBondContact O-CB 3.23Å; A52-F56 PolarHBondContact O-N 3.01Å; E53-F56 PolarHBondContact O-N 2.95Å; R54-F56 VanDerWaalsContact C-N 3.32Å; F56-L58 VanDerWaalsContact C-N 3.32Å; F56-L58 PolarHBondContact O-N 2.99Å; F56-K59 PolarHBondContact O-N 2.95Å; F56-N60 WeakPolarHBondContact CE1-ND2 3.29Å; F56-N60 VanDerWaalsContact CZ-ND2 3.25Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.36Å; F56-N60 PolarHBondContact O-N 2.97Å
57	R	90.4	Very high	89.2	Confident	52 Å²	52	84.1 Å²	84.1	20%	0.196	42%	0.415	C	S	.	.	H	α-helix	trans	-59.3	-42.1	176.2	-75.7	-171.6	-62.6	-88.5	-0.4	112.2	E53 N60 L61 E86	E53-R57 WeakPolarHBondContact O-CG 3.45Å; E53-R57 PolarHBondContact O-N 3.38Å; E53-R57 IonicContact OE2-NH1 3.61Å; R57-N60 PolarHBondContact O-N 3.14Å; R57-L61 PolarHBondContact O-N 3.25Å; R57-E86 IonicContact CZ-OE1 3.71Å; R57-E86 VanDerWaalsContact CZ-OE1 3.25Å; R57-E86 IonicContact NE-OE1 2.82Å; R57-E86 PolarHBondContact NE-OE1 3.44Å; R57-E86 IonicContact NH2-OE1 2.76Å; R57-E86 PolarHBondContact NH2-OE1 3.34Å; R57-E86 IonicContact NH2-OE2 3.8Å; R57-E86 PolarHBondContact NH2-OE2 2.98Å
58	L	90.6	Very high	89.5	Confident	75 Å²	75	86.2 Å²	86.2	39%	0.393	42%	0.423	S	S	.	.	H	α-helix	trans	-63.8	-45.3	175.4	-179.2	61.8	0	0	0	111.5	R54 E55 F56 N60 L61 E62	R54-L58 PolarHBondContact O-N 3.24Å; E55-L58 PolarHBondContact O-N 3.21Å; F56-L58 VanDerWaalsContact C-N 3.32Å; F56-L58 PolarHBondContact O-N 2.99Å; L58-N60 VanDerWaalsContact C-N 3.33Å; L58-N60 PolarHBondContact O-N 3.46Å; L58-L61 PolarHBondContact O-N 3.16Å; L58-E62 PolarHBondContact O-N 3.36Å
59	K	93	Very high	89.6	Confident	155 Å²	155	86.3 Å²	86.3	67%	0.674	43%	0.429	S	S	*	.	H	α-helix	trans	-60.8	-41.6	178.1	-173.3	-179.9	179.2	-177.9	0	112.1	E55 F56 E62 K63	E55-K59 WeakPolarHBondContact O-CB 3.24Å; E55-K59 PolarHBondContact O-N 3.47Å; F56-K59 PolarHBondContact O-N 2.95Å; K59-E62 PolarHBondContact O-N 3.31Å; K59-K63 PolarHBondContact O-N 2.89Å
60	N	90.4	Very high	89.9	Confident	64 Å²	64	84.4 Å²	84.4	34%	0.342	42%	0.416	S	S	.	.	H	α-helix	trans	-65.4	-41.6	176.8	-72.4	-7.7	0	0	0	111.7	F56 R57 L58 E62 K63 V64	F56-N60 WeakPolarHBondContact CE1-ND2 3.29Å; F56-N60 VanDerWaalsContact CZ-ND2 3.25Å; F56-N60 WeakPolarHBondContact CZ-ND2 3.36Å; F56-N60 PolarHBondContact O-N 2.97Å; R57-N60 PolarHBondContact O-N 3.14Å; L58-N60 VanDerWaalsContact C-N 3.33Å; L58-N60 PolarHBondContact O-N 3.46Å; N60-E62 VanDerWaalsContact C-N 3.34Å; N60-E62 PolarHBondContact O-N 2.88Å; N60-K63 PolarHBondContact O-N 2.68Å; N60-V64 WeakPolarHBondContact O-CG2 3.4Å; N60-V64 PolarHBondContact O-N 3.35Å
61	L	89.6	Confident	90.4	Very high	38 Å²	38	85.7 Å²	85.7	20%	0.199	43%	0.428	C	S	.	.	H	α-helix	trans	-59.8	-45.4	174.5	179.3	64.8	0	0	0	111.3	R57 L58 K63 V64 M65 H82	R57-L61 PolarHBondContact O-N 3.25Å; L58-L61 PolarHBondContact O-N 3.16Å; L61-K63 VanDerWaalsContact C-N 3.32Å; L61-K63 PolarHBondContact O-N 2.88Å; L61-V64 PolarHBondContact O-N 3.17Å; L61-M65 HydrophobicContact CD1-CG 4.33Å; L61-M65 HydrophobicContact CD1-SD 4.44Å; L61-M65 HydrophobicContact CG-CE 4.06Å; L61-M65 HydrophobicContact CG-SD 4.26Å; L61-M65 WeakPolarHBondContact O-CB 2.82Å; L61-M65 VanDerWaalsContact O-CG 3.25Å; L61-M65 WeakPolarHBondContact O-CG 3.36Å; L61-M65 PolarHBondContact O-N 3.43Å; L61-H82 HydrophobicContact CD2-CB 3.42Å; L61-H82 VanDerWaalsContact CD2-CB 3.42Å
62	E	92.4	Very high	90.5	Very high	46 Å²	46	84.3 Å²	84.3	22%	0.215	42%	0.423	C	S	.	.	H	α-helix	trans	-59.5	-43.1	176.2	-69.5	-60.5	152	0	0	112.4	L58 K59 N60 M65 E66 R75 R79	L58-E62 PolarHBondContact O-N 3.36Å; K59-E62 PolarHBondContact O-N 3.31Å; N60-E62 VanDerWaalsContact C-N 3.34Å; N60-E62 PolarHBondContact O-N 2.88Å; E62-M65 HydrophobicContact CB-CE 4.5Å; E62-M65 HydrophobicContact CG-CE 4.26Å; E62-M65 PolarHBondContact O-N 2.86Å; E62-M65 WeakPolarHBondContact OE1-CE 3.46Å; E62-M65 VanDerWaalsContact OE2-CE 3.23Å; E62-M65 WeakPolarHBondContact OE2-CE 3.47Å; E62-E66 WeakPolarHBondContact O-CB 3.49Å; E62-E66 PolarHBondContact O-N 3.15Å; E62-R75 IonicContact OE2-CZ 2.87Å; E62-R75 IonicContact OE2-NH2 2.75Å; E62-R75 PolarHBondContact OE2-NH2 3.36Å; E62-R79 WeakPolarHBondContact OE1-CD 3.46Å; E62-R79 WeakPolarHBondContact OE1-CG 3.23Å; E62-R79 IonicContact OE1-CZ 3.81Å; E62-R79 IonicContact OE1-NE 3.98Å; E62-R79 PolarHBondContact OE1-NE 2.85Å; E62-R79 IonicContact OE1-NH2 3.38Å; E62-R79 IonicContact OE2-CZ 3.17Å; E62-R79 IonicContact OE2-NE 2.77Å; E62-R79 PolarHBondContact OE2-NE 3.47Å; E62-R79 IonicContact OE2-NH2 3.3Å; E62-R79 PolarHBondContact OE2-NH2 3.46Å
63	K	92	Very high	90.6	Very high	114 Å²	114	85.8 Å²	85.8	50%	0.496	42%	0.423	S	S	.	.	H	α-helix	trans	-62	-47	177.9	-177	-178.4	167.5	-174.1	0	111.9	K59 N60 L61 M65 E66 E67	K59-K63 PolarHBondContact O-N 2.89Å; N60-K63 PolarHBondContact O-N 2.68Å; L61-K63 VanDerWaalsContact C-N 3.32Å; L61-K63 PolarHBondContact O-N 2.88Å; K63-M65 VanDerWaalsContact C-N 3.33Å; K63-M65 PolarHBondContact O-N 3.45Å; K63-E66 WeakPolarHBondContact O-CB 3.31Å; K63-E66 PolarHBondContact O-N 3.48Å; K63-E67 WeakPolarHBondContact CE-OE1 3.33Å; K63-E67 IonicContact NZ-OE1 2.7Å; K63-E67 WeakPolarHBondContact O-CG 3.07Å; K63-E67 PolarHBondContact O-N 3.4Å
64	V	90.1	Very high	90.9	Very high	65 Å²	65	86 Å²	86	39%	0.394	42%	0.424	S	S	.	.	H	α-helix	trans	-61.1	-43.3	177.4	171.6	0	0	0	0	110.9	N60 L61 E66 E67 E68	N60-V64 WeakPolarHBondContact O-CG2 3.4Å; N60-V64 PolarHBondContact O-N 3.35Å; L61-V64 PolarHBondContact O-N 3.17Å; V64-E66 VanDerWaalsContact C-N 3.28Å; V64-E66 PolarHBondContact O-N 2.98Å; V64-E67 PolarHBondContact O-N 3.22Å; V64-E68 HydrophobicContact CG1-CG 4.45Å; V64-E68 WeakPolarHBondContact O-CB 3.19Å; V64-E68 WeakPolarHBondContact O-CG 3.34Å; V64-E68 PolarHBondContact O-N 3.44Å
65	M	90.8	Very high	91.1	Very high	2 Å²	2	83.3 Å²	83.3	1%	0.01	41%	0.414	C	S	.	.	H	α-helix	trans	-64.2	-32.5	177.4	-70.4	-172.7	-56.6	0	0	113.2	L61 E62 K63 G69 L70 R75 L78 R79	L61-M65 HydrophobicContact CD1-CG 4.33Å; L61-M65 HydrophobicContact CD1-SD 4.44Å; L61-M65 HydrophobicContact CG-CE 4.06Å; L61-M65 HydrophobicContact CG-SD 4.26Å; L61-M65 WeakPolarHBondContact O-CB 2.82Å; L61-M65 VanDerWaalsContact O-CG 3.25Å; L61-M65 WeakPolarHBondContact O-CG 3.36Å; L61-M65 PolarHBondContact O-N 3.43Å; E62-M65 HydrophobicContact CB-CE 4.5Å; E62-M65 HydrophobicContact CG-CE 4.26Å; E62-M65 PolarHBondContact O-N 2.86Å; E62-M65 WeakPolarHBondContact OE1-CE 3.46Å; E62-M65 VanDerWaalsContact OE2-CE 3.23Å; E62-M65 WeakPolarHBondContact OE2-CE 3.47Å; K63-M65 VanDerWaalsContact C-N 3.33Å; K63-M65 PolarHBondContact O-N 3.45Å; M65-G69 PolarHBondContact O-N 2.84Å; M65-L70 HydrophobicContact CB-CD1 4.4Å; M65-L70 HydrophobicContact CG-CD1 4.12Å; M65-L70 PolarHBondContact O-N 2.99Å; M65-R75 HydrophobicContact CB-CG 4.14Å; M65-R75 HydrophobicContact CE-CB 4.42Å; M65-R75 HydrophobicContact CG-CG 4.5Å; M65-R75 HydrophobicContact SD-CB 3.87Å; M65-R75 HydrophobicContact SD-CG 4.04Å; M65-L78 HydrophobicContact CG-CD1 3.75Å; M65-L78 HydrophobicContact SD-CB 3.65Å; M65-L78 HydrophobicContact SD-CD1 3.7Å; M65-L78 HydrophobicContact SD-CG 4.32Å; M65-R79 HydrophobicContact CE-CG 4.06Å
66	E	91.3	Very high	91.2	Very high	145 Å²	145	82.4 Å²	82.4	68%	0.678	41%	0.41	S	S	*	.	H	α-helix	trans	-72.3	-43.9	174.9	-176.1	173.4	-163	0	0	111.6	E62 K63 V64 G69	E62-E66 WeakPolarHBondContact O-CB 3.49Å; E62-E66 PolarHBondContact O-N 3.15Å; K63-E66 WeakPolarHBondContact O-CB 3.31Å; K63-E66 PolarHBondContact O-N 3.48Å; V64-E66 VanDerWaalsContact C-N 3.28Å; V64-E66 PolarHBondContact O-N 2.98Å; E66-G69 PolarHBondContact O-N 3.38Å; E66-G69 VanDerWaalsContact O-N 3.16Å
67	E	91.6	Very high	91.2	Very high	135 Å²	135	82.4 Å²	82.4	63%	0.631	41%	0.41	S	S	*	.	H	α-helix	trans	-65.2	-36.9	177.7	-72.8	174.2	166.9	0	0	112.7	K63 V64 G69	K63-E67 WeakPolarHBondContact CE-OE1 3.33Å; K63-E67 IonicContact NZ-OE1 2.7Å; K63-E67 WeakPolarHBondContact O-CG 3.07Å; K63-E67 PolarHBondContact O-N 3.4Å; V64-E67 PolarHBondContact O-N 3.22Å; E67-G69 VanDerWaalsContact C-N 3.27Å; E67-G69 PolarHBondContact O-N 3.48Å
68	E	90.3	Very high	91.2	Very high	128 Å²	128	83.3 Å²	83.3	60%	0.598	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-9.8	174.9	-71.3	-175.6	170.5	0	0	113.4	V64 L70	V64-E68 HydrophobicContact CG1-CG 4.45Å; V64-E68 WeakPolarHBondContact O-CB 3.19Å; V64-E68 WeakPolarHBondContact O-CG 3.34Å; V64-E68 PolarHBondContact O-N 3.44Å; E68-L70 VanDerWaalsContact C-N 3.3Å; E68-L70 HydrophobicContact CB-CD1 4.49Å; E68-L70 HydrophobicContact CB-CD2 4.06Å; E68-L70 HydrophobicContact CB-CG 3.87Å; E68-L70 PolarHBondContact O-N 3.43Å
69	G	90.3	Very high	91.3	Very high	62 Å²	62	82.1 Å²	82.1	64%	0.639	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	31.5	178.9	0	0	0	0	0	114.1	M65 E66 E67	M65-G69 PolarHBondContact O-N 2.84Å; E66-G69 PolarHBondContact O-N 3.38Å; E66-G69 VanDerWaalsContact O-N 3.16Å; E67-G69 VanDerWaalsContact C-N 3.27Å; E67-G69 PolarHBondContact O-N 3.48Å
70	L	89.5	Confident	91.3	Very high	36 Å²	36	79.9 Å²	79.9	19%	0.188	40%	0.403	C	S	.	.			trans	-66.4	143	-173.8	-60.9	179.9	0	0	0	112.3	M65 E68 R75 L78	M65-L70 HydrophobicContact CB-CD1 4.4Å; M65-L70 HydrophobicContact CG-CD1 4.12Å; M65-L70 PolarHBondContact O-N 2.99Å; E68-L70 VanDerWaalsContact C-N 3.3Å; E68-L70 HydrophobicContact CB-CD1 4.49Å; E68-L70 HydrophobicContact CB-CD2 4.06Å; E68-L70 HydrophobicContact CB-CG 3.87Å; E68-L70 PolarHBondContact O-N 3.43Å; L70-R75 HydrophobicContact CB-CG 3.95Å; L70-R75 WeakPolarHBondContact O-CD 3.32Å; L70-L78 HydrophobicContact CD1-CD1 3.51Å
71	P	92	Very high	91.3	Very high	66 Å²	66	79 Å²	79	43%	0.429	40%	0.404	S	S	.	.			trans	-64.8	151.4	174.7	29	-34.7	0	0	0	111.4	D73 E74 R75	P71-D73 WeakPolarHBondContact CB-OD1 3.4Å; P71-D73 PolarHBondContact O-N 2.72Å; P71-D73 VanDerWaalsContact O-N 3.14Å; P71-E74 HydrophobicContact CG-CB 4.09Å; P71-E74 HydrophobicContact CG-CG 3.89Å; P71-E74 PolarHBondContact O-N 3.03Å; P71-R75 WeakPolarHBondContact O-CG 3.16Å; P71-R75 PolarHBondContact O-N 2.77Å
72	E	92	Very high	91.2	Very high	105 Å²	105	78.5 Å²	78.5	49%	0.491	40%	0.401	S	S	.	.	H	α-helix	trans	-60.9	-29.3	-170.4	-173.4	56.9	-153.5	0	0	113.8	R75 Q76 R79	E72-R75 PolarHBondContact O-N 2.8Å; E72-R75 IonicContact OE2-CZ 3.29Å; E72-R75 IonicContact OE2-NE 3.76Å; E72-R75 IonicContact OE2-NH1 3.77Å; E72-Q76 WeakPolarHBondContact O-CB 3.47Å; E72-Q76 PolarHBondContact O-N 3.24Å; E72-R79 IonicContact OE1-CZ 2.72Å; E72-R79 IonicContact OE1-NH1 2.88Å; E72-R79 PolarHBondContact OE1-NH1 3.22Å; E72-R79 IonicContact OE1-NH2 3.18Å
73	D	92.3	Very high	91.1	Very high	85 Å²	85	78.4 Å²	78.4	46%	0.455	41%	0.409	S	S	.	.	H	α-helix	trans	-68.9	-37.1	176.5	75.7	-61.7	0	0	0	112.1	P71 K77	P71-D73 WeakPolarHBondContact CB-OD1 3.4Å; P71-D73 PolarHBondContact O-N 2.72Å; P71-D73 VanDerWaalsContact O-N 3.14Å; D73-K77 VanDerWaalsContact O-CG 3.31Å; D73-K77 WeakPolarHBondContact O-CG 3.37Å; D73-K77 PolarHBondContact O-N 3.34Å; D73-K77 VanDerWaalsContact O-N 3.15Å; D73-K77 IonicContact OD2-NZ 3.67Å; D73-K77 PolarHBondContact OD2-NZ 3.48Å
74	E	91.2	Very high	91	Very high	86 Å²	86	75.3 Å²	75.3	40%	0.402	40%	0.404	S	S	.	.	H	α-helix	trans	-70.1	-42.7	172.7	-72.5	-170.2	-174.8	0	0	111.5	P71 Q76 K77 L78	P71-E74 HydrophobicContact CG-CB 4.09Å; P71-E74 HydrophobicContact CG-CG 3.89Å; P71-E74 PolarHBondContact O-N 3.03Å; E74-Q76 VanDerWaalsContact C-N 3.27Å; E74-Q76 PolarHBondContact O-N 2.92Å; E74-K77 WeakPolarHBondContact O-CB 3.12Å; E74-K77 PolarHBondContact O-N 3.17Å; E74-K77 VanDerWaalsContact O-N 3.11Å; E74-L78 WeakPolarHBondContact O-CG 3.46Å; E74-L78 PolarHBondContact O-N 3.16Å
75	R	91.3	Very high	90.8	Very high	56 Å²	56	76.1 Å²	76.1	21%	0.211	40%	0.402	C	S	.	.	H	α-helix	trans	-55.9	-44.7	173.8	-64.1	-178.4	66.1	-177	7.2	111.3	E62 M65 L70 P71 E72 K77 L78 R79	E62-R75 IonicContact OE2-CZ 2.87Å; E62-R75 IonicContact OE2-NH2 2.75Å; E62-R75 PolarHBondContact OE2-NH2 3.36Å; M65-R75 HydrophobicContact CB-CG 4.14Å; M65-R75 HydrophobicContact CE-CB 4.42Å; M65-R75 HydrophobicContact CG-CG 4.5Å; M65-R75 HydrophobicContact SD-CB 3.87Å; M65-R75 HydrophobicContact SD-CG 4.04Å; L70-R75 HydrophobicContact CB-CG 3.95Å; L70-R75 WeakPolarHBondContact O-CD 3.32Å; P71-R75 WeakPolarHBondContact O-CG 3.16Å; P71-R75 PolarHBondContact O-N 2.77Å; E72-R75 PolarHBondContact O-N 2.8Å; E72-R75 IonicContact OE2-CZ 3.29Å; E72-R75 IonicContact OE2-NE 3.76Å; E72-R75 IonicContact OE2-NH1 3.77Å; R75-K77 PolarHBondContact O-N 3.33Å; R75-L78 PolarHBondContact O-N 3.44Å; R75-R79 WeakPolarHBondContact O-CG 3.37Å; R75-R79 PolarHBondContact O-N 2.82Å
76	Q	92.7	Very high	90.6	Very high	90 Å²	90	76.1 Å²	76.1	42%	0.421	40%	0.403	S	S	.	.	H	α-helix	trans	-64.2	-40	177.7	-172.2	61	12.1	0	0	112.6	E72 E74 R79 L80	E72-Q76 WeakPolarHBondContact O-CB 3.47Å; E72-Q76 PolarHBondContact O-N 3.24Å; E74-Q76 VanDerWaalsContact C-N 3.27Å; E74-Q76 PolarHBondContact O-N 2.92Å; Q76-R79 PolarHBondContact O-N 3.22Å; Q76-L80 HydrophobicContact CG-CD1 4.45Å; Q76-L80 WeakPolarHBondContact O-CG 3.31Å; Q76-L80 PolarHBondContact O-N 2.8Å
77	K	92	Very high	90.4	Very high	126 Å²	126	73.5 Å²	73.5	55%	0.548	40%	0.397	S	S	.	.	H	α-helix	trans	-61.2	-43.2	174.1	-70.6	163.5	-170.8	150.6	0	111.3	D73 E74 R75 L80 A81	D73-K77 VanDerWaalsContact O-CG 3.31Å; D73-K77 WeakPolarHBondContact O-CG 3.37Å; D73-K77 PolarHBondContact O-N 3.34Å; D73-K77 VanDerWaalsContact O-N 3.15Å; D73-K77 IonicContact OD2-NZ 3.67Å; D73-K77 PolarHBondContact OD2-NZ 3.48Å; E74-K77 WeakPolarHBondContact O-CB 3.12Å; E74-K77 PolarHBondContact O-N 3.17Å; E74-K77 VanDerWaalsContact O-N 3.11Å; R75-K77 PolarHBondContact O-N 3.33Å; K77-L80 PolarHBondContact O-N 3.17Å; K77-A81 WeakPolarHBondContact O-CB 3.13Å; K77-A81 PolarHBondContact O-N 3.02Å
78	L	90.2	Very high	89.9	Confident	70 Å²	70	68.9 Å²	68.9	37%	0.366	38%	0.375	S	S	.	.	H	α-helix	trans	-65	-43.5	177.7	-72	174.2	0	0	0	112.2	M65 L70 E74 R75 L80 A81 H82	M65-L78 HydrophobicContact CG-CD1 3.75Å; M65-L78 HydrophobicContact SD-CB 3.65Å; M65-L78 HydrophobicContact SD-CD1 3.7Å; M65-L78 HydrophobicContact SD-CG 4.32Å; L70-L78 HydrophobicContact CD1-CD1 3.51Å; E74-L78 WeakPolarHBondContact O-CG 3.46Å; E74-L78 PolarHBondContact O-N 3.16Å; R75-L78 PolarHBondContact O-N 3.44Å; L78-L80 PolarHBondContact O-N 3.18Å; L78-A81 PolarHBondContact O-N 3.15Å; L78-H82 WeakPolarHBondContact O-CB 3.22Å; L78-H82 PolarHBondContact O-N 3.03Å
79	R	92.1	Very high	89.4	Confident	51 Å²	51	63.3 Å²	63.3	19%	0.192	35%	0.349	C	S	.	.	H	α-helix	trans	-58.9	-44.8	174	-71.2	175.3	-169.8	129.3	3.7	112.3	E62 M65 E72 R75 Q76 H82 A83	E62-R79 WeakPolarHBondContact OE1-CD 3.46Å; E62-R79 WeakPolarHBondContact OE1-CG 3.23Å; E62-R79 IonicContact OE1-CZ 3.81Å; E62-R79 IonicContact OE1-NE 3.98Å; E62-R79 PolarHBondContact OE1-NE 2.85Å; E62-R79 IonicContact OE1-NH2 3.38Å; E62-R79 IonicContact OE2-CZ 3.17Å; E62-R79 IonicContact OE2-NE 2.77Å; E62-R79 PolarHBondContact OE2-NE 3.47Å; E62-R79 IonicContact OE2-NH2 3.3Å; E62-R79 PolarHBondContact OE2-NH2 3.46Å; M65-R79 HydrophobicContact CE-CG 4.06Å; E72-R79 IonicContact OE1-CZ 2.72Å; E72-R79 IonicContact OE1-NH1 2.88Å; E72-R79 PolarHBondContact OE1-NH1 3.22Å; E72-R79 IonicContact OE1-NH2 3.18Å; R75-R79 WeakPolarHBondContact O-CG 3.37Å; R75-R79 PolarHBondContact O-N 2.82Å; Q76-R79 PolarHBondContact O-N 3.22Å; R79-H82 PolarHBondContact O-N 2.83Å; R79-A83 WeakPolarHBondContact O-CB 3.29Å; R79-A83 PolarHBondContact O-N 3.49Å
80	L	92.8	Very high	89	Confident	107 Å²	107	63.6 Å²	63.6	56%	0.56	34%	0.335	S	S	*	.	H	α-helix	trans	-63.5	-43.1	177.2	-72.3	172.1	0	0	0	111.6	Q76 K77 L78 H82 A83 A84	Q76-L80 HydrophobicContact CG-CD1 4.45Å; Q76-L80 WeakPolarHBondContact O-CG 3.31Å; Q76-L80 PolarHBondContact O-N 2.8Å; K77-L80 PolarHBondContact O-N 3.17Å; L78-L80 PolarHBondContact O-N 3.18Å; L80-H82 VanDerWaalsContact C-N 3.34Å; L80-H82 PolarHBondContact O-N 3.07Å; L80-A83 PolarHBondContact O-N 3.38Å; L80-A84 WeakPolarHBondContact O-CB 3.49Å; L80-A84 PolarHBondContact O-N 3.1Å
81	A	90.2	Very high	88.5	Confident	45 Å²	45	68.7 Å²	68.7	37%	0.372	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-40.9	175	0	0	0	0	0	111.9	K77 L78 A84 K85	K77-A81 WeakPolarHBondContact O-CB 3.13Å; K77-A81 PolarHBondContact O-N 3.02Å; L78-A81 PolarHBondContact O-N 3.15Å; A81-A84 PolarHBondContact O-N 3.3Å; A81-K85 WeakPolarHBondContact O-CG 3.29Å; A81-K85 PolarHBondContact O-N 2.94Å
82	H	88.9	Confident	87.6	Confident	28 Å²	28	66.8 Å²	66.8	13%	0.13	34%	0.338	C	S	.	.	H	α-helix	trans	-63.8	-46.3	174.8	-179	-90.8	0	0	0	112	L61 L78 R79 L80 A84 K85 E86	L61-H82 HydrophobicContact CD2-CB 3.42Å; L61-H82 VanDerWaalsContact CD2-CB 3.42Å; L78-H82 WeakPolarHBondContact O-CB 3.22Å; L78-H82 PolarHBondContact O-N 3.03Å; R79-H82 PolarHBondContact O-N 2.83Å; L80-H82 VanDerWaalsContact C-N 3.34Å; L80-H82 PolarHBondContact O-N 3.07Å; H82-A84 VanDerWaalsContact C-N 3.3Å; H82-A84 PolarHBondContact O-N 2.88Å; H82-K85 WeakPolarHBondContact O-CB 3.49Å; H82-K85 PolarHBondContact O-N 3.27Å; H82-K85 VanDerWaalsContact O-N 3.15Å; H82-E86 IonicContact CE1-OE1 3.95Å; H82-E86 IonicContact NE2-OE1 3.93Å; H82-E86 PolarHBondContact O-N 2.75Å
83	A	89.9	Confident	86.8	Confident	45 Å²	45	66.2 Å²	66.2	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-37.8	176.6	0	0	0	0	0	112.6	R79 L80 E86 T87	R79-A83 WeakPolarHBondContact O-CB 3.29Å; R79-A83 PolarHBondContact O-N 3.49Å; L80-A83 PolarHBondContact O-N 3.38Å; A83-E86 PolarHBondContact O-N 2.72Å; A83-T87 WeakPolarHBondContact O-CB 3.46Å; A83-T87 PolarHBondContact O-N 2.79Å; A83-T87 PolarHBondContact O-OG1 3.26Å
84	A	89.1	Confident	85.9	Confident	49 Å²	49	72.4 Å²	72.4	41%	0.405	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-44.6	173.2	0	0	0	0	0	111.6	L80 A81 H82 E86 T87 E88	L80-A84 WeakPolarHBondContact O-CB 3.49Å; L80-A84 PolarHBondContact O-N 3.1Å; A81-A84 PolarHBondContact O-N 3.3Å; H82-A84 VanDerWaalsContact C-N 3.3Å; H82-A84 PolarHBondContact O-N 2.88Å; A84-E86 PolarHBondContact O-N 3.21Å; A84-T87 PolarHBondContact O-N 3.44Å; A84-E88 WeakPolarHBondContact O-CB 3.37Å; A84-E88 PolarHBondContact O-N 3.09Å
85	K	86.1	Confident	85.2	Confident	81 Å²	81	71.9 Å²	71.9	35%	0.352	35%	0.351	S	S	.	.	H	α-helix	trans	-60.5	-43.1	174.8	-74.2	-179.4	-179.5	-178.5	0	112.2	A81 H82 E88 F89 F481 T485	A81-K85 WeakPolarHBondContact O-CG 3.29Å; A81-K85 PolarHBondContact O-N 2.94Å; H82-K85 WeakPolarHBondContact O-CB 3.49Å; H82-K85 PolarHBondContact O-N 3.27Å; H82-K85 VanDerWaalsContact O-N 3.15Å; K85-E88 PolarHBondContact O-N 3.31Å; K85-F89 WeakPolarHBondContact O-CB 3.28Å; K85-F89 PolarHBondContact O-N 2.67Å; K85-F481 HydrophobicContact CB-CE1 4.4Å; K85-F481 HydrophobicContact CB-CZ 3.82Å; K85-T485 HydrophobicContact CB-CG2 4.08Å; K85-T485 HydrophobicContact CG-CG2 4.37Å
86	E	86.9	Confident	84.6	Confident	3 Å²	3	80.1 Å²	80.1	1%	0.014	38%	0.382	C	S	.	.	H	α-helix	trans	-62.8	-42.7	176.4	-77.5	-66.7	159.5	0	0	112.6	R54 R57 H82 A83 A84 E88 F89 L90 F481	R54-E86 WeakPolarHBondContact CD-OE2 3.4Å; R54-E86 HydrophobicContact CG-CG 4.38Å; R54-E86 WeakPolarHBondContact CG-OE2 3.43Å; R54-E86 IonicContact NE-OE2 3.97Å; R57-E86 IonicContact CZ-OE1 3.71Å; R57-E86 VanDerWaalsContact CZ-OE1 3.25Å; R57-E86 IonicContact NE-OE1 2.82Å; R57-E86 PolarHBondContact NE-OE1 3.44Å; R57-E86 IonicContact NH2-OE1 2.76Å; R57-E86 PolarHBondContact NH2-OE1 3.34Å; R57-E86 IonicContact NH2-OE2 3.8Å; R57-E86 PolarHBondContact NH2-OE2 2.98Å; H82-E86 IonicContact CE1-OE1 3.95Å; H82-E86 IonicContact NE2-OE1 3.93Å; H82-E86 PolarHBondContact O-N 2.75Å; A83-E86 PolarHBondContact O-N 2.72Å; A84-E86 PolarHBondContact O-N 3.21Å; E86-E88 VanDerWaalsContact C-N 3.35Å; E86-F89 PolarHBondContact O-N 3.5Å; E86-L90 WeakPolarHBondContact O-CG 3.43Å; E86-L90 PolarHBondContact O-N 3.19Å; E86-F481 HydrophobicContact CG-CE2 4.39Å; E86-F481 WeakPolarHBondContact OE1-CE2 3.41Å
87	T	86.5	Confident	84.3	Confident	90 Å²	90	77.1 Å²	77.1	55%	0.552	37%	0.369	S	S	*	.	H	α-helix	trans	-63.8	-43.4	177	-57.8	0	0	0	0	111	A83 A84 L90 R91	A83-T87 WeakPolarHBondContact O-CB 3.46Å; A83-T87 PolarHBondContact O-N 2.79Å; A83-T87 PolarHBondContact O-OG1 3.26Å; A84-T87 PolarHBondContact O-N 3.44Å; T87-L90 PolarHBondContact O-N 3Å; T87-R91 PolarHBondContact O-N 3.16Å
88	E	82.2	Confident	84.2	Confident	37 Å²	37	74.1 Å²	74.1	17%	0.173	36%	0.361	C	S	.	.	H	α-helix	trans	-65.5	-40.7	177.1	-178.5	60.8	-176.3	0	0	112.1	A84 K85 E86 L90 R91 L92	A84-E88 WeakPolarHBondContact O-CB 3.37Å; A84-E88 PolarHBondContact O-N 3.09Å; K85-E88 PolarHBondContact O-N 3.31Å; E86-E88 VanDerWaalsContact C-N 3.35Å; E88-L90 PolarHBondContact O-N 2.9Å; E88-R91 WeakPolarHBondContact O-CB 3.48Å; E88-R91 PolarHBondContact O-N 3.39Å; E88-R91 VanDerWaalsContact O-N 3.15Å; E88-R91 IonicContact OE1-CZ 2.86Å; E88-R91 IonicContact OE1-NE 2.81Å; E88-R91 IonicContact OE1-NH2 3.16Å; E88-R91 PolarHBondContact OE1-NH2 3.04Å; E88-R91 IonicContact OE2-CZ 2.73Å; E88-R91 IonicContact OE2-NE 2.61Å; E88-R91 PolarHBondContact OE2-NE 3.04Å; E88-R91 IonicContact OE2-NH2 3.84Å; E88-R91 PolarHBondContact OE2-NH2 3.17Å; E88-L92 HydrophobicContact CG-CD1 3.77Å; E88-L92 HydrophobicContact CG-CG 4.2Å; E88-L92 WeakPolarHBondContact O-CB 3.46Å; E88-L92 WeakPolarHBondContact O-CG 3.46Å; E88-L92 PolarHBondContact O-N 3.12Å; E88-L92 WeakPolarHBondContact OE1-CD1 3.38Å; E88-L92 WeakPolarHBondContact OE1-CG 3.21Å
89	F	79.5	Confident	84.2	Confident	12 Å²	12	72 Å²	72	5%	0.053	35%	0.352	C	S	.	.	H	α-helix	trans	-57.2	-48.5	174.1	175.4	-104.1	0	0	0	111.5	K85 E86 R91 L92 R93 F481 L484	K85-F89 WeakPolarHBondContact O-CB 3.28Å; K85-F89 PolarHBondContact O-N 2.67Å; E86-F89 PolarHBondContact O-N 3.5Å; F89-R91 VanDerWaalsContact C-N 3.29Å; F89-R91 PolarHBondContact O-N 2.93Å; F89-L92 PolarHBondContact O-N 3.45Å; F89-R93 VanDerWaalsContact O-CB 3.22Å; F89-R93 WeakPolarHBondContact O-CB 3.47Å; F89-R93 PolarHBondContact O-N 2.92Å; F89-F481 HydrophobicContact CB-CD2 3.8Å; F89-F481 HydrophobicContact CB-CE2 3.67Å; F89-F481 AromaticContact CD1-CD2 3.98Å; F89-F481 HydrophobicContact CD1-CD2 3.98Å; F89-F481 HydrophobicContact CD1-CE2 4.37Å; F89-F481 HydrophobicContact CD2-CB 4.2Å; F89-F481 AromaticContact CD2-CD2 3.51Å; F89-F481 HydrophobicContact CD2-CD2 3.51Å; F89-F481 HydrophobicContact CD2-CE2 4.29Å; F89-F481 HydrophobicContact CD2-CG 4.18Å; F89-F481 HydrophobicContact CE1-CD2 4.45Å; F89-F481 HydrophobicContact CE2-CB 4.07Å; F89-F481 HydrophobicContact CE2-CD2 4.03Å; F89-F481 AromaticContact CG-CD2 3.49Å; F89-F481 HydrophobicContact CG-CD2 3.49Å; F89-F481 VanDerWaalsContact CG-CD2 3.49Å; F89-F481 AromaticContact CG-CE2 3.88Å; F89-F481 HydrophobicContact CG-CE2 3.88Å; F89-F481 HydrophobicContact CZ-CD2 4.47Å; F89-L484 HydrophobicContact CD2-CB 4.06Å; F89-L484 HydrophobicContact CD2-CD1 3.54Å; F89-L484 HydrophobicContact CD2-CG 4.35Å; F89-L484 HydrophobicContact CE2-CD1 3.65Å
90	L	80.6	Confident	84.2	Confident	68 Å²	68	71.9 Å²	71.9	36%	0.356	36%	0.361	S	S	.	.	H	α-helix	trans	-61.1	-37.7	176	-69.3	174.6	0	0	0	112.2	E86 T87 E88 R94	E86-L90 WeakPolarHBondContact O-CG 3.43Å; E86-L90 PolarHBondContact O-N 3.19Å; T87-L90 PolarHBondContact O-N 3Å; E88-L90 PolarHBondContact O-N 2.9Å; L90-R94 WeakPolarHBondContact O-CG 3.29Å
91	R	79.6	Confident	84.2	Confident	142 Å²	142	69.4 Å²	69.4	54%	0.536	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-54	176.2	-173.3	178.1	74.7	152.5	2.7	111.5	T87 E88 F89 R93 R94	T87-R91 PolarHBondContact O-N 3.16Å; E88-R91 WeakPolarHBondContact O-CB 3.48Å; E88-R91 PolarHBondContact O-N 3.39Å; E88-R91 VanDerWaalsContact O-N 3.15Å; E88-R91 IonicContact OE1-CZ 2.86Å; E88-R91 IonicContact OE1-NE 2.81Å; E88-R91 IonicContact OE1-NH2 3.16Å; E88-R91 PolarHBondContact OE1-NH2 3.04Å; E88-R91 IonicContact OE2-CZ 2.73Å; E88-R91 IonicContact OE2-NE 2.61Å; E88-R91 PolarHBondContact OE2-NE 3.04Å; E88-R91 IonicContact OE2-NH2 3.84Å; E88-R91 PolarHBondContact OE2-NH2 3.17Å; F89-R91 VanDerWaalsContact C-N 3.29Å; F89-R91 PolarHBondContact O-N 2.93Å; R91-R93 PolarHBondContact O-N 3.45Å; R91-R94 WeakPolarHBondContact O-CB 3.49Å; R91-R94 PolarHBondContact O-N 3.48Å; R91-R94 VanDerWaalsContact O-N 3.08Å
92	L	73.4	Confident	84.4	Confident	27 Å²	27	67.4 Å²	67.4	14%	0.141	33%	0.331	C	S	.	.	H	α-helix	trans	-68.3	-24.8	-176.8	-68.6	173	0	0	0	113.1	E88 F89 R94 T95 K479 L484	E88-L92 HydrophobicContact CG-CD1 3.77Å; E88-L92 HydrophobicContact CG-CG 4.2Å; E88-L92 WeakPolarHBondContact O-CB 3.46Å; E88-L92 WeakPolarHBondContact O-CG 3.46Å; E88-L92 PolarHBondContact O-N 3.12Å; E88-L92 WeakPolarHBondContact OE1-CD1 3.38Å; E88-L92 WeakPolarHBondContact OE1-CG 3.21Å; F89-L92 PolarHBondContact O-N 3.45Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 3.04Å; L92-T95 WeakPolarHBondContact O-CB 3.19Å; L92-T95 PolarHBondContact O-N 3.25Å; L92-K479 PolarHBondContact O-NZ 3.43Å; L92-L484 HydrophobicContact CB-CB 4.35Å; L92-L484 HydrophobicContact CB-CD1 4.07Å; L92-L484 HydrophobicContact CB-CD2 3.75Å; L92-L484 HydrophobicContact CB-CG 4.28Å; L92-L484 HydrophobicContact CD1-CB 3.94Å; L92-L484 HydrophobicContact CD1-CD2 4.19Å; L92-L484 WeakPolarHBondContact CD1-O 3.45Å
93	R	74.3	Confident	84.7	Confident	92 Å²	92	70.7 Å²	70.7	35%	0.347	35%	0.347	S	S	.	.	H	α-helix	trans	-68.8	-26.2	173.3	-172	167.7	150	-130.8	-15.2	112.9	F89 R91 T95 L484	F89-R93 VanDerWaalsContact O-CB 3.22Å; F89-R93 WeakPolarHBondContact O-CB 3.47Å; F89-R93 PolarHBondContact O-N 2.92Å; R91-R93 PolarHBondContact O-N 3.45Å; R93-T95 VanDerWaalsContact C-N 3.3Å; R93-L484 HydrophobicContact CB-CD1 4.44Å
94	R	73.8	Confident	84.8	Confident	216 Å²	216	70.1 Å²	70.1	82%	0.815	34%	0.339	S	S	*	.	H	α-helix	trans	-70.8	-26.7	172.2	-64.1	172.3	-178.2	-180	-0	112.4	L90 R91 L92 R96	L90-R94 WeakPolarHBondContact O-CG 3.29Å; R91-R94 WeakPolarHBondContact O-CB 3.49Å; R91-R94 PolarHBondContact O-N 3.48Å; R91-R94 VanDerWaalsContact O-N 3.08Å; L92-R94 VanDerWaalsContact C-N 3.27Å; L92-R94 PolarHBondContact O-N 3.04Å; R94-R96 PolarHBondContact O-N 3.31Å
95	T	76.2	Confident	85	Confident	75 Å²	75	70.4 Å²	70.4	46%	0.46	33%	0.334	S	S	.	.	S	Bend	trans	-67.1	130.8	175.2	-48.7	0	0	0	0	109.6	L92 R93 L97 K479	L92-T95 WeakPolarHBondContact O-CB 3.19Å; L92-T95 PolarHBondContact O-N 3.25Å; R93-T95 VanDerWaalsContact C-N 3.3Å; T95-L97 PolarHBondContact O-N 3.01Å; T95-K479 PolarHBondContact O-NZ 3.09Å
96	R	80.7	Confident	85.2	Confident	228 Å²	228	69.3 Å²	69.3	86%	0.86	33%	0.329	S	S	*	.			trans	-82.8	114.6	171.3	-76.8	178.3	146.4	-174	-7.6	108.8	R94	R94-R96 PolarHBondContact O-N 3.31Å
97	L	85.2	Confident	85.4	Confident	28 Å²	28	69.5 Å²	69.5	15%	0.147	33%	0.33	C	S	.	.			trans	-75.3	139	170.4	-77.6	169.4	0	0	0	109	T95 D101 Y167 F169 K479	T95-L97 PolarHBondContact O-N 3.01Å; L97-D101 HydrophobicContact CD2-CB 4.22Å; L97-Y167 HydrophobicContact CD1-CD1 3.53Å; L97-Y167 HydrophobicContact CD1-CD2 4.34Å; L97-Y167 HydrophobicContact CD1-CE1 3.97Å; L97-Y167 HydrophobicContact CD1-CG 3.74Å; L97-F169 HydrophobicContact CB-CD1 4.37Å; L97-K479 HydrophobicContact CD1-CD 4.15Å; L97-K479 HydrophobicContact CD1-CG 4.49Å
98	T	89.6	Confident	85.6	Confident	63 Å²	63	65.9 Å²	65.9	39%	0.387	31%	0.307	S	S	.	.			trans	-136.8	168.1	180	68.4	0	0	0	0	109.5	A100 D101 F102	T98-A100 PolarHBondContact O-N 3.01Å; T98-A100 VanDerWaalsContact O-N 3.1Å; T98-A100 PolarHBondContact OG1-N 3.16Å; T98-D101 PolarHBondContact N-OD2 3.44Å; T98-D101 WeakPolarHBondContact O-CB 3.49Å; T98-D101 PolarHBondContact O-N 3.32Å; T98-D101 VanDerWaalsContact O-N 3.11Å; T98-D101 PolarHBondContact OG1-OD2 2.94Å; T98-D101 VanDerWaalsContact OG1-OD2 3.1Å; T98-F102 WeakPolarHBondContact O-CD2 3.11Å
99	V	90.8	Very high	85.7	Confident	26 Å²	26	64.9 Å²	64.9	16%	0.158	31%	0.307	C	S	.	.	G	3₁₀ helix	trans	-54.3	-29.5	172.5	-176.1	0	0	0	0	112.5	D101 F102 F169 Y176 L434	V99-D101 PolarHBondContact O-N 3.48Å; V99-F102 PolarHBondContact O-N 3.43Å; V99-F169 HydrophobicContact CG2-CE2 3.76Å; V99-Y176 HydrophobicContact CG2-CD1 4.11Å; V99-Y176 HydrophobicContact CG2-CD2 4.11Å; V99-Y176 HydrophobicContact CG2-CE1 3.52Å; V99-Y176 HydrophobicContact CG2-CE2 3.53Å; V99-Y176 HydrophobicContact CG2-CG 4.38Å; V99-Y176 WeakPolarHBondContact CG2-OH 3.36Å; V99-L434 HydrophobicContact CG1-CB 3.54Å; V99-L434 HydrophobicContact CG1-CD1 3.37Å; V99-L434 HydrophobicContact CG1-CD2 4.28Å; V99-L434 HydrophobicContact CG1-CG 3.87Å
100	A	91.9	Very high	85.7	Confident	48 Å²	48	69.6 Å²	69.6	40%	0.397	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-69.4	-19.1	-177.5	0	0	0	0	0	113.8	T98 F102 K122	T98-A100 PolarHBondContact O-N 3.01Å; T98-A100 VanDerWaalsContact O-N 3.1Å; T98-A100 PolarHBondContact OG1-N 3.16Å; A100-F102 PolarHBondContact O-N 3.41Å; A100-K122 WeakPolarHBondContact O-CE 3.45Å; A100-K122 PolarHBondContact O-NZ 2.74Å
101	D	92.6	Very high	85.3	Confident	54 Å²	54	68.6 Å²	68.6	29%	0.289	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	-78	-8.3	177.8	-57.2	-58.4	0	0	0	112.6	L97 T98 V99 K122	L97-D101 HydrophobicContact CD2-CB 4.22Å; T98-D101 PolarHBondContact N-OD2 3.44Å; T98-D101 WeakPolarHBondContact O-CB 3.49Å; T98-D101 PolarHBondContact O-N 3.32Å; T98-D101 VanDerWaalsContact O-N 3.11Å; T98-D101 PolarHBondContact OG1-OD2 2.94Å; T98-D101 VanDerWaalsContact OG1-OD2 3.1Å; V99-D101 PolarHBondContact O-N 3.48Å; D101-K122 PolarHBondContact O-N 3.44Å
102	F	94.8	Very high	84.8	Confident	4 Å²	4	63.4 Å²	63.4	2%	0.018	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	143.7	-179.2	-60.2	-90	0	0	0	110.8	T98 V99 A100 V119 Q120 K121 Y128 M130 Y167 F169 V178	T98-F102 WeakPolarHBondContact O-CD2 3.11Å; V99-F102 PolarHBondContact O-N 3.43Å; A100-F102 PolarHBondContact O-N 3.41Å; F102-V119 HydrophobicContact CB-CB 4.22Å; F102-V119 HydrophobicContact CB-CG2 4.43Å; F102-V119 HydrophobicContact CD1-CB 4.43Å; F102-V119 HydrophobicContact CD1-CG2 3.82Å; F102-V119 HydrophobicContact CG-CG2 4.44Å; F102-Q120 CarbonylContact C-O 3.55Å; F102-Q120 WeakPolarHBondContact CA-O 3.38Å; F102-K121 HydrophobicContact CD1-CB 4.03Å; F102-K121 HydrophobicContact CE1-CB 3.94Å; F102-K121 HydrophobicContact CE1-CD 4.12Å; F102-K121 HydrophobicContact CE1-CG 4.21Å; F102-K121 HydrophobicContact CZ-CD 4.39Å; F102-Y128 HydrophobicContact CE1-CD2 4.23Å; F102-M130 HydrophobicContact CB-CE 3.74Å; F102-M130 HydrophobicContact CD1-CE 3.95Å; F102-M130 HydrophobicContact CD2-CE 3.51Å; F102-M130 HydrophobicContact CE1-CE 4.45Å; F102-M130 HydrophobicContact CE2-CE 4.07Å; F102-M130 HydrophobicContact CG-CE 3.44Å; F102-M130 VanDerWaalsContact CG-CE 3.44Å; F102-Y167 HydrophobicContact CZ-CD2 4.02Å; F102-Y167 HydrophobicContact CZ-CE2 4.35Å; F102-F169 HydrophobicContact CD2-CE1 4.33Å; F102-F169 HydrophobicContact CD2-CZ 4.07Å; F102-F169 AromaticContact CE2-CE1 3.63Å; F102-F169 HydrophobicContact CE2-CE1 3.63Å; F102-F169 AromaticContact CE2-CZ 3.83Å; F102-F169 HydrophobicContact CE2-CZ 3.83Å; F102-F169 HydrophobicContact CZ-CE1 4.27Å; F102-V178 HydrophobicContact CE1-CG1 3.98Å; F102-V178 HydrophobicContact CE1-CG2 4.3Å; F102-V178 HydrophobicContact CE2-CG2 4.43Å; F102-V178 HydrophobicContact CZ-CG1 4.3Å; F102-V178 HydrophobicContact CZ-CG2 4Å
103	E	94.6	Very high	84.6	Confident	96 Å²	96	62.5 Å²	62.5	45%	0.449	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	116.9	172	-179	163.8	-170.8	0	0	109	L105 V119 Q120 K122	E103-L105 HydrophobicContact CG-CD2 4.43Å; E103-L105 PolarHBondContact O-N 3.38Å; E103-V119 CarbonylContact O-C 3.57Å; E103-V119 VanDerWaalsContact O-CA 3.23Å; E103-V119 WeakPolarHBondContact O-CA 3.4Å; E103-Q120 PolarHBondContact N-O 3.16Å; E103-Q120 PolarHBondContact O-N 3.06Å; E103-K122 HydrophobicContact CB-CG 4.37Å
104	P	93.4	Very high	84.9	Confident	33 Å²	33	58.6 Å²	58.6	21%	0.214	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	126.2	176.5	28.8	-31.2	0	0	0	110.7	L432 L434	P104-L432 WeakPolarHBondContact CG-O 3.19Å; P104-L434 HydrophobicContact CB-CD1 4.13Å; P104-L434 HydrophobicContact CB-CG 4.46Å; P104-L434 HydrophobicContact CG-CD1 4.01Å; P104-L434 HydrophobicContact CG-CG 4.27Å
105	L	92.3	Very high	85.6	Confident	55 Å²	55	50 Å²	50	29%	0.288	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	-53.4	179.8	-58.2	-178.3	0	0	0	111.4	E103 L118 Q120 D419	E103-L105 HydrophobicContact CG-CD2 4.43Å; E103-L105 PolarHBondContact O-N 3.38Å; L105-L118 HydrophobicContact CB-CB 4.42Å; L105-L118 HydrophobicContact CB-CD2 4.3Å; L105-L118 HydrophobicContact CB-CG 4.4Å; L105-L118 HydrophobicContact CD1-CD2 4.11Å; L105-L118 HydrophobicContact CD1-CG 4.24Å; L105-L118 PolarHBondContact N-O 3.45Å; L105-Q120 HydrophobicContact CD1-CB 4.14Å; L105-Q120 HydrophobicContact CD2-CB 4.39Å; L105-Q120 HydrophobicContact CG-CB 4.35Å; L105-D419 HydrophobicContact CD1-CB 4.5Å
106	K	91.3	Very high	86.3	Confident	59 Å²	59	47.8 Å²	47.8	26%	0.257	26%	0.257	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	152.4	-175.9	-171.5	170.9	169.6	-177.2	0	111.4	R117 L118 T421	K106-R117 CarbonylContact O-C 3.59Å; K106-R117 VanDerWaalsContact O-CA 3.3Å; K106-R117 WeakPolarHBondContact O-CA 3.36Å; K106-L118 HydrophobicContact CB-CB 4.48Å; K106-L118 PolarHBondContact N-O 2.84Å; K106-L118 PolarHBondContact O-N 2.95Å; K106-T421 HydrophobicContact CD-CG2 4.07Å; K106-T421 VanDerWaalsContact CD-OG1 3.25Å; K106-T421 WeakPolarHBondContact CD-OG1 3.21Å; K106-T421 PolarHBondContact NZ-OG1 2.99Å
107	V	91.2	Very high	86.9	Confident	6 Å²	6	37.6 Å²	37.6	4%	0.036	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	124.7	167.1	-178.1	0	0	0	0	108.6	R110 E115 R117 F427 V430 L432	V107-R110 HydrophobicContact CG1-CG 4.31Å; V107-E115 HydrophobicContact CG1-CB 4.4Å; V107-R117 HydrophobicContact CG2-CG 4.19Å; V107-F427 HydrophobicContact CG1-CD2 4.23Å; V107-F427 HydrophobicContact CG1-CG 4.5Å; V107-V430 HydrophobicContact CB-CG2 4.42Å; V107-V430 HydrophobicContact CG2-CB 3.97Å; V107-V430 HydrophobicContact CG2-CG1 3.69Å; V107-V430 HydrophobicContact CG2-CG2 4.27Å; V107-L432 HydrophobicContact CG2-CD2 4.16Å
108	I	89.7	Confident	87.4	Confident	15 Å²	15	36.4 Å²	36.4	8%	0.077	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	-9	-175.9	60.4	172.8	0	0	0	113	V116 L118 A129 F181 T421 F424	I108-V116 HydrophobicContact CD1-CG1 3.89Å; I108-V116 HydrophobicContact CG1-CB 4.11Å; I108-V116 HydrophobicContact CG1-CG1 3.78Å; I108-V116 WeakPolarHBondContact CG1-O 3.37Å; I108-V116 PolarHBondContact N-O 3.22Å; I108-L118 HydrophobicContact CG2-CB 3.98Å; I108-A129 HydrophobicContact CD1-CB 4.12Å; I108-F181 HydrophobicContact CD1-CD2 3.96Å; I108-F181 HydrophobicContact CD1-CE2 3.9Å; I108-T421 HydrophobicContact CG2-CG2 3.8Å; I108-F424 HydrophobicContact CB-CD1 3.85Å; I108-F424 HydrophobicContact CB-CE1 4.19Å; I108-F424 HydrophobicContact CB-CG 4.18Å; I108-F424 HydrophobicContact CD1-CE1 4.27Å; I108-F424 HydrophobicContact CG2-CG 4.42Å; I108-F424 WeakPolarHBondContact O-CD1 3.45Å
109	G	85	Confident	87.7	Confident	15 Å²	15	33.4 Å²	33.4	16%	0.155	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.4	154.4	175.2	0	0	0	0	0	112.5	E115 V116	G109-E115 CarbonylContact O-C 3.47Å; G109-E115 WeakPolarHBondContact O-CA 3.37Å; G109-E115 WeakPolarHBondContact O-CB 3.28Å; G109-V116 PolarHBondContact N-O 3.47Å; G109-V116 VanDerWaalsContact N-O 3.17Å; G109-V116 PolarHBondContact O-N 3.37Å
110	R	79.8	Confident	87.9	Confident	112 Å²	112	35.3 Å²	35.3	42%	0.423	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	133	174.8	-76.7	-177.4	166.3	-178.6	-5.5	109.8	V107 E115 Y293 F427 V430	V107-R110 HydrophobicContact CG1-CG 4.31Å; R110-E115 HydrophobicContact CG-CB 4.22Å; R110-Y293 HydrophobicContact CB-CD1 4.46Å; R110-Y293 WeakPolarHBondContact O-CD1 3.41Å; R110-F427 HydrophobicContact CB-CE1 4.18Å; R110-F427 HydrophobicContact CG-CD1 4.17Å; R110-F427 HydrophobicContact CG-CE1 4.12Å; R110-V430 VanDerWaalsContact NH2-CG1 3.32Å
111	G	71.9	Confident	88	Confident	47 Å²	47	33.7 Å²	33.7	49%	0.485	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	178	177.2	0	0	0	0	0	112	F113 G114	G111-F113 PolarHBondContact O-N 3.22Å; G111-G114 PolarHBondContact N-O 2.98Å; G111-G114 PolarHBondContact O-N 3.37Å
112	A	67.7	Low	88	Confident	33 Å²	33	37 Å²	37	27%	0.273	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.7	-178.3	0	0	0	0	0	114.6	K141 T295	A112-K141 PolarHBondContact O-NZ 3.44Å; A112-T295 HydrophobicContact CB-CG2 4.47Å
113	F	70.8	Confident	87.7	Confident	7 Å²	7	40.4 Å²	40.4	3%	0.031	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-122.7	0	-172.1	-61.1	-71.2	0	0	0	114.5	G111 L133 R134 D137 M138 K141 Q143 L250	G111-F113 PolarHBondContact O-N 3.22Å; F113-L133 HydrophobicContact CB-CD2 4.01Å; F113-R134 PolarHBondContact O-N 2.98Å; F113-D137 HydrophobicContact CD1-CB 3.78Å; F113-D137 HydrophobicContact CE1-CB 4.39Å; F113-M138 HydrophobicContact CB-CE 3.52Å; F113-M138 HydrophobicContact CD1-CE 2.84Å; F113-M138 HydrophobicContact CD2-CE 3.84Å; F113-M138 HydrophobicContact CE1-CE 3.34Å; F113-M138 HydrophobicContact CE2-CE 4.33Å; F113-M138 HydrophobicContact CG-CE 3.08Å; F113-M138 HydrophobicContact CZ-CE 4.11Å; F113-K141 HydrophobicContact CE1-CB 4.28Å; F113-K141 HydrophobicContact CE1-CD 3.52Å; F113-K141 HydrophobicContact CE1-CG 4.26Å; F113-K141 HydrophobicContact CZ-CD 3.9Å; F113-Q143 HydrophobicContact CE1-CG 4.42Å; F113-Q143 HydrophobicContact CZ-CG 4.32Å; F113-L250 HydrophobicContact CD2-CD1 4.25Å; F113-L250 HydrophobicContact CE1-CD1 4.42Å; F113-L250 HydrophobicContact CE1-CD2 4.41Å; F113-L250 HydrophobicContact CE2-CB 4.13Å; F113-L250 HydrophobicContact CE2-CD1 3.17Å; F113-L250 HydrophobicContact CE2-CD2 4.26Å; F113-L250 HydrophobicContact CE2-CG 4.01Å; F113-L250 HydrophobicContact CZ-CB 4.13Å; F113-L250 HydrophobicContact CZ-CD1 3.27Å; F113-L250 HydrophobicContact CZ-CD2 3.5Å; F113-L250 HydrophobicContact CZ-CG 3.78Å
114	G	80.4	Confident	87.4	Confident	10 Å²	10	37.4 Å²	37.4	10%	0.103	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	155.6	-148.8	-173.1	0	0	0	0	0	111.6	G111 V132	G111-G114 PolarHBondContact N-O 2.98Å; G111-G114 PolarHBondContact O-N 3.37Å; G114-V132 VanDerWaalsContact CA-O 3.25Å; G114-V132 WeakPolarHBondContact CA-O 3.5Å
115	E	87.8	Confident	87.3	Confident	36 Å²	36	37.2 Å²	37.2	17%	0.168	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151	159.3	-167.6	64	-167.7	177.2	0	0	110.8	V107 G109 R110 R117 V132	V107-E115 HydrophobicContact CG1-CB 4.4Å; G109-E115 CarbonylContact O-C 3.47Å; G109-E115 WeakPolarHBondContact O-CA 3.37Å; G109-E115 WeakPolarHBondContact O-CB 3.28Å; R110-E115 HydrophobicContact CG-CB 4.22Å; E115-R117 HydrophobicContact CG-CG 4.21Å; E115-R117 IonicContact OE1-CZ 3.91Å; E115-R117 IonicContact OE1-NE 2.89Å; E115-R117 PolarHBondContact OE1-NE 3Å; E115-R117 IonicContact OE1-NH2 2.62Å; E115-R117 PolarHBondContact OE1-NH2 2.96Å; E115-V132 PolarHBondContact N-O 3.27Å; E115-V132 PolarHBondContact O-N 2.6Å
116	V	91.4	Very high	87.2	Confident	29 Å²	29	37.4 Å²	37.4	18%	0.176	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.1	175.6	-171.1	0	0	0	0	107.6	I108 G109 A129 M130 K131	I108-V116 HydrophobicContact CD1-CG1 3.89Å; I108-V116 HydrophobicContact CG1-CB 4.11Å; I108-V116 HydrophobicContact CG1-CG1 3.78Å; I108-V116 WeakPolarHBondContact CG1-O 3.37Å; I108-V116 PolarHBondContact N-O 3.22Å; G109-V116 PolarHBondContact N-O 3.47Å; G109-V116 VanDerWaalsContact N-O 3.17Å; G109-V116 PolarHBondContact O-N 3.37Å; V116-A129 HydrophobicContact CG1-CB 4.15Å; V116-M130 CarbonylContact C-O 3.55Å; V116-M130 WeakPolarHBondContact CA-O 3.47Å; V116-K131 HydrophobicContact CG2-CB 4.24Å; V116-K131 HydrophobicContact CG2-CG 4.11Å
117	R	93.5	Very high	87.4	Confident	14 Å²	14	35.8 Å²	35.8	5%	0.053	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	135.8	-178.9	-56.9	-174.2	177.3	-154.3	-6.1	110	K106 V107 E115 V119 M130 D431 L432 L434	K106-R117 CarbonylContact O-C 3.59Å; K106-R117 VanDerWaalsContact O-CA 3.3Å; K106-R117 WeakPolarHBondContact O-CA 3.36Å; V107-R117 HydrophobicContact CG2-CG 4.19Å; E115-R117 HydrophobicContact CG-CG 4.21Å; E115-R117 IonicContact OE1-CZ 3.91Å; E115-R117 IonicContact OE1-NE 2.89Å; E115-R117 PolarHBondContact OE1-NE 3Å; E115-R117 IonicContact OE1-NH2 2.62Å; E115-R117 PolarHBondContact OE1-NH2 2.96Å; R117-V119 HydrophobicContact CB-CG1 4.16Å; R117-V119 PolarHBondContact O-N 3.22Å; R117-M130 PolarHBondContact N-O 2.71Å; R117-M130 PolarHBondContact O-N 2.77Å; R117-D431 PolarHBondContact NH2-O 3.22Å; R117-L432 PolarHBondContact NH1-O 3.38Å; R117-L434 VanDerWaalsContact NH1-CD2 3.33Å; R117-L434 VanDerWaalsContact NH1-CG 3.35Å
118	L	95	Very high	87.6	Confident	3 Å²	3	35.7 Å²	35.7	2%	0.016	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	126	161.4	-169	68.9	0	0	0	108.4	L105 K106 I108 V127 F181 D419 T421	L105-L118 HydrophobicContact CB-CB 4.42Å; L105-L118 HydrophobicContact CB-CD2 4.3Å; L105-L118 HydrophobicContact CB-CG 4.4Å; L105-L118 HydrophobicContact CD1-CD2 4.11Å; L105-L118 HydrophobicContact CD1-CG 4.24Å; L105-L118 PolarHBondContact N-O 3.45Å; K106-L118 HydrophobicContact CB-CB 4.48Å; K106-L118 PolarHBondContact N-O 2.84Å; K106-L118 PolarHBondContact O-N 2.95Å; I108-L118 HydrophobicContact CG2-CB 3.98Å; L118-V127 HydrophobicContact CD1-CG1 3.26Å; L118-V127 HydrophobicContact CD2-CG1 4.28Å; L118-V127 HydrophobicContact CG-CG1 3.8Å; L118-F181 HydrophobicContact CD1-CB 4.04Å; L118-F181 HydrophobicContact CD1-CD1 3.66Å; L118-F181 HydrophobicContact CD1-CD2 3.41Å; L118-F181 VanDerWaalsContact CD1-CD2 3.41Å; L118-F181 HydrophobicContact CD1-CE1 3.89Å; L118-F181 HydrophobicContact CD1-CE2 3.67Å; L118-F181 HydrophobicContact CD1-CG 3.4Å; L118-F181 VanDerWaalsContact CD1-CG 3.4Å; L118-F181 HydrophobicContact CD1-CZ 3.89Å; L118-D419 HydrophobicContact CD2-CB 4.01Å; L118-T421 HydrophobicContact CD2-CG2 3.77Å
119	V	95.8	Very high	87.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	148.3	-178.6	-59.4	0	0	0	0	110.9	F102 E103 R117 V127 Y128 M130	F102-V119 HydrophobicContact CB-CB 4.22Å; F102-V119 HydrophobicContact CB-CG2 4.43Å; F102-V119 HydrophobicContact CD1-CB 4.43Å; F102-V119 HydrophobicContact CD1-CG2 3.82Å; F102-V119 HydrophobicContact CG-CG2 4.44Å; E103-V119 CarbonylContact O-C 3.57Å; E103-V119 VanDerWaalsContact O-CA 3.23Å; E103-V119 WeakPolarHBondContact O-CA 3.4Å; R117-V119 HydrophobicContact CB-CG1 4.16Å; R117-V119 PolarHBondContact O-N 3.22Å; V119-V127 CarbonylContact O-C 3.59Å; V119-V127 WeakPolarHBondContact O-CA 3.45Å; V119-Y128 WeakPolarHBondContact CG2-O 3.47Å; V119-Y128 PolarHBondContact N-O 3.43Å; V119-Y128 PolarHBondContact O-N 2.9Å; V119-M130 HydrophobicContact CB-CB 4.43Å; V119-M130 HydrophobicContact CG1-CB 3.67Å; V119-M130 HydrophobicContact CG1-CE 4.28Å; V119-M130 HydrophobicContact CG1-SD 4.2Å; V119-M130 HydrophobicContact CG2-CB 3.8Å; V119-M130 HydrophobicContact CG2-CE 4.18Å
120	Q	95.2	Very high	88.3	Confident	65 Å²	65	34.7 Å²	34.7	30%	0.304	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	129.2	170.1	-163.9	175.5	33.8	0	0	110	F102 E103 L105 K122 G125 H126	F102-Q120 CarbonylContact C-O 3.55Å; F102-Q120 WeakPolarHBondContact CA-O 3.38Å; E103-Q120 PolarHBondContact N-O 3.16Å; E103-Q120 PolarHBondContact O-N 3.06Å; L105-Q120 HydrophobicContact CD1-CB 4.14Å; L105-Q120 HydrophobicContact CD2-CB 4.39Å; L105-Q120 HydrophobicContact CG-CB 4.35Å; Q120-K122 PolarHBondContact O-N 2.86Å; Q120-G125 WeakPolarHBondContact CG-O 3.42Å; Q120-G125 PolarHBondContact NE2-O 3.47Å; Q120-H126 WeakPolarHBondContact CA-O 3.28Å
121	K	93.8	Very high	88.8	Confident	14 Å²	14	30 Å²	30	6%	0.061	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.2	175.2	177.9	163.8	-178.2	-72.5	0	109.6	F102 D123 T124 G125 H126 Y128 Y167	F102-K121 HydrophobicContact CD1-CB 4.03Å; F102-K121 HydrophobicContact CE1-CB 3.94Å; F102-K121 HydrophobicContact CE1-CD 4.12Å; F102-K121 HydrophobicContact CE1-CG 4.21Å; F102-K121 HydrophobicContact CZ-CD 4.39Å; K121-D123 VanDerWaalsContact CE-OD1 3.3Å; K121-D123 WeakPolarHBondContact CE-OD1 3.33Å; K121-D123 WeakPolarHBondContact CG-OD1 3.49Å; K121-D123 IonicContact NZ-OD1 2.61Å; K121-D123 PolarHBondContact NZ-OD1 3.32Å; K121-D123 IonicContact NZ-OD2 3.66Å; K121-D123 PolarHBondContact NZ-OD2 2.78Å; K121-D123 PolarHBondContact O-N 2.73Å; K121-T124 PolarHBondContact O-N 3.02Å; K121-G125 WeakPolarHBondContact O-CA 3.48Å; K121-G125 PolarHBondContact O-N 3.14Å; K121-H126 PolarHBondContact N-O 2.82Å; K121-Y128 HydrophobicContact CB-CD2 4.07Å; K121-Y128 HydrophobicContact CB-CE2 3.62Å; K121-Y128 HydrophobicContact CD-CE2 4Å; K121-Y128 HydrophobicContact CG-CE2 4.45Å; K121-Y167 HydrophobicContact CD-CE2 4.3Å
122	K	93	Very high	89.8	Confident	124 Å²	124	28.2 Å²	28.2	54%	0.539	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-35.6	-164.3	-70.4	178.5	178.6	169.9	0	115.1	A100 D101 E103 Q120	A100-K122 WeakPolarHBondContact O-CE 3.45Å; A100-K122 PolarHBondContact O-NZ 2.74Å; D101-K122 PolarHBondContact O-N 3.44Å; E103-K122 HydrophobicContact CB-CG 4.37Å; Q120-K122 PolarHBondContact O-N 2.86Å
123	D	88.6	Confident	90.7	Very high	76 Å²	76	26.9 Å²	26.9	41%	0.406	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-15.1	-175.6	68	-48.3	0	0	0	113.7	K121 R487	K121-D123 VanDerWaalsContact CE-OD1 3.3Å; K121-D123 WeakPolarHBondContact CE-OD1 3.33Å; K121-D123 WeakPolarHBondContact CG-OD1 3.49Å; K121-D123 IonicContact NZ-OD1 2.61Å; K121-D123 PolarHBondContact NZ-OD1 3.32Å; K121-D123 IonicContact NZ-OD2 3.66Å; K121-D123 PolarHBondContact NZ-OD2 2.78Å; K121-D123 PolarHBondContact O-N 2.73Å; D123-R487 IonicContact OD2-CZ 2.87Å; D123-R487 IonicContact OD2-NE 2.77Å; D123-R487 IonicContact OD2-NH2 3.33Å; D123-R487 PolarHBondContact OD2-NH2 3.31Å
124	T	88.4	Confident	91.5	Very high	32 Å²	32	31.5 Å²	31.5	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.6	-13	179.1	62.5	0	0	0	0	113.8	K121 H126 R487	K121-T124 PolarHBondContact O-N 3.02Å; T124-H126 WeakPolarHBondContact CB-ND1 3.47Å; T124-H126 PolarHBondContact O-N 2.87Å; T124-H126 VanDerWaalsContact O-N 3.17Å; T124-H126 PolarHBondContact O-ND1 2.78Å; T124-H126 PolarHBondContact OG1-N 3.02Å; T124-H126 PolarHBondContact OG1-ND1 2.56Å; T124-R487 HydrophobicContact CG2-CG 3.97Å
125	G	90.4	Very high	91.7	Very high	30 Å²	30	31 Å²	31	31%	0.309	16%	0.156	S	C	.	.			trans	67.9	4.4	-173.6	0	0	0	0	0	114.5	Q120 K121	Q120-G125 WeakPolarHBondContact CG-O 3.42Å; Q120-G125 PolarHBondContact NE2-O 3.47Å; K121-G125 WeakPolarHBondContact O-CA 3.48Å; K121-G125 PolarHBondContact O-N 3.14Å
126	H	91.6	Very high	91.5	Very high	59 Å²	59	31.4 Å²	31.4	27%	0.273	16%	0.159	S	C	.	.			trans	-76	139.9	-176.9	-73.6	54.4	0	0	0	111	Q120 K121 T124 Y128 Q486	Q120-H126 WeakPolarHBondContact CA-O 3.28Å; K121-H126 PolarHBondContact N-O 2.82Å; T124-H126 WeakPolarHBondContact CB-ND1 3.47Å; T124-H126 PolarHBondContact O-N 2.87Å; T124-H126 VanDerWaalsContact O-N 3.17Å; T124-H126 PolarHBondContact O-ND1 2.78Å; T124-H126 PolarHBondContact OG1-N 3.02Å; T124-H126 PolarHBondContact OG1-ND1 2.56Å; H126-Y128 HydrophobicContact CB-CE2 3.72Å; H126-Y128 WeakPolarHBondContact O-CD2 3.4Å; H126-Q486 PolarHBondContact CD2-OE1 2.95Å
127	V	94.1	Very high	90.9	Very high	25 Å²	25	31.3 Å²	31.3	15%	0.152	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	139	-179.6	179.8	0	0	0	0	110	L118 V119 F181 I418 D419	L118-V127 HydrophobicContact CD1-CG1 3.26Å; L118-V127 HydrophobicContact CD2-CG1 4.28Å; L118-V127 HydrophobicContact CG-CG1 3.8Å; V119-V127 CarbonylContact O-C 3.59Å; V119-V127 WeakPolarHBondContact O-CA 3.45Å; V127-F181 HydrophobicContact CG1-CB 4.33Å; V127-F181 HydrophobicContact CG1-CD1 4.14Å; V127-F181 HydrophobicContact CG1-CG 4.41Å; V127-I418 HydrophobicContact CG2-CD1 4.14Å; V127-I418 HydrophobicContact CG2-CG1 4.41Å; V127-D419 HydrophobicContact CG2-CB 4.39Å
128	Y	95.2	Very high	90.2	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.016	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	160.2	179.5	-59.6	-82.3	0	0	0	110.9	F102 V119 K121 H126 Y166 Y167 V178 M179 Q486	F102-Y128 HydrophobicContact CE1-CD2 4.23Å; V119-Y128 WeakPolarHBondContact CG2-O 3.47Å; V119-Y128 PolarHBondContact N-O 3.43Å; V119-Y128 PolarHBondContact O-N 2.9Å; K121-Y128 HydrophobicContact CB-CD2 4.07Å; K121-Y128 HydrophobicContact CB-CE2 3.62Å; K121-Y128 HydrophobicContact CD-CE2 4Å; K121-Y128 HydrophobicContact CG-CE2 4.45Å; H126-Y128 HydrophobicContact CB-CE2 3.72Å; H126-Y128 WeakPolarHBondContact O-CD2 3.4Å; Y128-Y166 AromaticContact CD1-CD2 3.71Å; Y128-Y166 HydrophobicContact CD1-CD2 3.71Å; Y128-Y166 HydrophobicContact CD1-CE2 4.15Å; Y128-Y166 HydrophobicContact CD1-CG 4.46Å; Y128-Y166 AromaticContact CE1-CD2 3.53Å; Y128-Y166 HydrophobicContact CE1-CD2 3.53Å; Y128-Y166 AromaticContact CE1-CE2 3.89Å; Y128-Y166 HydrophobicContact CE1-CE2 3.89Å; Y128-Y166 AromaticContact CE1-CG 3.95Å; Y128-Y166 HydrophobicContact CE1-CG 3.95Å; Y128-Y167 HydrophobicContact CE1-CE2 4.37Å; Y128-Y167 HydrophobicContact CE2-CE2 4.44Å; Y128-Y167 PolarHBondContact OH-OH 3.36Å; Y128-V178 HydrophobicContact CD1-CG1 4Å; Y128-V178 HydrophobicContact CD2-CG1 4.22Å; Y128-V178 HydrophobicContact CG-CG1 3.66Å; Y128-M179 WeakPolarHBondContact CA-O 3.04Å; Y128-M179 WeakPolarHBondContact CB-O 3.33Å; Y128-Q486 PolarHBondContact OH-OE1 2.81Å
129	A	94.8	Very high	89.4	Confident	8 Å²	8	32.1 Å²	32.1	7%	0.066	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	121.9	164.3	0	0	0	0	0	109.4	I108 V116 M179	I108-A129 HydrophobicContact CD1-CB 4.12Å; V116-A129 HydrophobicContact CG1-CB 4.15Å; A129-M179 PolarHBondContact N-O 3.36Å; A129-M179 PolarHBondContact O-N 3.39Å
130	M	94.8	Very high	88.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	110.8	177.2	-178.3	-178.2	-72.9	0	0	110.4	F102 V116 R117 V119 V132 F169 Y176 L177 V178	F102-M130 HydrophobicContact CB-CE 3.74Å; F102-M130 HydrophobicContact CD1-CE 3.95Å; F102-M130 HydrophobicContact CD2-CE 3.51Å; F102-M130 HydrophobicContact CE1-CE 4.45Å; F102-M130 HydrophobicContact CE2-CE 4.07Å; F102-M130 HydrophobicContact CG-CE 3.44Å; F102-M130 VanDerWaalsContact CG-CE 3.44Å; V116-M130 CarbonylContact C-O 3.55Å; V116-M130 WeakPolarHBondContact CA-O 3.47Å; R117-M130 PolarHBondContact N-O 2.71Å; R117-M130 PolarHBondContact O-N 2.77Å; V119-M130 HydrophobicContact CB-CB 4.43Å; V119-M130 HydrophobicContact CG1-CB 3.67Å; V119-M130 HydrophobicContact CG1-CE 4.28Å; V119-M130 HydrophobicContact CG1-SD 4.2Å; V119-M130 HydrophobicContact CG2-CB 3.8Å; V119-M130 HydrophobicContact CG2-CE 4.18Å; M130-V132 HydrophobicContact CG-CG2 4.17Å; M130-V132 HydrophobicContact SD-CG2 4.35Å; M130-F169 HydrophobicContact CE-CE1 4.36Å; M130-F169 HydrophobicContact CE-CZ 3.77Å; M130-Y176 HydrophobicContact CG-CD1 4.22Å; M130-Y176 HydrophobicContact SD-CD1 3.7Å; M130-Y176 HydrophobicContact SD-CE1 4.3Å; M130-L177 CarbonylContact C-O 3.58Å; M130-L177 VanDerWaalsContact CA-O 3.29Å; M130-L177 WeakPolarHBondContact CA-O 3.25Å; M130-V178 HydrophobicContact CE-CG2 3.85Å; M130-V178 HydrophobicContact CG-CG2 4.36Å
131	K	91.6	Very high	87.3	Confident	13 Å²	13	37 Å²	37	6%	0.057	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.9	122.2	171	-172.8	170.2	179.3	-175.4	0	109.1	V116 L133 E150 Y176 L177 M179 D243	V116-K131 HydrophobicContact CG2-CB 4.24Å; V116-K131 HydrophobicContact CG2-CG 4.11Å; K131-L133 HydrophobicContact CG-CD2 4.24Å; K131-L133 HydrophobicContact CG-CG 4.34Å; K131-E150 IonicContact NZ-OE1 2.69Å; K131-E150 PolarHBondContact NZ-OE1 3.22Å; K131-E150 IonicContact NZ-OE2 2.62Å; K131-E150 PolarHBondContact NZ-OE2 3.01Å; K131-Y176 WeakPolarHBondContact O-CA 3.45Å; K131-L177 HydrophobicContact CB-CB 4.25Å; K131-L177 HydrophobicContact CD-CD1 4.38Å; K131-L177 PolarHBondContact N-O 3.15Å; K131-L177 PolarHBondContact O-N 2.91Å; K131-M179 HydrophobicContact CB-CE 3.86Å; K131-M179 HydrophobicContact CD-CE 4.39Å; K131-D243 IonicContact NZ-OD1 3.03Å; K131-D243 PolarHBondContact NZ-OD1 3.46Å; K131-D243 IonicContact NZ-OD2 2.9Å
132	V	91.7	Very high	86.5	Confident	10 Å²	10	44 Å²	44	6%	0.061	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	122.5	-179.9	-173.5	0	0	0	0	108.1	G114 E115 M130 N174 Y176 L434	G114-V132 VanDerWaalsContact CA-O 3.25Å; G114-V132 WeakPolarHBondContact CA-O 3.5Å; E115-V132 PolarHBondContact N-O 3.27Å; E115-V132 PolarHBondContact O-N 2.6Å; M130-V132 HydrophobicContact CG-CG2 4.17Å; M130-V132 HydrophobicContact SD-CG2 4.35Å; V132-N174 HydrophobicContact CG1-CB 3.98Å; V132-Y176 HydrophobicContact CB-CD1 4.48Å; V132-Y176 HydrophobicContact CB-CE1 4.36Å; V132-Y176 HydrophobicContact CG1-CD1 4.24Å; V132-Y176 HydrophobicContact CG1-CE1 3.72Å; V132-Y176 HydrophobicContact CG2-CD1 3.94Å; V132-Y176 HydrophobicContact CG2-CE1 3.9Å; V132-L434 HydrophobicContact CG2-CD2 4.34Å
133	L	87.5	Confident	85.6	Confident	6 Å²	6	38.5 Å²	38.5	3%	0.031	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	127.6	-178.1	-58.8	166.7	0	0	0	110.1	F113 K131 K135 N174 L175 L177 L246	F113-L133 HydrophobicContact CB-CD2 4.01Å; K131-L133 HydrophobicContact CG-CD2 4.24Å; K131-L133 HydrophobicContact CG-CG 4.34Å; L133-K135 PolarHBondContact O-N 2.89Å; L133-N174 CarbonylContact O-C 3.56Å; L133-N174 WeakPolarHBondContact O-CA 3.47Å; L133-L175 HydrophobicContact CB-CB 4.24Å; L133-L175 PolarHBondContact N-O 2.66Å; L133-L175 PolarHBondContact O-N 2.91Å; L133-L177 HydrophobicContact CD1-CD1 4.48Å; L133-L246 HydrophobicContact CD1-CD1 3.41Å; L133-L246 VanDerWaalsContact CD1-CD1 3.41Å; L133-L246 HydrophobicContact CD2-CD1 4Å; L133-L246 HydrophobicContact CG-CD1 4.35Å
134	R	86.3	Confident	85	Confident	103 Å²	103	35.9 Å²	35.9	39%	0.389	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	123.1	179.9	-66.6	-177.7	-66.4	-91	-3	110.9	F113 I136 D137 M138	F113-R134 PolarHBondContact O-N 2.98Å; R134-I136 VanDerWaalsContact C-N 3.28Å; R134-I136 PolarHBondContact O-N 2.96Å; R134-D137 HydrophobicContact CB-CB 4.3Å; R134-D137 IonicContact CZ-OD2 3.74Å; R134-D137 IonicContact NE-OD1 3.99Å; R134-D137 PolarHBondContact NE-OD1 3.27Å; R134-D137 IonicContact NE-OD2 2.65Å; R134-D137 PolarHBondContact NE-OD2 2.88Å; R134-D137 IonicContact NH2-OD2 2.6Å; R134-D137 PolarHBondContact NH2-OD2 3.07Å; R134-D137 PolarHBondContact O-N 3.36Å; R134-M138 WeakPolarHBondContact O-CG 3.33Å; R134-M138 PolarHBondContact O-N 3.31Å
135	K	85.3	Confident	84.1	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.5	-37.9	179.6	-75.2	-178.2	168.2	-177.4	0	112.5	L133 M138 L139 Q170 D171 S173 L175 I443 D470 F473	L133-K135 PolarHBondContact O-N 2.89Å; K135-M138 WeakPolarHBondContact O-CB 3.17Å; K135-M138 PolarHBondContact O-N 3.42Å; K135-L139 WeakPolarHBondContact O-CG 3.47Å; K135-L139 PolarHBondContact O-N 3.49Å; K135-Q170 VanDerWaalsContact CE-OE1 3.3Å; K135-D171 VanDerWaalsContact CE-O 3.28Å; K135-D171 WeakPolarHBondContact CE-O 3.38Å; K135-D171 PolarHBondContact NZ-O 2.87Å; K135-S173 WeakPolarHBondContact CB-O 3.47Å; K135-S173 PolarHBondContact N-O 3.36Å; K135-L175 HydrophobicContact CD-CD2 4.4Å; K135-L175 VanDerWaalsContact CE-CD2 3.47Å; K135-L175 HydrophobicContact CG-CD2 4.06Å; K135-L175 HydrophobicContact CG-CG 4Å; K135-I443 HydrophobicContact CB-CD1 4Å; K135-I443 HydrophobicContact CD-CD1 4.14Å; K135-D470 IonicContact NZ-OD1 3.95Å; K135-D470 PolarHBondContact NZ-OD1 2.82Å; K135-F473 HydrophobicContact CB-CE2 4.27Å; K135-F473 HydrophobicContact CD-CD2 4.09Å; K135-F473 HydrophobicContact CD-CE2 4.2Å; K135-F473 HydrophobicContact CG-CD2 4.21Å; K135-F473 HydrophobicContact CG-CE2 3.92Å
136	I	83.3	Confident	83.3	Confident	45 Å²	45	38.3 Å²	38.3	23%	0.231	19%	0.193	C	C	.	.	H	α-helix	trans	-60	-53.9	180	-68.9	171.8	0	0	0	110	R134 M138 L139 E140 P442 I443 L446	R134-I136 VanDerWaalsContact C-N 3.28Å; R134-I136 PolarHBondContact O-N 2.96Å; I136-M138 PolarHBondContact O-N 3.06Å; I136-L139 PolarHBondContact O-N 3.46Å; I136-E140 HydrophobicContact CG2-CG 4.1Å; I136-E140 WeakPolarHBondContact O-CG 3.39Å; I136-E140 PolarHBondContact O-N 3.33Å; I136-P442 HydrophobicContact CD1-CB 4.17Å; I136-P442 HydrophobicContact CD1-CG 4.29Å; I136-I443 HydrophobicContact CD1-CG1 4.42Å; I136-I443 HydrophobicContact CG1-CG1 3.91Å; I136-L446 HydrophobicContact CG2-CD2 4.05Å
137	D	79.9	Confident	82.6	Confident	27 Å²	27	35.6 Å²	35.6	14%	0.144	18%	0.18	C	C	.	.	H	α-helix	trans	-60.1	-31.5	179.3	-55.7	26	0	0	0	112.8	F113 R134 K141	F113-D137 HydrophobicContact CD1-CB 3.78Å; F113-D137 HydrophobicContact CE1-CB 4.39Å; R134-D137 HydrophobicContact CB-CB 4.3Å; R134-D137 IonicContact CZ-OD2 3.74Å; R134-D137 IonicContact NE-OD1 3.99Å; R134-D137 PolarHBondContact NE-OD1 3.27Å; R134-D137 IonicContact NE-OD2 2.65Å; R134-D137 PolarHBondContact NE-OD2 2.88Å; R134-D137 IonicContact NH2-OD2 2.6Å; R134-D137 PolarHBondContact NH2-OD2 3.07Å; R134-D137 PolarHBondContact O-N 3.36Å; D137-K141 WeakPolarHBondContact O-CB 3.5Å; D137-K141 WeakPolarHBondContact O-CG 3.14Å; D137-K141 PolarHBondContact O-N 2.79Å
138	M	78.5	Confident	81.7	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-69	-38.7	175.3	-64	-68.7	89.4	0	0	112.9	F113 R134 K135 I136 E142 Q143 V147 L246 F473	F113-M138 HydrophobicContact CB-CE 3.52Å; F113-M138 HydrophobicContact CD1-CE 2.84Å; F113-M138 HydrophobicContact CD2-CE 3.84Å; F113-M138 HydrophobicContact CE1-CE 3.34Å; F113-M138 HydrophobicContact CE2-CE 4.33Å; F113-M138 HydrophobicContact CG-CE 3.08Å; F113-M138 HydrophobicContact CZ-CE 4.11Å; R134-M138 WeakPolarHBondContact O-CG 3.33Å; R134-M138 PolarHBondContact O-N 3.31Å; K135-M138 WeakPolarHBondContact O-CB 3.17Å; K135-M138 PolarHBondContact O-N 3.42Å; I136-M138 PolarHBondContact O-N 3.06Å; M138-E142 PolarHBondContact O-N 2.94Å; M138-Q143 HydrophobicContact CE-CB 3.98Å; M138-Q143 HydrophobicContact CE-CG 4.48Å; M138-Q143 PolarHBondContact O-N 2.73Å; M138-Q143 HydrophobicContact SD-CB 3.95Å; M138-V147 HydrophobicContact CG-CG2 3.93Å; M138-V147 HydrophobicContact SD-CG2 3.09Å; M138-V147 WeakPolarHBondContact SD-CG2 3.37Å; M138-L246 HydrophobicContact SD-CD2 4.25Å; M138-F473 HydrophobicContact CB-CZ 4.29Å
139	L	78.4	Confident	80.6	Confident	33 Å²	33	40.9 Å²	40.9	17%	0.173	21%	0.205	C	C	.	.	H	α-helix	trans	-74.7	-49.4	178.2	-68.9	169.3	0	0	0	110.6	K135 I136 K141 E142 V144 I443 A469 V472	K135-L139 WeakPolarHBondContact O-CG 3.47Å; K135-L139 PolarHBondContact O-N 3.49Å; I136-L139 PolarHBondContact O-N 3.46Å; L139-K141 PolarHBondContact O-N 2.96Å; L139-E142 PolarHBondContact O-N 3.36Å; L139-E142 VanDerWaalsContact O-N 3.1Å; L139-V144 HydrophobicContact CD2-CG2 3.91Å; L139-I443 HydrophobicContact CD1-CG2 3.69Å; L139-A469 HydrophobicContact CD1-CB 3.9Å; L139-V472 HydrophobicContact CD2-CG1 4.36Å
140	E	76.2	Confident	79.7	Confident	92 Å²	92	40.5 Å²	40.5	43%	0.43	20%	0.202	S	C	.	.	H	α-helix	trans	-58.4	-33.1	-179.3	-71.6	-176.5	162.6	0	0	113.3	I136 L446	I136-E140 HydrophobicContact CG2-CG 4.1Å; I136-E140 WeakPolarHBondContact O-CG 3.39Å; I136-E140 PolarHBondContact O-N 3.33Å; E140-L446 HydrophobicContact CG-CD2 3.63Å; E140-L446 WeakPolarHBondContact OE1-CD2 3.43Å
141	K	71.1	Confident	79	Confident	77 Å²	77	41.9 Å²	41.9	34%	0.335	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.9	8.8	-179.3	-55	-166.9	-141.3	161.2	0	113.7	A112 F113 D137 L139 Q143 L250	A112-K141 PolarHBondContact O-NZ 3.44Å; F113-K141 HydrophobicContact CE1-CB 4.28Å; F113-K141 HydrophobicContact CE1-CD 3.52Å; F113-K141 HydrophobicContact CE1-CG 4.26Å; F113-K141 HydrophobicContact CZ-CD 3.9Å; D137-K141 WeakPolarHBondContact O-CB 3.5Å; D137-K141 WeakPolarHBondContact O-CG 3.14Å; D137-K141 PolarHBondContact O-N 2.79Å; L139-K141 PolarHBondContact O-N 2.96Å; K141-Q143 HydrophobicContact CB-CG 3.94Å; K141-Q143 WeakPolarHBondContact O-CG 3.44Å; K141-Q143 PolarHBondContact O-N 2.91Å; K141-Q143 PolarHBondContact O-NE2 3.01Å; K141-L250 HydrophobicContact CB-CD2 4.23Å; K141-L250 HydrophobicContact CD-CD2 4.45Å
142	E	75.2	Confident	78.3	Confident	160 Å²	160	43.7 Å²	43.7	75%	0.748	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.1	39.9	178.5	-56.9	-179.3	178	0	0	114.4	M138 L139	M138-E142 PolarHBondContact O-N 2.94Å; L139-E142 PolarHBondContact O-N 3.36Å; L139-E142 VanDerWaalsContact O-N 3.1Å
143	Q	74	Confident	77.6	Confident	9 Å²	9	43.7 Å²	43.7	4%	0.042	22%	0.217	C	C	.	.			trans	-101.8	6.3	-171.4	-62.3	-56.2	-44.8	0	0	115.6	F113 M138 K141 A145 H146 V147 L250	F113-Q143 HydrophobicContact CE1-CG 4.42Å; F113-Q143 HydrophobicContact CZ-CG 4.32Å; M138-Q143 HydrophobicContact CE-CB 3.98Å; M138-Q143 HydrophobicContact CE-CG 4.48Å; M138-Q143 PolarHBondContact O-N 2.73Å; M138-Q143 HydrophobicContact SD-CB 3.95Å; K141-Q143 HydrophobicContact CB-CG 3.94Å; K141-Q143 WeakPolarHBondContact O-CG 3.44Å; K141-Q143 PolarHBondContact O-N 2.91Å; K141-Q143 PolarHBondContact O-NE2 3.01Å; Q143-A145 PolarHBondContact O-N 3.11Å; Q143-H146 PolarHBondContact O-N 2.94Å; Q143-H146 VanDerWaalsContact O-N 3.11Å; Q143-H146 PolarHBondContact OE1-ND1 3.36Å; Q143-V147 WeakPolarHBondContact O-CG2 3.17Å; Q143-V147 PolarHBondContact O-N 2.81Å; Q143-L250 VanDerWaalsContact CD-CD1 3.4Å; Q143-L250 VanDerWaalsContact CD-CG 3.45Å; Q143-L250 HydrophobicContact CG-CD1 3.68Å; Q143-L250 HydrophobicContact CG-CD2 3.53Å; Q143-L250 HydrophobicContact CG-CG 4.02Å; Q143-L250 VanDerWaalsContact OE1-CD1 3.22Å
144	V	75.8	Confident	77.3	Confident	20 Å²	20	43.5 Å²	43.5	12%	0.121	22%	0.216	C	C	.	.	H	α-helix	trans	-53.5	-42.6	-179.5	172.1	0	0	0	0	112.2	L139 H146 V147 R148 V472 F473	L139-V144 HydrophobicContact CD2-CG2 3.91Å; V144-H146 VanDerWaalsContact C-N 3.34Å; V144-H146 PolarHBondContact O-N 3.15Å; V144-V147 PolarHBondContact O-N 3.11Å; V144-R148 WeakPolarHBondContact O-CG 3.3Å; V144-R148 PolarHBondContact O-N 3.23Å; V144-R148 VanDerWaalsContact O-N 3.08Å; V144-V472 HydrophobicContact CB-CG1 3.98Å; V144-V472 HydrophobicContact CG1-CG1 3.22Å; V144-V472 HydrophobicContact CG2-CG1 3.54Å; V144-F473 HydrophobicContact CG1-CE1 4.28Å; V144-F473 HydrophobicContact CG2-CE1 4.25Å; V144-F473 HydrophobicContact CG2-CZ 3.98Å
145	A	71.4	Confident	76.9	Confident	70 Å²	70	40 Å²	40	58%	0.579	21%	0.207	S	C	*	.	H	α-helix	trans	-62.5	-42.9	-179.1	0	0	0	0	0	111.5	Q143 R148 A149	Q143-A145 PolarHBondContact O-N 3.11Å; A145-R148 PolarHBondContact O-N 3.04Å; A145-A149 PolarHBondContact O-N 3.32Å
146	H	72.5	Confident	76.3	Confident	43 Å²	43	45.7 Å²	45.7	20%	0.199	23%	0.234	C	C	.	.	H	α-helix	trans	-64.6	-41.5	177.1	-65.1	104.3	0	0	0	112.2	Q143 V144 R148 A149 E150 R224 G245 L246	Q143-H146 PolarHBondContact O-N 2.94Å; Q143-H146 VanDerWaalsContact O-N 3.11Å; Q143-H146 PolarHBondContact OE1-ND1 3.36Å; V144-H146 VanDerWaalsContact C-N 3.34Å; V144-H146 PolarHBondContact O-N 3.15Å; H146-R148 VanDerWaalsContact C-N 3.31Å; H146-R148 PolarHBondContact O-N 2.62Å; H146-A149 PolarHBondContact O-N 3.16Å; H146-E150 PolarHBondContact O-N 2.92Å; H146-R224 PolarHBondContact NE2-NH2 3.39Å; H146-G245 WeakPolarHBondContact CB-O 3.38Å; H146-G245 PolarHBondContact CD2-O 3.31Å; H146-L246 HydrophobicContact CB-CD2 4.02Å
147	V	76.4	Confident	75.9	Confident	2 Å²	2	43.7 Å²	43.7	1%	0.012	22%	0.224	C	C	.	.	H	α-helix	trans	-59.1	-44.3	174.7	178.7	0	0	0	0	111.7	M138 Q143 V144 E150 R151 L175 L246 Y476	M138-V147 HydrophobicContact CG-CG2 3.93Å; M138-V147 HydrophobicContact SD-CG2 3.09Å; M138-V147 WeakPolarHBondContact SD-CG2 3.37Å; Q143-V147 WeakPolarHBondContact O-CG2 3.17Å; Q143-V147 PolarHBondContact O-N 2.81Å; V144-V147 PolarHBondContact O-N 3.11Å; V147-E150 PolarHBondContact O-N 3.04Å; V147-R151 WeakPolarHBondContact O-CB 3.48Å; V147-R151 PolarHBondContact O-N 3.32Å; V147-L175 HydrophobicContact CG1-CD1 3.65Å; V147-L246 VanDerWaalsContact CA-CD2 3.48Å; V147-L246 HydrophobicContact CB-CD2 3.98Å; V147-L246 HydrophobicContact CG2-CD2 3.43Å; V147-L246 VanDerWaalsContact CG2-CD2 3.43Å; V147-Y476 HydrophobicContact CG1-CD2 4.12Å; V147-Y476 HydrophobicContact CG1-CE2 3.54Å
148	R	75.4	Confident	75.7	Confident	104 Å²	104	47.8 Å²	47.8	39%	0.392	25%	0.246	S	C	.	.	H	α-helix	trans	-66.2	-43.1	-179.8	-71.7	174.6	176	-169.2	0.6	110.6	V144 A145 H146 R151 D152 V472	V144-R148 WeakPolarHBondContact O-CG 3.3Å; V144-R148 PolarHBondContact O-N 3.23Å; V144-R148 VanDerWaalsContact O-N 3.08Å; A145-R148 PolarHBondContact O-N 3.04Å; H146-R148 VanDerWaalsContact C-N 3.31Å; H146-R148 PolarHBondContact O-N 2.62Å; R148-R151 PolarHBondContact O-N 2.65Å; R148-D152 WeakPolarHBondContact O-CB 3.36Å; R148-D152 PolarHBondContact O-N 3.35Å; R148-V472 VanDerWaalsContact CZ-O 3.26Å; R148-V472 PolarHBondContact NE-O 3.21Å; R148-V472 VanDerWaalsContact NE-O 3.07Å; R148-V472 PolarHBondContact NH2-O 3.44Å
149	A	72.6	Confident	76	Confident	37 Å²	37	49.9 Å²	49.9	31%	0.306	26%	0.26	S	S	.	.	H	α-helix	trans	-60.3	-46.7	174.9	0	0	0	0	0	112	A145 H146 R151 D152 I153	A145-A149 PolarHBondContact O-N 3.32Å; H146-A149 PolarHBondContact O-N 3.16Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 3.49Å; A149-D152 PolarHBondContact O-N 2.91Å; A149-D152 VanDerWaalsContact O-N 3.14Å; A149-I153 VanDerWaalsContact O-CG1 3.26Å; A149-I153 WeakPolarHBondContact O-CG1 3.4Å; A149-I153 PolarHBondContact O-N 2.87Å
150	E	76.8	Confident	76.5	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-57.3	-48	176.5	-174.4	168.6	136.2	0	0	111.1	K131 H146 V147 D152 I153 L154 L177 F244 L246	K131-E150 IonicContact NZ-OE1 2.69Å; K131-E150 PolarHBondContact NZ-OE1 3.22Å; K131-E150 IonicContact NZ-OE2 2.62Å; K131-E150 PolarHBondContact NZ-OE2 3.01Å; H146-E150 PolarHBondContact O-N 2.92Å; V147-E150 PolarHBondContact O-N 3.04Å; E150-D152 VanDerWaalsContact C-N 3.33Å; E150-D152 PolarHBondContact O-N 2.79Å; E150-I153 PolarHBondContact O-N 3.21Å; E150-L154 HydrophobicContact CG-CD1 3.82Å; E150-L154 HydrophobicContact CG-CG 4.38Å; E150-L154 VanDerWaalsContact O-CB 3.3Å; E150-L154 WeakPolarHBondContact O-CB 3.35Å; E150-L154 VanDerWaalsContact O-CG 3.28Å; E150-L154 WeakPolarHBondContact O-CG 3.19Å; E150-L154 PolarHBondContact O-N 3.34Å; E150-L177 HydrophobicContact CG-CD1 4.49Å; E150-L177 WeakPolarHBondContact OE1-CD1 3.4Å; E150-F244 WeakPolarHBondContact CB-O 3.36Å; E150-F244 HydrophobicContact CG-CB 4.33Å; E150-L246 HydrophobicContact CB-CG 4.19Å; E150-L246 WeakPolarHBondContact OE2-CB 3.5Å; E150-L246 WeakPolarHBondContact OE2-CD1 3.37Å; E150-L246 WeakPolarHBondContact OE2-CG 3.45Å
151	R	79.5	Confident	77.3	Confident	28 Å²	28	51.6 Å²	51.6	11%	0.106	27%	0.266	C	S	.	.	H	α-helix	trans	-59.6	-44	176.5	178.6	-143.8	60	-166.5	-13.8	111.3	V147 R148 A149 L154 S155 M165 N475 Y476	V147-R151 WeakPolarHBondContact O-CB 3.48Å; V147-R151 PolarHBondContact O-N 3.32Å; R148-R151 PolarHBondContact O-N 2.65Å; A149-R151 VanDerWaalsContact C-N 3.34Å; A149-R151 PolarHBondContact O-N 3.49Å; R151-L154 PolarHBondContact O-N 3.34Å; R151-S155 WeakPolarHBondContact O-CB 3.42Å; R151-S155 PolarHBondContact O-N 2.97Å; R151-S155 PolarHBondContact O-OG 3.49Å; R151-M165 HydrophobicContact CG-CE 4.34Å; R151-N475 VanDerWaalsContact NH1-CB 3.25Å; R151-N475 PolarHBondContact NH1-O 2.99Å; R151-Y476 HydrophobicContact CB-CE2 4.5Å
152	D	76.4	Confident	78.4	Confident	51 Å²	51	48 Å²	48	27%	0.273	25%	0.25	S	S	.	.	H	α-helix	trans	-63.8	-50	-178.1	-70.3	-19.8	0	0	0	111	R148 A149 E150 L154 S155 E156	R148-D152 WeakPolarHBondContact O-CB 3.36Å; R148-D152 PolarHBondContact O-N 3.35Å; A149-D152 PolarHBondContact O-N 2.91Å; A149-D152 VanDerWaalsContact O-N 3.14Å; E150-D152 VanDerWaalsContact C-N 3.33Å; E150-D152 PolarHBondContact O-N 2.79Å; D152-L154 PolarHBondContact O-N 3.23Å; D152-S155 WeakPolarHBondContact CA-OG 3.3Å; D152-S155 PolarHBondContact O-N 3.18Å; D152-S155 VanDerWaalsContact O-N 3.09Å; D152-S155 PolarHBondContact O-OG 3.34Å; D152-E156 WeakPolarHBondContact O-CB 3.34Å; D152-E156 WeakPolarHBondContact O-CG 3.49Å; D152-E156 PolarHBondContact O-N 3.39Å
153	I	76.5	Confident	79.2	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.051	22%	0.216	C	C	.	.	H	α-helix	trans	-53.9	-53.2	174.1	-64.5	165.1	0	0	0	110.2	A149 E150 S155 E156 A157 F221 F244	A149-I153 VanDerWaalsContact O-CG1 3.26Å; A149-I153 WeakPolarHBondContact O-CG1 3.4Å; A149-I153 PolarHBondContact O-N 2.87Å; E150-I153 PolarHBondContact O-N 3.21Å; I153-S155 PolarHBondContact O-N 3.07Å; I153-E156 PolarHBondContact O-N 3.25Å; I153-A157 WeakPolarHBondContact O-CA 3.46Å; I153-A157 WeakPolarHBondContact O-CB 3.25Å; I153-A157 PolarHBondContact O-N 3.3Å; I153-F221 HydrophobicContact CD1-CB 4.06Å; I153-F221 HydrophobicContact CD1-CD1 3.48Å; I153-F221 VanDerWaalsContact CD1-CD1 3.48Å; I153-F221 HydrophobicContact CD1-CD2 4.38Å; I153-F221 HydrophobicContact CD1-CE1 3.95Å; I153-F221 HydrophobicContact CD1-CG 3.72Å; I153-F221 HydrophobicContact CG1-CB 4.28Å; I153-F221 HydrophobicContact CG1-CD1 3.35Å; I153-F221 HydrophobicContact CG1-CD2 3.68Å; I153-F221 HydrophobicContact CG1-CE1 3.38Å; I153-F221 HydrophobicContact CG1-CE2 3.72Å; I153-F221 HydrophobicContact CG1-CG 3.49Å; I153-F221 VanDerWaalsContact CG1-CG 3.49Å; I153-F221 HydrophobicContact CG1-CZ 3.57Å; I153-F244 HydrophobicContact CB-CB 4.44Å; I153-F244 HydrophobicContact CB-CG 4.45Å; I153-F244 HydrophobicContact CD1-CB 3.66Å; I153-F244 HydrophobicContact CD1-CG 4.28Å; I153-F244 HydrophobicContact CG2-CB 4.26Å; I153-F244 HydrophobicContact CG2-CD1 3.96Å; I153-F244 HydrophobicContact CG2-CD2 4.03Å; I153-F244 HydrophobicContact CG2-CE1 4.4Å; I153-F244 HydrophobicContact CG2-CE2 4.48Å; I153-F244 HydrophobicContact CG2-CG 3.78Å
154	L	81.3	Confident	80	Confident	2 Å²	2	41.8 Å²	41.8	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-67.9	-23	-177.9	-73.4	176.9	0	0	0	113.5	E150 R151 D152 V162 V163 M165 L177 M179 F244 R480	E150-L154 HydrophobicContact CG-CD1 3.82Å; E150-L154 HydrophobicContact CG-CG 4.38Å; E150-L154 VanDerWaalsContact O-CB 3.3Å; E150-L154 WeakPolarHBondContact O-CB 3.35Å; E150-L154 VanDerWaalsContact O-CG 3.28Å; E150-L154 WeakPolarHBondContact O-CG 3.19Å; E150-L154 PolarHBondContact O-N 3.34Å; R151-L154 PolarHBondContact O-N 3.34Å; D152-L154 PolarHBondContact O-N 3.23Å; L154-V162 HydrophobicContact CD2-CG1 4.01Å; L154-V163 VanDerWaalsContact CD2-O 3.26Å; L154-V163 WeakPolarHBondContact CD2-O 3.29Å; L154-M165 HydrophobicContact CB-CB 3.77Å; L154-M165 HydrophobicContact CB-CE 3.88Å; L154-M165 HydrophobicContact CB-CG 4.44Å; L154-M165 HydrophobicContact CB-SD 3.85Å; L154-M165 HydrophobicContact CD1-CB 4.46Å; L154-M165 HydrophobicContact CD1-SD 4.28Å; L154-L177 HydrophobicContact CD1-CD1 4.29Å; L154-M179 HydrophobicContact CD1-SD 4.25Å; L154-F244 HydrophobicContact CD2-CD2 3.74Å; L154-F244 HydrophobicContact CD2-CE2 3.58Å; L154-F244 HydrophobicContact CG-CD2 4.02Å; L154-F244 HydrophobicContact CG-CE2 4.36Å; L154-R480 PolarHBondContact O-NH2 2.9Å
155	S	78	Confident	80.7	Confident	29 Å²	29	40.9 Å²	40.9	20%	0.203	22%	0.215	C	C	.	.	H	α-helix	trans	-82.3	-34.5	177.1	70.5	0	0	0	0	112.4	R151 D152 I153	R151-S155 WeakPolarHBondContact O-CB 3.42Å; R151-S155 PolarHBondContact O-N 2.97Å; R151-S155 PolarHBondContact O-OG 3.49Å; D152-S155 WeakPolarHBondContact CA-OG 3.3Å; D152-S155 PolarHBondContact O-N 3.18Å; D152-S155 VanDerWaalsContact O-N 3.09Å; D152-S155 PolarHBondContact O-OG 3.34Å; I153-S155 PolarHBondContact O-N 3.07Å
156	E	73.8	Confident	81.5	Confident	121 Å²	121	39.1 Å²	39.1	57%	0.565	19%	0.194	S	C	*	.	H	α-helix	trans	-90.5	-30.8	-178.1	-67	-178.8	-168.6	0	0	112.6	D152 I153 D158	D152-E156 WeakPolarHBondContact O-CB 3.34Å; D152-E156 WeakPolarHBondContact O-CG 3.49Å; D152-E156 PolarHBondContact O-N 3.39Å; I153-E156 PolarHBondContact O-N 3.25Å; E156-D158 PolarHBondContact O-N 3.4Å
157	A	73.6	Confident	82.4	Confident	3 Å²	3	37.1 Å²	37.1	3%	0.025	19%	0.185	C	C	.	.			trans	-68.6	102.9	177.1	0	0	0	0	0	110	I153 V162 L219 R480	I153-A157 WeakPolarHBondContact O-CA 3.46Å; I153-A157 WeakPolarHBondContact O-CB 3.25Å; I153-A157 PolarHBondContact O-N 3.3Å; A157-V162 HydrophobicContact CB-CB 4.06Å; A157-V162 HydrophobicContact CB-CG1 3.78Å; A157-V162 HydrophobicContact CB-CG2 4.33Å; A157-L219 HydrophobicContact CB-CD1 4.21Å; A157-R480 PolarHBondContact O-NH1 2.79Å; A157-R480 VanDerWaalsContact O-NH1 3.12Å; A157-R480 PolarHBondContact O-NH2 3.05Å
158	D	76.4	Confident	83	Confident	113 Å²	113	37 Å²	37	60%	0.604	19%	0.185	S	C	*	.			trans	-115.6	60.7	165.6	-158.4	35.7	0	0	0	109.2	E156 K164 R480	E156-D158 PolarHBondContact O-N 3.4Å; D158-K164 IonicContact OD1-NZ 2.68Å; D158-K164 PolarHBondContact OD1-NZ 3.06Å; D158-R480 IonicContact OD1-NH1 3.87Å; D158-R480 PolarHBondContact OD1-NH1 2.93Å
159	C	84.2	Confident	83.7	Confident	43 Å²	43	32.5 Å²	32.5	29%	0.291	17%	0.168	S	C	.	.	S	Bend	trans	-125.4	155.3	175.4	63.8	0	0	0	0	110.4	W161	C159-W161 PolarHBondContact O-N 3.14Å
160	E	90.5	Very high	84.5	Confident	124 Å²	124	33.1 Å²	33.1	58%	0.579	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.5	-20.6	-176.9	-59.3	-171.9	122.3	0	0	113.5	K240	E160-K240 WeakPolarHBondContact O-CE 3.47Å; E160-K240 VanDerWaalsContact O-CG 3.29Å; E160-K240 WeakPolarHBondContact O-CG 3.43Å; E160-K240 PolarHBondContact O-NZ 3.39Å
161	W	93	Very high	85	Confident	37 Å²	37	35.3 Å²	35.3	14%	0.14	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-8.4	-173	-54.8	113.3	0	0	0	115.8	C159 E208 L211 A212 K240 L241 I404 R405	C159-W161 PolarHBondContact O-N 3.14Å; W161-E208 HydrophobicContact CH2-CG 4.27Å; W161-E208 HydrophobicContact CZ3-CB 3.85Å; W161-E208 HydrophobicContact CZ3-CG 3.86Å; W161-L211 HydrophobicContact CD2-CB 4.04Å; W161-L211 HydrophobicContact CE3-CB 4.33Å; W161-L211 HydrophobicContact CH2-CB 4.19Å; W161-L211 HydrophobicContact CH2-CD1 3.7Å; W161-L211 HydrophobicContact CZ2-CB 3.87Å; W161-L211 HydrophobicContact CZ2-CD1 3.66Å; W161-L211 HydrophobicContact CZ2-CG 4.26Å; W161-L211 HydrophobicContact CZ3-CB 4.4Å; W161-L211 HydrophobicContact CZ3-CD1 4.48Å; W161-A212 HydrophobicContact CB-CB 3.65Å; W161-A212 HydrophobicContact CE3-CB 4.47Å; W161-A212 HydrophobicContact CG-CB 4.3Å; W161-K240 CarbonylContact O-C 3.53Å; W161-K240 WeakPolarHBondContact O-CA 3.46Å; W161-L241 PolarHBondContact O-N 3.45Å; W161-I404 HydrophobicContact CH2-CG2 3.86Å; W161-I404 HydrophobicContact CZ2-CG2 4.46Å; W161-R405 VanDerWaalsContact CE3-NH1 3.31Å; W161-R405 HydrophobicContact CH2-CB 4.13Å; W161-R405 HydrophobicContact CH2-CG 4.42Å; W161-R405 VanDerWaalsContact CZ3-NH1 3.29Å
162	V	92.1	Very high	85.2	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.012	19%	0.187	C	C	.	.	B	Isolated β-bridge	trans	-119.1	141.3	-178.3	169	0	0	0	0	108.6	L154 A157 K164 I216 F244	L154-V162 HydrophobicContact CD2-CG1 4.01Å; A157-V162 HydrophobicContact CB-CB 4.06Å; A157-V162 HydrophobicContact CB-CG1 3.78Å; A157-V162 HydrophobicContact CB-CG2 4.33Å; V162-K164 PolarHBondContact O-N 3.28Å; V162-I216 HydrophobicContact CG2-CG2 3.72Å; V162-F244 HydrophobicContact CB-CZ 4.03Å; V162-F244 HydrophobicContact CG1-CE1 4.43Å; V162-F244 HydrophobicContact CG1-CE2 3.45Å; V162-F244 VanDerWaalsContact CG1-CE2 3.45Å; V162-F244 HydrophobicContact CG1-CZ 3.37Å; V162-F244 HydrophobicContact CG2-CE1 4.21Å; V162-F244 HydrophobicContact CG2-CZ 3.74Å
163	V	92.8	Very high	85.7	Confident	4 Å²	4	34.7 Å²	34.7	2%	0.024	18%	0.18	C	C	.	.	P	Polyproline II helix	trans	-56.1	124.1	173.6	171.9	0	0	0	0	110.1	L154 M165 M179 E180 L182 L232 K240 L241	L154-V163 VanDerWaalsContact CD2-O 3.26Å; L154-V163 WeakPolarHBondContact CD2-O 3.29Å; V163-M165 PolarHBondContact O-N 3.44Å; V163-M179 HydrophobicContact CG1-CB 3.74Å; V163-M179 HydrophobicContact CG1-CG 4.19Å; V163-M179 HydrophobicContact CG1-SD 4.04Å; V163-E180 HydrophobicContact CG1-CG 4Å; V163-L182 HydrophobicContact CG2-CD1 3.76Å; V163-L232 HydrophobicContact CG2-CD1 3.93Å; V163-K240 HydrophobicContact CG2-CB 4.22Å; V163-L241 VanDerWaalsContact CG2-O 3.28Å; V163-L241 WeakPolarHBondContact CG2-O 3.39Å; V163-L241 PolarHBondContact N-O 3.01Å
164	K	90.6	Very high	86.4	Confident	35 Å²	35	35.6 Å²	35.6	15%	0.152	19%	0.185	C	C	.	.	P	Polyproline II helix	trans	-74.4	118.8	-178.3	-168.1	155.5	-174.1	143.5	0	111.5	D158 V162 Y166 M179 E180 R480 E482	D158-K164 IonicContact OD1-NZ 2.68Å; D158-K164 PolarHBondContact OD1-NZ 3.06Å; V162-K164 PolarHBondContact O-N 3.28Å; K164-Y166 HydrophobicContact CD-CE1 4.48Å; K164-Y166 HydrophobicContact CG-CE1 4.46Å; K164-Y166 HydrophobicContact CG-CE2 4.49Å; K164-M179 CarbonylContact O-C 3.49Å; K164-M179 VanDerWaalsContact O-CA 3.29Å; K164-M179 WeakPolarHBondContact O-CA 3.34Å; K164-E180 HydrophobicContact CB-CB 4.42Å; K164-E180 HydrophobicContact CB-CG 4.02Å; K164-E180 VanDerWaalsContact CB-OE1 3.27Å; K164-E180 WeakPolarHBondContact CB-OE1 3.43Å; K164-E180 PolarHBondContact N-OE1 2.89Å; K164-E180 PolarHBondContact O-N 3.44Å; K164-R480 VanDerWaalsContact CE-CD 3.46Å; K164-E482 WeakPolarHBondContact CE-OE2 3.37Å; K164-E482 IonicContact NZ-OE1 3.64Å; K164-E482 PolarHBondContact NZ-OE1 3.3Å; K164-E482 IonicContact NZ-OE2 3.01Å; K164-E482 PolarHBondContact NZ-OE2 2.98Å
165	M	90.4	Very high	86.8	Confident	0 Å²	0	35.5 Å²	35.5	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	124.2	171	179.5	-179	72.1	0	0	111.4	R151 L154 V163 L177 M179 F478 R480	R151-M165 HydrophobicContact CG-CE 4.34Å; L154-M165 HydrophobicContact CB-CB 3.77Å; L154-M165 HydrophobicContact CB-CE 3.88Å; L154-M165 HydrophobicContact CB-CG 4.44Å; L154-M165 HydrophobicContact CB-SD 3.85Å; L154-M165 HydrophobicContact CD1-CB 4.46Å; L154-M165 HydrophobicContact CD1-SD 4.28Å; V163-M165 PolarHBondContact O-N 3.44Å; M165-L177 HydrophobicContact SD-CD2 3.72Å; M165-M179 HydrophobicContact CB-CG 4.39Å; M165-F478 HydrophobicContact CE-CB 4.43Å; M165-F478 HydrophobicContact CE-CD1 3.49Å; M165-F478 VanDerWaalsContact CE-CD1 3.49Å; M165-F478 HydrophobicContact CE-CE1 3.88Å; M165-F478 HydrophobicContact CE-CG 4.1Å; M165-R480 PolarHBondContact O-NE 3.31Å
166	Y	89.7	Confident	87.4	Confident	33 Å²	33	34.3 Å²	34.3	13%	0.129	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93	-43.5	178.1	-70.4	-74.6	0	0	0	112.8	Y128 K164 V178 E180 K479 R480 G483	Y128-Y166 AromaticContact CD1-CD2 3.71Å; Y128-Y166 HydrophobicContact CD1-CD2 3.71Å; Y128-Y166 HydrophobicContact CD1-CE2 4.15Å; Y128-Y166 HydrophobicContact CD1-CG 4.46Å; Y128-Y166 AromaticContact CE1-CD2 3.53Å; Y128-Y166 HydrophobicContact CE1-CD2 3.53Å; Y128-Y166 AromaticContact CE1-CE2 3.89Å; Y128-Y166 HydrophobicContact CE1-CE2 3.89Å; Y128-Y166 AromaticContact CE1-CG 3.95Å; Y128-Y166 HydrophobicContact CE1-CG 3.95Å; K164-Y166 HydrophobicContact CD-CE1 4.48Å; K164-Y166 HydrophobicContact CG-CE1 4.46Å; K164-Y166 HydrophobicContact CG-CE2 4.49Å; Y166-V178 PolarHBondContact N-O 2.89Å; Y166-E180 HydrophobicContact CE2-CB 3.95Å; Y166-K479 CarbonylContact O-C 3.5Å; Y166-K479 WeakPolarHBondContact O-CA 3.22Å; Y166-R480 PolarHBondContact O-N 3.13Å; Y166-G483 VanDerWaalsContact CD1-CA 3.4Å
167	Y	89.5	Confident	88.3	Confident	1 Å²	1	28.7 Å²	28.7	0%	0.004	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	150.7	-176.5	-39	-69.9	0	0	0	110.5	L97 F102 K121 Y128 V178 F478 K479 G483 L484	L97-Y167 HydrophobicContact CD1-CD1 3.53Å; L97-Y167 HydrophobicContact CD1-CD2 4.34Å; L97-Y167 HydrophobicContact CD1-CE1 3.97Å; L97-Y167 HydrophobicContact CD1-CG 3.74Å; F102-Y167 HydrophobicContact CZ-CD2 4.02Å; F102-Y167 HydrophobicContact CZ-CE2 4.35Å; K121-Y167 HydrophobicContact CD-CE2 4.3Å; Y128-Y167 HydrophobicContact CE1-CE2 4.37Å; Y128-Y167 HydrophobicContact CE2-CE2 4.44Å; Y128-Y167 PolarHBondContact OH-OH 3.36Å; Y167-V178 HydrophobicContact CD2-CB 3.77Å; Y167-V178 HydrophobicContact CD2-CG1 3.73Å; Y167-V178 HydrophobicContact CD2-CG2 4.3Å; Y167-V178 HydrophobicContact CE2-CG1 4.31Å; Y167-V178 HydrophobicContact CG-CB 4.41Å; Y167-V178 PolarHBondContact N-O 2.86Å; Y167-V178 PolarHBondContact O-N 3.46Å; Y167-F478 WeakPolarHBondContact CA-O 3.32Å; Y167-K479 HydrophobicContact CD1-CB 4.3Å; Y167-K479 HydrophobicContact CD1-CG 4.26Å; Y167-G483 PolarHBondContact OH-O 2.99Å; Y167-L484 HydrophobicContact CE1-CD2 3.95Å; Y167-L484 HydrophobicContact CE1-CG 4.32Å
168	S	89.7	Confident	89.2	Confident	1 Å²	1	28.5 Å²	28.5	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	141.4	160	62	0	0	0	0	109.3	Y176 Y476 T477 F478	S168-Y176 CarbonylContact C-O 3.5Å; S168-Y176 WeakPolarHBondContact CA-O 3.44Å; S168-Y476 WeakPolarHBondContact CB-O 3.24Å; S168-Y476 PolarHBondContact OG-O 3.43Å; S168-T477 VanDerWaalsContact O-CA 3.26Å; S168-T477 WeakPolarHBondContact O-CA 3.38Å; S168-F478 PolarHBondContact N-O 2.91Å; S168-F478 PolarHBondContact O-N 2.74Å; S168-F478 WeakPolarHBondContact OG-CB 2.99Å; S168-F478 PolarHBondContact OG-N 3.39Å
169	F	90.1	Very high	90	Very high	9 Å²	9	23.9 Å²	23.9	4%	0.039	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	173	178.7	57.8	-92.3	0	0	0	109.9	L97 V99 F102 M130 Y176 V178 Y476	L97-F169 HydrophobicContact CB-CD1 4.37Å; V99-F169 HydrophobicContact CG2-CE2 3.76Å; F102-F169 HydrophobicContact CD2-CE1 4.33Å; F102-F169 HydrophobicContact CD2-CZ 4.07Å; F102-F169 AromaticContact CE2-CE1 3.63Å; F102-F169 HydrophobicContact CE2-CE1 3.63Å; F102-F169 AromaticContact CE2-CZ 3.83Å; F102-F169 HydrophobicContact CE2-CZ 3.83Å; F102-F169 HydrophobicContact CZ-CE1 4.27Å; M130-F169 HydrophobicContact CE-CE1 4.36Å; M130-F169 HydrophobicContact CE-CZ 3.77Å; F169-Y176 AromaticContact CD2-CD2 3.55Å; F169-Y176 HydrophobicContact CD2-CD2 3.55Å; F169-Y176 HydrophobicContact CD2-CE2 4.45Å; F169-Y176 AromaticContact CD2-CG 3.8Å; F169-Y176 HydrophobicContact CD2-CG 3.8Å; F169-Y176 VanDerWaalsContact CE2-CB 3.45Å; F169-Y176 HydrophobicContact CE2-CD1 4.01Å; F169-Y176 AromaticContact CE2-CD2 3.44Å; F169-Y176 HydrophobicContact CE2-CD2 3.44Å; F169-Y176 VanDerWaalsContact CE2-CD2 3.44Å; F169-Y176 HydrophobicContact CE2-CE2 4.2Å; F169-Y176 AromaticContact CE2-CG 3.33Å; F169-Y176 HydrophobicContact CE2-CG 3.33Å; F169-Y176 HydrophobicContact CZ-CD1 4.33Å; F169-Y176 HydrophobicContact CZ-CD2 4.41Å; F169-Y176 AromaticContact CZ-CG 3.87Å; F169-Y176 HydrophobicContact CZ-CG 3.87Å; F169-Y176 PolarHBondContact N-O 3.36Å; F169-Y176 WeakPolarHBondContact O-CB 3.47Å; F169-Y176 PolarHBondContact O-N 3.31Å; F169-V178 HydrophobicContact CD1-CG2 4.49Å; F169-V178 HydrophobicContact CE1-CG2 3.63Å; F169-V178 HydrophobicContact CZ-CG2 4.33Å; F169-Y476 WeakPolarHBondContact O-CD1 3.45Å; F169-Y476 WeakPolarHBondContact O-CE1 3.45Å
170	Q	89.4	Confident	90.4	Very high	50 Å²	50	23.7 Å²	23.7	23%	0.234	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	156.9	-175.9	62.8	-177.3	-52.8	0	0	110.2	K135 N174 L175 F473 Y476	K135-Q170 VanDerWaalsContact CE-OE1 3.3Å; Q170-N174 WeakPolarHBondContact CA-O 3.33Å; Q170-L175 HydrophobicContact CB-CD2 3.63Å; Q170-F473 PolarHBondContact NE2-O 3.33Å; Q170-Y476 HydrophobicContact CB-CD1 4.28Å
171	D	87.5	Confident	90.6	Very high	45 Å²	45	18.9 Å²	18.9	24%	0.241	10%	0.095	C	C	.	.			trans	-122.2	-163.1	165.2	69.3	17.2	0	0	0	110.3	K135 S173 N174 Y176	K135-D171 VanDerWaalsContact CE-O 3.28Å; K135-D171 WeakPolarHBondContact CE-O 3.38Å; K135-D171 PolarHBondContact NZ-O 2.87Å; D171-S173 PolarHBondContact O-N 2.64Å; D171-S173 WeakPolarHBondContact OD1-CA 3.42Å; D171-S173 PolarHBondContact OD1-N 3.25Å; D171-N174 PolarHBondContact N-O 2.79Å; D171-N174 PolarHBondContact OD1-N 2.86Å; D171-Y176 HydrophobicContact CB-CE2 4.31Å; D171-Y176 PolarHBondContact OD2-OH 3.02Å
172	S	84.7	Confident	90.7	Very high	48 Å²	48	17.5 Å²	17.5	34%	0.336	9%	0.09	S	C	.	.	S	Bend	trans	-64.2	-19	179.4	51.6	0	0	0	0	114	I443	S172-I443 VanDerWaalsContact O-CD1 3.23Å; S172-I443 WeakPolarHBondContact O-CD1 3.24Å
173	S	86	Confident	90.8	Very high	19 Å²	19	18 Å²	18	13%	0.133	9%	0.094	C	C	.	.	S	Bend	trans	-127.1	-31.1	-165	-58.1	0	0	0	0	113.2	K135 D171 P438	K135-S173 WeakPolarHBondContact CB-O 3.47Å; K135-S173 PolarHBondContact N-O 3.36Å; D171-S173 PolarHBondContact O-N 2.64Å; D171-S173 WeakPolarHBondContact OD1-CA 3.42Å; D171-S173 PolarHBondContact OD1-N 3.25Å; S173-P438 WeakPolarHBondContact OG-CD 3.47Å; S173-P438 VanDerWaalsContact OG-CG 3.29Å; S173-P438 WeakPolarHBondContact OG-CG 3.39Å
174	N	90.2	Very high	90.8	Very high	29 Å²	29	18.1 Å²	18.1	16%	0.155	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	158.8	-171.4	-53.5	-59	0	0	0	112.2	V132 L133 Q170 D171 Y176	V132-N174 HydrophobicContact CG1-CB 3.98Å; L133-N174 CarbonylContact O-C 3.56Å; L133-N174 WeakPolarHBondContact O-CA 3.47Å; Q170-N174 WeakPolarHBondContact CA-O 3.33Å; D171-N174 PolarHBondContact N-O 2.79Å; D171-N174 PolarHBondContact OD1-N 2.86Å; N174-Y176 HydrophobicContact CB-CD2 4.48Å; N174-Y176 HydrophobicContact CB-CE1 4.35Å; N174-Y176 HydrophobicContact CB-CE2 3.68Å; N174-Y176 WeakPolarHBondContact CB-OH 3.43Å; N174-Y176 PolarHBondContact ND2-OH 3.11Å; N174-Y176 VanDerWaalsContact ND2-OH 3.1Å
175	L	89.8	Confident	90.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	143.7	166.2	-52.6	176	0	0	0	108.5	L133 K135 V147 Q170 F473 Y476	L133-L175 HydrophobicContact CB-CB 4.24Å; L133-L175 PolarHBondContact N-O 2.66Å; L133-L175 PolarHBondContact O-N 2.91Å; K135-L175 HydrophobicContact CD-CD2 4.4Å; K135-L175 VanDerWaalsContact CE-CD2 3.47Å; K135-L175 HydrophobicContact CG-CD2 4.06Å; K135-L175 HydrophobicContact CG-CG 4Å; V147-L175 HydrophobicContact CG1-CD1 3.65Å; Q170-L175 HydrophobicContact CB-CD2 3.63Å; L175-F473 HydrophobicContact CD1-CD1 3.63Å; L175-F473 HydrophobicContact CD1-CE1 3.49Å; L175-F473 VanDerWaalsContact CD1-CE1 3.49Å; L175-F473 HydrophobicContact CD1-CG 4.3Å; L175-F473 HydrophobicContact CD1-CZ 4.05Å; L175-F473 HydrophobicContact CD2-CB 4.09Å; L175-F473 HydrophobicContact CD2-CD1 3.97Å; L175-F473 HydrophobicContact CD2-CD2 4.27Å; L175-F473 HydrophobicContact CD2-CG 3.84Å; L175-F473 HydrophobicContact CG-CD1 4.42Å; L175-Y476 HydrophobicContact CB-CD1 4.35Å; L175-Y476 HydrophobicContact CB-CE1 3.7Å; L175-Y476 HydrophobicContact CB-CE2 4.1Å; L175-Y476 WeakPolarHBondContact CB-OH 3.44Å; L175-Y476 HydrophobicContact CD1-CD2 4.24Å; L175-Y476 HydrophobicContact CD1-CE2 3.95Å; L175-Y476 HydrophobicContact CD2-CD1 4.06Å; L175-Y476 HydrophobicContact CD2-CD2 4.34Å; L175-Y476 HydrophobicContact CD2-CE1 4.26Å; L175-Y476 HydrophobicContact CD2-CG 4.08Å; L175-Y476 HydrophobicContact CG-CE1 4.48Å; L175-Y476 HydrophobicContact CG-CE2 4.43Å
176	Y	92	Very high	91.1	Very high	4 Å²	4	17.9 Å²	17.9	2%	0.016	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	125	-175.1	-60	-88.3	0	0	0	109.8	V99 M130 K131 V132 S168 F169 D171 N174 Y476	V99-Y176 HydrophobicContact CG2-CD1 4.11Å; V99-Y176 HydrophobicContact CG2-CD2 4.11Å; V99-Y176 HydrophobicContact CG2-CE1 3.52Å; V99-Y176 HydrophobicContact CG2-CE2 3.53Å; V99-Y176 HydrophobicContact CG2-CG 4.38Å; V99-Y176 WeakPolarHBondContact CG2-OH 3.36Å; M130-Y176 HydrophobicContact CG-CD1 4.22Å; M130-Y176 HydrophobicContact SD-CD1 3.7Å; M130-Y176 HydrophobicContact SD-CE1 4.3Å; K131-Y176 WeakPolarHBondContact O-CA 3.45Å; V132-Y176 HydrophobicContact CB-CD1 4.48Å; V132-Y176 HydrophobicContact CB-CE1 4.36Å; V132-Y176 HydrophobicContact CG1-CD1 4.24Å; V132-Y176 HydrophobicContact CG1-CE1 3.72Å; V132-Y176 HydrophobicContact CG2-CD1 3.94Å; V132-Y176 HydrophobicContact CG2-CE1 3.9Å; S168-Y176 CarbonylContact C-O 3.5Å; S168-Y176 WeakPolarHBondContact CA-O 3.44Å; F169-Y176 AromaticContact CD2-CD2 3.55Å; F169-Y176 HydrophobicContact CD2-CD2 3.55Å; F169-Y176 HydrophobicContact CD2-CE2 4.45Å; F169-Y176 AromaticContact CD2-CG 3.8Å; F169-Y176 HydrophobicContact CD2-CG 3.8Å; F169-Y176 VanDerWaalsContact CE2-CB 3.45Å; F169-Y176 HydrophobicContact CE2-CD1 4.01Å; F169-Y176 AromaticContact CE2-CD2 3.44Å; F169-Y176 HydrophobicContact CE2-CD2 3.44Å; F169-Y176 VanDerWaalsContact CE2-CD2 3.44Å; F169-Y176 HydrophobicContact CE2-CE2 4.2Å; F169-Y176 AromaticContact CE2-CG 3.33Å; F169-Y176 HydrophobicContact CE2-CG 3.33Å; F169-Y176 HydrophobicContact CZ-CD1 4.33Å; F169-Y176 HydrophobicContact CZ-CD2 4.41Å; F169-Y176 AromaticContact CZ-CG 3.87Å; F169-Y176 HydrophobicContact CZ-CG 3.87Å; F169-Y176 PolarHBondContact N-O 3.36Å; F169-Y176 WeakPolarHBondContact O-CB 3.47Å; F169-Y176 PolarHBondContact O-N 3.31Å; D171-Y176 HydrophobicContact CB-CE2 4.31Å; D171-Y176 PolarHBondContact OD2-OH 3.02Å; N174-Y176 HydrophobicContact CB-CD2 4.48Å; N174-Y176 HydrophobicContact CB-CE1 4.35Å; N174-Y176 HydrophobicContact CB-CE2 3.68Å; N174-Y176 WeakPolarHBondContact CB-OH 3.43Å; N174-Y176 PolarHBondContact ND2-OH 3.11Å; N174-Y176 VanDerWaalsContact ND2-OH 3.1Å; Y176-Y476 WeakPolarHBondContact O-CE1 3.21Å
177	L	91.4	Very high	91.3	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	9%	0.09	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	126.2	167.4	-56.3	172.4	0	0	0	107.7	M130 K131 L133 E150 L154 M165 Y476	M130-L177 CarbonylContact C-O 3.58Å; M130-L177 VanDerWaalsContact CA-O 3.29Å; M130-L177 WeakPolarHBondContact CA-O 3.25Å; K131-L177 HydrophobicContact CB-CB 4.25Å; K131-L177 HydrophobicContact CD-CD1 4.38Å; K131-L177 PolarHBondContact N-O 3.15Å; K131-L177 PolarHBondContact O-N 2.91Å; L133-L177 HydrophobicContact CD1-CD1 4.48Å; E150-L177 HydrophobicContact CG-CD1 4.49Å; E150-L177 WeakPolarHBondContact OE1-CD1 3.4Å; L154-L177 HydrophobicContact CD1-CD1 4.29Å; M165-L177 HydrophobicContact SD-CD2 3.72Å; L177-Y476 HydrophobicContact CD2-CE1 4.21Å; L177-Y476 HydrophobicContact CD2-CE2 4.21Å; L177-Y476 WeakPolarHBondContact CD2-OH 3.49Å; L177-Y476 WeakPolarHBondContact CG-OH 2.99Å
178	V	93.2	Very high	91.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.093	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.4	177.1	-174.6	0	0	0	0	108.5	F102 Y128 M130 Y166 Y167 F169	F102-V178 HydrophobicContact CE1-CG1 3.98Å; F102-V178 HydrophobicContact CE1-CG2 4.3Å; F102-V178 HydrophobicContact CE2-CG2 4.43Å; F102-V178 HydrophobicContact CZ-CG1 4.3Å; F102-V178 HydrophobicContact CZ-CG2 4Å; Y128-V178 HydrophobicContact CD1-CG1 4Å; Y128-V178 HydrophobicContact CD2-CG1 4.22Å; Y128-V178 HydrophobicContact CG-CG1 3.66Å; M130-V178 HydrophobicContact CE-CG2 3.85Å; M130-V178 HydrophobicContact CG-CG2 4.36Å; Y166-V178 PolarHBondContact N-O 2.89Å; Y167-V178 HydrophobicContact CD2-CB 3.77Å; Y167-V178 HydrophobicContact CD2-CG1 3.73Å; Y167-V178 HydrophobicContact CD2-CG2 4.3Å; Y167-V178 HydrophobicContact CE2-CG1 4.31Å; Y167-V178 HydrophobicContact CG-CB 4.41Å; Y167-V178 PolarHBondContact N-O 2.86Å; Y167-V178 PolarHBondContact O-N 3.46Å; F169-V178 HydrophobicContact CD1-CG2 4.49Å; F169-V178 HydrophobicContact CE1-CG2 3.63Å; F169-V178 HydrophobicContact CZ-CG2 4.33Å
179	M	93	Very high	91.4	Very high	16 Å²	16	17.2 Å²	17.2	8%	0.079	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	163.5	-169	-60	175	-61.4	0	0	110.4	Y128 A129 K131 L154 V163 K164 M165	Y128-M179 WeakPolarHBondContact CA-O 3.04Å; Y128-M179 WeakPolarHBondContact CB-O 3.33Å; A129-M179 PolarHBondContact N-O 3.36Å; A129-M179 PolarHBondContact O-N 3.39Å; K131-M179 HydrophobicContact CB-CE 3.86Å; K131-M179 HydrophobicContact CD-CE 4.39Å; L154-M179 HydrophobicContact CD1-SD 4.25Å; V163-M179 HydrophobicContact CG1-CB 3.74Å; V163-M179 HydrophobicContact CG1-CG 4.19Å; V163-M179 HydrophobicContact CG1-SD 4.04Å; K164-M179 CarbonylContact O-C 3.49Å; K164-M179 VanDerWaalsContact O-CA 3.29Å; K164-M179 WeakPolarHBondContact O-CA 3.34Å; M165-M179 HydrophobicContact CB-CG 4.39Å
180	E	93.1	Very high	91.5	Very high	38 Å²	38	17.6 Å²	17.6	18%	0.178	10%	0.097	C	C	.	.			trans	-55.1	141.3	165.9	64.6	-178.7	142.5	0	0	110.8	V163 K164 Y166 L182 K240	V163-E180 HydrophobicContact CG1-CG 4Å; K164-E180 HydrophobicContact CB-CB 4.42Å; K164-E180 HydrophobicContact CB-CG 4.02Å; K164-E180 VanDerWaalsContact CB-OE1 3.27Å; K164-E180 WeakPolarHBondContact CB-OE1 3.43Å; K164-E180 PolarHBondContact N-OE1 2.89Å; K164-E180 PolarHBondContact O-N 3.44Å; Y166-E180 HydrophobicContact CE2-CB 3.95Å; E180-L182 HydrophobicContact CG-CD2 3.98Å; E180-L182 HydrophobicContact CG-CG 4.3Å; E180-K240 WeakPolarHBondContact OE1-CE 3.36Å; E180-K240 IonicContact OE1-NZ 2.72Å; E180-K240 PolarHBondContact OE1-NZ 3.44Å; E180-K240 IonicContact OE2-NZ 3.55Å
181	F	94.8	Very high	91.7	Very high	23 Å²	23	15.5 Å²	15.5	10%	0.101	9%	0.087	C	C	.	.			trans	-87.8	127.7	171.4	172.9	-121.1	0	0	0	109.1	I108 L118 V127 P183 I418 D420 T421 F424	I108-F181 HydrophobicContact CD1-CD2 3.96Å; I108-F181 HydrophobicContact CD1-CE2 3.9Å; L118-F181 HydrophobicContact CD1-CB 4.04Å; L118-F181 HydrophobicContact CD1-CD1 3.66Å; L118-F181 HydrophobicContact CD1-CD2 3.41Å; L118-F181 VanDerWaalsContact CD1-CD2 3.41Å; L118-F181 HydrophobicContact CD1-CE1 3.89Å; L118-F181 HydrophobicContact CD1-CE2 3.67Å; L118-F181 HydrophobicContact CD1-CG 3.4Å; L118-F181 VanDerWaalsContact CD1-CG 3.4Å; L118-F181 HydrophobicContact CD1-CZ 3.89Å; V127-F181 HydrophobicContact CG1-CB 4.33Å; V127-F181 HydrophobicContact CG1-CD1 4.14Å; V127-F181 HydrophobicContact CG1-CG 4.41Å; F181-P183 HydrophobicContact CD1-CB 4.47Å; F181-P183 HydrophobicContact CE1-CB 3.8Å; F181-P183 HydrophobicContact CZ-CB 4.16Å; F181-P183 WeakPolarHBondContact O-CD 3.37Å; F181-I418 WeakPolarHBondContact CD1-O 3.4Å; F181-D420 VanDerWaalsContact CZ-O 3.31Å; F181-D420 WeakPolarHBondContact CZ-O 3.38Å; F181-T421 HydrophobicContact CZ-CG2 4.24Å; F181-F424 HydrophobicContact CD2-CZ 4.42Å; F181-F424 HydrophobicContact CE2-CD2 4.47Å; F181-F424 AromaticContact CE2-CE2 3.5Å; F181-F424 HydrophobicContact CE2-CE2 3.5Å; F181-F424 AromaticContact CE2-CZ 3.51Å; F181-F424 HydrophobicContact CE2-CZ 3.51Å; F181-F424 HydrophobicContact CZ-CD2 4.5Å; F181-F424 AromaticContact CZ-CE2 3.65Å; F181-F424 HydrophobicContact CZ-CE2 3.65Å; F181-F424 HydrophobicContact CZ-CZ 4.13Å
182	L	94.5	Very high	91.7	Very high	8 Å²	8	15.4 Å²	15.4	4%	0.042	9%	0.086	C	C	.	.			trans	-109.5	99.9	179.9	-63.5	-175.5	0	0	0	109.6	V163 E180 G184 G185 L232 L233 D234 K240 F424	V163-L182 HydrophobicContact CG2-CD1 3.76Å; E180-L182 HydrophobicContact CG-CD2 3.98Å; E180-L182 HydrophobicContact CG-CG 4.3Å; L182-G184 PolarHBondContact O-N 3.04Å; L182-G184 VanDerWaalsContact O-N 3.16Å; L182-G185 PolarHBondContact O-N 3.48Å; L182-L232 HydrophobicContact CB-CB 4.41Å; L182-L232 HydrophobicContact CD1-CB 3.51Å; L182-L232 HydrophobicContact CD1-CD1 3.98Å; L182-L232 HydrophobicContact CD1-CG 4.4Å; L182-L233 WeakPolarHBondContact CB-O 3.32Å; L182-D234 HydrophobicContact CD2-CB 3.95Å; L182-K240 HydrophobicContact CD1-CB 3.75Å; L182-K240 HydrophobicContact CD1-CD 3.65Å; L182-K240 HydrophobicContact CD1-CG 4.31Å; L182-K240 HydrophobicContact CD2-CD 3.73Å; L182-K240 HydrophobicContact CG-CD 4.35Å; L182-F424 VanDerWaalsContact O-CZ 3.24Å; L182-F424 WeakPolarHBondContact O-CZ 3.12Å
183	P	94.1	Very high	91.8	Very high	14 Å²	14	18.7 Å²	18.7	9%	0.091	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.5	-7.1	-169	29.3	-36.6	0	0	0	114.5	F181 G185 V415 N423	F181-P183 HydrophobicContact CD1-CB 4.47Å; F181-P183 HydrophobicContact CE1-CB 3.8Å; F181-P183 HydrophobicContact CZ-CB 4.16Å; F181-P183 WeakPolarHBondContact O-CD 3.37Å; P183-G185 PolarHBondContact O-N 3.49Å; P183-V415 HydrophobicContact CB-CG1 3.83Å; P183-V415 HydrophobicContact CB-CG2 3.98Å; P183-V415 HydrophobicContact CG-CG1 4.12Å; P183-V415 HydrophobicContact CG-CG2 4.09Å; P183-N423 WeakPolarHBondContact O-CB 3.32Å; P183-N423 PolarHBondContact O-ND2 2.7Å
184	G	93.8	Very high	92	Very high	6 Å²	6	20.6 Å²	20.6	6%	0.062	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-8.6	176.2	0	0	0	0	0	114.5	L182 L233	L182-G184 PolarHBondContact O-N 3.04Å; L182-G184 VanDerWaalsContact O-N 3.16Å; G184-L233 WeakPolarHBondContact CA-O 3.41Å; G184-L233 PolarHBondContact N-O 2.88Å
185	G	93.2	Very high	91.9	Very high	1 Å²	1	22.9 Å²	22.9	1%	0.01	12%	0.117	C	C	.	.			trans	72.3	-154.4	-177.1	0	0	0	0	0	111.8	L182 P183 L232 L233	L182-G185 PolarHBondContact O-N 3.48Å; P183-G185 PolarHBondContact O-N 3.49Å; G185-L232 CarbonylContact O-C 3.58Å; G185-L232 WeakPolarHBondContact O-CA 3.49Å; G185-L233 PolarHBondContact O-N 2.89Å
186	D	93	Very high	92.1	Very high	29 Å²	29	25.7 Å²	25.7	16%	0.155	13%	0.134	C	C	.	.	B	Isolated β-bridge	trans	-107.7	156.1	-180	57	74.6	0	0	0	113	M188 T189 L190 L231 L232	D186-M188 PolarHBondContact O-N 3.04Å; D186-M188 WeakPolarHBondContact OD1-CA 3.44Å; D186-M188 VanDerWaalsContact OD1-CB 3.27Å; D186-M188 WeakPolarHBondContact OD1-CB 3.36Å; D186-M188 PolarHBondContact OD1-N 3.45Å; D186-T189 PolarHBondContact O-N 3.18Å; D186-T189 WeakPolarHBondContact OD1-CB 3.47Å; D186-T189 PolarHBondContact OD1-N 3.48Å; D186-T189 PolarHBondContact OD1-OG1 2.55Å; D186-T189 PolarHBondContact OD2-OG1 2.7Å; D186-L190 PolarHBondContact O-N 2.8Å; D186-L190 VanDerWaalsContact O-N 3.1Å; D186-L231 CarbonylContact C-O 3.21Å; D186-L231 WeakPolarHBondContact CA-O 3.32Å; D186-L232 HydrophobicContact CB-CD2 3.71Å
187	M	94.5	Very high	92.3	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-61.2	-29.1	178.7	-179.4	60.4	65.9	0	0	111.8	L190 L191 L197 Y205 P228 L231 L233 M328	M187-L190 HydrophobicContact CE-CD2 4.1Å; M187-L190 PolarHBondContact O-N 3.44Å; M187-L190 HydrophobicContact SD-CB 4.47Å; M187-L190 HydrophobicContact SD-CD2 3.74Å; M187-L190 HydrophobicContact SD-CG 4.4Å; M187-L191 HydrophobicContact CG-CD1 4.06Å; M187-L191 HydrophobicContact CG-CG 4.27Å; M187-L191 WeakPolarHBondContact O-CB 3.42Å; M187-L191 VanDerWaalsContact O-CG 3.25Å; M187-L191 WeakPolarHBondContact O-CG 3.37Å; M187-L191 PolarHBondContact O-N 3.47Å; M187-L191 HydrophobicContact SD-CG 4.17Å; M187-L197 HydrophobicContact SD-CD1 4.47Å; M187-Y205 HydrophobicContact CE-CD1 3.57Å; M187-Y205 HydrophobicContact CE-CD2 3.78Å; M187-Y205 HydrophobicContact CE-CE1 3.93Å; M187-Y205 HydrophobicContact CE-CE2 4.12Å; M187-Y205 HydrophobicContact CE-CG 3.49Å; M187-Y205 VanDerWaalsContact CE-CG 3.49Å; M187-P228 HydrophobicContact CB-CB 4.01Å; M187-P228 WeakPolarHBondContact CB-O 3.48Å; M187-P228 HydrophobicContact CG-CB 4Å; M187-P228 PolarHBondContact N-O 3.33Å; M187-L231 HydrophobicContact CB-CB 3.81Å; M187-L231 HydrophobicContact CB-CD1 4.43Å; M187-L231 HydrophobicContact CG-CD1 4.48Å; M187-L231 PolarHBondContact N-O 3.12Å; M187-L233 HydrophobicContact CE-CD2 4.23Å; M187-M328 HydrophobicContact CE-CE 3.98Å; M187-M328 HydrophobicContact CG-CE 3.99Å; M187-M328 HydrophobicContact SD-CE 3.86Å
188	M	91.6	Very high	92.5	Very high	12 Å²	12	29.4 Å²	29.4	6%	0.059	16%	0.16	C	C	.	.	H	α-helix	trans	-61.9	-48.7	174.8	163.1	154.6	167.6	0	0	111.6	D186 L190 L191 M192 P228 D229 R288 A292	D186-M188 PolarHBondContact O-N 3.04Å; D186-M188 WeakPolarHBondContact OD1-CA 3.44Å; D186-M188 VanDerWaalsContact OD1-CB 3.27Å; D186-M188 WeakPolarHBondContact OD1-CB 3.36Å; D186-M188 PolarHBondContact OD1-N 3.45Å; M188-L190 VanDerWaalsContact C-N 3.31Å; M188-L190 PolarHBondContact O-N 3.15Å; M188-L191 PolarHBondContact O-N 3.11Å; M188-M192 HydrophobicContact CE-SD 4.26Å; M188-M192 WeakPolarHBondContact O-CG 3.32Å; M188-M192 PolarHBondContact O-N 3.33Å; M188-P228 HydrophobicContact CB-CB 3.89Å; M188-P228 PolarHBondContact N-O 3.19Å; M188-P228 VanDerWaalsContact N-O 3.12Å; M188-D229 HydrophobicContact CB-CB 4.2Å; M188-D229 HydrophobicContact SD-CB 4.12Å; M188-R288 VanDerWaalsContact CE-C 3.43Å; M188-R288 HydrophobicContact CE-CB 3.86Å; M188-R288 HydrophobicContact CE-CG 3.47Å; M188-R288 VanDerWaalsContact CE-CG 3.47Å; M188-R288 WeakPolarHBondContact CE-O 3.22Å; M188-R288 HydrophobicContact SD-CG 3.99Å; M188-R288 PolarHBondContact SD-NE 3.12Å; M188-R288 VanDerWaalsContact SD-NE 3.45Å; M188-A292 HydrophobicContact CE-CB 3.6Å; M188-A292 HydrophobicContact SD-CB 3.97Å
189	T	90.2	Very high	92.7	Very high	9 Å²	9	32.3 Å²	32.3	6%	0.055	17%	0.174	C	C	.	.	H	α-helix	trans	-64	-39	177.9	-60.4	0	0	0	0	110.8	D186 M192 K193	D186-T189 PolarHBondContact O-N 3.18Å; D186-T189 WeakPolarHBondContact OD1-CB 3.47Å; D186-T189 PolarHBondContact OD1-N 3.48Å; D186-T189 PolarHBondContact OD1-OG1 2.55Å; D186-T189 PolarHBondContact OD2-OG1 2.7Å; T189-M192 PolarHBondContact O-N 3.46Å; T189-K193 WeakPolarHBondContact O-CG 3.37Å; T189-K193 PolarHBondContact O-N 2.94Å; T189-K193 VanDerWaalsContact O-N 3.15Å
190	L	92.3	Very high	92.8	Very high	17 Å²	17	38.5 Å²	38.5	9%	0.089	20%	0.203	C	C	.	.	H	α-helix	trans	-60.1	-51.7	172.7	175.3	60.5	0	0	0	111.7	D186 M187 M188 M192 K193 V194 Y205 L233 I411	D186-L190 PolarHBondContact O-N 2.8Å; D186-L190 VanDerWaalsContact O-N 3.1Å; M187-L190 HydrophobicContact CE-CD2 4.1Å; M187-L190 PolarHBondContact O-N 3.44Å; M187-L190 HydrophobicContact SD-CB 4.47Å; M187-L190 HydrophobicContact SD-CD2 3.74Å; M187-L190 HydrophobicContact SD-CG 4.4Å; M188-L190 VanDerWaalsContact C-N 3.31Å; M188-L190 PolarHBondContact O-N 3.15Å; L190-M192 PolarHBondContact O-N 3.25Å; L190-K193 WeakPolarHBondContact O-CB 3.25Å; L190-K193 PolarHBondContact O-N 2.92Å; L190-V194 HydrophobicContact CD1-CG1 3.96Å; L190-V194 WeakPolarHBondContact O-CG2 3.38Å; L190-V194 PolarHBondContact O-N 2.92Å; L190-Y205 HydrophobicContact CD2-CE2 4.45Å; L190-L233 HydrophobicContact CB-CD1 4.44Å; L190-L233 HydrophobicContact CD2-CD1 3.64Å; L190-I411 HydrophobicContact CD1-CD1 4.14Å; L190-I411 HydrophobicContact CD1-CG2 4.12Å; L190-I411 HydrophobicContact CD2-CD1 3.9Å; L190-I411 HydrophobicContact CG-CD1 4.4Å
191	L	92.4	Very high	93	Very high	5 Å²	5	37 Å²	37	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-31.1	178.3	-72.4	172.3	0	0	0	112.8	M187 M188 K193 D195 L197 P228 E327 M328	M187-L191 HydrophobicContact CG-CD1 4.06Å; M187-L191 HydrophobicContact CG-CG 4.27Å; M187-L191 WeakPolarHBondContact O-CB 3.42Å; M187-L191 VanDerWaalsContact O-CG 3.25Å; M187-L191 WeakPolarHBondContact O-CG 3.37Å; M187-L191 PolarHBondContact O-N 3.47Å; M187-L191 HydrophobicContact SD-CG 4.17Å; M188-L191 PolarHBondContact O-N 3.11Å; L191-K193 VanDerWaalsContact C-N 3.34Å; L191-D195 WeakPolarHBondContact O-CA 3.23Å; L191-D195 PolarHBondContact O-N 2.92Å; L191-L197 HydrophobicContact CD2-CD1 4.25Å; L191-L197 HydrophobicContact CD2-CD2 4.39Å; L191-L197 HydrophobicContact CD2-CG 3.92Å; L191-P228 HydrophobicContact CD1-CB 4.14Å; L191-P228 HydrophobicContact CD1-CG 4.15Å; L191-E327 HydrophobicContact CD1-CG 4.21Å; L191-M328 HydrophobicContact CD1-CG 4.46Å; L191-M328 HydrophobicContact CD2-CB 4.47Å; L191-M328 HydrophobicContact CD2-CG 4.1Å
192	M	87.7	Confident	93.1	Very high	43 Å²	43	35.9 Å²	35.9	21%	0.212	19%	0.191	C	C	.	.	H	α-helix	trans	-68.6	-30.4	172.1	-74.1	-174.5	64.1	0	0	113.3	M188 T189 L190 R288 R289	M188-M192 HydrophobicContact CE-SD 4.26Å; M188-M192 WeakPolarHBondContact O-CG 3.32Å; M188-M192 PolarHBondContact O-N 3.33Å; T189-M192 PolarHBondContact O-N 3.46Å; L190-M192 PolarHBondContact O-N 3.25Å; M192-R288 HydrophobicContact SD-CB 4.36Å; M192-R289 HydrophobicContact CE-CG 3.85Å; M192-R289 HydrophobicContact SD-CG 3.86Å
193	K	87.4	Confident	93.3	Very high	118 Å²	118	37.3 Å²	37.3	51%	0.513	20%	0.198	S	C	.	.	H	α-helix	trans	-80.6	-40.6	179.3	-72.4	177	179.5	-175.9	0	112.6	T189 L190 L191 N423	T189-K193 WeakPolarHBondContact O-CG 3.37Å; T189-K193 PolarHBondContact O-N 2.94Å; T189-K193 VanDerWaalsContact O-N 3.15Å; L190-K193 WeakPolarHBondContact O-CB 3.25Å; L190-K193 PolarHBondContact O-N 2.92Å; L191-K193 VanDerWaalsContact C-N 3.34Å; K193-N423 PolarHBondContact NZ-OD1 2.86Å
194	V	89.8	Confident	93.4	Very high	58 Å²	58	37.5 Å²	37.5	35%	0.352	20%	0.197	S	C	.	.	H	α-helix	trans	-101.3	-6.8	-171.7	-55.7	0	0	0	0	114.3	L190 T196 L197	L190-V194 HydrophobicContact CD1-CG1 3.96Å; L190-V194 WeakPolarHBondContact O-CG2 3.38Å; L190-V194 PolarHBondContact O-N 2.92Å; V194-T196 PolarHBondContact O-N 2.8Å; V194-L197 HydrophobicContact CG2-CD2 3.5Å; V194-L197 VanDerWaalsContact CG2-CD2 3.5Å
195	D	88.4	Confident	93.6	Very high	77 Å²	77	37.2 Å²	37.2	41%	0.412	19%	0.194	S	C	.	.	S	Bend	trans	67.4	-53.9	-177.2	-63.7	-22.2	0	0	0	115.6	L191 K285 G331	L191-D195 WeakPolarHBondContact O-CA 3.23Å; L191-D195 PolarHBondContact O-N 2.92Å; D195-K285 WeakPolarHBondContact OD1-CE 3.47Å; D195-K285 IonicContact OD1-NZ 3.92Å; D195-K285 PolarHBondContact OD1-NZ 2.88Å; D195-K285 IonicContact OD2-NZ 2.91Å; D195-K285 PolarHBondContact OD2-NZ 2.86Å; D195-K285 VanDerWaalsContact OD2-NZ 3.17Å; D195-G331 WeakPolarHBondContact O-CA 3.5Å
196	T	93.8	Very high	93.8	Very high	59 Å²	59	37.1 Å²	37.1	36%	0.362	19%	0.194	S	C	.	.	S	Bend	trans	-146.4	153.5	179.1	54.1	0	0	0	0	109.7	V194 M328 M360	V194-T196 PolarHBondContact O-N 2.8Å; T196-M328 CarbonylContact C-O 3.39Å; T196-M328 WeakPolarHBondContact CA-O 3.41Å; T196-M360 HydrophobicContact CG2-CE 4.31Å
197	L	95.8	Very high	94.1	Very high	13 Å²	13	35.8 Å²	35.8	7%	0.068	19%	0.186	C	C	.	.			trans	-98.3	151.5	174.4	-58.7	-169.7	0	0	0	111	M187 L191 V194 A201 A202 Y205 M328 I411	M187-L197 HydrophobicContact SD-CD1 4.47Å; L191-L197 HydrophobicContact CD2-CD1 4.25Å; L191-L197 HydrophobicContact CD2-CD2 4.39Å; L191-L197 HydrophobicContact CD2-CG 3.92Å; V194-L197 HydrophobicContact CG2-CD2 3.5Å; V194-L197 VanDerWaalsContact CG2-CD2 3.5Å; L197-A201 HydrophobicContact CB-CB 4.17Å; L197-A202 HydrophobicContact CB-CB 4.44Å; L197-Y205 HydrophobicContact CD1-CD2 3.76Å; L197-Y205 HydrophobicContact CD1-CE2 4.18Å; L197-M328 HydrophobicContact CB-CB 4.31Å; L197-M328 HydrophobicContact CD1-CB 4.08Å; L197-M328 HydrophobicContact CD1-CG 3.82Å; L197-M328 HydrophobicContact CD1-SD 4.13Å; L197-M328 HydrophobicContact CG-CB 4.24Å; L197-M328 HydrophobicContact CG-CG 4.41Å; L197-M328 PolarHBondContact N-O 2.88Å; L197-I411 HydrophobicContact CD2-CD1 3.65Å
198	S	96.5	Very high	94.2	Very high	71 Å²	71	35.8 Å²	35.8	50%	0.497	19%	0.186	S	C	.	.			trans	-63.8	158.1	164.1	64.8	0	0	0	0	110.1	E200 A201 A202	S198-E200 PolarHBondContact O-N 2.82Å; S198-A201 PolarHBondContact O-N 3.35Å; S198-A201 VanDerWaalsContact O-N 3.17Å; S198-A201 WeakPolarHBondContact OG-CB 3.4Å; S198-A201 PolarHBondContact OG-N 3.43Å; S198-A202 WeakPolarHBondContact O-CB 3.35Å; S198-A202 PolarHBondContact O-N 3.17Å
199	E	96.6	Very high	94.5	Very high	62 Å²	62	35.2 Å²	35.2	29%	0.29	18%	0.184	S	C	.	.	H	α-helix	trans	-60.1	-35	176.6	-69.4	-167.9	-164.8	0	0	112.7	A202 Q203 L329 I362 S363	E199-A202 PolarHBondContact O-N 3.12Å; E199-Q203 VanDerWaalsContact O-CB 3.24Å; E199-Q203 WeakPolarHBondContact O-CB 3.26Å; E199-Q203 PolarHBondContact O-N 2.97Å; E199-L329 HydrophobicContact CB-CD2 4.49Å; E199-L329 HydrophobicContact CG-CD2 3.84Å; E199-I362 WeakPolarHBondContact OE1-CA 3.41Å; E199-S363 VanDerWaalsContact CD-OG 3.23Å; E199-S363 VanDerWaalsContact OE1-CB 3.23Å; E199-S363 WeakPolarHBondContact OE1-CB 3.09Å; E199-S363 PolarHBondContact OE1-N 2.83Å; E199-S363 PolarHBondContact OE1-OG 2.84Å; E199-S363 WeakPolarHBondContact OE2-CB 3.23Å; E199-S363 PolarHBondContact OE2-OG 3.44Å
200	E	95.6	Very high	94.8	Very high	146 Å²	146	34.8 Å²	34.8	68%	0.682	18%	0.181	S	C	*	.	H	α-helix	trans	-62.5	-46.8	174.7	-176.2	-179.4	-177.2	0	0	111.7	S198 Q203 F204	S198-E200 PolarHBondContact O-N 2.82Å; E200-Q203 PolarHBondContact O-N 3.19Å; E200-F204 PolarHBondContact O-N 2.87Å
201	A	96.7	Very high	95	Very high	5 Å²	5	34.7 Å²	34.7	4%	0.041	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-39.9	177.5	0	0	0	0	0	111.8	L197 S198 F204 Y205 P410	L197-A201 HydrophobicContact CB-CB 4.17Å; S198-A201 PolarHBondContact O-N 3.35Å; S198-A201 VanDerWaalsContact O-N 3.17Å; S198-A201 WeakPolarHBondContact OG-CB 3.4Å; S198-A201 PolarHBondContact OG-N 3.43Å; A201-F204 PolarHBondContact O-N 2.87Å; A201-Y205 WeakPolarHBondContact O-CD2 3.5Å; A201-Y205 PolarHBondContact O-N 2.73Å; A201-P410 HydrophobicContact CB-CB 3.98Å; A201-P410 HydrophobicContact CB-CG 3.99Å
202	A	97.4	Very high	95.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-64.6	-40.2	175.3	0	0	0	0	0	111.9	L197 S198 E199 A206 M328 L329	L197-A202 HydrophobicContact CB-CB 4.44Å; S198-A202 WeakPolarHBondContact O-CB 3.35Å; S198-A202 PolarHBondContact O-N 3.17Å; E199-A202 PolarHBondContact O-N 3.12Å; A202-A206 WeakPolarHBondContact O-CB 3.44Å; A202-A206 PolarHBondContact O-N 3.18Å; A202-M328 HydrophobicContact CB-CB 4.16Å; A202-M328 HydrophobicContact CB-SD 4.36Å; A202-L329 HydrophobicContact CB-CD2 3.61Å; A202-L329 HydrophobicContact CB-CG 4.11Å
203	Q	97.7	Very high	95.5	Very high	38 Å²	38	32.4 Å²	32.4	18%	0.178	17%	0.169	C	C	.	.	H	α-helix	trans	-59.4	-47.4	174.4	-174	-163.4	61.2	0	0	110.9	E199 E200 A207 F395 F396	E199-Q203 VanDerWaalsContact O-CB 3.24Å; E199-Q203 WeakPolarHBondContact O-CB 3.26Å; E199-Q203 PolarHBondContact O-N 2.97Å; E200-Q203 PolarHBondContact O-N 3.19Å; Q203-A207 VanDerWaalsContact O-CB 3.28Å; Q203-A207 WeakPolarHBondContact O-CB 2.97Å; Q203-A207 PolarHBondContact O-N 3.19Å; Q203-F395 HydrophobicContact CB-CE1 3.83Å; Q203-F395 HydrophobicContact CB-CZ 3.93Å; Q203-F395 HydrophobicContact CG-CD1 4.45Å; Q203-F395 HydrophobicContact CG-CE1 4.08Å; Q203-F395 PolarHBondContact NE2-O 3Å; Q203-F396 HydrophobicContact CG-CD1 3.82Å; Q203-F396 HydrophobicContact CG-CE1 4.32Å
204	F	97.4	Very high	95.8	Very high	18 Å²	18	28 Å²	28	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-59.5	-55	177.9	-179.9	-87.7	0	0	0	112.2	E200 A201 A206 A207 E208 H238 I404 A409 P410	E200-F204 PolarHBondContact O-N 2.87Å; A201-F204 PolarHBondContact O-N 2.87Å; F204-A206 PolarHBondContact O-N 3.26Å; F204-A207 PolarHBondContact O-N 3.33Å; F204-E208 HydrophobicContact CD1-CG 4.42Å; F204-E208 VanDerWaalsContact CE1-CD 3.42Å; F204-E208 HydrophobicContact CE1-CG 4.03Å; F204-E208 WeakPolarHBondContact CE1-OE2 3.48Å; F204-E208 HydrophobicContact CZ-CG 4.21Å; F204-E208 VanDerWaalsContact CZ-OE1 3.32Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.38Å; F204-E208 PolarHBondContact O-N 2.78Å; F204-H238 AromaticContact CZ-CE1 3.76Å; F204-H238 AromaticContact CZ-ND1 3.57Å; F204-I404 HydrophobicContact CD2-CD1 4Å; F204-I404 HydrophobicContact CD2-CG1 3.82Å; F204-I404 HydrophobicContact CE2-CD1 4.13Å; F204-I404 HydrophobicContact CE2-CG1 3.51Å; F204-I404 HydrophobicContact CZ-CG1 4.22Å; F204-A409 HydrophobicContact CE1-CB 4.06Å; F204-A409 HydrophobicContact CZ-CB 4.09Å; F204-P410 HydrophobicContact CB-CG 3.93Å; F204-P410 HydrophobicContact CD1-CG 3.7Å; F204-P410 VanDerWaalsContact CE1-CD 3.47Å; F204-P410 HydrophobicContact CE1-CG 4.38Å; F204-P410 VanDerWaalsContact CG-CD 3.48Å; F204-P410 HydrophobicContact CG-CG 3.82Å
205	Y	97.8	Very high	95.8	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-69.6	-33.2	-177.3	-69.9	-58.5	0	0	0	112.9	M187 L190 L197 A201 A207 T209 L233 G237 P410 I411	M187-Y205 HydrophobicContact CE-CD1 3.57Å; M187-Y205 HydrophobicContact CE-CD2 3.78Å; M187-Y205 HydrophobicContact CE-CE1 3.93Å; M187-Y205 HydrophobicContact CE-CE2 4.12Å; M187-Y205 HydrophobicContact CE-CG 3.49Å; M187-Y205 VanDerWaalsContact CE-CG 3.49Å; L190-Y205 HydrophobicContact CD2-CE2 4.45Å; L197-Y205 HydrophobicContact CD1-CD2 3.76Å; L197-Y205 HydrophobicContact CD1-CE2 4.18Å; A201-Y205 WeakPolarHBondContact O-CD2 3.5Å; A201-Y205 PolarHBondContact O-N 2.73Å; Y205-A207 VanDerWaalsContact C-N 3.33Å; Y205-T209 VanDerWaalsContact O-CB 3.31Å; Y205-T209 WeakPolarHBondContact O-CB 3.39Å; Y205-T209 PolarHBondContact O-N 3.29Å; Y205-T209 PolarHBondContact O-OG1 3.1Å; Y205-L233 HydrophobicContact CD1-CD2 4.39Å; Y205-L233 HydrophobicContact CE1-CD2 3.8Å; Y205-G237 WeakPolarHBondContact CE1-O 3.45Å; Y205-P410 HydrophobicContact CE2-CG 3.94Å; Y205-I411 HydrophobicContact CE2-CD1 3.83Å; Y205-I411 HydrophobicContact CE2-CG1 4.26Å; Y205-I411 WeakPolarHBondContact OH-CB 3.34Å
206	A	97.9	Very high	95.8	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.2	-40.3	173.8	0	0	0	0	0	111.4	A202 F204 T209 A210 L321 M325 F396	A202-A206 WeakPolarHBondContact O-CB 3.44Å; A202-A206 PolarHBondContact O-N 3.18Å; F204-A206 PolarHBondContact O-N 3.26Å; A206-T209 PolarHBondContact O-N 3.48Å; A206-A210 WeakPolarHBondContact O-CB 3.31Å; A206-A210 PolarHBondContact O-N 3.45Å; A206-L321 HydrophobicContact CB-CD1 4.26Å; A206-M325 HydrophobicContact CB-CE 4.11Å; A206-M325 HydrophobicContact CB-CG 3.69Å; A206-M325 HydrophobicContact CB-SD 3.76Å; A206-F396 HydrophobicContact CB-CE1 4.02Å; A206-F396 HydrophobicContact CB-CZ 4.12Å
207	A	97.9	Very high	95.6	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-67.8	-44.9	176.6	0	0	0	0	0	112.8	Q203 F204 Y205 T209 A210 L211 F396 L399 W401 I404	Q203-A207 VanDerWaalsContact O-CB 3.28Å; Q203-A207 WeakPolarHBondContact O-CB 2.97Å; Q203-A207 PolarHBondContact O-N 3.19Å; F204-A207 PolarHBondContact O-N 3.33Å; Y205-A207 VanDerWaalsContact C-N 3.33Å; A207-T209 VanDerWaalsContact C-N 3.32Å; A207-T209 PolarHBondContact O-N 3.36Å; A207-A210 PolarHBondContact O-N 3.08Å; A207-A210 VanDerWaalsContact O-N 3.14Å; A207-L211 WeakPolarHBondContact O-CG 3.46Å; A207-L211 PolarHBondContact O-N 3.38Å; A207-F396 HydrophobicContact CB-CD1 4.29Å; A207-F396 HydrophobicContact CB-CE1 4.18Å; A207-L399 HydrophobicContact CB-CD2 3.17Å; A207-W401 HydrophobicContact CB-CE3 4.14Å; A207-W401 HydrophobicContact CB-CH2 3.54Å; A207-W401 HydrophobicContact CB-CZ2 4.21Å; A207-W401 HydrophobicContact CB-CZ3 3.49Å; A207-W401 VanDerWaalsContact CB-CZ3 3.49Å; A207-I404 HydrophobicContact CB-CD1 3.83Å
208	E	97.6	Very high	95.3	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.8	-39.7	174.3	-70	-158.2	146.5	0	0	112	W161 F204 A210 L211 A212 H238 L239 I404	W161-E208 HydrophobicContact CH2-CG 4.27Å; W161-E208 HydrophobicContact CZ3-CB 3.85Å; W161-E208 HydrophobicContact CZ3-CG 3.86Å; F204-E208 HydrophobicContact CD1-CG 4.42Å; F204-E208 VanDerWaalsContact CE1-CD 3.42Å; F204-E208 HydrophobicContact CE1-CG 4.03Å; F204-E208 WeakPolarHBondContact CE1-OE2 3.48Å; F204-E208 HydrophobicContact CZ-CG 4.21Å; F204-E208 VanDerWaalsContact CZ-OE1 3.32Å; F204-E208 WeakPolarHBondContact CZ-OE1 3.38Å; F204-E208 PolarHBondContact O-N 2.78Å; E208-A210 VanDerWaalsContact C-N 3.3Å; E208-A210 PolarHBondContact O-N 3.49Å; E208-L211 PolarHBondContact O-N 3.16Å; E208-A212 WeakPolarHBondContact O-CB 3.29Å; E208-A212 PolarHBondContact O-N 3.07Å; E208-H238 IonicContact OE1-CE1 2.81Å; E208-H238 IonicContact OE1-CG 3.97Å; E208-H238 IonicContact OE1-ND1 2.89Å; E208-H238 PolarHBondContact OE1-ND1 3.16Å; E208-H238 WeakPolarHBondContact OE2-CA 3.35Å; E208-H238 IonicContact OE2-ND1 3.49Å; E208-L239 HydrophobicContact CB-CB 4Å; E208-L239 WeakPolarHBondContact OE2-CB 3.47Å; E208-L239 PolarHBondContact OE2-N 3.4Å; E208-I404 HydrophobicContact CG-CD1 3.8Å; E208-I404 HydrophobicContact CG-CG1 4.17Å; E208-I404 HydrophobicContact CG-CG2 4.49Å
209	T	97.7	Very high	94.5	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.1	-42.1	173.1	-54.4	0	0	0	0	110.5	Y205 A206 A207 A212 V213 L231 L239 L321	Y205-T209 VanDerWaalsContact O-CB 3.31Å; Y205-T209 WeakPolarHBondContact O-CB 3.39Å; Y205-T209 PolarHBondContact O-N 3.29Å; Y205-T209 PolarHBondContact O-OG1 3.1Å; A206-T209 PolarHBondContact O-N 3.48Å; A207-T209 VanDerWaalsContact C-N 3.32Å; A207-T209 PolarHBondContact O-N 3.36Å; T209-A212 PolarHBondContact O-N 3.16Å; T209-V213 HydrophobicContact CG2-CG2 4.3Å; T209-V213 WeakPolarHBondContact O-CG2 3.39Å; T209-V213 PolarHBondContact O-N 2.69Å; T209-L231 HydrophobicContact CG2-CD1 4.28Å; T209-L231 HydrophobicContact CG2-CD2 4.06Å; T209-L239 WeakPolarHBondContact OG1-CD1 3.15Å; T209-L321 HydrophobicContact CG2-CD1 3.78Å
210	A	97.5	Very high	93.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-65.6	-41.1	179.6	0	0	0	0	0	112.7	A206 A207 E208 A212 V213 E214 W318 L321 L387 I390 W401	A206-A210 WeakPolarHBondContact O-CB 3.31Å; A206-A210 PolarHBondContact O-N 3.45Å; A207-A210 PolarHBondContact O-N 3.08Å; A207-A210 VanDerWaalsContact O-N 3.14Å; E208-A210 VanDerWaalsContact C-N 3.3Å; E208-A210 PolarHBondContact O-N 3.49Å; A210-A212 VanDerWaalsContact C-N 3.3Å; A210-A212 PolarHBondContact O-N 3.03Å; A210-V213 PolarHBondContact O-N 3.43Å; A210-E214 WeakPolarHBondContact O-CB 3.27Å; A210-E214 PolarHBondContact O-N 3.41Å; A210-W318 HydrophobicContact CB-CZ3 3.95Å; A210-L321 HydrophobicContact CB-CD2 3.9Å; A210-L387 HydrophobicContact CB-CD1 3.61Å; A210-I390 HydrophobicContact CB-CG2 4.49Å; A210-W401 HydrophobicContact CB-CZ3 4.41Å
211	L	96.4	Very high	93.2	Very high	15 Å²	15	23.1 Å²	23.1	8%	0.079	13%	0.128	C	C	.	.	H	α-helix	trans	-60.9	-40.8	172.2	-74.7	161.5	0	0	0	111.5	W161 A207 E208 S215 L387 W401 I404	W161-L211 HydrophobicContact CD2-CB 4.04Å; W161-L211 HydrophobicContact CE3-CB 4.33Å; W161-L211 HydrophobicContact CH2-CB 4.19Å; W161-L211 HydrophobicContact CH2-CD1 3.7Å; W161-L211 HydrophobicContact CZ2-CB 3.87Å; W161-L211 HydrophobicContact CZ2-CD1 3.66Å; W161-L211 HydrophobicContact CZ2-CG 4.26Å; W161-L211 HydrophobicContact CZ3-CB 4.4Å; W161-L211 HydrophobicContact CZ3-CD1 4.48Å; A207-L211 WeakPolarHBondContact O-CG 3.46Å; A207-L211 PolarHBondContact O-N 3.38Å; E208-L211 PolarHBondContact O-N 3.16Å; L211-S215 WeakPolarHBondContact O-CB 3.19Å; L211-S215 PolarHBondContact O-N 3.05Å; L211-L387 HydrophobicContact CD2-CD2 3.58Å; L211-L387 HydrophobicContact CG-CD2 4.29Å; L211-W401 HydrophobicContact CD1-CE3 4.04Å; L211-W401 HydrophobicContact CD1-CZ3 4.49Å; L211-W401 HydrophobicContact CD2-CE3 4.33Å; L211-W401 HydrophobicContact CG-CE3 4.02Å; L211-W401 HydrophobicContact CG-CZ3 4.24Å; L211-I404 HydrophobicContact CD1-CG2 3.65Å
212	A	95	Very high	92.7	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-67.4	-44.8	178.4	0	0	0	0	0	112.8	W161 E208 T209 A210 S215 I216 L239 L241	W161-A212 HydrophobicContact CB-CB 3.65Å; W161-A212 HydrophobicContact CE3-CB 4.47Å; W161-A212 HydrophobicContact CG-CB 4.3Å; E208-A212 WeakPolarHBondContact O-CB 3.29Å; E208-A212 PolarHBondContact O-N 3.07Å; T209-A212 PolarHBondContact O-N 3.16Å; A210-A212 VanDerWaalsContact C-N 3.3Å; A210-A212 PolarHBondContact O-N 3.03Å; A212-S215 PolarHBondContact O-N 2.97Å; A212-S215 PolarHBondContact O-OG 2.77Å; A212-I216 PolarHBondContact O-N 2.87Å; A212-L239 HydrophobicContact CB-CD2 4.08Å; A212-L241 VanDerWaalsContact C-CD1 3.46Å; A212-L241 HydrophobicContact CB-CD1 3.47Å; A212-L241 VanDerWaalsContact CB-CD1 3.47Å; A212-L241 HydrophobicContact CB-CD2 4.44Å; A212-L241 HydrophobicContact CB-CG 3.54Å; A212-L241 WeakPolarHBondContact O-CD1 3.34Å
213	V	93.8	Very high	92.2	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-63.1	-43.1	175.5	171.3	0	0	0	0	110.9	T209 A210 S215 I216 H217 I226 L241 D317 W318	T209-V213 HydrophobicContact CG2-CG2 4.3Å; T209-V213 WeakPolarHBondContact O-CG2 3.39Å; T209-V213 PolarHBondContact O-N 2.69Å; A210-V213 PolarHBondContact O-N 3.43Å; V213-S215 VanDerWaalsContact C-N 3.29Å; V213-S215 PolarHBondContact O-N 3.3Å; V213-I216 WeakPolarHBondContact O-CG1 3.36Å; V213-I216 PolarHBondContact O-N 3.34Å; V213-H217 WeakPolarHBondContact CG1-CE1 3.45Å; V213-H217 WeakPolarHBondContact CG1-NE2 3.39Å; V213-H217 PolarHBondContact O-CD2 3.19Å; V213-H217 VanDerWaalsContact O-CG 3.29Å; V213-H217 PolarHBondContact O-N 3.26Å; V213-I226 HydrophobicContact CG2-CD1 3.84Å; V213-I226 HydrophobicContact CG2-CG1 4.24Å; V213-L241 HydrophobicContact CG2-CD1 4.4Å; V213-D317 HydrophobicContact CG1-CB 3.77Å; V213-W318 HydrophobicContact CB-CH2 3.98Å; V213-W318 HydrophobicContact CB-CZ3 3.9Å; V213-W318 HydrophobicContact CG1-CE3 4.15Å; V213-W318 HydrophobicContact CG1-CH2 3.67Å; V213-W318 HydrophobicContact CG1-CZ2 4.06Å; V213-W318 HydrophobicContact CG1-CZ3 3.73Å
214	E	93.6	Very high	91.7	Very high	27 Å²	27	27.7 Å²	27.7	13%	0.126	15%	0.146	C	C	.	.	H	α-helix	trans	-59.9	-40.8	175.5	-170	-144.6	-147.5	0	0	111.7	A210 I216 H217 K218 W318 L387	A210-E214 WeakPolarHBondContact O-CB 3.27Å; A210-E214 PolarHBondContact O-N 3.41Å; E214-I216 VanDerWaalsContact C-N 3.31Å; E214-I216 PolarHBondContact O-N 2.8Å; E214-H217 PolarHBondContact O-N 2.99Å; E214-K218 HydrophobicContact CG-CD 4.3Å; E214-K218 WeakPolarHBondContact O-CG 3.5Å; E214-K218 PolarHBondContact O-N 3.03Å; E214-K218 WeakPolarHBondContact OE1-CE 3.41Å; E214-K218 IonicContact OE1-NZ 3.09Å; E214-K218 PolarHBondContact OE1-NZ 3.37Å; E214-K218 WeakPolarHBondContact OE2-CE 3.17Å; E214-K218 IonicContact OE2-NZ 2.69Å; E214-K218 PolarHBondContact OE2-NZ 3.45Å; E214-W318 HydrophobicContact CB-CH2 4.44Å; E214-L387 HydrophobicContact CB-CB 4.08Å; E214-L387 HydrophobicContact CB-CD2 4.1Å; E214-L387 HydrophobicContact CG-CB 3.72Å; E214-L387 HydrophobicContact CG-CD2 4.09Å; E214-L387 HydrophobicContact CG-CG 4.49Å; E214-L387 WeakPolarHBondContact OE1-CB 3.49Å; E214-L387 WeakPolarHBondContact OE1-CD2 3.5Å
215	S	91.1	Very high	91.2	Very high	16 Å²	16	27.1 Å²	27.1	11%	0.112	14%	0.144	C	C	.	.	H	α-helix	trans	-60.2	-39.9	-178.9	77.5	0	0	0	0	112.7	L211 A212 V213 L219	L211-S215 WeakPolarHBondContact O-CB 3.19Å; L211-S215 PolarHBondContact O-N 3.05Å; A212-S215 PolarHBondContact O-N 2.97Å; A212-S215 PolarHBondContact O-OG 2.77Å; V213-S215 VanDerWaalsContact C-N 3.29Å; V213-S215 PolarHBondContact O-N 3.3Å; S215-L219 WeakPolarHBondContact O-CG 3.36Å; S215-L219 PolarHBondContact O-N 2.93Å
216	I	88.9	Confident	91	Very high	1 Å²	1	27.1 Å²	27.1	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-79.2	-32	177.3	59.5	171.3	0	0	0	112.3	V162 A212 V213 E214 K218 L219 G220 F221 H223 L241 F244	V162-I216 HydrophobicContact CG2-CG2 3.72Å; A212-I216 PolarHBondContact O-N 2.87Å; V213-I216 WeakPolarHBondContact O-CG1 3.36Å; V213-I216 PolarHBondContact O-N 3.34Å; E214-I216 VanDerWaalsContact C-N 3.31Å; E214-I216 PolarHBondContact O-N 2.8Å; I216-K218 VanDerWaalsContact C-N 3.33Å; I216-L219 WeakPolarHBondContact O-CB 3.25Å; I216-L219 PolarHBondContact O-N 3.18Å; I216-L219 VanDerWaalsContact O-N 3.16Å; I216-G220 PolarHBondContact O-N 3.26Å; I216-F221 CarbonylContact C-O 3.36Å; I216-F221 PolarHBondContact O-N 3.4Å; I216-H223 HydrophobicContact CD1-CB 3.67Å; I216-L241 HydrophobicContact CD1-CD1 3.98Å; I216-L241 HydrophobicContact CG1-CD1 4.49Å; I216-F244 HydrophobicContact CD1-CD1 4.5Å; I216-F244 HydrophobicContact CD1-CE1 4.33Å; I216-F244 HydrophobicContact CG2-CD1 4.41Å; I216-F244 HydrophobicContact CG2-CE1 3.82Å
217	H	89.5	Confident	90.7	Very high	28 Å²	28	27.7 Å²	27.7	13%	0.13	15%	0.147	C	C	.	.	H	α-helix	trans	-63.9	-39.7	173.7	-73.4	-173.9	0	0	0	111.3	V213 E214 L219 G220 F221 T314 D317 W318	V213-H217 WeakPolarHBondContact CG1-CE1 3.45Å; V213-H217 WeakPolarHBondContact CG1-NE2 3.39Å; V213-H217 PolarHBondContact O-CD2 3.19Å; V213-H217 VanDerWaalsContact O-CG 3.29Å; V213-H217 PolarHBondContact O-N 3.26Å; E214-H217 PolarHBondContact O-N 2.99Å; H217-L219 PolarHBondContact O-N 2.99Å; H217-G220 WeakPolarHBondContact O-CA 3.42Å; H217-G220 PolarHBondContact O-N 3.27Å; H217-F221 WeakPolarHBondContact CA-O 3.26Å; H217-F221 PolarHBondContact CD2-O 3.28Å; H217-T314 HydrophobicContact CB-CG2 4.42Å; H217-T314 PolarHBondContact CE1-O 3.06Å; H217-T314 VanDerWaalsContact CE1-O 3.23Å; H217-D317 IonicContact CD2-OD2 3.76Å; H217-D317 IonicContact CE1-OD2 3.58Å; H217-D317 IonicContact NE2-OD2 3.63Å; H217-D317 PolarHBondContact NE2-OD2 3.45Å; H217-W318 AromaticContact ND1-CZ2 3.88Å
218	K	87.9	Confident	90.5	Very high	149 Å²	149	27.7 Å²	27.7	65%	0.648	15%	0.147	S	C	*	.	H	α-helix	trans	-62.9	-27	174	-77.9	175.2	175.7	163.9	0	113.3	E214 I216	E214-K218 HydrophobicContact CG-CD 4.3Å; E214-K218 WeakPolarHBondContact O-CG 3.5Å; E214-K218 PolarHBondContact O-N 3.03Å; E214-K218 WeakPolarHBondContact OE1-CE 3.41Å; E214-K218 IonicContact OE1-NZ 3.09Å; E214-K218 PolarHBondContact OE1-NZ 3.37Å; E214-K218 WeakPolarHBondContact OE2-CE 3.17Å; E214-K218 IonicContact OE2-NZ 2.69Å; E214-K218 PolarHBondContact OE2-NZ 3.45Å; I216-K218 VanDerWaalsContact C-N 3.33Å
219	L	81.6	Confident	90.1	Very high	72 Å²	72	29.5 Å²	29.5	38%	0.377	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-0.2	172.8	-65	173.6	0	0	0	112.8	A157 S215 I216 H217 F221	A157-L219 HydrophobicContact CB-CD1 4.21Å; S215-L219 WeakPolarHBondContact O-CG 3.36Å; S215-L219 PolarHBondContact O-N 2.93Å; I216-L219 WeakPolarHBondContact O-CB 3.25Å; I216-L219 PolarHBondContact O-N 3.18Å; I216-L219 VanDerWaalsContact O-N 3.16Å; H217-L219 PolarHBondContact O-N 2.99Å; L219-F221 HydrophobicContact CB-CD2 3.6Å; L219-F221 HydrophobicContact CB-CE2 3.91Å; L219-F221 WeakPolarHBondContact O-CD2 3.43Å; L219-F221 WeakPolarHBondContact O-CE2 3.15Å
220	G	82.5	Confident	89.9	Confident	68 Å²	68	29.7 Å²	29.7	70%	0.701	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.1	15.2	179	0	0	0	0	0	114.5	I216 H217	I216-G220 PolarHBondContact O-N 3.26Å; H217-G220 WeakPolarHBondContact O-CA 3.42Å; H217-G220 PolarHBondContact O-N 3.27Å
221	F	82.2	Confident	89.8	Confident	49 Å²	49	29.7 Å²	29.7	22%	0.215	16%	0.157	C	C	.	.			trans	-106.9	146.8	-178.8	-61.2	-78.8	0	0	0	112	I153 I216 H217 L219	I153-F221 HydrophobicContact CD1-CB 4.06Å; I153-F221 HydrophobicContact CD1-CD1 3.48Å; I153-F221 VanDerWaalsContact CD1-CD1 3.48Å; I153-F221 HydrophobicContact CD1-CD2 4.38Å; I153-F221 HydrophobicContact CD1-CE1 3.95Å; I153-F221 HydrophobicContact CD1-CG 3.72Å; I153-F221 HydrophobicContact CG1-CB 4.28Å; I153-F221 HydrophobicContact CG1-CD1 3.35Å; I153-F221 HydrophobicContact CG1-CD2 3.68Å; I153-F221 HydrophobicContact CG1-CE1 3.38Å; I153-F221 HydrophobicContact CG1-CE2 3.72Å; I153-F221 HydrophobicContact CG1-CG 3.49Å; I153-F221 VanDerWaalsContact CG1-CG 3.49Å; I153-F221 HydrophobicContact CG1-CZ 3.57Å; I216-F221 CarbonylContact C-O 3.36Å; I216-F221 PolarHBondContact O-N 3.4Å; H217-F221 WeakPolarHBondContact CA-O 3.26Å; H217-F221 PolarHBondContact CD2-O 3.28Å; L219-F221 HydrophobicContact CB-CD2 3.6Å; L219-F221 HydrophobicContact CB-CE2 3.91Å; L219-F221 WeakPolarHBondContact O-CD2 3.43Å; L219-F221 WeakPolarHBondContact O-CE2 3.15Å
222	I	85.2	Confident	89.7	Confident	55 Å²	55	30.6 Å²	30.6	28%	0.282	16%	0.162	S	C	.	.			trans	-114.3	129.5	171.1	-51.2	176.7	0	0	0	106.9	R224 Y312 T314 C316 D317	I222-R224 HydrophobicContact CB-CG 4.08Å; I222-R224 HydrophobicContact CG2-CG 3.55Å; I222-Y312 HydrophobicContact CD1-CE2 4.29Å; I222-T314 HydrophobicContact CD1-CG2 4.18Å; I222-T314 HydrophobicContact CG1-CG2 3.77Å; I222-C316 VanDerWaalsContact CG2-SG 3.56Å; I222-D317 WeakPolarHBondContact CG2-OD2 3.25Å
223	H	87.3	Confident	89.8	Confident	3 Å²	3	30.6 Å²	30.6	1%	0.014	16%	0.162	C	C	.	.			trans	-73.7	-46.6	-175.1	-165.1	-77.3	0	0	0	112.1	I216 D225 I226 S242 F244 T248 D317	I216-H223 HydrophobicContact CD1-CB 3.67Å; H223-D225 PolarHBondContact CE1-O 3Å; H223-D225 VanDerWaalsContact CE1-O 3.24Å; H223-D225 PolarHBondContact ND1-N 2.77Å; H223-D225 PolarHBondContact ND1-O 2.9Å; H223-D225 PolarHBondContact O-N 2.87Å; H223-I226 HydrophobicContact CB-CD1 3.57Å; H223-I226 HydrophobicContact CB-CG1 3.71Å; H223-I226 PolarHBondContact ND1-N 3.38Å; H223-S242 PolarHBondContact NE2-O 3.03Å; H223-F244 AromaticContact CD2-CD1 3.51Å; H223-F244 AromaticContact CD2-CE1 3.79Å; H223-F244 AromaticContact NE2-CD1 3.82Å; H223-T248 WeakPolarHBondContact O-CG2 3.21Å; H223-D317 PolarHBondContact N-OD2 2.94Å
224	R	87	Confident	89.8	Confident	80 Å²	80	31.5 Å²	31.5	30%	0.302	17%	0.167	S	C	.	.	S	Bend	trans	63.2	-8	178.1	-48	179.3	-65	174.8	-0.1	117.1	H146 I222 T248 Y312 D317	H146-R224 PolarHBondContact NE2-NH2 3.39Å; I222-R224 HydrophobicContact CB-CG 4.08Å; I222-R224 HydrophobicContact CG2-CG 3.55Å; R224-T248 HydrophobicContact CB-CG2 3.56Å; R224-T248 PolarHBondContact NH2-OG1 3.39Å; R224-Y312 WeakPolarHBondContact CD-OH 3.45Å; R224-Y312 HydrophobicContact CG-CE2 4.02Å; R224-Y312 PolarHBondContact NH1-OH 2.82Å; R224-D317 WeakPolarHBondContact CA-OD1 3.29Å; R224-D317 PolarHBondContact N-OD1 3.25Å
225	D	87.4	Confident	89.7	Confident	7 Å²	7	33.7 Å²	33.7	4%	0.037	19%	0.185	C	C	.	.			trans	-132.6	48.2	174.7	-167.2	36.7	0	0	0	110.1	H223 K227 N230 C247 T248 H254	H223-D225 PolarHBondContact CE1-O 3Å; H223-D225 VanDerWaalsContact CE1-O 3.24Å; H223-D225 PolarHBondContact ND1-N 2.77Å; H223-D225 PolarHBondContact ND1-O 2.9Å; H223-D225 PolarHBondContact O-N 2.87Å; D225-K227 VanDerWaalsContact CG-CE 3.42Å; D225-K227 PolarHBondContact O-N 2.98Å; D225-K227 WeakPolarHBondContact OD1-CD 3.48Å; D225-K227 WeakPolarHBondContact OD1-CE 3.35Å; D225-K227 IonicContact OD1-NZ 2.74Å; D225-K227 WeakPolarHBondContact OD2-CE 3.44Å; D225-K227 IonicContact OD2-NZ 3.89Å; D225-K227 PolarHBondContact OD2-NZ 2.98Å; D225-N230 PolarHBondContact O-ND2 3.17Å; D225-N230 PolarHBondContact OD2-ND2 2.7Å; D225-C247 WeakPolarHBondContact OD2-CB 2.99Å; D225-T248 HydrophobicContact CB-CG2 3.52Å; D225-H254 IonicContact OD1-CE1 3.77Å; D225-H254 PolarHBondContact OD1-CE1 3.45Å
226	I	93.1	Very high	89.8	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.203	C	C	.	.			trans	-74.7	119.9	174.2	-64.7	-67.2	0	0	0	108.4	V213 H223 L241 Y301 D317 S320 I324	V213-I226 HydrophobicContact CG2-CD1 3.84Å; V213-I226 HydrophobicContact CG2-CG1 4.24Å; H223-I226 HydrophobicContact CB-CD1 3.57Å; H223-I226 HydrophobicContact CB-CG1 3.71Å; H223-I226 PolarHBondContact ND1-N 3.38Å; I226-L241 HydrophobicContact CD1-CD2 3.84Å; I226-Y301 WeakPolarHBondContact O-CB 3.05Å; I226-D317 HydrophobicContact CG1-CB 4.11Å; I226-S320 WeakPolarHBondContact O-CB 3.36Å; I226-I324 HydrophobicContact CG2-CD1 3.63Å
227	K	92.2	Very high	90.1	Very high	12 Å²	12	39 Å²	39	5%	0.052	20%	0.203	C	C	.	.	S	Bend	trans	-166.2	160.4	-175.5	53.3	179.5	-175.3	177.6	0	109.3	D225 D229 N230 Y301	D225-K227 VanDerWaalsContact CG-CE 3.42Å; D225-K227 PolarHBondContact O-N 2.98Å; D225-K227 WeakPolarHBondContact OD1-CD 3.48Å; D225-K227 WeakPolarHBondContact OD1-CE 3.35Å; D225-K227 IonicContact OD1-NZ 2.74Å; D225-K227 WeakPolarHBondContact OD2-CE 3.44Å; D225-K227 IonicContact OD2-NZ 3.89Å; D225-K227 PolarHBondContact OD2-NZ 2.98Å; K227-D229 VanDerWaalsContact C-N 3.31Å; K227-D229 WeakPolarHBondContact CD-OD1 3.34Å; K227-D229 VanDerWaalsContact CE-CG 3.41Å; K227-D229 VanDerWaalsContact CE-OD1 3.3Å; K227-D229 WeakPolarHBondContact CE-OD1 3.19Å; K227-D229 WeakPolarHBondContact CE-OD2 3.43Å; K227-D229 WeakPolarHBondContact CG-OD1 3.44Å; K227-D229 IonicContact NZ-OD2 2.87Å; K227-D229 PolarHBondContact NZ-OD2 3.09Å; K227-D229 PolarHBondContact O-N 3.28Å; K227-N230 VanDerWaalsContact CE-CG 3.4Å; K227-N230 WeakPolarHBondContact CE-ND2 3.34Å; K227-N230 WeakPolarHBondContact CE-OD1 3.33Å; K227-N230 HydrophobicContact CG-CB 4.3Å; K227-N230 PolarHBondContact O-N 3.49Å; K227-Y301 HydrophobicContact CB-CD1 4.31Å; K227-Y301 HydrophobicContact CB-CD2 3.61Å; K227-Y301 HydrophobicContact CB-CE2 3.9Å; K227-Y301 HydrophobicContact CB-CG 3.84Å
228	P	93.7	Very high	90.4	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-63.1	-26.3	-169.7	-29.3	41.2	0	0	0	116.1	M187 M188 L191 N230 L231 Y301 I324 E327	M187-P228 HydrophobicContact CB-CB 4.01Å; M187-P228 WeakPolarHBondContact CB-O 3.48Å; M187-P228 HydrophobicContact CG-CB 4Å; M187-P228 PolarHBondContact N-O 3.33Å; M188-P228 HydrophobicContact CB-CB 3.89Å; M188-P228 PolarHBondContact N-O 3.19Å; M188-P228 VanDerWaalsContact N-O 3.12Å; L191-P228 HydrophobicContact CD1-CB 4.14Å; L191-P228 HydrophobicContact CD1-CG 4.15Å; P228-N230 VanDerWaalsContact C-N 3.26Å; P228-N230 PolarHBondContact O-N 3.25Å; P228-L231 PolarHBondContact O-N 2.81Å; P228-Y301 VanDerWaalsContact CD-CZ 3.46Å; P228-Y301 WeakPolarHBondContact CD-OH 3.19Å; P228-Y301 HydrophobicContact CG-CE1 4.18Å; P228-I324 HydrophobicContact CG-CD1 4.48Å; P228-I324 HydrophobicContact CG-CG1 4.07Å; P228-I324 HydrophobicContact CG-CG2 4.35Å; P228-E327 WeakPolarHBondContact CG-OE2 3.34Å
229	D	89.4	Confident	90.8	Very high	37 Å²	37	30.6 Å²	30.6	20%	0.198	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-69.8	-20.7	173.7	49.3	-47.9	0	0	0	113.5	M188 K227	M188-D229 HydrophobicContact CB-CB 4.2Å; M188-D229 HydrophobicContact SD-CB 4.12Å; K227-D229 VanDerWaalsContact C-N 3.31Å; K227-D229 WeakPolarHBondContact CD-OD1 3.34Å; K227-D229 VanDerWaalsContact CE-CG 3.41Å; K227-D229 VanDerWaalsContact CE-OD1 3.3Å; K227-D229 WeakPolarHBondContact CE-OD1 3.19Å; K227-D229 WeakPolarHBondContact CE-OD2 3.43Å; K227-D229 WeakPolarHBondContact CG-OD1 3.44Å; K227-D229 IonicContact NZ-OD2 2.87Å; K227-D229 PolarHBondContact NZ-OD2 3.09Å; K227-D229 PolarHBondContact O-N 3.28Å
230	N	91.9	Very high	91.5	Very high	4 Å²	4	28.1 Å²	28.1	2%	0.021	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-96.6	3.1	176.5	-69.7	-5.2	0	0	0	113.1	D225 K227 P228 S242	D225-N230 PolarHBondContact O-ND2 3.17Å; D225-N230 PolarHBondContact OD2-ND2 2.7Å; K227-N230 VanDerWaalsContact CE-CG 3.4Å; K227-N230 WeakPolarHBondContact CE-ND2 3.34Å; K227-N230 WeakPolarHBondContact CE-OD1 3.33Å; K227-N230 HydrophobicContact CG-CB 4.3Å; K227-N230 PolarHBondContact O-N 3.49Å; P228-N230 VanDerWaalsContact C-N 3.26Å; P228-N230 PolarHBondContact O-N 3.25Å; N230-S242 PolarHBondContact O-N 2.84Å; N230-S242 PolarHBondContact O-OG 3.43Å
231	L	95.3	Very high	92	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	99.8	176.1	-55.9	-176.5	0	0	0	108.6	D186 M187 T209 P228 L239 L241 I324	D186-L231 CarbonylContact C-O 3.21Å; D186-L231 WeakPolarHBondContact CA-O 3.32Å; M187-L231 HydrophobicContact CB-CB 3.81Å; M187-L231 HydrophobicContact CB-CD1 4.43Å; M187-L231 HydrophobicContact CG-CD1 4.48Å; M187-L231 PolarHBondContact N-O 3.12Å; T209-L231 HydrophobicContact CG2-CD1 4.28Å; T209-L231 HydrophobicContact CG2-CD2 4.06Å; P228-L231 PolarHBondContact O-N 2.81Å; L231-L239 HydrophobicContact CB-CD1 3.9Å; L231-L239 HydrophobicContact CB-CG 4.33Å; L231-L239 HydrophobicContact CD1-CD1 4Å; L231-L239 HydrophobicContact CD2-CD1 4.24Å; L231-L239 HydrophobicContact CD2-CD2 4.38Å; L231-L239 HydrophobicContact CG-CD1 4.24Å; L231-L241 HydrophobicContact CD2-CD2 3.35Å; L231-I324 HydrophobicContact CD1-CD1 3.95Å; L231-I324 HydrophobicContact CD1-CG2 4.37Å
232	L	95.6	Very high	92.4	Very high	35 Å²	35	23 Å²	23	18%	0.183	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	154.3	-178.8	-59.8	-172.3	0	0	0	111.9	V163 L182 G185 D186 L239 K240	V163-L232 HydrophobicContact CG2-CD1 3.93Å; L182-L232 HydrophobicContact CB-CB 4.41Å; L182-L232 HydrophobicContact CD1-CB 3.51Å; L182-L232 HydrophobicContact CD1-CD1 3.98Å; L182-L232 HydrophobicContact CD1-CG 4.4Å; G185-L232 CarbonylContact O-C 3.58Å; G185-L232 WeakPolarHBondContact O-CA 3.49Å; D186-L232 HydrophobicContact CB-CD2 3.71Å; L232-L239 CarbonylContact O-C 3.55Å; L232-L239 VanDerWaalsContact O-CA 3.3Å; L232-L239 WeakPolarHBondContact O-CA 3.44Å; L232-K240 PolarHBondContact N-O 2.88Å; L232-K240 PolarHBondContact O-N 2.91Å
233	L	95.9	Very high	92	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	129.3	179.1	-59.7	173.5	0	0	0	110.6	L182 G184 G185 M187 L190 Y205 H238 L239 I413	L182-L233 WeakPolarHBondContact CB-O 3.32Å; G184-L233 WeakPolarHBondContact CA-O 3.41Å; G184-L233 PolarHBondContact N-O 2.88Å; G185-L233 PolarHBondContact O-N 2.89Å; M187-L233 HydrophobicContact CE-CD2 4.23Å; L190-L233 HydrophobicContact CB-CD1 4.44Å; L190-L233 HydrophobicContact CD2-CD1 3.64Å; Y205-L233 HydrophobicContact CD1-CD2 4.39Å; Y205-L233 HydrophobicContact CE1-CD2 3.8Å; L233-H238 WeakPolarHBondContact CA-O 3.21Å; L233-L239 HydrophobicContact CD2-CB 4.44Å; L233-I413 HydrophobicContact CD1-CD1 4.04Å
234	D	93.8	Very high	91.1	Very high	18 Å²	18	22.4 Å²	22.4	10%	0.096	11%	0.109	C	C	.	.			trans	-73.9	178.7	173.1	71	24.5	0	0	0	112.3	L182 R236 G237 H238 R405	L182-D234 HydrophobicContact CD2-CB 3.95Å; D234-R236 PolarHBondContact O-N 3.31Å; D234-R236 VanDerWaalsContact O-N 3.11Å; D234-R236 WeakPolarHBondContact OD1-CA 3.4Å; D234-R236 WeakPolarHBondContact OD1-CB 3.49Å; D234-R236 PolarHBondContact OD1-N 3.25Å; D234-G237 PolarHBondContact O-N 2.91Å; D234-G237 PolarHBondContact OD1-N 2.79Å; D234-G237 VanDerWaalsContact OD1-N 3.07Å; D234-H238 PolarHBondContact N-O 3.49Å; D234-H238 PolarHBondContact OD1-N 2.95Å; D234-R405 IonicContact OD2-CZ 3.79Å; D234-R405 IonicContact OD2-NH2 2.72Å; D234-R405 PolarHBondContact OD2-NH2 3.25Å
235	S	92.4	Very high	89.7	Confident	73 Å²	73	19.1 Å²	19.1	51%	0.51	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64	-14.8	-179.1	61.6	0	0	0	0	114.2
236	R	93.3	Very high	88.1	Confident	130 Å²	130	18.9 Å²	18.9	49%	0.491	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.9	-5.8	176.9	-68.2	174	59	-148.9	-11	112	D234 H238 R405 A409	D234-R236 PolarHBondContact O-N 3.31Å; D234-R236 VanDerWaalsContact O-N 3.11Å; D234-R236 WeakPolarHBondContact OD1-CA 3.4Å; D234-R236 WeakPolarHBondContact OD1-CB 3.49Å; D234-R236 PolarHBondContact OD1-N 3.25Å; R236-H238 PolarHBondContact NH2-NE2 3.24Å; R236-H238 VanDerWaalsContact NH2-NE2 3.16Å; R236-R405 PolarHBondContact NH1-O 2.77Å; R236-R405 PolarHBondContact NH2-O 3.04Å; R236-A409 WeakPolarHBondContact O-CB 3.41Å
237	G	94.6	Very high	85.9	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	S	Bend	trans	87.6	12.7	-177.3	0	0	0	0	0	114.7	Y205 D234 A409 I413	Y205-G237 WeakPolarHBondContact CE1-O 3.45Å; D234-G237 PolarHBondContact O-N 2.91Å; D234-G237 PolarHBondContact OD1-N 2.79Å; D234-G237 VanDerWaalsContact OD1-N 3.07Å; G237-A409 WeakPolarHBondContact O-CB 3.44Å; G237-I413 VanDerWaalsContact CA-CG1 3.5Å
238	H	96.7	Very high	84	Confident	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.108	C	C	.	.			trans	-88.6	147.4	175.7	-64.3	-79.9	0	0	0	111.9	F204 E208 L233 D234 R236 R405 R407	F204-H238 AromaticContact CZ-CE1 3.76Å; F204-H238 AromaticContact CZ-ND1 3.57Å; E208-H238 IonicContact OE1-CE1 2.81Å; E208-H238 IonicContact OE1-CG 3.97Å; E208-H238 IonicContact OE1-ND1 2.89Å; E208-H238 PolarHBondContact OE1-ND1 3.16Å; E208-H238 WeakPolarHBondContact OE2-CA 3.35Å; E208-H238 IonicContact OE2-ND1 3.49Å; L233-H238 WeakPolarHBondContact CA-O 3.21Å; D234-H238 PolarHBondContact N-O 3.49Å; D234-H238 PolarHBondContact OD1-N 2.95Å; R236-H238 PolarHBondContact NH2-NE2 3.24Å; R236-H238 VanDerWaalsContact NH2-NE2 3.16Å; H238-R405 HydrophobicContact CB-CG 4.15Å; H238-R405 PolarHBondContact CE1-O 3.07Å; H238-R405 PolarHBondContact NE2-O 3.19Å; H238-R407 PolarHBondContact CE1-O 3.43Å; H238-R407 PolarHBondContact NE2-O 3.23Å; H238-R407 VanDerWaalsContact NE2-O 3.15Å
239	L	96.6	Very high	81.9	Confident	0 Å²	0	21.3 Å²	21.3	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	143.1	-174.1	-173.7	149.4	0	0	0	112.8	E208 T209 A212 L231 L232 L233 R405	E208-L239 HydrophobicContact CB-CB 4Å; E208-L239 WeakPolarHBondContact OE2-CB 3.47Å; E208-L239 PolarHBondContact OE2-N 3.4Å; T209-L239 WeakPolarHBondContact OG1-CD1 3.15Å; A212-L239 HydrophobicContact CB-CD2 4.08Å; L231-L239 HydrophobicContact CB-CD1 3.9Å; L231-L239 HydrophobicContact CB-CG 4.33Å; L231-L239 HydrophobicContact CD1-CD1 4Å; L231-L239 HydrophobicContact CD2-CD1 4.24Å; L231-L239 HydrophobicContact CD2-CD2 4.38Å; L231-L239 HydrophobicContact CG-CD1 4.24Å; L232-L239 CarbonylContact O-C 3.55Å; L232-L239 VanDerWaalsContact O-CA 3.3Å; L232-L239 WeakPolarHBondContact O-CA 3.44Å; L233-L239 HydrophobicContact CD2-CB 4.44Å; L239-R405 PolarHBondContact O-NH1 3.29Å; L239-R405 PolarHBondContact O-NH2 3.36Å
240	K	95.5	Very high	80	Confident	19 Å²	19	20.6 Å²	20.6	8%	0.083	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	136.1	167.4	-79.2	169	173.1	-81.7	0	109.9	E160 W161 V163 E180 L182 L232	E160-K240 WeakPolarHBondContact O-CE 3.47Å; E160-K240 VanDerWaalsContact O-CG 3.29Å; E160-K240 WeakPolarHBondContact O-CG 3.43Å; E160-K240 PolarHBondContact O-NZ 3.39Å; W161-K240 CarbonylContact O-C 3.53Å; W161-K240 WeakPolarHBondContact O-CA 3.46Å; V163-K240 HydrophobicContact CG2-CB 4.22Å; E180-K240 WeakPolarHBondContact OE1-CE 3.36Å; E180-K240 IonicContact OE1-NZ 2.72Å; E180-K240 PolarHBondContact OE1-NZ 3.44Å; E180-K240 IonicContact OE2-NZ 3.55Å; L182-K240 HydrophobicContact CD1-CB 3.75Å; L182-K240 HydrophobicContact CD1-CD 3.65Å; L182-K240 HydrophobicContact CD1-CG 4.31Å; L182-K240 HydrophobicContact CD2-CD 3.73Å; L182-K240 HydrophobicContact CG-CD 4.35Å; L232-K240 PolarHBondContact N-O 2.88Å; L232-K240 PolarHBondContact O-N 2.91Å
241	L	93.7	Very high	78.6	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	135.1	173.1	-71.5	175.7	0	0	0	111.2	W161 V163 A212 V213 I216 I226 L231 F244	W161-L241 PolarHBondContact O-N 3.45Å; V163-L241 VanDerWaalsContact CG2-O 3.28Å; V163-L241 WeakPolarHBondContact CG2-O 3.39Å; V163-L241 PolarHBondContact N-O 3.01Å; A212-L241 VanDerWaalsContact C-CD1 3.46Å; A212-L241 HydrophobicContact CB-CD1 3.47Å; A212-L241 VanDerWaalsContact CB-CD1 3.47Å; A212-L241 HydrophobicContact CB-CD2 4.44Å; A212-L241 HydrophobicContact CB-CG 3.54Å; A212-L241 WeakPolarHBondContact O-CD1 3.34Å; V213-L241 HydrophobicContact CG2-CD1 4.4Å; I216-L241 HydrophobicContact CD1-CD1 3.98Å; I216-L241 HydrophobicContact CG1-CD1 4.49Å; I226-L241 HydrophobicContact CD1-CD2 3.84Å; L231-L241 HydrophobicContact CD2-CD2 3.35Å; L241-F244 HydrophobicContact CB-CE1 3.78Å; L241-F244 HydrophobicContact CB-CZ 3.59Å; L241-F244 HydrophobicContact CD1-CE1 4.33Å; L241-F244 WeakPolarHBondContact O-CZ 3.08Å
242	S	89.2	Confident	77.1	Confident	9 Å²	9	27.9 Å²	27.9	6%	0.063	15%	0.147	C	C	.	.			trans	-121.5	170.6	171.9	70.5	0	0	0	0	111.3	H223 N230	H223-S242 PolarHBondContact NE2-O 3.03Å; N230-S242 PolarHBondContact O-N 2.84Å; N230-S242 PolarHBondContact O-OG 3.43Å
243	D	78.1	Confident	75.9	Confident	44 Å²	44	26.2 Å²	26.2	24%	0.235	14%	0.139	C	C	.	.			trans	57.1	58.6	167.5	-74.2	2.5	0	0	0	116.1	K131 G245	K131-D243 IonicContact NZ-OD1 3.03Å; K131-D243 PolarHBondContact NZ-OD1 3.46Å; K131-D243 IonicContact NZ-OD2 2.9Å; D243-G245 PolarHBondContact O-N 2.85Å
244	F	68.3	Low	74.8	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.013	14%	0.143	C	C	.	.			trans	-71.6	94.4	176.8	-52.5	-82.9	0	0	0	112.7	E150 I153 L154 V162 I216 H223 L241 L246	E150-F244 WeakPolarHBondContact CB-O 3.36Å; E150-F244 HydrophobicContact CG-CB 4.33Å; I153-F244 HydrophobicContact CB-CB 4.44Å; I153-F244 HydrophobicContact CB-CG 4.45Å; I153-F244 HydrophobicContact CD1-CB 3.66Å; I153-F244 HydrophobicContact CD1-CG 4.28Å; I153-F244 HydrophobicContact CG2-CB 4.26Å; I153-F244 HydrophobicContact CG2-CD1 3.96Å; I153-F244 HydrophobicContact CG2-CD2 4.03Å; I153-F244 HydrophobicContact CG2-CE1 4.4Å; I153-F244 HydrophobicContact CG2-CE2 4.48Å; I153-F244 HydrophobicContact CG2-CG 3.78Å; L154-F244 HydrophobicContact CD2-CD2 3.74Å; L154-F244 HydrophobicContact CD2-CE2 3.58Å; L154-F244 HydrophobicContact CG-CD2 4.02Å; L154-F244 HydrophobicContact CG-CE2 4.36Å; V162-F244 HydrophobicContact CB-CZ 4.03Å; V162-F244 HydrophobicContact CG1-CE1 4.43Å; V162-F244 HydrophobicContact CG1-CE2 3.45Å; V162-F244 VanDerWaalsContact CG1-CE2 3.45Å; V162-F244 HydrophobicContact CG1-CZ 3.37Å; V162-F244 HydrophobicContact CG2-CE1 4.21Å; V162-F244 HydrophobicContact CG2-CZ 3.74Å; I216-F244 HydrophobicContact CD1-CD1 4.5Å; I216-F244 HydrophobicContact CD1-CE1 4.33Å; I216-F244 HydrophobicContact CG2-CD1 4.41Å; I216-F244 HydrophobicContact CG2-CE1 3.82Å; H223-F244 AromaticContact CD2-CD1 3.51Å; H223-F244 AromaticContact CD2-CE1 3.79Å; H223-F244 AromaticContact NE2-CD1 3.82Å; L241-F244 HydrophobicContact CB-CE1 3.78Å; L241-F244 HydrophobicContact CB-CZ 3.59Å; L241-F244 HydrophobicContact CD1-CE1 4.33Å; L241-F244 WeakPolarHBondContact O-CZ 3.08Å; F244-L246 VanDerWaalsContact C-N 3.34Å; F244-L246 PolarHBondContact O-N 3.41Å
245	G	57.8	Low	73.7	Confident	10 Å²	10	30.8 Å²	30.8	10%	0.103	16%	0.155	C	C	.	.	S	Bend	trans	83.6	-5.8	158	0	0	0	0	0	116.7	H146 D243 C247 T248	H146-G245 WeakPolarHBondContact CB-O 3.38Å; H146-G245 PolarHBondContact CD2-O 3.31Å; D243-G245 PolarHBondContact O-N 2.85Å; G245-C247 PolarHBondContact O-N 3.28Å; G245-T248 PolarHBondContact O-OG1 3.48Å; G245-T248 VanDerWaalsContact O-OG1 3.12Å
246	L	52.3	Low	72.7	Confident	3 Å²	3	30.3 Å²	30.3	2%	0.016	15%	0.15	C	C	.	.	S	Bend	trans	-70.9	-4.3	170.3	-83.8	-176	0	0	0	114.7	L133 M138 H146 V147 E150 F244 L250	L133-L246 HydrophobicContact CD1-CD1 3.41Å; L133-L246 VanDerWaalsContact CD1-CD1 3.41Å; L133-L246 HydrophobicContact CD2-CD1 4Å; L133-L246 HydrophobicContact CG-CD1 4.35Å; M138-L246 HydrophobicContact SD-CD2 4.25Å; H146-L246 HydrophobicContact CB-CD2 4.02Å; V147-L246 VanDerWaalsContact CA-CD2 3.48Å; V147-L246 HydrophobicContact CB-CD2 3.98Å; V147-L246 HydrophobicContact CG2-CD2 3.43Å; V147-L246 VanDerWaalsContact CG2-CD2 3.43Å; E150-L246 HydrophobicContact CB-CG 4.19Å; E150-L246 WeakPolarHBondContact OE2-CB 3.5Å; E150-L246 WeakPolarHBondContact OE2-CD1 3.37Å; E150-L246 WeakPolarHBondContact OE2-CG 3.45Å; F244-L246 VanDerWaalsContact C-N 3.34Å; F244-L246 PolarHBondContact O-N 3.41Å; L246-L250 WeakPolarHBondContact O-CD1 3.09Å
247	C	47.7	Very low	71.9	Confident	27 Å²	27	29 Å²	29	18%	0.182	15%	0.152	C	C	.	.	S	Bend	trans	-121.5	-10.4	178.7	-75.8	0	0	0	0	114.2	D225 G245 G249 L250	D225-C247 WeakPolarHBondContact OD2-CB 2.99Å; G245-C247 PolarHBondContact O-N 3.28Å; C247-G249 PolarHBondContact O-N 2.78Å; C247-G249 VanDerWaalsContact O-N 3.13Å; C247-L250 PolarHBondContact O-N 2.85Å; C247-L250 VanDerWaalsContact O-N 3.12Å
248	T	51.6	Low	70.9	Confident	11 Å²	11	31.9 Å²	31.9	7%	0.067	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68	112.7	-178.5	55.5	0	0	0	0	110.2	H223 R224 D225 G245	H223-T248 WeakPolarHBondContact O-CG2 3.21Å; R224-T248 HydrophobicContact CB-CG2 3.56Å; R224-T248 PolarHBondContact NH2-OG1 3.39Å; D225-T248 HydrophobicContact CB-CG2 3.52Å; G245-T248 PolarHBondContact O-OG1 3.48Å; G245-T248 VanDerWaalsContact O-OG1 3.12Å
249	G	49.7	Very low	70.1	Confident	25 Å²	25	32.1 Å²	32.1	26%	0.258	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.5	15.1	-178.2	0	0	0	0	0	114.7	C247 R255	C247-G249 PolarHBondContact O-N 2.78Å; C247-G249 VanDerWaalsContact O-N 3.13Å; G249-R255 WeakPolarHBondContact O-CG 2.81Å; G249-R255 PolarHBondContact O-NE 2.73Å; G249-R255 PolarHBondContact O-NH2 2.79Å
250	L	50.3	Low	69.1	Low	21 Å²	21	41.2 Å²	41.2	11%	0.11	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.6	-33.7	177.5	-83.7	165.1	0	0	0	114.4	F113 K141 Q143 L246 C247 K252	F113-L250 HydrophobicContact CD2-CD1 4.25Å; F113-L250 HydrophobicContact CE1-CD1 4.42Å; F113-L250 HydrophobicContact CE1-CD2 4.41Å; F113-L250 HydrophobicContact CE2-CB 4.13Å; F113-L250 HydrophobicContact CE2-CD1 3.17Å; F113-L250 HydrophobicContact CE2-CD2 4.26Å; F113-L250 HydrophobicContact CE2-CG 4.01Å; F113-L250 HydrophobicContact CZ-CB 4.13Å; F113-L250 HydrophobicContact CZ-CD1 3.27Å; F113-L250 HydrophobicContact CZ-CD2 3.5Å; F113-L250 HydrophobicContact CZ-CG 3.78Å; K141-L250 HydrophobicContact CB-CD2 4.23Å; K141-L250 HydrophobicContact CD-CD2 4.45Å; Q143-L250 VanDerWaalsContact CD-CD1 3.4Å; Q143-L250 VanDerWaalsContact CD-CG 3.45Å; Q143-L250 HydrophobicContact CG-CD1 3.68Å; Q143-L250 HydrophobicContact CG-CD2 3.53Å; Q143-L250 HydrophobicContact CG-CG 4.02Å; Q143-L250 VanDerWaalsContact OE1-CD1 3.22Å; L246-L250 WeakPolarHBondContact O-CD1 3.09Å; C247-L250 PolarHBondContact O-N 2.85Å; C247-L250 VanDerWaalsContact O-N 3.12Å; L250-K252 PolarHBondContact O-N 3.24Å
251	K	62	Low	68	Low	24 Å²	24	46.9 Å²	46.9	10%	0.104	23%	0.231	C	C	.	.	S	Bend	trans	-61.9	123.8	162.3	-80	172.3	175.9	-152.5	0	106.8	A253 H254 L291 A292 S294 T295 V296	K251-A253 PolarHBondContact O-N 3.2Å; K251-H254 HydrophobicContact CB-CB 4.21Å; K251-H254 WeakPolarHBondContact O-CA 3.05Å; K251-H254 VanDerWaalsContact O-CB 3.3Å; K251-H254 WeakPolarHBondContact O-CB 3.33Å; K251-H254 PolarHBondContact O-N 3.25Å; K251-L291 PolarHBondContact NZ-O 2.94Å; K251-A292 PolarHBondContact NZ-O 2.76Å; K251-S294 WeakPolarHBondContact CE-O 3.43Å; K251-T295 WeakPolarHBondContact CA-O 3.18Å; K251-V296 CarbonylContact C-O 3.58Å; K251-V296 VanDerWaalsContact CB-O 3.31Å; K251-V296 WeakPolarHBondContact CB-O 3.3Å
252	K	65	Low	67.1	Low	133 Å²	133	49.2 Å²	49.2	58%	0.578	24%	0.243	S	C	*	.	G	3₁₀ helix	trans	-53.5	-39.3	-177.3	-71.5	-172.3	177.2	-176.6	0	111	L250 H254 R255 F258 T295 V296	L250-K252 PolarHBondContact O-N 3.24Å; K252-H254 PolarHBondContact O-N 2.93Å; K252-H254 VanDerWaalsContact O-N 3.17Å; K252-R255 PolarHBondContact O-N 3.29Å; K252-R255 VanDerWaalsContact O-N 3.16Å; K252-F258 HydrophobicContact CB-CD2 3.77Å; K252-F258 HydrophobicContact CB-CE2 4.08Å; K252-F258 HydrophobicContact CB-CG 4.44Å; K252-F258 WeakPolarHBondContact O-CB 3.27Å; K252-T295 PolarHBondContact N-O 3.38Å; K252-V296 PolarHBondContact N-O 2.96Å; K252-V296 VanDerWaalsContact N-O 3.12Å
253	A	70.2	Confident	66.1	Low	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-67	-8.6	176.1	0	0	0	0	0	114.7	K251 F258 Y259 V296 G297 P340	K251-A253 PolarHBondContact O-N 3.2Å; A253-F258 HydrophobicContact CB-CD1 4.38Å; A253-F258 HydrophobicContact CB-CE1 4.3Å; A253-Y259 WeakPolarHBondContact CB-OH 3.44Å; A253-Y259 WeakPolarHBondContact O-CE2 3.28Å; A253-Y259 PolarHBondContact O-OH 3.46Å; A253-Y259 VanDerWaalsContact O-OH 3.08Å; A253-V296 HydrophobicContact CB-CG1 4.29Å; A253-V296 WeakPolarHBondContact CB-O 3.35Å; A253-V296 PolarHBondContact N-O 3.04Å; A253-G297 WeakPolarHBondContact CB-O 3Å; A253-P340 HydrophobicContact CB-CB 3.86Å
254	H	71.3	Confident	65.5	Low	20 Å²	20	58 Å²	58	9%	0.093	29%	0.291	C	S	.	.	G	3₁₀ helix	trans	-92.1	-3.8	175.7	-64.9	-166.4	0	0	0	112.5	D225 K251 K252 T298 I302	D225-H254 IonicContact OD1-CE1 3.77Å; D225-H254 PolarHBondContact OD1-CE1 3.45Å; K251-H254 HydrophobicContact CB-CB 4.21Å; K251-H254 WeakPolarHBondContact O-CA 3.05Å; K251-H254 VanDerWaalsContact O-CB 3.3Å; K251-H254 WeakPolarHBondContact O-CB 3.33Å; K251-H254 PolarHBondContact O-N 3.25Å; K252-H254 PolarHBondContact O-N 2.93Å; K252-H254 VanDerWaalsContact O-N 3.17Å; H254-T298 PolarHBondContact CD2-O 2.97Å; H254-T298 PolarHBondContact NE2-O 2.77Å; H254-I302 HydrophobicContact CB-CD1 3.73Å; H254-I302 WeakPolarHBondContact CD2-CD1 3.12Å; H254-I302 VanDerWaalsContact CG-CD1 3.47Å
255	R	70.7	Confident	65.5	Low	95 Å²	95	59.4 Å²	59.4	36%	0.358	31%	0.306	S	S	.	.	S	Bend	trans	-105.3	141.8	-179.8	-58.3	-178.2	179.3	-165.2	-8.8	110.8	G249 K252 D257 F258	G249-R255 WeakPolarHBondContact O-CG 2.81Å; G249-R255 PolarHBondContact O-NE 2.73Å; G249-R255 PolarHBondContact O-NH2 2.79Å; K252-R255 PolarHBondContact O-N 3.29Å; K252-R255 VanDerWaalsContact O-N 3.16Å; R255-D257 WeakPolarHBondContact CB-OD1 3.41Å; R255-D257 WeakPolarHBondContact CD-OD1 3.35Å; R255-D257 PolarHBondContact O-N 3.4Å; R255-F258 WeakPolarHBondContact O-CB 3.4Å; R255-F258 PolarHBondContact O-N 3.03Å
256	T	72.3	Confident	66.3	Low	63 Å²	63	62.6 Å²	62.6	39%	0.387	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-61.7	-31.1	177.5	-46.6	0	0	0	0	113	F258 Y259 F307	T256-F258 PolarHBondContact O-N 3.28Å; T256-Y259 PolarHBondContact O-N 3.08Å; T256-Y259 VanDerWaalsContact O-N 3.14Å; T256-F307 WeakPolarHBondContact CG2-O 3.31Å
257	D	75.6	Confident	67.3	Low	101 Å²	101	62.6 Å²	62.6	54%	0.54	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-61.8	-31.3	-179.8	66	-25.9	0	0	0	113	R255 Y259 R260	R255-D257 WeakPolarHBondContact CB-OD1 3.41Å; R255-D257 WeakPolarHBondContact CD-OD1 3.35Å; R255-D257 PolarHBondContact O-N 3.4Å; D257-Y259 PolarHBondContact O-N 2.96Å; D257-R260 PolarHBondContact O-N 3.42Å
258	F	74.8	Confident	68.5	Low	61 Å²	61	65.4 Å²	65.4	27%	0.268	34%	0.34	S	S	.	.	G	3₁₀ helix	trans	-63.8	-21.2	177.7	-173.9	-99.5	0	0	0	113.5	K252 A253 R255 T256 V296 P340 Q341	K252-F258 HydrophobicContact CB-CD2 3.77Å; K252-F258 HydrophobicContact CB-CE2 4.08Å; K252-F258 HydrophobicContact CB-CG 4.44Å; K252-F258 WeakPolarHBondContact O-CB 3.27Å; A253-F258 HydrophobicContact CB-CD1 4.38Å; A253-F258 HydrophobicContact CB-CE1 4.3Å; R255-F258 WeakPolarHBondContact O-CB 3.4Å; R255-F258 PolarHBondContact O-N 3.03Å; T256-F258 PolarHBondContact O-N 3.28Å; F258-V296 HydrophobicContact CE2-CG1 4.44Å; F258-V296 HydrophobicContact CZ-CG1 4.1Å; F258-P340 HydrophobicContact CE1-CB 4.2Å; F258-Q341 HydrophobicContact CE1-CG 4.49Å; F258-Q341 VanDerWaalsContact CZ-NE2 3.29Å
259	Y	79	Confident	69.6	Low	5 Å²	5	66.5 Å²	66.5	2%	0.02	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-112.4	6	-176.2	-57.5	-69.5	0	0	0	114.4	A253 T256 D257 D261 L262 P299 F307 P340 Q341 Y344	A253-Y259 WeakPolarHBondContact CB-OH 3.44Å; A253-Y259 WeakPolarHBondContact O-CE2 3.28Å; A253-Y259 PolarHBondContact O-OH 3.46Å; A253-Y259 VanDerWaalsContact O-OH 3.08Å; T256-Y259 PolarHBondContact O-N 3.08Å; T256-Y259 VanDerWaalsContact O-N 3.14Å; D257-Y259 PolarHBondContact O-N 2.96Å; Y259-D261 PolarHBondContact O-N 3.1Å; Y259-D261 VanDerWaalsContact O-N 3.13Å; Y259-L262 HydrophobicContact CD1-CD2 4.34Å; Y259-L262 WeakPolarHBondContact O-CB 3.41Å; Y259-L262 PolarHBondContact O-N 3.34Å; Y259-L262 VanDerWaalsContact O-N 3.1Å; Y259-P299 WeakPolarHBondContact OH-CD 3.42Å; Y259-P299 VanDerWaalsContact OH-CG 3.32Å; Y259-P299 WeakPolarHBondContact OH-CG 3.45Å; Y259-F307 HydrophobicContact CD2-CD1 4.34Å; Y259-F307 HydrophobicContact CD2-CE1 4.23Å; Y259-F307 HydrophobicContact CE2-CD1 4.44Å; Y259-F307 AromaticContact CE2-CE1 3.88Å; Y259-F307 HydrophobicContact CE2-CE1 3.88Å; Y259-F307 HydrophobicContact CE2-CZ 4.44Å; Y259-P340 WeakPolarHBondContact CE1-O 3.49Å; Y259-P340 PolarHBondContact OH-O 3.37Å; Y259-Q341 HydrophobicContact CE1-CG 4.46Å; Y259-Y344 AromaticContact CD1-CD1 3.6Å; Y259-Y344 HydrophobicContact CD1-CD1 3.6Å; Y259-Y344 AromaticContact CD1-CD2 3.99Å; Y259-Y344 HydrophobicContact CD1-CD2 3.99Å; Y259-Y344 HydrophobicContact CD1-CE1 4.12Å; Y259-Y344 HydrophobicContact CD1-CE2 4.46Å; Y259-Y344 AromaticContact CD1-CG 3.5Å; Y259-Y344 HydrophobicContact CD1-CG 3.5Å; Y259-Y344 HydrophobicContact CD2-CD1 4.43Å; Y259-Y344 AromaticContact CD2-CD2 3.48Å; Y259-Y344 HydrophobicContact CD2-CD2 3.48Å; Y259-Y344 VanDerWaalsContact CD2-CD2 3.48Å; Y259-Y344 AromaticContact CD2-CE2 3.58Å; Y259-Y344 HydrophobicContact CD2-CE2 3.58Å; Y259-Y344 AromaticContact CD2-CG 3.91Å; Y259-Y344 HydrophobicContact CD2-CG 3.91Å; Y259-Y344 HydrophobicContact CE1-CD1 4.14Å; Y259-Y344 HydrophobicContact CE1-CD2 4.09Å; Y259-Y344 AromaticContact CE1-CG 3.61Å; Y259-Y344 HydrophobicContact CE1-CG 3.61Å; Y259-Y344 AromaticContact CE2-CD2 3.6Å; Y259-Y344 HydrophobicContact CE2-CD2 3.6Å; Y259-Y344 HydrophobicContact CE2-CE2 4.14Å; Y259-Y344 HydrophobicContact CE2-CG 4.01Å; Y259-Y344 AromaticContact CG-CD1 3.75Å; Y259-Y344 HydrophobicContact CG-CD1 3.75Å; Y259-Y344 AromaticContact CG-CD2 3.66Å; Y259-Y344 HydrophobicContact CG-CD2 3.66Å; Y259-Y344 AromaticContact CG-CE1 3.84Å; Y259-Y344 HydrophobicContact CG-CE1 3.84Å; Y259-Y344 AromaticContact CG-CE2 3.75Å; Y259-Y344 HydrophobicContact CG-CE2 3.75Å; Y259-Y344 AromaticContact CG-CG 3.64Å; Y259-Y344 HydrophobicContact CG-CG 3.64Å; Y259-Y344 AromaticContact CG-CZ 3.82Å; Y259-Y344 AromaticContact CZ-CD2 3.9Å; Y259-Y344 AromaticContact CZ-CG 3.86Å
260	R	75.3	Confident	70.8	Confident	192 Å²	192	66.2 Å²	66.2	73%	0.725	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.1	-171.1	-172.4	-178.6	66	-160.7	-4.8	114.4	D257	D257-R260 PolarHBondContact O-N 3.42Å
261	D	74	Confident	71.9	Confident	138 Å²	138	71 Å²	71	74%	0.738	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.5	8.8	-173.4	-52.7	-26.7	0	0	0	112.5	Y259	Y259-D261 PolarHBondContact O-N 3.1Å; Y259-D261 VanDerWaalsContact O-N 3.13Å
262	L	74.1	Confident	72.2	Confident	48 Å²	48	73.9 Å²	73.9	25%	0.251	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-89.9	124.7	-175.4	-139.6	79	0	0	0	111	Y259 H264 Q341 Y344 K345	Y259-L262 HydrophobicContact CD1-CD2 4.34Å; Y259-L262 WeakPolarHBondContact O-CB 3.41Å; Y259-L262 PolarHBondContact O-N 3.34Å; Y259-L262 VanDerWaalsContact O-N 3.1Å; L262-H264 PolarHBondContact O-N 3.14Å; L262-Q341 HydrophobicContact CD1-CB 4.24Å; L262-Q341 HydrophobicContact CD1-CG 3.97Å; L262-Q341 HydrophobicContact CD2-CB 3.84Å; L262-Q341 HydrophobicContact CD2-CG 4.21Å; L262-Y344 HydrophobicContact CD2-CD1 4.01Å; L262-K345 HydrophobicContact CD2-CD 4.24Å; L262-K345 VanDerWaalsContact CD2-CE 3.49Å; L262-K345 HydrophobicContact CD2-CG 3.98Å
263	S	68.3	Low	72.6	Confident	86 Å²	86	74 Å²	74	60%	0.601	38%	0.382	S	S	*	.	P	Polyproline II helix	trans	-63.6	134.2	174.9	58.7	0	0	0	0	111.7	G265 K345	S263-G265 PolarHBondContact O-N 2.77Å; S263-K345 WeakPolarHBondContact O-CE 3.49Å; S263-K345 PolarHBondContact O-NZ 2.79Å
264	H	66	Low	72.4	Confident	153 Å²	153	75.9 Å²	75.9	71%	0.708	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-68.9	125.2	168.8	-60.4	-61	0	0	0	109.2	L262	L262-H264 PolarHBondContact O-N 3.14Å
265	G	68.4	Low	72.3	Confident	31 Å²	31	81.4 Å²	81.4	32%	0.32	42%	0.415	S	S	.	.	S	Bend	trans	172.7	154.9	180	0	0	0	0	0	111.1	S263	S263-G265 PolarHBondContact O-N 2.77Å
266	I	72.9	Confident	72.6	Confident	78 Å²	78	79.2 Å²	79.2	40%	0.4	41%	0.411	S	S	.	.			trans	-59.6	129.1	178.1	-57.2	173.7	0	0	0	108.2	F270 L271	I266-F270 HydrophobicContact CG2-CD1 4.09Å; I266-L271 HydrophobicContact CG2-CD2 3.84Å; I266-L271 HydrophobicContact CG2-CG 3.96Å
267	P	74.1	Confident	72.9	Confident	3 Å²	3	76.6 Å²	76.6	2%	0.019	40%	0.395	C	S	.	.			trans	-71.1	144.6	-177	25.3	-27.1	0	0	0	111.3	D269 F270 L271 E342 K345 K346	P267-D269 VanDerWaalsContact C-N 3.29Å; P267-D269 VanDerWaalsContact CB-OD1 3.32Å; P267-D269 WeakPolarHBondContact CB-OD1 3.48Å; P267-D269 PolarHBondContact O-N 3.32Å; P267-F270 HydrophobicContact CG-CB 4.15Å; P267-F270 WeakPolarHBondContact O-CB 3.42Å; P267-F270 PolarHBondContact O-N 2.86Å; P267-L271 PolarHBondContact O-N 3.29Å; P267-E342 HydrophobicContact CB-CB 4.35Å; P267-E342 HydrophobicContact CB-CG 4.37Å; P267-K345 HydrophobicContact CB-CB 3.96Å; P267-K345 HydrophobicContact CB-CD 4.19Å; P267-K345 HydrophobicContact CG-CB 3.89Å; P267-K346 HydrophobicContact CG-CB 4.47Å; P267-K346 HydrophobicContact CG-CD 4.48Å; P267-K346 HydrophobicContact CG-CG 3.44Å; P267-K346 VanDerWaalsContact CG-CG 3.44Å
268	S	72.7	Confident	73	Confident	86 Å²	86	80.8 Å²	80.8	60%	0.601	40%	0.403	S	S	*	.	H	α-helix	trans	-64.7	-32.5	-172.9	43.1	0	0	0	0	113.2	F270 L271 S272	S268-F270 VanDerWaalsContact C-N 3.31Å; S268-F270 PolarHBondContact O-N 2.58Å; S268-L271 PolarHBondContact O-N 2.9Å; S268-S272 PolarHBondContact O-N 2.72Å
269	D	75.3	Confident	73.4	Confident	33 Å²	33	83.6 Å²	83.6	18%	0.176	41%	0.412	C	S	.	.	H	α-helix	trans	-61.9	-40.9	176.8	70.9	-31.6	0	0	0	111.2	P267 S272 R273 S337 K346	P267-D269 VanDerWaalsContact C-N 3.29Å; P267-D269 VanDerWaalsContact CB-OD1 3.32Å; P267-D269 WeakPolarHBondContact CB-OD1 3.48Å; P267-D269 PolarHBondContact O-N 3.32Å; D269-S272 PolarHBondContact O-N 2.95Å; D269-S272 PolarHBondContact O-OG 3.28Å; D269-R273 PolarHBondContact O-N 3.36Å; D269-S337 PolarHBondContact OD2-OG 2.76Å; D269-K346 WeakPolarHBondContact OD1-CE 3.32Å; D269-K346 IonicContact OD1-NZ 3.3Å; D269-K346 WeakPolarHBondContact OD2-CE 3.36Å; D269-K346 IonicContact OD2-NZ 3.33Å; D269-K346 PolarHBondContact OD2-NZ 3.07Å
270	F	74.5	Confident	73.6	Confident	20 Å²	20	85 Å²	85	9%	0.088	42%	0.417	C	S	.	.	H	α-helix	trans	-65	-42.8	178.7	-170.8	-96.3	0	0	0	112.4	I266 P267 S268 S272 P274 Q352 T353 V355	I266-F270 HydrophobicContact CG2-CD1 4.09Å; P267-F270 HydrophobicContact CG-CB 4.15Å; P267-F270 WeakPolarHBondContact O-CB 3.42Å; P267-F270 PolarHBondContact O-N 2.86Å; S268-F270 VanDerWaalsContact C-N 3.31Å; S268-F270 PolarHBondContact O-N 2.58Å; F270-S272 VanDerWaalsContact C-N 3.26Å; F270-S272 PolarHBondContact O-N 2.83Å; F270-P274 HydrophobicContact CE2-CB 4.48Å; F270-P274 HydrophobicContact CZ-CB 4.27Å; F270-P274 WeakPolarHBondContact O-CD 3.43Å; F270-Q352 WeakPolarHBondContact CZ-O 3.48Å; F270-T353 HydrophobicContact CD1-CG2 4.27Å; F270-T353 HydrophobicContact CD2-CG2 4.22Å; F270-T353 HydrophobicContact CE1-CG2 4.34Å; F270-T353 HydrophobicContact CE2-CG2 4.3Å; F270-T353 HydrophobicContact CG-CG2 4.21Å; F270-T353 HydrophobicContact CZ-CG2 4.37Å; F270-V355 HydrophobicContact CE2-CG2 4.36Å; F270-V355 HydrophobicContact CZ-CG2 3.79Å
271	L	72.7	Confident	73.9	Confident	122 Å²	122	76.5 Å²	76.5	64%	0.639	39%	0.389	S	S	*	.	H	α-helix	trans	-63.3	-34	177.5	-65.8	176.9	0	0	0	112.2	I266 P267 S268	I266-L271 HydrophobicContact CG2-CD2 3.84Å; I266-L271 HydrophobicContact CG2-CG 3.96Å; P267-L271 PolarHBondContact O-N 3.29Å; S268-L271 PolarHBondContact O-N 2.9Å
272	S	69.7	Low	74.3	Confident	84 Å²	84	74.2 Å²	74.2	59%	0.587	37%	0.374	S	S	*	.	H	α-helix	trans	-73.9	-40.6	-176.4	74.1	0	0	0	0	113.3	S268 D269 F270	S268-S272 PolarHBondContact O-N 2.72Å; D269-S272 PolarHBondContact O-N 2.95Å; D269-S272 PolarHBondContact O-OG 3.28Å; F270-S272 VanDerWaalsContact C-N 3.26Å; F270-S272 PolarHBondContact O-N 2.83Å
273	R	72	Confident	74.8	Confident	135 Å²	135	73.3 Å²	73.3	51%	0.509	37%	0.37	S	S	.	.			trans	-151.5	76.5	-171	-62.8	-172.3	-172.2	-170.1	3.3	111.9	D269 Y275 D276 R280	D269-R273 PolarHBondContact O-N 3.36Å; R273-Y275 PolarHBondContact O-N 3.29Å; R273-D276 HydrophobicContact CB-CB 4.33Å; R273-D276 IonicContact NH1-OD2 3.53Å; R273-R280 PolarHBondContact O-NH2 3.14Å
274	P	67.4	Low	75.6	Confident	40 Å²	40	69.9 Å²	69.9	26%	0.26	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-29.9	-177.8	21.6	-29.3	0	0	0	114	F270 R280	F270-P274 HydrophobicContact CE2-CB 4.48Å; F270-P274 HydrophobicContact CZ-CB 4.27Å; F270-P274 WeakPolarHBondContact O-CD 3.43Å; P274-R280 PolarHBondContact O-NH2 3.21Å
275	Y	68.7	Low	76.5	Confident	135 Å²	135	65 Å²	65	53%	0.529	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112	13.3	-168.5	-57.2	-73	0	0	0	116	R273 S277 V355 P358	R273-Y275 PolarHBondContact O-N 3.29Å; Y275-S277 VanDerWaalsContact C-N 3.28Å; Y275-S277 PolarHBondContact O-N 3.3Å; Y275-V355 HydrophobicContact CD1-CG1 3.94Å; Y275-V355 HydrophobicContact CE1-CG1 3.39Å; Y275-P358 HydrophobicContact CD1-CG 4.34Å
276	D	77.1	Confident	77.2	Confident	50 Å²	50	72 Å²	72	27%	0.267	34%	0.337	S	S	.	.			trans	-81	69.1	-177.8	-167.3	-3.8	0	0	0	111.7	R273 R279 R280	R273-D276 HydrophobicContact CB-CB 4.33Å; R273-D276 IonicContact NH1-OD2 3.53Å; D276-R279 VanDerWaalsContact CG-CB 3.49Å; D276-R279 WeakPolarHBondContact OD1-CB 3.31Å; D276-R279 WeakPolarHBondContact OD2-CB 3.46Å; D276-R279 VanDerWaalsContact OD2-CD 3.29Å; D276-R279 WeakPolarHBondContact OD2-CD 3.25Å; D276-R280 VanDerWaalsContact O-CG 3.31Å; D276-R280 WeakPolarHBondContact O-CG 3.24Å; D276-R280 PolarHBondContact O-N 3.3Å
277	S	78.2	Confident	77.8	Confident	7 Å²	7	71.4 Å²	71.4	5%	0.049	34%	0.335	C	S	.	.	H	α-helix	trans	-65.1	-42.9	-171.1	71.1	0	0	0	0	113.3	Y275 R279 R280 A281 Y332 E359	Y275-S277 VanDerWaalsContact C-N 3.28Å; Y275-S277 PolarHBondContact O-N 3.3Å; S277-R279 PolarHBondContact O-N 3.18Å; S277-R280 PolarHBondContact O-N 3.41Å; S277-A281 WeakPolarHBondContact O-CB 3.18Å; S277-A281 PolarHBondContact O-N 3.1Å; S277-Y332 WeakPolarHBondContact CA-OH 2.81Å; S277-Y332 WeakPolarHBondContact CB-OH 3.41Å; S277-Y332 WeakPolarHBondContact O-CE1 3.34Å; S277-E359 WeakPolarHBondContact CB-OE1 3.29Å; S277-E359 PolarHBondContact OG-OE1 3.45Å
278	R	78.7	Confident	78.2	Confident	189 Å²	189	71.6 Å²	71.6	71%	0.713	34%	0.335	S	S	*	.	H	α-helix	trans	-62.2	-47.7	-176.6	-176.1	176.6	179.7	156.4	5	111.2	R280 A281 E282	R278-R280 VanDerWaalsContact C-N 3.32Å; R278-R280 PolarHBondContact O-N 3.39Å; R278-A281 PolarHBondContact O-N 2.86Å; R278-E282 WeakPolarHBondContact CG-OE1 3.42Å; R278-E282 IonicContact NE-OE1 2.95Å; R278-E282 PolarHBondContact NE-OE1 3.09Å; R278-E282 WeakPolarHBondContact O-CB 3.04Å; R278-E282 WeakPolarHBondContact O-CG 2.93Å; R278-E282 PolarHBondContact O-N 3.28Å
279	R	82	Confident	78.4	Confident	121 Å²	121	73.1 Å²	73.1	46%	0.457	33%	0.328	S	S	.	.	H	α-helix	trans	-63.7	-39.1	177.5	-175	-178.7	171.4	-132.1	-6.5	111.5	D276 S277 T283	D276-R279 VanDerWaalsContact CG-CB 3.49Å; D276-R279 WeakPolarHBondContact OD1-CB 3.31Å; D276-R279 WeakPolarHBondContact OD2-CB 3.46Å; D276-R279 VanDerWaalsContact OD2-CD 3.29Å; D276-R279 WeakPolarHBondContact OD2-CD 3.25Å; S277-R279 PolarHBondContact O-N 3.18Å; R279-T283 VanDerWaalsContact O-CB 3.3Å; R279-T283 WeakPolarHBondContact O-CB 3.49Å; R279-T283 PolarHBondContact O-N 3.32Å; R279-T283 PolarHBondContact O-OG1 2.99Å
280	R	82.9	Confident	78.6	Confident	33 Å²	33	74.7 Å²	74.7	13%	0.125	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-47.7	176.3	-74.7	-179.9	-174.5	-171.5	7.4	111.3	R273 P274 D276 S277 R278 E282 T283 W284 Y332	R273-R280 PolarHBondContact O-NH2 3.14Å; P274-R280 PolarHBondContact O-NH2 3.21Å; D276-R280 VanDerWaalsContact O-CG 3.31Å; D276-R280 WeakPolarHBondContact O-CG 3.24Å; D276-R280 PolarHBondContact O-N 3.3Å; S277-R280 PolarHBondContact O-N 3.41Å; R278-R280 VanDerWaalsContact C-N 3.32Å; R278-R280 PolarHBondContact O-N 3.39Å; R280-E282 PolarHBondContact O-N 2.81Å; R280-T283 PolarHBondContact O-N 3.27Å; R280-W284 WeakPolarHBondContact O-CB 3.41Å; R280-W284 PolarHBondContact O-N 3.04Å; R280-Y332 HydrophobicContact CB-CD1 4.13Å; R280-Y332 HydrophobicContact CB-CD2 4.12Å; R280-Y332 HydrophobicContact CB-CE1 4.01Å; R280-Y332 HydrophobicContact CB-CE2 4.03Å; R280-Y332 HydrophobicContact CB-CG 4.18Å
281	A	82.6	Confident	78.7	Confident	15 Å²	15	75.8 Å²	75.8	12%	0.124	35%	0.352	C	S	.	.	H	α-helix	trans	-59	-46.2	176.3	0	0	0	0	0	112	S277 R278 W284 K285 Y332	S277-A281 WeakPolarHBondContact O-CB 3.18Å; S277-A281 PolarHBondContact O-N 3.1Å; R278-A281 PolarHBondContact O-N 2.86Å; A281-W284 PolarHBondContact O-N 3.32Å; A281-K285 WeakPolarHBondContact O-CB 3.46Å; A281-K285 VanDerWaalsContact O-CG 3.29Å; A281-K285 WeakPolarHBondContact O-CG 3.43Å; A281-K285 PolarHBondContact O-N 2.94Å; A281-Y332 HydrophobicContact CB-CD1 3.85Å; A281-Y332 HydrophobicContact CB-CE1 4.44Å
282	E	82.9	Confident	78.6	Confident	90 Å²	90	71.1 Å²	71.1	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-63.7	-43.3	177.8	-72.8	172.8	-170.5	0	0	112.3	R278 R280 R286	R278-E282 WeakPolarHBondContact CG-OE1 3.42Å; R278-E282 IonicContact NE-OE1 2.95Å; R278-E282 PolarHBondContact NE-OE1 3.09Å; R278-E282 WeakPolarHBondContact O-CB 3.04Å; R278-E282 WeakPolarHBondContact O-CG 2.93Å; R278-E282 PolarHBondContact O-N 3.28Å; R280-E282 PolarHBondContact O-N 2.81Å; E282-R286 WeakPolarHBondContact O-CB 3.35Å; E282-R286 PolarHBondContact O-N 3.41Å; E282-R286 VanDerWaalsContact O-N 3.08Å
283	T	84.3	Confident	78.6	Confident	28 Å²	28	71.6 Å²	71.6	17%	0.172	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-44	178.4	-55.3	0	0	0	0	111.1	R279 R280 R286 N287	R279-T283 VanDerWaalsContact O-CB 3.3Å; R279-T283 WeakPolarHBondContact O-CB 3.49Å; R279-T283 PolarHBondContact O-N 3.32Å; R279-T283 PolarHBondContact O-OG1 2.99Å; R280-T283 PolarHBondContact O-N 3.27Å; T283-R286 PolarHBondContact O-N 3.23Å; T283-N287 WeakPolarHBondContact O-CB 3.27Å; T283-N287 PolarHBondContact O-N 3.39Å; T283-N287 PolarHBondContact O-ND2 2.91Å
284	W	84.5	Confident	78.6	Confident	14 Å²	14	66.8 Å²	66.8	5%	0.053	31%	0.308	C	S	.	.	H	α-helix	trans	-57.4	-54.6	176.2	-179.2	-112.1	0	0	0	110.8	R280 A281 R286 N287 R288 L291 D300 E327 P333 C336	R280-W284 WeakPolarHBondContact O-CB 3.41Å; R280-W284 PolarHBondContact O-N 3.04Å; A281-W284 PolarHBondContact O-N 3.32Å; W284-R286 VanDerWaalsContact C-N 3.33Å; W284-R286 PolarHBondContact O-N 3.12Å; W284-N287 PolarHBondContact O-N 3.5Å; W284-N287 VanDerWaalsContact O-N 3.16Å; W284-R288 HydrophobicContact CZ2-CG 4.17Å; W284-R288 WeakPolarHBondContact O-CA 3.37Å; W284-R288 VanDerWaalsContact O-CB 3.26Å; W284-R288 WeakPolarHBondContact O-CB 3.26Å; W284-R288 PolarHBondContact O-N 3.14Å; W284-L291 HydrophobicContact CE3-CD1 4.34Å; W284-L291 HydrophobicContact CH2-CD1 4.34Å; W284-L291 HydrophobicContact CZ3-CD1 3.86Å; W284-D300 HydrophobicContact CH2-CB 4.37Å; W284-D300 WeakPolarHBondContact CH2-OD2 3.28Å; W284-E327 PolarHBondContact NE1-OE1 2.89Å; W284-P333 HydrophobicContact CD2-CG 4.17Å; W284-P333 HydrophobicContact CE3-CG 4.19Å; W284-P333 HydrophobicContact CH2-CG 3.42Å; W284-P333 VanDerWaalsContact CH2-CG 3.42Å; W284-P333 VanDerWaalsContact CZ2-CD 3.42Å; W284-P333 HydrophobicContact CZ2-CG 3.38Å; W284-P333 HydrophobicContact CZ3-CG 3.83Å; W284-C336 HydrophobicContact CD2-CB 4.46Å; W284-C336 HydrophobicContact CE3-CB 3.64Å; W284-C336 HydrophobicContact CZ3-CB 3.82Å
285	K	83.9	Confident	78.5	Confident	50 Å²	50	69 Å²	69	22%	0.217	32%	0.321	C	S	.	.	H	α-helix	trans	-57.3	-43.1	178.5	-74.2	174.9	-170.5	167.5	0	112.9	D195 A281 N287	D195-K285 WeakPolarHBondContact OD1-CE 3.47Å; D195-K285 IonicContact OD1-NZ 3.92Å; D195-K285 PolarHBondContact OD1-NZ 2.88Å; D195-K285 IonicContact OD2-NZ 2.91Å; D195-K285 PolarHBondContact OD2-NZ 2.86Å; D195-K285 VanDerWaalsContact OD2-NZ 3.17Å; A281-K285 WeakPolarHBondContact O-CB 3.46Å; A281-K285 VanDerWaalsContact O-CG 3.29Å; A281-K285 WeakPolarHBondContact O-CG 3.43Å; A281-K285 PolarHBondContact O-N 2.94Å; K285-N287 VanDerWaalsContact C-N 3.33Å; K285-N287 PolarHBondContact O-N 3.01Å
286	R	84	Confident	78.4	Confident	179 Å²	179	65 Å²	65	68%	0.675	31%	0.31	S	S	*	.	H	α-helix	trans	-61.6	-42.1	178.7	-173.6	-177.5	-63.2	123.7	3	111.9	E282 T283 W284	E282-R286 WeakPolarHBondContact O-CB 3.35Å; E282-R286 PolarHBondContact O-N 3.41Å; E282-R286 VanDerWaalsContact O-N 3.08Å; T283-R286 PolarHBondContact O-N 3.23Å; W284-R286 VanDerWaalsContact C-N 3.33Å; W284-R286 PolarHBondContact O-N 3.12Å
287	N	84.9	Confident	78.4	Confident	66 Å²	66	62.6 Å²	62.6	35%	0.353	30%	0.298	S	S	.	.	H	α-helix	trans	-90.7	-16.6	-174.4	-65.6	-18.7	0	0	0	113.1	T283 W284 K285 R289 A290 L291	T283-N287 WeakPolarHBondContact O-CB 3.27Å; T283-N287 PolarHBondContact O-N 3.39Å; T283-N287 PolarHBondContact O-ND2 2.91Å; W284-N287 PolarHBondContact O-N 3.5Å; W284-N287 VanDerWaalsContact O-N 3.16Å; K285-N287 VanDerWaalsContact C-N 3.33Å; K285-N287 PolarHBondContact O-N 3.01Å; N287-R289 PolarHBondContact O-N 3.16Å; N287-A290 WeakPolarHBondContact O-CB 3.05Å; N287-A290 PolarHBondContact O-N 3.43Å; N287-L291 HydrophobicContact CB-CD1 4.37Å; N287-L291 WeakPolarHBondContact O-CG 3.49Å; N287-L291 PolarHBondContact O-N 3.17Å
288	R	83.6	Confident	78.5	Confident	7 Å²	7	63.1 Å²	63.1	3%	0.026	30%	0.3	C	S	.	.	H	α-helix	trans	-52.7	-51.8	-169.1	-148.2	-172.3	169.1	131.7	12.4	113	M188 M192 W284 A290 L291 A292 Y301 E327	M188-R288 VanDerWaalsContact CE-C 3.43Å; M188-R288 HydrophobicContact CE-CB 3.86Å; M188-R288 HydrophobicContact CE-CG 3.47Å; M188-R288 VanDerWaalsContact CE-CG 3.47Å; M188-R288 WeakPolarHBondContact CE-O 3.22Å; M188-R288 HydrophobicContact SD-CG 3.99Å; M188-R288 PolarHBondContact SD-NE 3.12Å; M188-R288 VanDerWaalsContact SD-NE 3.45Å; M192-R288 HydrophobicContact SD-CB 4.36Å; W284-R288 HydrophobicContact CZ2-CG 4.17Å; W284-R288 WeakPolarHBondContact O-CA 3.37Å; W284-R288 VanDerWaalsContact O-CB 3.26Å; W284-R288 WeakPolarHBondContact O-CB 3.26Å; W284-R288 PolarHBondContact O-N 3.14Å; R288-A290 VanDerWaalsContact C-N 3.34Å; R288-A290 PolarHBondContact O-N 2.82Å; R288-L291 WeakPolarHBondContact O-CB 3.3Å; R288-L291 PolarHBondContact O-N 3.13Å; R288-L291 VanDerWaalsContact O-N 3.08Å; R288-A292 PolarHBondContact O-N 3.17Å; R288-Y301 PolarHBondContact NH2-OH 2.89Å; R288-E327 IonicContact CZ-OE1 2.72Å; R288-E327 IonicContact CZ-OE2 2.78Å; R288-E327 IonicContact NE-OE1 3.91Å; R288-E327 IonicContact NH1-OE1 2.95Å; R288-E327 PolarHBondContact NH1-OE1 3.44Å; R288-E327 IonicContact NH1-OE2 3.32Å; R288-E327 IonicContact NH2-OE1 3.09Å; R288-E327 PolarHBondContact NH2-OE1 3.3Å; R288-E327 IonicContact NH2-OE2 2.73Å; R288-E327 PolarHBondContact NH2-OE2 3.35Å
289	R	77.2	Confident	79	Confident	118 Å²	118	54.1 Å²	54.1	45%	0.445	27%	0.267	S	S	.	.	H	α-helix	trans	-57.3	-46.8	178.2	-77.7	179.8	173.3	159.1	0.2	111.6	M192 N287 L291 A292 Y293 D425	M192-R289 HydrophobicContact CE-CG 3.85Å; M192-R289 HydrophobicContact SD-CG 3.86Å; N287-R289 PolarHBondContact O-N 3.16Å; R289-L291 VanDerWaalsContact C-N 3.27Å; R289-L291 PolarHBondContact O-N 3.08Å; R289-A292 PolarHBondContact O-N 2.88Å; R289-Y293 HydrophobicContact CB-CE2 4.21Å; R289-Y293 WeakPolarHBondContact O-CD2 3.2Å; R289-Y293 PolarHBondContact O-N 3.28Å; R289-D425 IonicContact CZ-OD1 3.53Å; R289-D425 IonicContact NE-OD1 3.56Å; R289-D425 PolarHBondContact NE-OD1 3.4Å; R289-D425 IonicContact NE-OD2 2.72Å; R289-D425 PolarHBondContact NE-OD2 3.19Å; R289-D425 IonicContact NH2-OD1 2.85Å; R289-D425 PolarHBondContact NH2-OD1 3.03Å
290	A	78	Confident	79.5	Confident	66 Å²	66	48.4 Å²	48.4	55%	0.545	25%	0.245	S	C	.	.	H	α-helix	trans	-61.2	-36.8	177.8	0	0	0	0	0	112	N287 R288 S294	N287-A290 WeakPolarHBondContact O-CB 3.05Å; N287-A290 PolarHBondContact O-N 3.43Å; R288-A290 VanDerWaalsContact C-N 3.34Å; R288-A290 PolarHBondContact O-N 2.82Å; A290-S294 VanDerWaalsContact O-CB 3.25Å; A290-S294 WeakPolarHBondContact O-CB 3.46Å; A290-S294 PolarHBondContact O-N 2.71Å
291	L	76.4	Confident	80.1	Confident	42 Å²	42	47.8 Å²	47.8	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-69.6	-38	176.6	-67.5	176.6	0	0	0	113.2	K251 W284 N287 R288 R289 S294 T298	K251-L291 PolarHBondContact NZ-O 2.94Å; W284-L291 HydrophobicContact CE3-CD1 4.34Å; W284-L291 HydrophobicContact CH2-CD1 4.34Å; W284-L291 HydrophobicContact CZ3-CD1 3.86Å; N287-L291 HydrophobicContact CB-CD1 4.37Å; N287-L291 WeakPolarHBondContact O-CG 3.49Å; N287-L291 PolarHBondContact O-N 3.17Å; R288-L291 WeakPolarHBondContact O-CB 3.3Å; R288-L291 PolarHBondContact O-N 3.13Å; R288-L291 VanDerWaalsContact O-N 3.08Å; R289-L291 VanDerWaalsContact C-N 3.27Å; R289-L291 PolarHBondContact O-N 3.08Å; L291-S294 PolarHBondContact O-N 2.85Å; L291-T298 HydrophobicContact CD1-CG2 4.23Å; L291-T298 HydrophobicContact CD2-CG2 3.69Å; L291-T298 HydrophobicContact CG-CG2 4.49Å
292	A	71.4	Confident	80.6	Confident	24 Å²	24	47.6 Å²	47.6	20%	0.198	24%	0.24	C	C	.	.	H	α-helix	trans	-60.5	-48.3	175.4	0	0	0	0	0	111.1	M188 K251 R288 R289 S294	M188-A292 HydrophobicContact CE-CB 3.6Å; M188-A292 HydrophobicContact SD-CB 3.97Å; K251-A292 PolarHBondContact NZ-O 2.76Å; R288-A292 PolarHBondContact O-N 3.17Å; R289-A292 PolarHBondContact O-N 2.88Å; A292-S294 VanDerWaalsContact C-N 3.33Å; A292-S294 PolarHBondContact O-N 2.93Å
293	Y	70.5	Confident	81.1	Confident	94 Å²	94	43.4 Å²	43.4	37%	0.369	22%	0.22	S	C	.	.	H	α-helix	trans	-79.1	-10.1	179.3	-55.9	-56.7	0	0	0	114.3	R110 R289 D425 F427	R110-Y293 HydrophobicContact CB-CD1 4.46Å; R110-Y293 WeakPolarHBondContact O-CD1 3.41Å; R289-Y293 HydrophobicContact CB-CE2 4.21Å; R289-Y293 WeakPolarHBondContact O-CD2 3.2Å; R289-Y293 PolarHBondContact O-N 3.28Å; Y293-D425 PolarHBondContact OH-OD2 3.41Å; Y293-F427 AromaticContact CE1-CE1 3.85Å; Y293-F427 HydrophobicContact CE1-CE1 3.85Å; Y293-F427 AromaticContact CE1-CZ 3.93Å; Y293-F427 HydrophobicContact CE1-CZ 3.93Å; Y293-F427 HydrophobicContact CE2-CE1 4.47Å; Y293-F427 AromaticContact CZ-CE1 3.74Å; Y293-F427 AromaticContact CZ-CZ 3.82Å; Y293-F427 VanDerWaalsContact OH-CZ 3.27Å; Y293-F427 WeakPolarHBondContact OH-CZ 3.4Å
294	S	71.5	Confident	81.5	Confident	35 Å²	35	42.3 Å²	42.3	25%	0.245	21%	0.214	C	C	.	.			trans	-68.7	134.8	-178.7	176.7	0	0	0	0	112.4	K251 A290 L291 A292 V296 G297	K251-S294 WeakPolarHBondContact CE-O 3.43Å; A290-S294 VanDerWaalsContact O-CB 3.25Å; A290-S294 WeakPolarHBondContact O-CB 3.46Å; A290-S294 PolarHBondContact O-N 2.71Å; L291-S294 PolarHBondContact O-N 2.85Å; A292-S294 VanDerWaalsContact C-N 3.33Å; A292-S294 PolarHBondContact O-N 2.93Å; S294-V296 VanDerWaalsContact C-N 3.29Å; S294-V296 PolarHBondContact OG-N 3.44Å; S294-V296 VanDerWaalsContact OG-N 3.1Å; S294-G297 PolarHBondContact OG-N 3.3Å
295	T	64.4	Low	81.8	Confident	87 Å²	87	42.5 Å²	42.5	53%	0.534	22%	0.215	S	C	.	.	S	Bend	trans	-75.6	-17.2	171.2	56.9	0	0	0	0	113.1	A112 K251 K252	A112-T295 HydrophobicContact CB-CG2 4.47Å; K251-T295 WeakPolarHBondContact CA-O 3.18Å; K252-T295 PolarHBondContact N-O 3.38Å
296	V	67.4	Low	82.1	Confident	49 Å²	49	41.8 Å²	41.8	30%	0.297	22%	0.215	S	C	.	.	S	Bend	trans	-80	-44.9	173.1	-179.4	0	0	0	0	109.3	K251 K252 A253 F258 S294 P340	K251-V296 CarbonylContact C-O 3.58Å; K251-V296 VanDerWaalsContact CB-O 3.31Å; K251-V296 WeakPolarHBondContact CB-O 3.3Å; K252-V296 PolarHBondContact N-O 2.96Å; K252-V296 VanDerWaalsContact N-O 3.12Å; A253-V296 HydrophobicContact CB-CG1 4.29Å; A253-V296 WeakPolarHBondContact CB-O 3.35Å; A253-V296 PolarHBondContact N-O 3.04Å; F258-V296 HydrophobicContact CE2-CG1 4.44Å; F258-V296 HydrophobicContact CZ-CG1 4.1Å; S294-V296 VanDerWaalsContact C-N 3.29Å; S294-V296 PolarHBondContact OG-N 3.44Å; S294-V296 VanDerWaalsContact OG-N 3.1Å; V296-P340 HydrophobicContact CG1-CG 4.19Å
297	G	76.3	Confident	82.1	Confident	1 Å²	1	33.6 Å²	33.6	1%	0.01	18%	0.184	C	C	.	.			trans	68.5	-171.8	-175.1	0	0	0	0	0	113.9	A253 S294 P340	A253-G297 WeakPolarHBondContact CB-O 3Å; S294-G297 PolarHBondContact OG-N 3.3Å; G297-P340 WeakPolarHBondContact O-CG 3.45Å
298	T	80.9	Confident	82	Confident	18 Å²	18	35.7 Å²	35.7	11%	0.11	19%	0.193	C	C	.	.			trans	-138.7	151.2	172.2	51.9	0	0	0	0	109.8	H254 L291 D300 P340	H254-T298 PolarHBondContact CD2-O 2.97Å; H254-T298 PolarHBondContact NE2-O 2.77Å; L291-T298 HydrophobicContact CD1-CG2 4.23Å; L291-T298 HydrophobicContact CD2-CG2 3.69Å; L291-T298 HydrophobicContact CG-CG2 4.49Å; T298-D300 VanDerWaalsContact C-N 3.28Å; T298-D300 WeakPolarHBondContact CB-OD2 3.3Å; T298-D300 PolarHBondContact O-N 3.27Å; T298-D300 PolarHBondContact OG1-OD2 2.94Å; T298-P340 HydrophobicContact CG2-CG 4.23Å
299	P	89.6	Confident	81.4	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.237	C	C	.	.			trans	-88	19.8	-178	38	-39	0	0	0	113.6	Y259 Y301 I302 F307 T343	Y259-P299 WeakPolarHBondContact OH-CD 3.42Å; Y259-P299 VanDerWaalsContact OH-CG 3.32Å; Y259-P299 WeakPolarHBondContact OH-CG 3.45Å; P299-Y301 PolarHBondContact O-N 3.35Å; P299-Y301 VanDerWaalsContact O-N 3.11Å; P299-I302 HydrophobicContact CB-CB 4.47Å; P299-I302 HydrophobicContact CB-CD1 4.28Å; P299-I302 PolarHBondContact O-N 3.47Å; P299-F307 HydrophobicContact CB-CE2 4.25Å; P299-F307 HydrophobicContact CB-CZ 3.61Å; P299-T343 HydrophobicContact CG-CG2 3.73Å
300	D	93	Very high	81.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-38.7	-169.1	-68.9	-80.2	0	0	0	114.3	W284 T298 V323 P333 C336 T343	W284-D300 HydrophobicContact CH2-CB 4.37Å; W284-D300 WeakPolarHBondContact CH2-OD2 3.28Å; T298-D300 VanDerWaalsContact C-N 3.28Å; T298-D300 WeakPolarHBondContact CB-OD2 3.3Å; T298-D300 PolarHBondContact O-N 3.27Å; T298-D300 PolarHBondContact OG1-OD2 2.94Å; D300-V323 WeakPolarHBondContact O-CG1 3.26Å; D300-P333 HydrophobicContact CB-CB 4.23Å; D300-P333 HydrophobicContact CB-CG 4.01Å; D300-C336 VanDerWaalsContact OD1-CA 3.26Å; D300-C336 WeakPolarHBondContact OD1-CA 3.13Å; D300-T343 HydrophobicContact CB-CG2 4.46Å; D300-T343 WeakPolarHBondContact OD1-CG2 3.22Å
301	Y	94.8	Very high	81.1	Confident	20 Å²	20	42.3 Å²	42.3	8%	0.078	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	-0.3	-176.3	-50.4	-85.6	0	0	0	113.3	I226 K227 P228 R288 P299 S320 V323 I324 E327 P333	I226-Y301 WeakPolarHBondContact O-CB 3.05Å; K227-Y301 HydrophobicContact CB-CD1 4.31Å; K227-Y301 HydrophobicContact CB-CD2 3.61Å; K227-Y301 HydrophobicContact CB-CE2 3.9Å; K227-Y301 HydrophobicContact CB-CG 3.84Å; P228-Y301 VanDerWaalsContact CD-CZ 3.46Å; P228-Y301 WeakPolarHBondContact CD-OH 3.19Å; P228-Y301 HydrophobicContact CG-CE1 4.18Å; R288-Y301 PolarHBondContact NH2-OH 2.89Å; P299-Y301 PolarHBondContact O-N 3.35Å; P299-Y301 VanDerWaalsContact O-N 3.11Å; Y301-S320 WeakPolarHBondContact O-CB 3.46Å; Y301-S320 PolarHBondContact O-OG 3.45Å; Y301-V323 HydrophobicContact CD1-CB 4.01Å; Y301-V323 HydrophobicContact CD1-CG1 3.38Å; Y301-V323 HydrophobicContact CE1-CG1 3.81Å; Y301-V323 HydrophobicContact CG-CG1 4.15Å; Y301-I324 HydrophobicContact CD1-CG1 3.83Å; Y301-I324 HydrophobicContact CE1-CG1 3.91Å; Y301-E327 WeakPolarHBondContact CE1-OE2 2.91Å; Y301-E327 PolarHBondContact OH-OE1 2.96Å; Y301-E327 PolarHBondContact OH-OE2 3.05Å; Y301-P333 HydrophobicContact CE1-CB 4.43Å
302	I	92.4	Very high	81.4	Confident	12 Å²	12	44.6 Å²	44.6	6%	0.062	26%	0.259	C	S	.	.			trans	-84.8	131.3	-175.6	-60.6	-177.8	0	0	0	109.8	H254 P299 V306 F307 W319	H254-I302 HydrophobicContact CB-CD1 3.73Å; H254-I302 WeakPolarHBondContact CD2-CD1 3.12Å; H254-I302 VanDerWaalsContact CG-CD1 3.47Å; P299-I302 HydrophobicContact CB-CB 4.47Å; P299-I302 HydrophobicContact CB-CD1 4.28Å; P299-I302 PolarHBondContact O-N 3.47Å; I302-V306 HydrophobicContact CG2-CB 3.64Å; I302-V306 HydrophobicContact CG2-CG1 3.8Å; I302-V306 HydrophobicContact CG2-CG2 4.08Å; I302-F307 HydrophobicContact CB-CE2 3.95Å; I302-F307 HydrophobicContact CB-CZ 3.86Å; I302-F307 HydrophobicContact CD1-CZ 4.08Å; I302-F307 HydrophobicContact CG2-CD2 4.29Å; I302-F307 HydrophobicContact CG2-CE1 4.31Å; I302-F307 HydrophobicContact CG2-CE2 3.49Å; I302-F307 VanDerWaalsContact CG2-CE2 3.49Å; I302-F307 HydrophobicContact CG2-CZ 3.49Å; I302-F307 VanDerWaalsContact CG2-CZ 3.49Å; I302-W319 PolarHBondContact O-NE1 2.67Å
303	A	93.7	Very high	82.1	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.008	26%	0.263	C	S	.	.			trans	-67.4	143.6	177	0	0	0	0	0	111.6	E305 V306 C316 W319	A303-E305 VanDerWaalsContact CB-CD 3.49Å; A303-E305 WeakPolarHBondContact CB-OE1 3.42Å; A303-E305 WeakPolarHBondContact CB-OE2 3.33Å; A303-E305 PolarHBondContact O-N 3.5Å; A303-V306 HydrophobicContact CB-CG2 4.18Å; A303-V306 WeakPolarHBondContact O-CB 3.38Å; A303-V306 PolarHBondContact O-N 3Å; A303-C316 HydrophobicContact CB-CB 3.9Å; A303-W319 VanDerWaalsContact CA-CD1 3.46Å; A303-W319 HydrophobicContact CB-CB 3.63Å; A303-W319 HydrophobicContact CB-CD2 4.19Å; A303-W319 HydrophobicContact CB-CG 3.63Å
304	P	93.3	Very high	83.1	Confident	6 Å²	6	43.6 Å²	43.6	4%	0.039	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-59.2	-35.1	-175.2	23.4	-34.1	0	0	0	112.7	V306 F307 M308 W319 V347 L348	P304-V306 PolarHBondContact O-N 3.38Å; P304-F307 PolarHBondContact O-N 3.43Å; P304-M308 HydrophobicContact CB-CE 4.33Å; P304-W319 HydrophobicContact CG-CE3 4.37Å; P304-W319 HydrophobicContact CG-CH2 3.96Å; P304-W319 HydrophobicContact CG-CZ2 4.35Å; P304-W319 HydrophobicContact CG-CZ3 3.95Å; P304-V347 HydrophobicContact CB-CG1 4.12Å; P304-L348 HydrophobicContact CB-CD2 4.43Å
305	E	91.5	Very high	84.1	Confident	17 Å²	17	42 Å²	42	8%	0.079	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-66.7	-21.1	179.5	70.2	-86.2	-164.5	0	0	113.9	A303 F307 M308 A377 R380	A303-E305 VanDerWaalsContact CB-CD 3.49Å; A303-E305 WeakPolarHBondContact CB-OE1 3.42Å; A303-E305 WeakPolarHBondContact CB-OE2 3.33Å; A303-E305 PolarHBondContact O-N 3.5Å; E305-F307 PolarHBondContact O-N 3.47Å; E305-M308 HydrophobicContact CB-SD 4.42Å; E305-M308 WeakPolarHBondContact O-CB 3.48Å; E305-M308 PolarHBondContact O-N 3.33Å; E305-A377 HydrophobicContact CG-CB 4.29Å; E305-R380 IonicContact OE1-CZ 3.25Å; E305-R380 IonicContact OE1-NH1 2.88Å; E305-R380 PolarHBondContact OE1-NH1 3.15Å; E305-R380 IonicContact OE1-NH2 2.8Å; E305-R380 PolarHBondContact OE1-NH2 3.41Å; E305-R380 IonicContact OE2-CZ 2.76Å; E305-R380 IonicContact OE2-NH1 3.28Å; E305-R380 IonicContact OE2-NH2 3.21Å; E305-R380 PolarHBondContact OE2-NH2 2.93Å
306	V	88.5	Confident	85.5	Confident	35 Å²	35	38 Å²	38	21%	0.212	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-64.8	-27.3	176.5	176.4	0	0	0	0	111	I302 A303 P304 Y312 C316	I302-V306 HydrophobicContact CG2-CB 3.64Å; I302-V306 HydrophobicContact CG2-CG1 3.8Å; I302-V306 HydrophobicContact CG2-CG2 4.08Å; A303-V306 HydrophobicContact CB-CG2 4.18Å; A303-V306 WeakPolarHBondContact O-CB 3.38Å; A303-V306 PolarHBondContact O-N 3Å; P304-V306 PolarHBondContact O-N 3.38Å; V306-Y312 HydrophobicContact CG2-CD1 4.4Å; V306-Y312 HydrophobicContact CG2-CG 4.21Å; V306-C316 HydrophobicContact CG2-CB 3.92Å
307	F	84.6	Confident	86.8	Confident	8 Å²	8	35.6 Å²	35.6	4%	0.035	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-85.2	-11.6	175	-57.8	-68.2	0	0	0	113.2	T256 Y259 P299 I302 P304 E305 Y344 V347	T256-F307 WeakPolarHBondContact CG2-O 3.31Å; Y259-F307 HydrophobicContact CD2-CD1 4.34Å; Y259-F307 HydrophobicContact CD2-CE1 4.23Å; Y259-F307 HydrophobicContact CE2-CD1 4.44Å; Y259-F307 AromaticContact CE2-CE1 3.88Å; Y259-F307 HydrophobicContact CE2-CE1 3.88Å; Y259-F307 HydrophobicContact CE2-CZ 4.44Å; P299-F307 HydrophobicContact CB-CE2 4.25Å; P299-F307 HydrophobicContact CB-CZ 3.61Å; I302-F307 HydrophobicContact CB-CE2 3.95Å; I302-F307 HydrophobicContact CB-CZ 3.86Å; I302-F307 HydrophobicContact CD1-CZ 4.08Å; I302-F307 HydrophobicContact CG2-CD2 4.29Å; I302-F307 HydrophobicContact CG2-CE1 4.31Å; I302-F307 HydrophobicContact CG2-CE2 3.49Å; I302-F307 VanDerWaalsContact CG2-CE2 3.49Å; I302-F307 HydrophobicContact CG2-CZ 3.49Å; I302-F307 VanDerWaalsContact CG2-CZ 3.49Å; P304-F307 PolarHBondContact O-N 3.43Å; E305-F307 PolarHBondContact O-N 3.47Å; F307-Y344 HydrophobicContact CB-CE2 3.88Å; F307-Y344 HydrophobicContact CD1-CD2 4.21Å; F307-Y344 AromaticContact CD1-CE2 3.79Å; F307-Y344 HydrophobicContact CD1-CE2 3.79Å; F307-Y344 HydrophobicContact CD2-CD2 4.08Å; F307-Y344 AromaticContact CD2-CE2 3.86Å; F307-Y344 HydrophobicContact CD2-CE2 3.86Å; F307-Y344 HydrophobicContact CE1-CD2 4.25Å; F307-Y344 HydrophobicContact CE1-CE2 4.28Å; F307-Y344 HydrophobicContact CE2-CD2 4.11Å; F307-Y344 HydrophobicContact CE2-CE2 4.34Å; F307-Y344 HydrophobicContact CG-CD2 4.14Å; F307-Y344 AromaticContact CG-CE2 3.56Å; F307-Y344 HydrophobicContact CG-CE2 3.56Å; F307-Y344 HydrophobicContact CZ-CD2 4.2Å; F307-V347 HydrophobicContact CE2-CG1 4.47Å
308	M	82.5	Confident	87.8	Confident	110 Å²	110	35.6 Å²	35.6	54%	0.542	21%	0.211	S	C	.	.	S	Bend	trans	-86	150.5	-178	-59.9	-178.7	-173.9	0	0	111.1	P304 E305 G310	P304-M308 HydrophobicContact CB-CE 4.33Å; E305-M308 HydrophobicContact CB-SD 4.42Å; E305-M308 WeakPolarHBondContact O-CB 3.48Å; E305-M308 PolarHBondContact O-N 3.33Å; M308-G310 PolarHBondContact O-N 2.89Å
309	Q	72.3	Confident	88.6	Confident	201 Å²	201	34.7 Å²	34.7	94%	0.939	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-5.1	-178.4	-66.4	-178.2	-8.6	0	0	113.9	G311	Q309-G311 VanDerWaalsContact C-N 3.26Å; Q309-G311 PolarHBondContact O-N 3.07Å
310	G	71.2	Confident	88.9	Confident	80 Å²	80	34.9 Å²	34.9	83%	0.825	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-0.5	-175.6	0	0	0	0	0	115.4	M308	M308-G310 PolarHBondContact O-N 2.89Å
311	G	76.6	Confident	89.2	Confident	48 Å²	48	34.9 Å²	34.9	50%	0.495	21%	0.207	S	C	.	.			trans	77.9	175.5	-167.9	0	0	0	0	0	111.9	Q309	Q309-G311 VanDerWaalsContact C-N 3.26Å; Q309-G311 PolarHBondContact O-N 3.07Å
312	Y	82.9	Confident	89.3	Confident	90 Å²	90	34 Å²	34	35%	0.353	20%	0.204	S	C	.	.			trans	-141.7	163.6	179.8	59.5	-92.9	0	0	0	109.2	I222 R224 V306	I222-Y312 HydrophobicContact CD1-CE2 4.29Å; R224-Y312 WeakPolarHBondContact CD-OH 3.45Å; R224-Y312 HydrophobicContact CG-CE2 4.02Å; R224-Y312 PolarHBondContact NH1-OH 2.82Å; V306-Y312 HydrophobicContact CG2-CD1 4.4Å; V306-Y312 HydrophobicContact CG2-CG 4.21Å
313	S	86.9	Confident	89.6	Confident	43 Å²	43	33.4 Å²	33.4	30%	0.301	20%	0.201	S	C	.	.			trans	-116.6	-177.2	179.5	84.3	0	0	0	0	111.3	S315 C316	S313-S315 PolarHBondContact O-N 2.68Å; S313-S315 VanDerWaalsContact OG-CB 3.29Å; S313-S315 WeakPolarHBondContact OG-CB 3.48Å; S313-S315 PolarHBondContact OG-N 3.46Å; S313-S315 VanDerWaalsContact OG-N 3.11Å; S313-S315 PolarHBondContact OG-OG 3.27Å; S313-C316 PolarHBondContact O-N 2.84Å; S313-C316 PolarHBondContact O-SG 2.88Å; S313-C316 VanDerWaalsContact O-SG 3.32Å
314	T	89.9	Confident	89.8	Confident	54 Å²	54	33.3 Å²	33.3	33%	0.331	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-23.4	169.2	45.9	0	0	0	0	112.9	H217 I222 C316 D317	H217-T314 HydrophobicContact CB-CG2 4.42Å; H217-T314 PolarHBondContact CE1-O 3.06Å; H217-T314 VanDerWaalsContact CE1-O 3.23Å; I222-T314 HydrophobicContact CD1-CG2 4.18Å; I222-T314 HydrophobicContact CG1-CG2 3.77Å; T314-C316 PolarHBondContact O-N 3Å; T314-D317 PolarHBondContact O-N 3.41Å
315	S	93.1	Very high	90.1	Very high	2 Å²	2	33 Å²	33	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-55.6	-24.1	177.9	66.3	0	0	0	0	114.6	S313 D317 W318 W319 R380	S313-S315 PolarHBondContact O-N 2.68Å; S313-S315 VanDerWaalsContact OG-CB 3.29Å; S313-S315 WeakPolarHBondContact OG-CB 3.48Å; S313-S315 PolarHBondContact OG-N 3.46Å; S313-S315 VanDerWaalsContact OG-N 3.11Å; S313-S315 PolarHBondContact OG-OG 3.27Å; S315-D317 PolarHBondContact O-N 3.34Å; S315-W318 PolarHBondContact O-N 2.82Å; S315-W319 PolarHBondContact O-N 2.97Å; S315-R380 VanDerWaalsContact C-NH1 3.3Å; S315-R380 WeakPolarHBondContact O-CD 3.42Å; S315-R380 PolarHBondContact O-NH1 3.02Å
316	C	93.6	Very high	90.4	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.014	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-33	-179.6	67.2	0	0	0	0	112.4	I222 A303 V306 S313 T314 W318 W319 S320	I222-C316 VanDerWaalsContact CG2-SG 3.56Å; A303-C316 HydrophobicContact CB-CB 3.9Å; V306-C316 HydrophobicContact CG2-CB 3.92Å; S313-C316 PolarHBondContact O-N 2.84Å; S313-C316 PolarHBondContact O-SG 2.88Å; S313-C316 VanDerWaalsContact O-SG 3.32Å; T314-C316 PolarHBondContact O-N 3Å; C316-W318 VanDerWaalsContact C-N 3.3Å; C316-W318 PolarHBondContact O-N 3.18Å; C316-W319 WeakPolarHBondContact O-CB 3.41Å; C316-W319 PolarHBondContact O-N 3.01Å; C316-S320 PolarHBondContact O-N 3.01Å; C316-S320 PolarHBondContact O-OG 2.95Å
317	D	94.8	Very high	90.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-69.9	-30	179.7	-66.6	-22.9	0	0	0	111.5	V213 H217 I222 H223 R224 I226 T314 S315 W319 S320 L321	V213-D317 HydrophobicContact CG1-CB 3.77Å; H217-D317 IonicContact CD2-OD2 3.76Å; H217-D317 IonicContact CE1-OD2 3.58Å; H217-D317 IonicContact NE2-OD2 3.63Å; H217-D317 PolarHBondContact NE2-OD2 3.45Å; I222-D317 WeakPolarHBondContact CG2-OD2 3.25Å; H223-D317 PolarHBondContact N-OD2 2.94Å; R224-D317 WeakPolarHBondContact CA-OD1 3.29Å; R224-D317 PolarHBondContact N-OD1 3.25Å; I226-D317 HydrophobicContact CG1-CB 4.11Å; T314-D317 PolarHBondContact O-N 3.41Å; S315-D317 PolarHBondContact O-N 3.34Å; D317-W319 VanDerWaalsContact C-N 3.35Å; D317-S320 WeakPolarHBondContact O-CB 3.45Å; D317-S320 PolarHBondContact O-N 3Å; D317-L321 PolarHBondContact O-N 2.85Å
318	W	97.4	Very high	91.4	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-69.6	-30.9	174.6	-55.9	135.9	0	0	0	112.9	A210 V213 E214 H217 S315 C316 L321 G322 F373 R380 G382 I390	A210-W318 HydrophobicContact CB-CZ3 3.95Å; V213-W318 HydrophobicContact CB-CH2 3.98Å; V213-W318 HydrophobicContact CB-CZ3 3.9Å; V213-W318 HydrophobicContact CG1-CE3 4.15Å; V213-W318 HydrophobicContact CG1-CH2 3.67Å; V213-W318 HydrophobicContact CG1-CZ2 4.06Å; V213-W318 HydrophobicContact CG1-CZ3 3.73Å; E214-W318 HydrophobicContact CB-CH2 4.44Å; H217-W318 AromaticContact ND1-CZ2 3.88Å; S315-W318 PolarHBondContact O-N 2.82Å; C316-W318 VanDerWaalsContact C-N 3.3Å; C316-W318 PolarHBondContact O-N 3.18Å; W318-L321 HydrophobicContact CE3-CD2 4.04Å; W318-L321 HydrophobicContact CZ3-CD2 4.23Å; W318-L321 PolarHBondContact O-N 2.91Å; W318-G322 PolarHBondContact O-N 2.85Å; W318-G322 VanDerWaalsContact O-N 3.16Å; W318-F373 HydrophobicContact CB-CD1 4.04Å; W318-F373 HydrophobicContact CB-CE1 4.24Å; W318-F373 VanDerWaalsContact O-CD1 3.24Å; W318-F373 WeakPolarHBondContact O-CD1 3.42Å; W318-R380 HydrophobicContact CB-CG 4.36Å; W318-G382 PolarHBondContact NE1-O 2.86Å; W318-I390 HydrophobicContact CD2-CD1 3.82Å; W318-I390 HydrophobicContact CE3-CD1 3.47Å; W318-I390 VanDerWaalsContact CE3-CD1 3.47Å; W318-I390 HydrophobicContact CH2-CD1 3.78Å; W318-I390 HydrophobicContact CZ2-CD1 4.09Å; W318-I390 HydrophobicContact CZ3-CD1 3.44Å; W318-I390 VanDerWaalsContact CZ3-CD1 3.44Å
319	W	97.8	Very high	92.1	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-49.2	170.7	172.6	-82.5	0	0	0	110.3	I302 A303 P304 S315 C316 D317 L321 G322 V323 F335 V347 W350 C374	I302-W319 PolarHBondContact O-NE1 2.67Å; A303-W319 VanDerWaalsContact CA-CD1 3.46Å; A303-W319 HydrophobicContact CB-CB 3.63Å; A303-W319 HydrophobicContact CB-CD2 4.19Å; A303-W319 HydrophobicContact CB-CG 3.63Å; P304-W319 HydrophobicContact CG-CE3 4.37Å; P304-W319 HydrophobicContact CG-CH2 3.96Å; P304-W319 HydrophobicContact CG-CZ2 4.35Å; P304-W319 HydrophobicContact CG-CZ3 3.95Å; S315-W319 PolarHBondContact O-N 2.97Å; C316-W319 WeakPolarHBondContact O-CB 3.41Å; C316-W319 PolarHBondContact O-N 3.01Å; D317-W319 VanDerWaalsContact C-N 3.35Å; W319-L321 PolarHBondContact O-N 2.82Å; W319-G322 WeakPolarHBondContact O-CA 2.94Å; W319-G322 PolarHBondContact O-N 2.86Å; W319-V323 WeakPolarHBondContact O-CG2 3.38Å; W319-V323 PolarHBondContact O-N 2.86Å; W319-F335 HydrophobicContact CH2-CE2 4.31Å; W319-F335 HydrophobicContact CH2-CZ 4.16Å; W319-F335 HydrophobicContact CZ2-CD2 4.44Å; W319-F335 AromaticContact CZ2-CE2 3.46Å; W319-F335 HydrophobicContact CZ2-CE2 3.46Å; W319-F335 VanDerWaalsContact CZ2-CE2 3.46Å; W319-F335 AromaticContact CZ2-CZ 3.74Å; W319-F335 HydrophobicContact CZ2-CZ 3.74Å; W319-V347 HydrophobicContact CZ2-CG1 4.4Å; W319-W350 HydrophobicContact CH2-CB 3.67Å; W319-W350 AromaticContact CH2-CD1 3.91Å; W319-W350 HydrophobicContact CH2-CD2 4.13Å; W319-W350 AromaticContact CH2-CG 3.61Å; W319-W350 HydrophobicContact CH2-CG 3.61Å; W319-W350 HydrophobicContact CZ2-CB 4.36Å; W319-W350 HydrophobicContact CZ3-CD2 4.35Å; W319-W350 HydrophobicContact CZ3-CG 4.25Å; W319-C374 HydrophobicContact CE3-CB 4.23Å; W319-C374 HydrophobicContact CH2-CB 4.22Å; W319-C374 VanDerWaalsContact CZ3-C 3.41Å; W319-C374 HydrophobicContact CZ3-CB 4.03Å
320	S	97	Very high	93.1	Very high	4 Å²	4	16.2 Å²	16.2	3%	0.028	12%	0.117	C	C	.	.	H	α-helix	trans	-57.3	-40.4	178.7	-53.5	0	0	0	0	111.6	I226 Y301 C316 D317 G322 V323 I324	I226-S320 WeakPolarHBondContact O-CB 3.36Å; Y301-S320 WeakPolarHBondContact O-CB 3.46Å; Y301-S320 PolarHBondContact O-OG 3.45Å; C316-S320 PolarHBondContact O-N 3.01Å; C316-S320 PolarHBondContact O-OG 2.95Å; D317-S320 WeakPolarHBondContact O-CB 3.45Å; D317-S320 PolarHBondContact O-N 3Å; S320-G322 PolarHBondContact O-N 3.17Å; S320-V323 PolarHBondContact O-N 3.13Å; S320-I324 VanDerWaalsContact O-CG1 3.28Å; S320-I324 WeakPolarHBondContact O-CG1 3.41Å; S320-I324 PolarHBondContact O-N 3.2Å
321	L	98	Very high	94.2	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-58.4	-45.2	172.9	179.6	57.4	0	0	0	112.1	A206 T209 A210 D317 W318 W319 V323 I324 M325 F373	A206-L321 HydrophobicContact CB-CD1 4.26Å; T209-L321 HydrophobicContact CG2-CD1 3.78Å; A210-L321 HydrophobicContact CB-CD2 3.9Å; D317-L321 PolarHBondContact O-N 2.85Å; W318-L321 HydrophobicContact CE3-CD2 4.04Å; W318-L321 HydrophobicContact CZ3-CD2 4.23Å; W318-L321 PolarHBondContact O-N 2.91Å; W319-L321 PolarHBondContact O-N 2.82Å; L321-V323 VanDerWaalsContact C-N 3.35Å; L321-V323 PolarHBondContact O-N 3.06Å; L321-I324 PolarHBondContact O-N 3.18Å; L321-M325 HydrophobicContact CD1-CG 4.37Å; L321-M325 HydrophobicContact CG-SD 4.4Å; L321-M325 WeakPolarHBondContact O-CG 3.47Å; L321-M325 PolarHBondContact O-N 3.35Å; L321-F373 HydrophobicContact CD2-CE1 4.06Å; L321-F373 HydrophobicContact CD2-CE2 4.34Å; L321-F373 HydrophobicContact CD2-CZ 3.73Å; L321-F373 HydrophobicContact CG-CE2 4.45Å; L321-F373 HydrophobicContact CG-CZ 4.26Å
322	G	98.3	Very high	95	Very high	0 Å²	0	10.4 Å²	10.4	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-60.2	-40.7	175.1	0	0	0	0	0	113.8	W318 W319 S320 M325 Y326 F373	W318-G322 PolarHBondContact O-N 2.85Å; W318-G322 VanDerWaalsContact O-N 3.16Å; W319-G322 WeakPolarHBondContact O-CA 2.94Å; W319-G322 PolarHBondContact O-N 2.86Å; S320-G322 PolarHBondContact O-N 3.17Å; G322-M325 PolarHBondContact O-N 2.87Å; G322-Y326 PolarHBondContact O-N 3.17Å; G322-F373 VanDerWaalsContact CA-CB 3.49Å
323	V	98.3	Very high	95.6	Very high	0 Å²	0	6.1 Å²	6.1	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-63.3	-42.9	174.9	177.3	0	0	0	0	110.7	D300 Y301 W319 S320 L321 Y326 E327 P333 P334 F335	D300-V323 WeakPolarHBondContact O-CG1 3.26Å; Y301-V323 HydrophobicContact CD1-CB 4.01Å; Y301-V323 HydrophobicContact CD1-CG1 3.38Å; Y301-V323 HydrophobicContact CE1-CG1 3.81Å; Y301-V323 HydrophobicContact CG-CG1 4.15Å; W319-V323 WeakPolarHBondContact O-CG2 3.38Å; W319-V323 PolarHBondContact O-N 2.86Å; S320-V323 PolarHBondContact O-N 3.13Å; L321-V323 VanDerWaalsContact C-N 3.35Å; L321-V323 PolarHBondContact O-N 3.06Å; V323-Y326 PolarHBondContact O-N 3.13Å; V323-E327 WeakPolarHBondContact O-CB 3.43Å; V323-E327 PolarHBondContact O-N 2.97Å; V323-P333 HydrophobicContact CG1-CB 3.77Å; V323-P334 HydrophobicContact CG1-CG 4.37Å; V323-P334 HydrophobicContact CG2-CG 4.48Å; V323-F335 HydrophobicContact CG2-CE2 4.14Å
324	I	98	Very high	95.9	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-64.6	-42.9	176.6	-68.1	172.1	0	0	0	111	I226 P228 L231 Y301 S320 L321 Y326 E327 M328	I226-I324 HydrophobicContact CG2-CD1 3.63Å; P228-I324 HydrophobicContact CG-CD1 4.48Å; P228-I324 HydrophobicContact CG-CG1 4.07Å; P228-I324 HydrophobicContact CG-CG2 4.35Å; L231-I324 HydrophobicContact CD1-CD1 3.95Å; L231-I324 HydrophobicContact CD1-CG2 4.37Å; Y301-I324 HydrophobicContact CD1-CG1 3.83Å; Y301-I324 HydrophobicContact CE1-CG1 3.91Å; S320-I324 VanDerWaalsContact O-CG1 3.28Å; S320-I324 WeakPolarHBondContact O-CG1 3.41Å; S320-I324 PolarHBondContact O-N 3.2Å; L321-I324 PolarHBondContact O-N 3.18Å; I324-Y326 PolarHBondContact O-N 3.39Å; I324-E327 WeakPolarHBondContact O-CB 3.43Å; I324-E327 PolarHBondContact O-N 3.17Å; I324-E327 VanDerWaalsContact O-N 3.15Å; I324-M328 HydrophobicContact CG2-CE 3.54Å; I324-M328 HydrophobicContact CG2-CG 4.35Å; I324-M328 HydrophobicContact CG2-SD 4.1Å; I324-M328 WeakPolarHBondContact O-CG 3.36Å; I324-M328 PolarHBondContact O-N 3.19Å
325	M	98.2	Very high	96.1	Very high	0 Å²	0	1.6 Å²	1.6	0%	0	1%	0.01	C	C	.	.	H	α-helix	trans	-60.6	-44.3	176.1	-73.6	179.8	70.6	0	0	111.9	A206 L321 G322 E327 M328 L329 V369 I370 F373 F395 F396	A206-M325 HydrophobicContact CB-CE 4.11Å; A206-M325 HydrophobicContact CB-CG 3.69Å; A206-M325 HydrophobicContact CB-SD 3.76Å; L321-M325 HydrophobicContact CD1-CG 4.37Å; L321-M325 HydrophobicContact CG-SD 4.4Å; L321-M325 WeakPolarHBondContact O-CG 3.47Å; L321-M325 PolarHBondContact O-N 3.35Å; G322-M325 PolarHBondContact O-N 2.87Å; M325-E327 VanDerWaalsContact C-N 3.28Å; M325-E327 PolarHBondContact O-N 3.16Å; M325-M328 PolarHBondContact O-N 2.96Å; M325-L329 WeakPolarHBondContact O-CG 3.43Å; M325-L329 PolarHBondContact O-N 3.43Å; M325-V369 HydrophobicContact CE-CG1 3.55Å; M325-V369 HydrophobicContact CE-CG2 4.47Å; M325-I370 HydrophobicContact CB-CD1 4.36Å; M325-I370 HydrophobicContact CB-CG1 3.99Å; M325-F373 HydrophobicContact SD-CD2 3.77Å; M325-F373 HydrophobicContact SD-CE2 3.46Å; M325-F373 WeakPolarHBondContact SD-CE2 3.38Å; M325-F395 HydrophobicContact CE-CD1 3.67Å; M325-F395 HydrophobicContact CE-CE1 3.35Å; M325-F395 HydrophobicContact CE-CZ 4.1Å; M325-F396 HydrophobicContact CE-CZ 4.25Å; M325-F396 HydrophobicContact SD-CZ 4.44Å
326	Y	98.1	Very high	96	Very high	1 Å²	1	2 Å²	2	0%	0.004	1%	0.012	C	C	.	.	H	α-helix	trans	-57.8	-46.4	173.6	-179	-74.6	0	0	0	110.4	G322 V323 I324 M328 L329 I330 Y332 P334 L354 V355 F356 I370	G322-Y326 PolarHBondContact O-N 3.17Å; V323-Y326 PolarHBondContact O-N 3.13Å; I324-Y326 PolarHBondContact O-N 3.39Å; Y326-M328 PolarHBondContact O-N 3.48Å; Y326-L329 PolarHBondContact O-N 3.37Å; Y326-I330 HydrophobicContact CD1-CB 3.9Å; Y326-I330 HydrophobicContact CD1-CG1 3.91Å; Y326-I330 HydrophobicContact CD1-CG2 4.46Å; Y326-I330 HydrophobicContact CD2-CG1 4.14Å; Y326-I330 HydrophobicContact CE1-CB 3.56Å; Y326-I330 HydrophobicContact CE1-CG1 3.72Å; Y326-I330 HydrophobicContact CE1-CG2 3.63Å; Y326-I330 HydrophobicContact CE2-CG1 3.96Å; Y326-I330 HydrophobicContact CG-CG1 4.12Å; Y326-I330 VanDerWaalsContact O-CB 3.23Å; Y326-I330 WeakPolarHBondContact O-CB 3.46Å; Y326-I330 VanDerWaalsContact O-CG1 3.29Å; Y326-I330 WeakPolarHBondContact O-CG1 3.27Å; Y326-I330 PolarHBondContact O-N 3.41Å; Y326-Y332 WeakPolarHBondContact CD1-O 3.27Å; Y326-Y332 HydrophobicContact CE1-CD2 4.38Å; Y326-Y332 HydrophobicContact CE1-CE2 4.18Å; Y326-Y332 WeakPolarHBondContact CE1-O 3.37Å; Y326-P334 HydrophobicContact CD1-CB 3.91Å; Y326-P334 HydrophobicContact CD1-CG 4.12Å; Y326-P334 HydrophobicContact CD2-CB 3.95Å; Y326-P334 HydrophobicContact CD2-CG 4.39Å; Y326-P334 HydrophobicContact CE1-CB 3.91Å; Y326-P334 HydrophobicContact CE2-CB 3.95Å; Y326-P334 HydrophobicContact CG-CB 3.94Å; Y326-P334 HydrophobicContact CG-CG 4.02Å; Y326-L354 HydrophobicContact CD2-CD1 4.17Å; Y326-L354 HydrophobicContact CE2-CD1 4.33Å; Y326-V355 PolarHBondContact OH-O 2.79Å; Y326-F356 HydrophobicContact CD2-CD1 4.14Å; Y326-F356 AromaticContact CD2-CE1 3.77Å; Y326-F356 HydrophobicContact CD2-CE1 3.77Å; Y326-F356 HydrophobicContact CD2-CZ 4.39Å; Y326-F356 AromaticContact CE2-CD1 3.87Å; Y326-F356 HydrophobicContact CE2-CD1 3.87Å; Y326-F356 AromaticContact CE2-CE1 3.95Å; Y326-F356 HydrophobicContact CE2-CE1 3.95Å; Y326-I370 HydrophobicContact CD2-CG2 4.28Å
327	E	96.8	Very high	95.7	Very high	1 Å²	1	2.9 Å²	2.9	1%	0.005	2%	0.018	C	C	.	.	H	α-helix	trans	-63.9	-40.9	180	177.5	169.3	-145.1	0	0	113.3	L191 P228 W284 R288 Y301 V323 I324 M325 L329 G331 Y332	L191-E327 HydrophobicContact CD1-CG 4.21Å; P228-E327 WeakPolarHBondContact CG-OE2 3.34Å; W284-E327 PolarHBondContact NE1-OE1 2.89Å; R288-E327 IonicContact CZ-OE1 2.72Å; R288-E327 IonicContact CZ-OE2 2.78Å; R288-E327 IonicContact NE-OE1 3.91Å; R288-E327 IonicContact NH1-OE1 2.95Å; R288-E327 PolarHBondContact NH1-OE1 3.44Å; R288-E327 IonicContact NH1-OE2 3.32Å; R288-E327 IonicContact NH2-OE1 3.09Å; R288-E327 PolarHBondContact NH2-OE1 3.3Å; R288-E327 IonicContact NH2-OE2 2.73Å; R288-E327 PolarHBondContact NH2-OE2 3.35Å; Y301-E327 WeakPolarHBondContact CE1-OE2 2.91Å; Y301-E327 PolarHBondContact OH-OE1 2.96Å; Y301-E327 PolarHBondContact OH-OE2 3.05Å; V323-E327 WeakPolarHBondContact O-CB 3.43Å; V323-E327 PolarHBondContact O-N 2.97Å; I324-E327 WeakPolarHBondContact O-CB 3.43Å; I324-E327 PolarHBondContact O-N 3.17Å; I324-E327 VanDerWaalsContact O-N 3.15Å; M325-E327 VanDerWaalsContact C-N 3.28Å; M325-E327 PolarHBondContact O-N 3.16Å; E327-L329 VanDerWaalsContact C-N 3.25Å; E327-L329 PolarHBondContact O-N 3.06Å; E327-G331 VanDerWaalsContact O-CA 3.22Å; E327-G331 WeakPolarHBondContact O-CA 3.48Å; E327-G331 PolarHBondContact O-N 3.5Å; E327-Y332 WeakPolarHBondContact CA-O 3.39Å
328	M	97.2	Very high	95.1	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-57.1	-41.9	175	-73.3	171	172.8	0	0	111.1	M187 L191 T196 L197 A202 I324 M325 Y326	M187-M328 HydrophobicContact CE-CE 3.98Å; M187-M328 HydrophobicContact CG-CE 3.99Å; M187-M328 HydrophobicContact SD-CE 3.86Å; L191-M328 HydrophobicContact CD1-CG 4.46Å; L191-M328 HydrophobicContact CD2-CB 4.47Å; L191-M328 HydrophobicContact CD2-CG 4.1Å; T196-M328 CarbonylContact C-O 3.39Å; T196-M328 WeakPolarHBondContact CA-O 3.41Å; L197-M328 HydrophobicContact CB-CB 4.31Å; L197-M328 HydrophobicContact CD1-CB 4.08Å; L197-M328 HydrophobicContact CD1-CG 3.82Å; L197-M328 HydrophobicContact CD1-SD 4.13Å; L197-M328 HydrophobicContact CG-CB 4.24Å; L197-M328 HydrophobicContact CG-CG 4.41Å; L197-M328 PolarHBondContact N-O 2.88Å; A202-M328 HydrophobicContact CB-CB 4.16Å; A202-M328 HydrophobicContact CB-SD 4.36Å; I324-M328 HydrophobicContact CG2-CE 3.54Å; I324-M328 HydrophobicContact CG2-CG 4.35Å; I324-M328 HydrophobicContact CG2-SD 4.1Å; I324-M328 WeakPolarHBondContact O-CG 3.36Å; I324-M328 PolarHBondContact O-N 3.19Å; M325-M328 PolarHBondContact O-N 2.96Å; Y326-M328 PolarHBondContact O-N 3.48Å
329	L	96.8	Very high	94.5	Very high	11 Å²	11	10.6 Å²	10.6	6%	0.058	6%	0.062	C	C	.	.	H	α-helix	trans	-87	-29.6	-174.4	-63.6	176.5	0	0	0	113.9	E199 A202 M325 Y326 E327 I362 A366 I370	E199-L329 HydrophobicContact CB-CD2 4.49Å; E199-L329 HydrophobicContact CG-CD2 3.84Å; A202-L329 HydrophobicContact CB-CD2 3.61Å; A202-L329 HydrophobicContact CB-CG 4.11Å; M325-L329 WeakPolarHBondContact O-CG 3.43Å; M325-L329 PolarHBondContact O-N 3.43Å; Y326-L329 PolarHBondContact O-N 3.37Å; E327-L329 VanDerWaalsContact C-N 3.25Å; E327-L329 PolarHBondContact O-N 3.06Å; L329-I362 HydrophobicContact CB-CD1 4.22Å; L329-I362 HydrophobicContact CD1-CD1 3.75Å; L329-I362 HydrophobicContact CD1-CG1 4.23Å; L329-A366 HydrophobicContact CD1-CB 3.79Å; L329-I370 HydrophobicContact CD1-CD1 4.1Å
330	I	94.9	Very high	94	Very high	4 Å²	4	11.7 Å²	11.7	2%	0.021	7%	0.069	C	C	.	.	H	α-helix	trans	-107.5	-23.8	-172.4	-54.4	-60.2	0	0	0	112.3	Y326 Y332 P357 M360 I362	Y326-I330 HydrophobicContact CD1-CB 3.9Å; Y326-I330 HydrophobicContact CD1-CG1 3.91Å; Y326-I330 HydrophobicContact CD1-CG2 4.46Å; Y326-I330 HydrophobicContact CD2-CG1 4.14Å; Y326-I330 HydrophobicContact CE1-CB 3.56Å; Y326-I330 HydrophobicContact CE1-CG1 3.72Å; Y326-I330 HydrophobicContact CE1-CG2 3.63Å; Y326-I330 HydrophobicContact CE2-CG1 3.96Å; Y326-I330 HydrophobicContact CG-CG1 4.12Å; Y326-I330 VanDerWaalsContact O-CB 3.23Å; Y326-I330 WeakPolarHBondContact O-CB 3.46Å; Y326-I330 VanDerWaalsContact O-CG1 3.29Å; Y326-I330 WeakPolarHBondContact O-CG1 3.27Å; Y326-I330 PolarHBondContact O-N 3.41Å; I330-Y332 HydrophobicContact CG2-CD1 4.05Å; I330-Y332 HydrophobicContact CG2-CE1 3.52Å; I330-Y332 HydrophobicContact CG2-CE2 4.37Å; I330-P357 HydrophobicContact CG2-CG 4.13Å; I330-M360 HydrophobicContact CD1-CB 3.88Å; I330-M360 HydrophobicContact CD1-CG 4.29Å; I330-M360 HydrophobicContact CG2-CG 4.44Å; I330-I362 HydrophobicContact CD1-CD1 4.28Å; I330-I362 HydrophobicContact CD1-CG2 4.24Å
331	G	93	Very high	93.6	Very high	4 Å²	4	14.4 Å²	14.4	4%	0.041	8%	0.081	C	C	.	.	S	Bend	trans	95.2	-0.9	177	0	0	0	0	0	115.5	D195 E327	D195-G331 WeakPolarHBondContact O-CA 3.5Å; E327-G331 VanDerWaalsContact O-CA 3.22Å; E327-G331 WeakPolarHBondContact O-CA 3.48Å; E327-G331 PolarHBondContact O-N 3.5Å
332	Y	93.3	Very high	93.2	Very high	3 Å²	3	16.5 Å²	16.5	1%	0.012	9%	0.091	C	C	.	.	S	Bend	trans	-154.8	154.8	173.9	59.2	-87.9	0	0	0	109.6	S277 R280 A281 Y326 E327 I330 C336 P357	S277-Y332 WeakPolarHBondContact CA-OH 2.81Å; S277-Y332 WeakPolarHBondContact CB-OH 3.41Å; S277-Y332 WeakPolarHBondContact O-CE1 3.34Å; R280-Y332 HydrophobicContact CB-CD1 4.13Å; R280-Y332 HydrophobicContact CB-CD2 4.12Å; R280-Y332 HydrophobicContact CB-CE1 4.01Å; R280-Y332 HydrophobicContact CB-CE2 4.03Å; R280-Y332 HydrophobicContact CB-CG 4.18Å; A281-Y332 HydrophobicContact CB-CD1 3.85Å; A281-Y332 HydrophobicContact CB-CE1 4.44Å; Y326-Y332 WeakPolarHBondContact CD1-O 3.27Å; Y326-Y332 HydrophobicContact CE1-CD2 4.38Å; Y326-Y332 HydrophobicContact CE1-CE2 4.18Å; Y326-Y332 WeakPolarHBondContact CE1-O 3.37Å; E327-Y332 WeakPolarHBondContact CA-O 3.39Å; I330-Y332 HydrophobicContact CG2-CD1 4.05Å; I330-Y332 HydrophobicContact CG2-CE1 3.52Å; I330-Y332 HydrophobicContact CG2-CE2 4.37Å; Y332-C336 VanDerWaalsContact CD2-SG 3.52Å; Y332-P357 WeakPolarHBondContact OH-CG 2.96Å
333	P	95.4	Very high	92.9	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.			trans	-72.8	148.8	179	26.3	-27.5	0	0	0	111.1	W284 D300 Y301 V323 F335 C336	W284-P333 HydrophobicContact CD2-CG 4.17Å; W284-P333 HydrophobicContact CE3-CG 4.19Å; W284-P333 HydrophobicContact CH2-CG 3.42Å; W284-P333 VanDerWaalsContact CH2-CG 3.42Å; W284-P333 VanDerWaalsContact CZ2-CD 3.42Å; W284-P333 HydrophobicContact CZ2-CG 3.38Å; W284-P333 HydrophobicContact CZ3-CG 3.83Å; D300-P333 HydrophobicContact CB-CB 4.23Å; D300-P333 HydrophobicContact CB-CG 4.01Å; Y301-P333 HydrophobicContact CE1-CB 4.43Å; V323-P333 HydrophobicContact CG1-CB 3.77Å; P333-F335 PolarHBondContact O-N 3.31Å; P333-C336 HydrophobicContact CG-CB 4Å; P333-C336 PolarHBondContact O-N 3.11Å; P333-C336 VanDerWaalsContact O-N 3.16Å
334	P	94.7	Very high	92.5	Very high	2 Å²	2	17.2 Å²	17.2	1%	0.013	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-30.3	-168.4	21.5	-32.4	0	0	0	113.9	V323 Y326 L354	V323-P334 HydrophobicContact CG1-CG 4.37Å; V323-P334 HydrophobicContact CG2-CG 4.48Å; Y326-P334 HydrophobicContact CD1-CB 3.91Å; Y326-P334 HydrophobicContact CD1-CG 4.12Å; Y326-P334 HydrophobicContact CD2-CB 3.95Å; Y326-P334 HydrophobicContact CD2-CG 4.39Å; Y326-P334 HydrophobicContact CE1-CB 3.91Å; Y326-P334 HydrophobicContact CE2-CB 3.95Å; Y326-P334 HydrophobicContact CG-CB 3.94Å; Y326-P334 HydrophobicContact CG-CG 4.02Å; P334-L354 HydrophobicContact CB-CD1 3.53Å; P334-L354 HydrophobicContact CG-CD1 4.02Å
335	F	93.9	Very high	92.2	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.4	8.4	-173.1	-47.1	-60.2	0	0	0	113.7	W319 V323 P333 S337 T343 K346 V347 W350 L354	W319-F335 HydrophobicContact CH2-CE2 4.31Å; W319-F335 HydrophobicContact CH2-CZ 4.16Å; W319-F335 HydrophobicContact CZ2-CD2 4.44Å; W319-F335 AromaticContact CZ2-CE2 3.46Å; W319-F335 HydrophobicContact CZ2-CE2 3.46Å; W319-F335 VanDerWaalsContact CZ2-CE2 3.46Å; W319-F335 AromaticContact CZ2-CZ 3.74Å; W319-F335 HydrophobicContact CZ2-CZ 3.74Å; V323-F335 HydrophobicContact CG2-CE2 4.14Å; P333-F335 PolarHBondContact O-N 3.31Å; F335-S337 PolarHBondContact O-N 3.17Å; F335-T343 HydrophobicContact CB-CG2 4.43Å; F335-T343 WeakPolarHBondContact O-CG2 3.21Å; F335-K346 HydrophobicContact CB-CB 3.91Å; F335-K346 HydrophobicContact CD1-CB 4.15Å; F335-K346 HydrophobicContact CG-CB 4.45Å; F335-K346 WeakPolarHBondContact O-CD 3.44Å; F335-V347 HydrophobicContact CB-CG2 3.78Å; F335-V347 HydrophobicContact CD2-CG2 3.72Å; F335-V347 HydrophobicContact CG-CG2 3.8Å; F335-W350 HydrophobicContact CE1-CB 3.91Å; F335-W350 HydrophobicContact CZ-CB 3.91Å; F335-L354 HydrophobicContact CE1-CB 4.1Å; F335-L354 HydrophobicContact CZ-CB 4.35Å; F335-L354 HydrophobicContact CZ-CD1 4.3Å
336	C	90.7	Very high	91.9	Very high	10 Å²	10	19.4 Å²	19.4	7%	0.068	10%	0.103	C	C	.	.			trans	-59.4	139.8	-175.3	72.8	0	0	0	0	112.5	W284 D300 Y332 P333 K346	W284-C336 HydrophobicContact CD2-CB 4.46Å; W284-C336 HydrophobicContact CE3-CB 3.64Å; W284-C336 HydrophobicContact CZ3-CB 3.82Å; D300-C336 VanDerWaalsContact OD1-CA 3.26Å; D300-C336 WeakPolarHBondContact OD1-CA 3.13Å; Y332-C336 VanDerWaalsContact CD2-SG 3.52Å; P333-C336 HydrophobicContact CG-CB 4Å; P333-C336 PolarHBondContact O-N 3.11Å; P333-C336 VanDerWaalsContact O-N 3.16Å; C336-K346 PolarHBondContact O-NZ 3.46Å
337	S	86.9	Confident	91.7	Very high	20 Å²	20	19.3 Å²	19.3	14%	0.14	10%	0.103	C	C	.	.			trans	-143.4	170.3	173.4	-75.7	0	0	0	0	110.6	D269 F335 T339 E342 T343 K346	D269-S337 PolarHBondContact OD2-OG 2.76Å; F335-S337 PolarHBondContact O-N 3.17Å; S337-T339 PolarHBondContact O-N 3.23Å; S337-E342 VanDerWaalsContact CB-CB 3.47Å; S337-E342 WeakPolarHBondContact OG-CB 3.5Å; S337-T343 PolarHBondContact N-OG1 3.23Å; S337-K346 WeakPolarHBondContact OG-CE 3Å; S337-K346 PolarHBondContact OG-NZ 2.72Å
338	D	82.1	Confident	91.4	Very high	114 Å²	114	21.4 Å²	21.4	61%	0.61	11%	0.114	S	C	*	.	S	Bend	trans	-66.9	-26.8	175	-65.8	-31.3	0	0	0	111.7
339	T	85.8	Confident	91.2	Very high	49 Å²	49	22.5 Å²	22.5	30%	0.301	12%	0.121	S	C	.	.	S	Bend	trans	-120.5	146.6	179.2	69.1	0	0	0	0	113.4	S337 Q341 E342 T343	S337-T339 PolarHBondContact O-N 3.23Å; T339-Q341 PolarHBondContact O-N 3.33Å; T339-E342 PolarHBondContact N-OE2 2.69Å; T339-E342 PolarHBondContact O-N 3.12Å; T339-E342 WeakPolarHBondContact OG1-CB 3.38Å; T339-E342 VanDerWaalsContact OG1-CD 3.26Å; T339-E342 WeakPolarHBondContact OG1-CG 3.12Å; T339-E342 PolarHBondContact OG1-N 3.1Å; T339-E342 PolarHBondContact OG1-OE2 3.37Å; T339-T343 PolarHBondContact O-N 2.87Å; T339-T343 VanDerWaalsContact O-N 3.09Å; T339-T343 PolarHBondContact O-OG1 3.34Å
340	P	86.9	Confident	91.1	Very high	22 Å²	22	23.7 Å²	23.7	14%	0.143	13%	0.125	C	C	.	.	H	α-helix	trans	-60.4	-27.7	172.8	-23	32.4	0	0	0	113.6	A253 F258 Y259 V296 G297 T298 Y344	A253-P340 HydrophobicContact CB-CB 3.86Å; F258-P340 HydrophobicContact CE1-CB 4.2Å; Y259-P340 WeakPolarHBondContact CE1-O 3.49Å; Y259-P340 PolarHBondContact OH-O 3.37Å; V296-P340 HydrophobicContact CG1-CG 4.19Å; G297-P340 WeakPolarHBondContact O-CG 3.45Å; T298-P340 HydrophobicContact CG2-CG 4.23Å; P340-Y344 WeakPolarHBondContact O-CB 2.84Å; P340-Y344 PolarHBondContact O-N 3.05Å
341	Q	88.1	Confident	91	Very high	62 Å²	62	29.5 Å²	29.5	29%	0.29	15%	0.152	S	C	.	.	H	α-helix	trans	-70.5	-43.2	178.2	-69.8	82.5	-1.2	0	0	112.3	F258 Y259 L262 T339 Y344 K345	F258-Q341 HydrophobicContact CE1-CG 4.49Å; F258-Q341 VanDerWaalsContact CZ-NE2 3.29Å; Y259-Q341 HydrophobicContact CE1-CG 4.46Å; L262-Q341 HydrophobicContact CD1-CB 4.24Å; L262-Q341 HydrophobicContact CD1-CG 3.97Å; L262-Q341 HydrophobicContact CD2-CB 3.84Å; L262-Q341 HydrophobicContact CD2-CG 4.21Å; T339-Q341 PolarHBondContact O-N 3.33Å; Q341-Y344 PolarHBondContact O-N 3.46Å; Q341-K345 WeakPolarHBondContact O-CG 3.34Å; Q341-K345 PolarHBondContact O-N 2.87Å
342	E	89.4	Confident	90.9	Very high	43 Å²	43	33.8 Å²	33.8	20%	0.201	17%	0.171	C	C	.	.	H	α-helix	trans	-68.4	-41.5	174.4	-71.8	165.3	148.5	0	0	111.1	P267 S337 T339 Y344 K345 K346	P267-E342 HydrophobicContact CB-CB 4.35Å; P267-E342 HydrophobicContact CB-CG 4.37Å; S337-E342 VanDerWaalsContact CB-CB 3.47Å; S337-E342 WeakPolarHBondContact OG-CB 3.5Å; T339-E342 PolarHBondContact N-OE2 2.69Å; T339-E342 PolarHBondContact O-N 3.12Å; T339-E342 WeakPolarHBondContact OG1-CB 3.38Å; T339-E342 VanDerWaalsContact OG1-CD 3.26Å; T339-E342 WeakPolarHBondContact OG1-CG 3.12Å; T339-E342 PolarHBondContact OG1-N 3.1Å; T339-E342 PolarHBondContact OG1-OE2 3.37Å; E342-Y344 VanDerWaalsContact C-N 3.3Å; E342-Y344 PolarHBondContact O-N 2.98Å; E342-K345 PolarHBondContact O-N 3.34Å; E342-K345 VanDerWaalsContact O-N 3.14Å; E342-K346 WeakPolarHBondContact O-CG 3.37Å; E342-K346 PolarHBondContact O-N 2.92Å
343	T	91.3	Very high	90.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-55.7	-48.1	174.4	-51.6	0	0	0	0	110.2	P299 D300 F335 S337 T339 K345 K346 V347	P299-T343 HydrophobicContact CG-CG2 3.73Å; D300-T343 HydrophobicContact CB-CG2 4.46Å; D300-T343 WeakPolarHBondContact OD1-CG2 3.22Å; F335-T343 HydrophobicContact CB-CG2 4.43Å; F335-T343 WeakPolarHBondContact O-CG2 3.21Å; S337-T343 PolarHBondContact N-OG1 3.23Å; T339-T343 PolarHBondContact O-N 2.87Å; T339-T343 VanDerWaalsContact O-N 3.09Å; T339-T343 PolarHBondContact O-OG1 3.34Å; T343-K345 PolarHBondContact O-N 3.42Å; T343-K346 WeakPolarHBondContact O-CB 3.42Å; T343-K346 PolarHBondContact O-N 3Å; T343-K346 VanDerWaalsContact O-N 3.15Å; T343-V347 WeakPolarHBondContact O-CG2 3.13Å; T343-V347 PolarHBondContact O-N 2.85Å
344	Y	90.8	Very high	90.9	Very high	16 Å²	16	34.8 Å²	34.8	6%	0.063	18%	0.176	C	C	.	.	H	α-helix	trans	-58.1	-46.1	175.4	172.3	-100.2	0	0	0	113	Y259 L262 F307 P340 Q341 E342 K346 V347 L348	Y259-Y344 AromaticContact CD1-CD1 3.6Å; Y259-Y344 HydrophobicContact CD1-CD1 3.6Å; Y259-Y344 AromaticContact CD1-CD2 3.99Å; Y259-Y344 HydrophobicContact CD1-CD2 3.99Å; Y259-Y344 HydrophobicContact CD1-CE1 4.12Å; Y259-Y344 HydrophobicContact CD1-CE2 4.46Å; Y259-Y344 AromaticContact CD1-CG 3.5Å; Y259-Y344 HydrophobicContact CD1-CG 3.5Å; Y259-Y344 HydrophobicContact CD2-CD1 4.43Å; Y259-Y344 AromaticContact CD2-CD2 3.48Å; Y259-Y344 HydrophobicContact CD2-CD2 3.48Å; Y259-Y344 VanDerWaalsContact CD2-CD2 3.48Å; Y259-Y344 AromaticContact CD2-CE2 3.58Å; Y259-Y344 HydrophobicContact CD2-CE2 3.58Å; Y259-Y344 AromaticContact CD2-CG 3.91Å; Y259-Y344 HydrophobicContact CD2-CG 3.91Å; Y259-Y344 HydrophobicContact CE1-CD1 4.14Å; Y259-Y344 HydrophobicContact CE1-CD2 4.09Å; Y259-Y344 AromaticContact CE1-CG 3.61Å; Y259-Y344 HydrophobicContact CE1-CG 3.61Å; Y259-Y344 AromaticContact CE2-CD2 3.6Å; Y259-Y344 HydrophobicContact CE2-CD2 3.6Å; Y259-Y344 HydrophobicContact CE2-CE2 4.14Å; Y259-Y344 HydrophobicContact CE2-CG 4.01Å; Y259-Y344 AromaticContact CG-CD1 3.75Å; Y259-Y344 HydrophobicContact CG-CD1 3.75Å; Y259-Y344 AromaticContact CG-CD2 3.66Å; Y259-Y344 HydrophobicContact CG-CD2 3.66Å; Y259-Y344 AromaticContact CG-CE1 3.84Å; Y259-Y344 HydrophobicContact CG-CE1 3.84Å; Y259-Y344 AromaticContact CG-CE2 3.75Å; Y259-Y344 HydrophobicContact CG-CE2 3.75Å; Y259-Y344 AromaticContact CG-CG 3.64Å; Y259-Y344 HydrophobicContact CG-CG 3.64Å; Y259-Y344 AromaticContact CG-CZ 3.82Å; Y259-Y344 AromaticContact CZ-CD2 3.9Å; Y259-Y344 AromaticContact CZ-CG 3.86Å; L262-Y344 HydrophobicContact CD2-CD1 4.01Å; F307-Y344 HydrophobicContact CB-CE2 3.88Å; F307-Y344 HydrophobicContact CD1-CD2 4.21Å; F307-Y344 AromaticContact CD1-CE2 3.79Å; F307-Y344 HydrophobicContact CD1-CE2 3.79Å; F307-Y344 HydrophobicContact CD2-CD2 4.08Å; F307-Y344 AromaticContact CD2-CE2 3.86Å; F307-Y344 HydrophobicContact CD2-CE2 3.86Å; F307-Y344 HydrophobicContact CE1-CD2 4.25Å; F307-Y344 HydrophobicContact CE1-CE2 4.28Å; F307-Y344 HydrophobicContact CE2-CD2 4.11Å; F307-Y344 HydrophobicContact CE2-CE2 4.34Å; F307-Y344 HydrophobicContact CG-CD2 4.14Å; F307-Y344 AromaticContact CG-CE2 3.56Å; F307-Y344 HydrophobicContact CG-CE2 3.56Å; F307-Y344 HydrophobicContact CZ-CD2 4.2Å; P340-Y344 WeakPolarHBondContact O-CB 2.84Å; P340-Y344 PolarHBondContact O-N 3.05Å; Q341-Y344 PolarHBondContact O-N 3.46Å; E342-Y344 VanDerWaalsContact C-N 3.3Å; E342-Y344 PolarHBondContact O-N 2.98Å; Y344-K346 VanDerWaalsContact C-N 3.29Å; Y344-K346 PolarHBondContact O-N 3.38Å; Y344-V347 PolarHBondContact O-N 3.38Å; Y344-L348 HydrophobicContact CD1-CD1 4.2Å; Y344-L348 HydrophobicContact CE1-CD1 3.48Å; Y344-L348 VanDerWaalsContact CE1-CD1 3.48Å; Y344-L348 HydrophobicContact CE1-CG 4.24Å; Y344-L348 HydrophobicContact CE2-CD1 4.12Å; Y344-L348 HydrophobicContact CE2-CD2 4.48Å; Y344-L348 HydrophobicContact CE2-CG 4.22Å; Y344-L348 VanDerWaalsContact CZ-CD1 3.45Å; Y344-L348 PolarHBondContact O-N 2.83Å
345	K	91.2	Very high	90.9	Very high	43 Å²	43	36.2 Å²	36.2	19%	0.187	19%	0.185	C	C	.	.	H	α-helix	trans	-60.8	-39.4	175.4	-73	-179	177.2	-163.4	0	111.8	L262 S263 P267 Q341 E342 T343 L348 C349	L262-K345 HydrophobicContact CD2-CD 4.24Å; L262-K345 VanDerWaalsContact CD2-CE 3.49Å; L262-K345 HydrophobicContact CD2-CG 3.98Å; S263-K345 WeakPolarHBondContact O-CE 3.49Å; S263-K345 PolarHBondContact O-NZ 2.79Å; P267-K345 HydrophobicContact CB-CB 3.96Å; P267-K345 HydrophobicContact CB-CD 4.19Å; P267-K345 HydrophobicContact CG-CB 3.89Å; Q341-K345 WeakPolarHBondContact O-CG 3.34Å; Q341-K345 PolarHBondContact O-N 2.87Å; E342-K345 PolarHBondContact O-N 3.34Å; E342-K345 VanDerWaalsContact O-N 3.14Å; T343-K345 PolarHBondContact O-N 3.42Å; K345-L348 PolarHBondContact O-N 3.46Å; K345-C349 WeakPolarHBondContact O-CB 3.46Å; K345-C349 PolarHBondContact O-N 2.83Å; K345-C349 PolarHBondContact O-SG 2.83Å
346	K	92.7	Very high	90.9	Very high	2 Å²	2	37.4 Å²	37.4	1%	0.009	19%	0.19	C	C	.	.	H	α-helix	trans	-63	-46.2	175.5	-72.2	-177.1	-178.5	165.8	0	111.3	P267 D269 F335 C336 S337 E342 T343 Y344 L348 C349 W350 T353	P267-K346 HydrophobicContact CG-CB 4.47Å; P267-K346 HydrophobicContact CG-CD 4.48Å; P267-K346 HydrophobicContact CG-CG 3.44Å; P267-K346 VanDerWaalsContact CG-CG 3.44Å; D269-K346 WeakPolarHBondContact OD1-CE 3.32Å; D269-K346 IonicContact OD1-NZ 3.3Å; D269-K346 WeakPolarHBondContact OD2-CE 3.36Å; D269-K346 IonicContact OD2-NZ 3.33Å; D269-K346 PolarHBondContact OD2-NZ 3.07Å; F335-K346 HydrophobicContact CB-CB 3.91Å; F335-K346 HydrophobicContact CD1-CB 4.15Å; F335-K346 HydrophobicContact CG-CB 4.45Å; F335-K346 WeakPolarHBondContact O-CD 3.44Å; C336-K346 PolarHBondContact O-NZ 3.46Å; S337-K346 WeakPolarHBondContact OG-CE 3Å; S337-K346 PolarHBondContact OG-NZ 2.72Å; E342-K346 WeakPolarHBondContact O-CG 3.37Å; E342-K346 PolarHBondContact O-N 2.92Å; T343-K346 WeakPolarHBondContact O-CB 3.42Å; T343-K346 PolarHBondContact O-N 3Å; T343-K346 VanDerWaalsContact O-N 3.15Å; Y344-K346 VanDerWaalsContact C-N 3.29Å; Y344-K346 PolarHBondContact O-N 3.38Å; K346-L348 PolarHBondContact O-N 3.18Å; K346-C349 CarbonylContact O-C 3.56Å; K346-C349 PolarHBondContact O-N 2.79Å; K346-W350 PolarHBondContact O-N 2.83Å; K346-W350 VanDerWaalsContact O-N 3.12Å; K346-T353 HydrophobicContact CB-CG2 4.21Å; K346-T353 HydrophobicContact CG-CG2 4.15Å; K346-T353 PolarHBondContact O-OG1 2.94Å
347	V	93.3	Very high	90.9	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-60	-44.8	177.4	171.3	0	0	0	0	111.6	P304 F307 W319 F335 T343 Y344 C349 W350	P304-V347 HydrophobicContact CB-CG1 4.12Å; F307-V347 HydrophobicContact CE2-CG1 4.47Å; W319-V347 HydrophobicContact CZ2-CG1 4.4Å; F335-V347 HydrophobicContact CB-CG2 3.78Å; F335-V347 HydrophobicContact CD2-CG2 3.72Å; F335-V347 HydrophobicContact CG-CG2 3.8Å; T343-V347 WeakPolarHBondContact O-CG2 3.13Å; T343-V347 PolarHBondContact O-N 2.85Å; Y344-V347 PolarHBondContact O-N 3.38Å; V347-C349 VanDerWaalsContact C-N 3.29Å; V347-C349 PolarHBondContact O-N 2.71Å; V347-W350 WeakPolarHBondContact O-CB 3.39Å; V347-W350 PolarHBondContact O-N 2.82Å
348	L	91.8	Very high	91	Very high	45 Å²	45	40.9 Å²	40.9	24%	0.236	21%	0.212	C	C	.	.	H	α-helix	trans	-66.2	-30.8	176.6	-69.9	-172.9	0	0	0	113.3	P304 Y344 K345 K346	P304-L348 HydrophobicContact CB-CD2 4.43Å; Y344-L348 HydrophobicContact CD1-CD1 4.2Å; Y344-L348 HydrophobicContact CE1-CD1 3.48Å; Y344-L348 VanDerWaalsContact CE1-CD1 3.48Å; Y344-L348 HydrophobicContact CE1-CG 4.24Å; Y344-L348 HydrophobicContact CE2-CD1 4.12Å; Y344-L348 HydrophobicContact CE2-CD2 4.48Å; Y344-L348 HydrophobicContact CE2-CG 4.22Å; Y344-L348 VanDerWaalsContact CZ-CD1 3.45Å; Y344-L348 PolarHBondContact O-N 2.83Å; K345-L348 PolarHBondContact O-N 3.46Å; K346-L348 PolarHBondContact O-N 3.18Å
349	C	92.4	Very high	91.3	Very high	22 Å²	22	40.1 Å²	40.1	15%	0.149	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	32.1	177.6	-55.5	0	0	0	0	112	K345 K346 V347 Q351 Q352 T353	K345-C349 WeakPolarHBondContact O-CB 3.46Å; K345-C349 PolarHBondContact O-N 2.83Å; K345-C349 PolarHBondContact O-SG 2.83Å; K346-C349 CarbonylContact O-C 3.56Å; K346-C349 PolarHBondContact O-N 2.79Å; V347-C349 VanDerWaalsContact C-N 3.29Å; V347-C349 PolarHBondContact O-N 2.71Å; C349-Q351 PolarHBondContact O-N 2.82Å; C349-Q351 VanDerWaalsContact O-N 3.09Å; C349-Q352 PolarHBondContact O-N 3.47Å; C349-Q352 PolarHBondContact O-OE1 2.62Å; C349-Q352 VanDerWaalsContact O-OE1 3.04Å; C349-T353 HydrophobicContact CB-CG2 3.99Å; C349-T353 WeakPolarHBondContact O-CG2 3.42Å; C349-T353 PolarHBondContact O-N 3.48Å; C349-T353 PolarHBondContact O-OG1 2.75Å; C349-T353 VanDerWaalsContact O-OG1 3.04Å
350	W	94.3	Very high	91.4	Very high	36 Å²	36	39.8 Å²	39.8	14%	0.136	20%	0.201	C	C	.	.	H	α-helix	trans	-54.7	-32.8	-172	64	-93.9	0	0	0	113.7	W319 F335 K346 V347 Q352 T353 L354 C374 C375	W319-W350 HydrophobicContact CH2-CB 3.67Å; W319-W350 AromaticContact CH2-CD1 3.91Å; W319-W350 HydrophobicContact CH2-CD2 4.13Å; W319-W350 AromaticContact CH2-CG 3.61Å; W319-W350 HydrophobicContact CH2-CG 3.61Å; W319-W350 HydrophobicContact CZ2-CB 4.36Å; W319-W350 HydrophobicContact CZ3-CD2 4.35Å; W319-W350 HydrophobicContact CZ3-CG 4.25Å; F335-W350 HydrophobicContact CE1-CB 3.91Å; F335-W350 HydrophobicContact CZ-CB 3.91Å; K346-W350 PolarHBondContact O-N 2.83Å; K346-W350 VanDerWaalsContact O-N 3.12Å; V347-W350 WeakPolarHBondContact O-CB 3.39Å; V347-W350 PolarHBondContact O-N 2.82Å; W350-Q352 PolarHBondContact O-N 3.17Å; W350-T353 VanDerWaalsContact CA-OG1 3.28Å; W350-T353 WeakPolarHBondContact CA-OG1 3.43Å; W350-T353 PolarHBondContact O-N 2.87Å; W350-L354 WeakPolarHBondContact O-CB 3.42Å; W350-L354 PolarHBondContact O-N 2.76Å; W350-C374 VanDerWaalsContact CE3-O 3.23Å; W350-C374 VanDerWaalsContact CZ3-O 3.29Å; W350-C374 WeakPolarHBondContact CZ3-O 3.26Å; W350-C375 HydrophobicContact CH2-CB 3.83Å; W350-C375 HydrophobicContact CZ3-CB 4.14Å
351	Q	93.2	Very high	91.6	Very high	126 Å²	126	44.3 Å²	44.3	59%	0.589	23%	0.23	S	C	*	.	H	α-helix	trans	-58.6	-31.1	177.9	-69.5	-179.9	-19.1	0	0	112.6	C349	C349-Q351 PolarHBondContact O-N 2.82Å; C349-Q351 VanDerWaalsContact O-N 3.09Å
352	Q	91.4	Very high	91.9	Very high	94 Å²	94	42.3 Å²	42.3	44%	0.439	22%	0.221	S	C	.	.	H	α-helix	trans	-99.2	-28.7	177.2	-56.4	84.4	22.6	0	0	112.5	F270 C349 W350	F270-Q352 WeakPolarHBondContact CZ-O 3.48Å; C349-Q352 PolarHBondContact O-N 3.47Å; C349-Q352 PolarHBondContact O-OE1 2.62Å; C349-Q352 VanDerWaalsContact O-OE1 3.04Å; W350-Q352 PolarHBondContact O-N 3.17Å
353	T	93.1	Very high	92.3	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-97.1	-18.6	-168	63.1	0	0	0	0	113.8	F270 K346 C349 W350 V355	F270-T353 HydrophobicContact CD1-CG2 4.27Å; F270-T353 HydrophobicContact CD2-CG2 4.22Å; F270-T353 HydrophobicContact CE1-CG2 4.34Å; F270-T353 HydrophobicContact CE2-CG2 4.3Å; F270-T353 HydrophobicContact CG-CG2 4.21Å; F270-T353 HydrophobicContact CZ-CG2 4.37Å; K346-T353 HydrophobicContact CB-CG2 4.21Å; K346-T353 HydrophobicContact CG-CG2 4.15Å; K346-T353 PolarHBondContact O-OG1 2.94Å; C349-T353 HydrophobicContact CB-CG2 3.99Å; C349-T353 WeakPolarHBondContact O-CG2 3.42Å; C349-T353 PolarHBondContact O-N 3.48Å; C349-T353 PolarHBondContact O-OG1 2.75Å; C349-T353 VanDerWaalsContact O-OG1 3.04Å; W350-T353 VanDerWaalsContact CA-OG1 3.28Å; W350-T353 WeakPolarHBondContact CA-OG1 3.43Å; W350-T353 PolarHBondContact O-N 2.87Å; T353-V355 VanDerWaalsContact C-N 3.35Å; T353-V355 PolarHBondContact O-N 2.75Å
354	L	95.2	Very high	92.5	Very high	22 Å²	22	50 Å²	50	12%	0.115	26%	0.257	C	S	.	.			trans	-74	87.6	171.5	-177.5	62.2	0	0	0	110.1	Y326 P334 F335 W350 I370 K371 C374	Y326-L354 HydrophobicContact CD2-CD1 4.17Å; Y326-L354 HydrophobicContact CE2-CD1 4.33Å; P334-L354 HydrophobicContact CB-CD1 3.53Å; P334-L354 HydrophobicContact CG-CD1 4.02Å; F335-L354 HydrophobicContact CE1-CB 4.1Å; F335-L354 HydrophobicContact CZ-CB 4.35Å; F335-L354 HydrophobicContact CZ-CD1 4.3Å; W350-L354 WeakPolarHBondContact O-CB 3.42Å; W350-L354 PolarHBondContact O-N 2.76Å; L354-I370 HydrophobicContact CD1-CG2 4.49Å; L354-K371 HydrophobicContact CD2-CG 4.3Å; L354-C374 HydrophobicContact CD2-CB 3.69Å
355	V	93.5	Very high	92.8	Very high	33 Å²	33	53.6 Å²	53.6	20%	0.2	28%	0.275	C	S	.	.			trans	-119.1	135.6	-177.6	177.1	0	0	0	0	110	F270 Y275 Y326 T353	F270-V355 HydrophobicContact CE2-CG2 4.36Å; F270-V355 HydrophobicContact CZ-CG2 3.79Å; Y275-V355 HydrophobicContact CD1-CG1 3.94Å; Y275-V355 HydrophobicContact CE1-CG1 3.39Å; Y326-V355 PolarHBondContact OH-O 2.79Å; T353-V355 VanDerWaalsContact C-N 3.35Å; T353-V355 PolarHBondContact O-N 2.75Å
356	F	94	Very high	93.1	Very high	24 Å²	24	51.6 Å²	51.6	11%	0.105	27%	0.266	C	S	.	.			trans	-94	122.9	174.4	-61.8	-91	0	0	0	109.2	Y326 I362 K367 I370 K371	Y326-F356 HydrophobicContact CD2-CD1 4.14Å; Y326-F356 AromaticContact CD2-CE1 3.77Å; Y326-F356 HydrophobicContact CD2-CE1 3.77Å; Y326-F356 HydrophobicContact CD2-CZ 4.39Å; Y326-F356 AromaticContact CE2-CD1 3.87Å; Y326-F356 HydrophobicContact CE2-CD1 3.87Å; Y326-F356 AromaticContact CE2-CE1 3.95Å; Y326-F356 HydrophobicContact CE2-CE1 3.95Å; F356-I362 HydrophobicContact CD1-CD1 4Å; F356-I362 HydrophobicContact CE1-CD1 4.02Å; F356-K367 HydrophobicContact CD1-CG 3.83Å; F356-K367 HydrophobicContact CD2-CG 4.3Å; F356-K367 HydrophobicContact CE1-CB 4.35Å; F356-K367 HydrophobicContact CE1-CG 3.95Å; F356-K367 HydrophobicContact CE2-CB 4.43Å; F356-K367 HydrophobicContact CE2-CG 4.44Å; F356-K367 HydrophobicContact CG-CD 4.28Å; F356-K367 HydrophobicContact CG-CG 4Å; F356-K367 HydrophobicContact CZ-CB 4.23Å; F356-K367 HydrophobicContact CZ-CG 4.25Å; F356-I370 HydrophobicContact CE1-CB 4.36Å; F356-I370 HydrophobicContact CE1-CD1 4.02Å; F356-I370 HydrophobicContact CE1-CG2 4.18Å; F356-I370 HydrophobicContact CZ-CB 4.08Å; F356-I370 HydrophobicContact CZ-CG2 3.83Å; F356-K371 HydrophobicContact CE2-CD 4.35Å; F356-K371 HydrophobicContact CE2-CG 4.02Å; F356-K371 HydrophobicContact CZ-CG 4.31Å
357	P	91.9	Very high	93.4	Very high	2 Å²	2	54.6 Å²	54.6	1%	0.013	28%	0.279	C	S	.	.			trans	-61.4	129.4	178.6	-20.1	30.7	0	0	0	111.1	I330 Y332 E359 M360	I330-P357 HydrophobicContact CG2-CG 4.13Å; Y332-P357 WeakPolarHBondContact OH-CG 2.96Å; P357-E359 VanDerWaalsContact CB-CD 3.5Å; P357-E359 HydrophobicContact CB-CG 4.47Å; P357-E359 WeakPolarHBondContact CB-OE1 3.39Å; P357-E359 VanDerWaalsContact CB-OE2 3.31Å; P357-E359 WeakPolarHBondContact CB-OE2 3.41Å; P357-E359 PolarHBondContact O-N 3.26Å; P357-M360 HydrophobicContact CB-CB 4.49Å; P357-M360 HydrophobicContact CB-CG 3.99Å; P357-M360 HydrophobicContact CG-CG 4.23Å; P357-M360 PolarHBondContact O-N 3.25Å
358	P	88.6	Confident	93.6	Very high	101 Å²	101	58.3 Å²	58.3	66%	0.656	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-23.5	-176.1	24.8	-34.9	0	0	0	114.1	Y275	Y275-P358 HydrophobicContact CD1-CG 4.34Å
359	E	87.9	Confident	93.9	Very high	98 Å²	98	56.2 Å²	56.2	46%	0.458	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-15	179.8	69.6	-83.7	-158.7	0	0	114.2	S277 P357	S277-E359 WeakPolarHBondContact CB-OE1 3.29Å; S277-E359 PolarHBondContact OG-OE1 3.45Å; P357-E359 VanDerWaalsContact CB-CD 3.5Å; P357-E359 HydrophobicContact CB-CG 4.47Å; P357-E359 WeakPolarHBondContact CB-OE1 3.39Å; P357-E359 VanDerWaalsContact CB-OE2 3.31Å; P357-E359 WeakPolarHBondContact CB-OE2 3.41Å; P357-E359 PolarHBondContact O-N 3.26Å
360	M	89.2	Confident	94.2	Very high	43 Å²	43	55.1 Å²	55.1	21%	0.212	28%	0.281	C	S	.	.	S	Bend	trans	-87.8	128.2	-177.8	-68.6	-59	-66.4	0	0	111.2	T196 I330 P357 I362	T196-M360 HydrophobicContact CG2-CE 4.31Å; I330-M360 HydrophobicContact CD1-CB 3.88Å; I330-M360 HydrophobicContact CD1-CG 4.29Å; I330-M360 HydrophobicContact CG2-CG 4.44Å; P357-M360 HydrophobicContact CB-CB 4.49Å; P357-M360 HydrophobicContact CB-CG 3.99Å; P357-M360 HydrophobicContact CG-CG 4.23Å; P357-M360 PolarHBondContact O-N 3.25Å; M360-I362 WeakPolarHBondContact O-CG2 3.3Å; M360-I362 PolarHBondContact O-N 2.79Å; M360-I362 VanDerWaalsContact O-N 3.14Å
361	P	90.3	Very high	94.3	Very high	117 Å²	117	58.7 Å²	58.7	76%	0.76	30%	0.297	S	S	*	.			trans	-73.1	107.1	177.5	29.9	-32.8	0	0	0	109.8
362	I	94.7	Very high	94.5	Very high	19 Å²	19	56.7 Å²	56.7	10%	0.097	28%	0.284	C	S	.	.			trans	-146.8	130.8	177.1	178.4	173.4	0	0	0	110	E199 L329 I330 F356 M360 A366 K367 I370	E199-I362 WeakPolarHBondContact OE1-CA 3.41Å; L329-I362 HydrophobicContact CB-CD1 4.22Å; L329-I362 HydrophobicContact CD1-CD1 3.75Å; L329-I362 HydrophobicContact CD1-CG1 4.23Å; I330-I362 HydrophobicContact CD1-CD1 4.28Å; I330-I362 HydrophobicContact CD1-CG2 4.24Å; F356-I362 HydrophobicContact CD1-CD1 4Å; F356-I362 HydrophobicContact CE1-CD1 4.02Å; M360-I362 WeakPolarHBondContact O-CG2 3.3Å; M360-I362 PolarHBondContact O-N 2.79Å; M360-I362 VanDerWaalsContact O-N 3.14Å; I362-A366 HydrophobicContact CD1-CB 3.94Å; I362-A366 HydrophobicContact CG1-CB 3.59Å; I362-K367 HydrophobicContact CD1-CG 4Å; I362-K367 HydrophobicContact CG1-CG 4.01Å; I362-K367 HydrophobicContact CG2-CD 4.35Å; I362-K367 HydrophobicContact CG2-CG 4.24Å; I362-K367 WeakPolarHBondContact O-CE 3.36Å; I362-I370 HydrophobicContact CD1-CD1 4.16Å
363	S	96.7	Very high	94.9	Very high	30 Å²	30	52.2 Å²	52.2	21%	0.21	26%	0.263	C	S	.	.			trans	-65.2	165.3	-176.6	69.4	0	0	0	0	112.6	E199 E365 A366 K367	E199-S363 VanDerWaalsContact CD-OG 3.23Å; E199-S363 VanDerWaalsContact OE1-CB 3.23Å; E199-S363 WeakPolarHBondContact OE1-CB 3.09Å; E199-S363 PolarHBondContact OE1-N 2.83Å; E199-S363 PolarHBondContact OE1-OG 2.84Å; E199-S363 WeakPolarHBondContact OE2-CB 3.23Å; E199-S363 PolarHBondContact OE2-OG 3.44Å; S363-E365 VanDerWaalsContact C-N 3.29Å; S363-A366 VanDerWaalsContact OG-CB 3.22Å; S363-A366 WeakPolarHBondContact OG-CB 3.3Å; S363-A366 PolarHBondContact OG-N 3.49Å; S363-K367 WeakPolarHBondContact O-CG 3.5Å; S363-K367 PolarHBondContact O-N 3.34Å; S363-K367 VanDerWaalsContact O-N 3.15Å
364	K	96.8	Very high	95.1	Very high	174 Å²	174	52.1 Å²	52.1	76%	0.757	26%	0.263	S	S	*	.	H	α-helix	trans	-68.5	-37.4	177.6	-68.9	179.7	-178.5	175.6	0	110.2	K367 N368	K364-K367 PolarHBondContact O-N 3.49Å; K364-N368 VanDerWaalsContact O-CB 3.28Å; K364-N368 WeakPolarHBondContact O-CB 3.3Å; K364-N368 PolarHBondContact O-N 3.34Å
365	E	97.3	Very high	95.1	Very high	93 Å²	93	52 Å²	52	44%	0.435	26%	0.264	S	S	.	.	H	α-helix	trans	-64.3	-49.2	179.6	-63.8	67.3	-149	0	0	110	S363 K367 N368 V369 F395	S363-E365 VanDerWaalsContact C-N 3.29Å; E365-K367 PolarHBondContact O-N 3.47Å; E365-N368 PolarHBondContact O-N 3.16Å; E365-N368 VanDerWaalsContact O-N 3.16Å; E365-V369 PolarHBondContact O-N 2.97Å; E365-F395 HydrophobicContact CB-CB 4.42Å; E365-F395 HydrophobicContact CB-CD2 4.31Å
366	A	98	Very high	95.2	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.2	-43.7	176.1	0	0	0	0	0	112.6	L329 I362 S363 N368 V369 I370 F395	L329-A366 HydrophobicContact CD1-CB 3.79Å; I362-A366 HydrophobicContact CD1-CB 3.94Å; I362-A366 HydrophobicContact CG1-CB 3.59Å; S363-A366 VanDerWaalsContact OG-CB 3.22Å; S363-A366 WeakPolarHBondContact OG-CB 3.3Å; S363-A366 PolarHBondContact OG-N 3.49Å; A366-N368 VanDerWaalsContact C-N 3.31Å; A366-N368 PolarHBondContact O-N 2.92Å; A366-V369 WeakPolarHBondContact O-CG1 3.35Å; A366-I370 WeakPolarHBondContact O-CD1 3.39Å; A366-I370 WeakPolarHBondContact O-CG1 3.4Å; A366-I370 PolarHBondContact O-N 3.06Å; A366-F395 HydrophobicContact CB-CD2 3.94Å; A366-F395 HydrophobicContact CB-CE2 3.68Å
367	K	97.7	Very high	95.2	Very high	66 Å²	66	54 Å²	54	29%	0.287	28%	0.278	S	S	.	.	H	α-helix	trans	-61.5	-41.3	174.2	-72.9	176.7	-172.7	174.2	0	111.9	F356 I362 S363 K364 E365 K371	F356-K367 HydrophobicContact CD1-CG 3.83Å; F356-K367 HydrophobicContact CD2-CG 4.3Å; F356-K367 HydrophobicContact CE1-CB 4.35Å; F356-K367 HydrophobicContact CE1-CG 3.95Å; F356-K367 HydrophobicContact CE2-CB 4.43Å; F356-K367 HydrophobicContact CE2-CG 4.44Å; F356-K367 HydrophobicContact CG-CD 4.28Å; F356-K367 HydrophobicContact CG-CG 4Å; F356-K367 HydrophobicContact CZ-CB 4.23Å; F356-K367 HydrophobicContact CZ-CG 4.25Å; I362-K367 HydrophobicContact CD1-CG 4Å; I362-K367 HydrophobicContact CG1-CG 4.01Å; I362-K367 HydrophobicContact CG2-CD 4.35Å; I362-K367 HydrophobicContact CG2-CG 4.24Å; I362-K367 WeakPolarHBondContact O-CE 3.36Å; S363-K367 WeakPolarHBondContact O-CG 3.5Å; S363-K367 PolarHBondContact O-N 3.34Å; S363-K367 VanDerWaalsContact O-N 3.15Å; K364-K367 PolarHBondContact O-N 3.49Å; E365-K367 PolarHBondContact O-N 3.47Å; K367-K371 VanDerWaalsContact O-CG 3.31Å; K367-K371 WeakPolarHBondContact O-CG 3.38Å; K367-K371 PolarHBondContact O-N 2.67Å; K367-K371 VanDerWaalsContact O-N 3.15Å
368	N	97.6	Very high	95.2	Very high	78 Å²	78	60.7 Å²	60.7	42%	0.417	31%	0.309	S	S	.	.	H	α-helix	trans	-67.4	-49	-177.2	-171.5	38.6	0	0	0	111.3	K364 E365 A366 I370 K371 R372	K364-N368 VanDerWaalsContact O-CB 3.28Å; K364-N368 WeakPolarHBondContact O-CB 3.3Å; K364-N368 PolarHBondContact O-N 3.34Å; E365-N368 PolarHBondContact O-N 3.16Å; E365-N368 VanDerWaalsContact O-N 3.16Å; A366-N368 VanDerWaalsContact C-N 3.31Å; A366-N368 PolarHBondContact O-N 2.92Å; N368-I370 VanDerWaalsContact C-N 3.34Å; N368-I370 PolarHBondContact O-N 2.96Å; N368-K371 PolarHBondContact O-N 3.32Å; N368-K371 VanDerWaalsContact O-N 3.15Å; N368-R372 WeakPolarHBondContact O-CG 3.38Å; N368-R372 PolarHBondContact O-N 3.17Å
369	V	98.1	Very high	95.5	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-62.7	-40.5	-179.4	72.3	0	0	0	0	111.7	M325 E365 A366 K371 R372 F373 L381 D393 F395 F396	M325-V369 HydrophobicContact CE-CG1 3.55Å; M325-V369 HydrophobicContact CE-CG2 4.47Å; E365-V369 PolarHBondContact O-N 2.97Å; A366-V369 WeakPolarHBondContact O-CG1 3.35Å; V369-K371 VanDerWaalsContact C-N 3.34Å; V369-K371 PolarHBondContact O-N 3.32Å; V369-R372 PolarHBondContact O-N 3.07Å; V369-R372 VanDerWaalsContact O-N 3.12Å; V369-F373 HydrophobicContact CG2-CD2 3.94Å; V369-F373 HydrophobicContact CG2-CE2 3.66Å; V369-F373 WeakPolarHBondContact O-CD2 3.42Å; V369-F373 PolarHBondContact O-N 3.21Å; V369-L381 HydrophobicContact CG2-CD2 3.89Å; V369-D393 HydrophobicContact CG2-CB 4.41Å; V369-F395 HydrophobicContact CB-CB 3.83Å; V369-F395 HydrophobicContact CB-CG 4.31Å; V369-F395 HydrophobicContact CG1-CB 3.71Å; V369-F395 HydrophobicContact CG1-CD1 3.82Å; V369-F395 HydrophobicContact CG1-CD2 4.21Å; V369-F395 HydrophobicContact CG1-CG 3.63Å; V369-F395 HydrophobicContact CG2-CB 4.24Å; V369-F396 HydrophobicContact CG2-CE2 3.99Å
370	I	98.4	Very high	95.9	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-60.8	-44	175.1	-71.3	165.8	0	0	0	110.7	M325 Y326 L329 L354 F356 I362 A366 N368 R372 F373 C374	M325-I370 HydrophobicContact CB-CD1 4.36Å; M325-I370 HydrophobicContact CB-CG1 3.99Å; Y326-I370 HydrophobicContact CD2-CG2 4.28Å; L329-I370 HydrophobicContact CD1-CD1 4.1Å; L354-I370 HydrophobicContact CD1-CG2 4.49Å; F356-I370 HydrophobicContact CE1-CB 4.36Å; F356-I370 HydrophobicContact CE1-CD1 4.02Å; F356-I370 HydrophobicContact CE1-CG2 4.18Å; F356-I370 HydrophobicContact CZ-CB 4.08Å; F356-I370 HydrophobicContact CZ-CG2 3.83Å; I362-I370 HydrophobicContact CD1-CD1 4.16Å; A366-I370 WeakPolarHBondContact O-CD1 3.39Å; A366-I370 WeakPolarHBondContact O-CG1 3.4Å; A366-I370 PolarHBondContact O-N 3.06Å; N368-I370 VanDerWaalsContact C-N 3.34Å; N368-I370 PolarHBondContact O-N 2.96Å; I370-R372 VanDerWaalsContact C-N 3.28Å; I370-R372 PolarHBondContact O-N 3.08Å; I370-F373 PolarHBondContact O-N 2.82Å; I370-C374 WeakPolarHBondContact O-CB 3.42Å; I370-C374 PolarHBondContact O-N 3.41Å
371	K	97.8	Very high	96.2	Very high	111 Å²	111	55.4 Å²	55.4	48%	0.483	27%	0.274	S	S	.	.	H	α-helix	trans	-63.7	-33.7	176.4	-73.9	176.7	179	-172	0	112.6	L354 F356 K367 N368 V369 C374 C375	L354-K371 HydrophobicContact CD2-CG 4.3Å; F356-K371 HydrophobicContact CE2-CD 4.35Å; F356-K371 HydrophobicContact CE2-CG 4.02Å; F356-K371 HydrophobicContact CZ-CG 4.31Å; K367-K371 VanDerWaalsContact O-CG 3.31Å; K367-K371 WeakPolarHBondContact O-CG 3.38Å; K367-K371 PolarHBondContact O-N 2.67Å; K367-K371 VanDerWaalsContact O-N 3.15Å; N368-K371 PolarHBondContact O-N 3.32Å; N368-K371 VanDerWaalsContact O-N 3.15Å; V369-K371 VanDerWaalsContact C-N 3.34Å; V369-K371 PolarHBondContact O-N 3.32Å; K371-C374 CarbonylContact O-C 3.52Å; K371-C375 WeakPolarHBondContact O-CB 3.35Å
372	R	97.4	Very high	96.4	Very high	84 Å²	84	50 Å²	50	32%	0.317	24%	0.239	S	C	.	.	H	α-helix	trans	-74.1	-29.8	176.3	-68.8	-172.4	68.1	-171.5	1.8	113	N368 V369 I370 C375 R380 L381 E389 D393	N368-R372 WeakPolarHBondContact O-CG 3.38Å; N368-R372 PolarHBondContact O-N 3.17Å; V369-R372 PolarHBondContact O-N 3.07Å; V369-R372 VanDerWaalsContact O-N 3.12Å; I370-R372 VanDerWaalsContact C-N 3.28Å; I370-R372 PolarHBondContact O-N 3.08Å; R372-C375 PolarHBondContact O-SG 2.95Å; R372-R380 WeakPolarHBondContact O-CA 3.37Å; R372-L381 HydrophobicContact CB-CB 4.17Å; R372-L381 PolarHBondContact O-N 2.61Å; R372-E389 IonicContact NH2-OE1 3.04Å; R372-E389 PolarHBondContact NH2-OE1 3.29Å; R372-E389 VanDerWaalsContact NH2-OE1 3.09Å; R372-D393 IonicContact CZ-OD2 3.48Å; R372-D393 IonicContact NH1-OD2 2.88Å; R372-D393 PolarHBondContact NH1-OD2 2.99Å
373	F	98.1	Very high	96.2	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-75.2	-42.5	168.7	-78.2	-56.9	0	0	0	112.3	W318 L321 G322 M325 V369 I370 C375 R380 L381 I390 F396	W318-F373 HydrophobicContact CB-CD1 4.04Å; W318-F373 HydrophobicContact CB-CE1 4.24Å; W318-F373 VanDerWaalsContact O-CD1 3.24Å; W318-F373 WeakPolarHBondContact O-CD1 3.42Å; L321-F373 HydrophobicContact CD2-CE1 4.06Å; L321-F373 HydrophobicContact CD2-CE2 4.34Å; L321-F373 HydrophobicContact CD2-CZ 3.73Å; L321-F373 HydrophobicContact CG-CE2 4.45Å; L321-F373 HydrophobicContact CG-CZ 4.26Å; G322-F373 VanDerWaalsContact CA-CB 3.49Å; M325-F373 HydrophobicContact SD-CD2 3.77Å; M325-F373 HydrophobicContact SD-CE2 3.46Å; M325-F373 WeakPolarHBondContact SD-CE2 3.38Å; V369-F373 HydrophobicContact CG2-CD2 3.94Å; V369-F373 HydrophobicContact CG2-CE2 3.66Å; V369-F373 WeakPolarHBondContact O-CD2 3.42Å; V369-F373 PolarHBondContact O-N 3.21Å; I370-F373 PolarHBondContact O-N 2.82Å; F373-C375 PolarHBondContact O-N 2.82Å; F373-R380 WeakPolarHBondContact O-CD 3.09Å; F373-R380 WeakPolarHBondContact O-CG 3.2Å; F373-R380 PolarHBondContact O-NE 3.15Å; F373-R380 VanDerWaalsContact O-NE 3.16Å; F373-L381 HydrophobicContact CD1-CB 3.93Å; F373-L381 HydrophobicContact CD1-CD2 4.3Å; F373-L381 HydrophobicContact CD2-CD2 4.4Å; F373-L381 HydrophobicContact CE1-CB 4.02Å; F373-L381 HydrophobicContact CE1-CD2 3.83Å; F373-L381 HydrophobicContact CE1-CG 4.19Å; F373-L381 HydrophobicContact CE2-CD2 3.94Å; F373-L381 HydrophobicContact CZ-CD2 3.65Å; F373-L381 HydrophobicContact CZ-CG 4.47Å; F373-I390 HydrophobicContact CE1-CD1 3.89Å; F373-I390 HydrophobicContact CE1-CG1 3.99Å; F373-I390 HydrophobicContact CZ-CD1 4.17Å; F373-I390 HydrophobicContact CZ-CG1 4.1Å; F373-I390 HydrophobicContact CZ-CG2 3.96Å; F373-F396 HydrophobicContact CE2-CE2 4.43Å
374	C	97.6	Very high	95.8	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	27%	0.27	C	S	.	.	S	Bend	trans	-94.2	61.4	-178.9	-61	0	0	0	0	111.6	W319 W350 L354 I370 K371	W319-C374 HydrophobicContact CE3-CB 4.23Å; W319-C374 HydrophobicContact CH2-CB 4.22Å; W319-C374 VanDerWaalsContact CZ3-C 3.41Å; W319-C374 HydrophobicContact CZ3-CB 4.03Å; W350-C374 VanDerWaalsContact CE3-O 3.23Å; W350-C374 VanDerWaalsContact CZ3-O 3.29Å; W350-C374 WeakPolarHBondContact CZ3-O 3.26Å; L354-C374 HydrophobicContact CD2-CB 3.69Å; I370-C374 WeakPolarHBondContact O-CB 3.42Å; I370-C374 PolarHBondContact O-N 3.41Å; K371-C374 CarbonylContact O-C 3.52Å
375	C	96.5	Very high	95.5	Very high	19 Å²	19	53.2 Å²	53.2	13%	0.128	26%	0.257	C	S	.	.	S	Bend	trans	-135.4	-174.7	172.8	69.9	0	0	0	0	112.4	W350 K371 R372 F373 R380	W350-C375 HydrophobicContact CH2-CB 3.83Å; W350-C375 HydrophobicContact CZ3-CB 4.14Å; K371-C375 WeakPolarHBondContact O-CB 3.35Å; R372-C375 PolarHBondContact O-SG 2.95Å; F373-C375 PolarHBondContact O-N 2.82Å; C375-R380 PolarHBondContact O-NE 3.48Å; C375-R380 PolarHBondContact O-NH2 3.47Å; C375-R380 VanDerWaalsContact SG-CA 3.59Å
376	D	94.3	Very high	95.2	Very high	77 Å²	77	50.7 Å²	50.7	41%	0.412	25%	0.252	S	S	.	.			trans	-53.3	137.6	176.3	-66.1	-61.1	0	0	0	111.5	E378 H379 R380	D376-E378 PolarHBondContact O-N 3.07Å; D376-E378 VanDerWaalsContact O-N 3.1Å; D376-H379 PolarHBondContact O-N 2.92Å; D376-R380 PolarHBondContact O-N 3.02Å; D376-R380 VanDerWaalsContact O-N 3.12Å
377	A	93.7	Very high	95.1	Very high	23 Å²	23	50.7 Å²	50.7	19%	0.19	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-54.7	-36.7	-168.8	0	0	0	0	0	114.1	E305 H379 R380 H383	E305-A377 HydrophobicContact CG-CB 4.29Å; A377-H379 VanDerWaalsContact C-N 3.33Å; A377-H379 PolarHBondContact O-N 3.45Å; A377-R380 WeakPolarHBondContact O-CB 3.2Å; A377-R380 PolarHBondContact O-N 3.08Å; A377-H383 WeakPolarHBondContact O-CB 3.34Å; A377-H383 VanDerWaalsContact O-CG 3.23Å; A377-H383 PolarHBondContact O-ND1 3.01Å
378	E	92.5	Very high	95	Very high	142 Å²	142	51.7 Å²	51.7	66%	0.664	26%	0.258	S	S	*	.	G	3₁₀ helix	trans	-71.2	-25	-178.3	-59.3	176.3	177.4	0	0	113.6	D376 H383	D376-E378 PolarHBondContact O-N 3.07Å; D376-E378 VanDerWaalsContact O-N 3.1Å; E378-H383 PolarHBondContact O-CD2 2.54Å
379	H	94.1	Very high	94.9	Very high	130 Å²	130	49.3 Å²	49.3	60%	0.602	25%	0.245	S	C	*	.	G	3₁₀ helix	trans	-105.8	-1.2	-179.1	-56.5	99.6	0	0	0	112.5	D376 A377	D376-H379 PolarHBondContact O-N 2.92Å; A377-H379 VanDerWaalsContact C-N 3.33Å; A377-H379 PolarHBondContact O-N 3.45Å
380	R	96.8	Very high	94.8	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	-66.4	138.2	-174	-168.9	172.6	-59.1	145.3	3.7	110.8	E305 S315 W318 R372 F373 C375 D376 A377 G382 H383	E305-R380 IonicContact OE1-CZ 3.25Å; E305-R380 IonicContact OE1-NH1 2.88Å; E305-R380 PolarHBondContact OE1-NH1 3.15Å; E305-R380 IonicContact OE1-NH2 2.8Å; E305-R380 PolarHBondContact OE1-NH2 3.41Å; E305-R380 IonicContact OE2-CZ 2.76Å; E305-R380 IonicContact OE2-NH1 3.28Å; E305-R380 IonicContact OE2-NH2 3.21Å; E305-R380 PolarHBondContact OE2-NH2 2.93Å; S315-R380 VanDerWaalsContact C-NH1 3.3Å; S315-R380 WeakPolarHBondContact O-CD 3.42Å; S315-R380 PolarHBondContact O-NH1 3.02Å; W318-R380 HydrophobicContact CB-CG 4.36Å; R372-R380 WeakPolarHBondContact O-CA 3.37Å; F373-R380 WeakPolarHBondContact O-CD 3.09Å; F373-R380 WeakPolarHBondContact O-CG 3.2Å; F373-R380 PolarHBondContact O-NE 3.15Å; F373-R380 VanDerWaalsContact O-NE 3.16Å; C375-R380 PolarHBondContact O-NE 3.48Å; C375-R380 PolarHBondContact O-NH2 3.47Å; C375-R380 VanDerWaalsContact SG-CA 3.59Å; D376-R380 PolarHBondContact O-N 3.02Å; D376-R380 VanDerWaalsContact O-N 3.12Å; A377-R380 WeakPolarHBondContact O-CB 3.2Å; A377-R380 PolarHBondContact O-N 3.08Å; R380-G382 PolarHBondContact O-N 3.32Å; R380-G382 VanDerWaalsContact O-N 3.17Å; R380-H383 WeakPolarHBondContact O-CB 3.44Å; R380-H383 PolarHBondContact O-N 3.38Å
381	L	95.6	Very high	94.8	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	123.1	173.3	-167.2	71.8	0	0	0	110	V369 R372 F373 E389 I390 D393	V369-L381 HydrophobicContact CG2-CD2 3.89Å; R372-L381 HydrophobicContact CB-CB 4.17Å; R372-L381 PolarHBondContact O-N 2.61Å; F373-L381 HydrophobicContact CD1-CB 3.93Å; F373-L381 HydrophobicContact CD1-CD2 4.3Å; F373-L381 HydrophobicContact CD2-CD2 4.4Å; F373-L381 HydrophobicContact CE1-CB 4.02Å; F373-L381 HydrophobicContact CE1-CD2 3.83Å; F373-L381 HydrophobicContact CE1-CG 4.19Å; F373-L381 HydrophobicContact CE2-CD2 3.94Å; F373-L381 HydrophobicContact CZ-CD2 3.65Å; F373-L381 HydrophobicContact CZ-CG 4.47Å; L381-E389 HydrophobicContact CD1-CB 4.41Å; L381-E389 HydrophobicContact CD1-CG 3.78Å; L381-I390 HydrophobicContact CD2-CB 4.37Å; L381-I390 HydrophobicContact CD2-CG1 4.01Å; L381-I390 HydrophobicContact CD2-CG2 4.42Å; L381-I390 HydrophobicContact CG-CB 4.47Å; L381-I390 HydrophobicContact CG-CG1 3.79Å; L381-D393 HydrophobicContact CD2-CB 4.2Å
382	G	93.9	Very high	94.7	Very high	3 Å²	3	53.6 Å²	53.6	3%	0.031	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	89	6.3	-177.1	0	0	0	0	0	115.1	W318 R380 A386 E389	W318-G382 PolarHBondContact NE1-O 2.86Å; R380-G382 PolarHBondContact O-N 3.32Å; R380-G382 VanDerWaalsContact O-N 3.17Å; G382-A386 VanDerWaalsContact CA-O 3.23Å; G382-A386 WeakPolarHBondContact CA-O 3.36Å; G382-A386 VanDerWaalsContact O-CA 3.28Å; G382-A386 WeakPolarHBondContact O-CA 3.4Å; G382-A386 PolarHBondContact O-N 3Å; G382-E389 PolarHBondContact N-OE2 2.81Å
383	H	92.1	Very high	94.7	Very high	68 Å²	68	49.7 Å²	49.7	32%	0.315	24%	0.244	S	C	.	.	S	Bend	trans	-70.8	-47.5	172.3	-177	76.5	0	0	0	112	A377 E378 R380	A377-H383 WeakPolarHBondContact O-CB 3.34Å; A377-H383 VanDerWaalsContact O-CG 3.23Å; A377-H383 PolarHBondContact O-ND1 3.01Å; E378-H383 PolarHBondContact O-CD2 2.54Å; R380-H383 WeakPolarHBondContact O-CB 3.44Å; R380-H383 PolarHBondContact O-N 3.38Å
384	N	88.7	Confident	94.6	Very high	117 Å²	117	53.5 Å²	53.5	63%	0.626	27%	0.269	S	S	*	.	S	Bend	trans	-86.7	-51.6	-170.7	-66.3	-53.1	0	0	0	112.8
385	E	89.9	Confident	94.6	Very high	106 Å²	106	54 Å²	54	50%	0.495	27%	0.272	S	S	.	.	S	Bend	trans	-115.8	22.2	-176	-64.6	179.1	-148.2	0	0	112.6	L387 E388 E389 R392	E385-L387 PolarHBondContact O-N 2.8Å; E385-E388 HydrophobicContact CB-CB 4.37Å; E385-E388 PolarHBondContact O-N 2.86Å; E385-E388 VanDerWaalsContact O-N 3.08Å; E385-E389 HydrophobicContact CB-CB 4.27Å; E385-R392 VanDerWaalsContact CD-NH2 3.27Å; E385-R392 IonicContact OE1-NH2 3.63Å; E385-R392 PolarHBondContact OE1-NH2 2.81Å; E385-R392 IonicContact OE2-CZ 2.89Å; E385-R392 IonicContact OE2-NH1 3.66Å; E385-R392 PolarHBondContact OE2-NH1 3.06Å; E385-R392 IonicContact OE2-NH2 2.7Å; E385-R392 PolarHBondContact OE2-NH2 3.48Å
386	A	91.4	Very high	94.7	Very high	40 Å²	40	53.2 Å²	53.2	33%	0.331	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	-127.7	179.6	0	0	0	0	0	111.8	G382 E388 E389	G382-A386 VanDerWaalsContact CA-O 3.23Å; G382-A386 WeakPolarHBondContact CA-O 3.36Å; G382-A386 VanDerWaalsContact O-CA 3.28Å; G382-A386 WeakPolarHBondContact O-CA 3.4Å; G382-A386 PolarHBondContact O-N 3Å; A386-E388 VanDerWaalsContact C-N 3.28Å; A386-E388 PolarHBondContact O-N 2.69Å; A386-E389 PolarHBondContact O-N 3.44Å
387	L	94.5	Very high	94.7	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.005	28%	0.275	C	S	.	.	H	α-helix	trans	-63.4	-30.8	-176.8	-173.2	66.5	0	0	0	113.5	A210 L211 E214 E385 E389 I390 K391 W401	A210-L387 HydrophobicContact CB-CD1 3.61Å; L211-L387 HydrophobicContact CD2-CD2 3.58Å; L211-L387 HydrophobicContact CG-CD2 4.29Å; E214-L387 HydrophobicContact CB-CB 4.08Å; E214-L387 HydrophobicContact CB-CD2 4.1Å; E214-L387 HydrophobicContact CG-CB 3.72Å; E214-L387 HydrophobicContact CG-CD2 4.09Å; E214-L387 HydrophobicContact CG-CG 4.49Å; E214-L387 WeakPolarHBondContact OE1-CB 3.49Å; E214-L387 WeakPolarHBondContact OE1-CD2 3.5Å; E385-L387 PolarHBondContact O-N 2.8Å; L387-E389 VanDerWaalsContact C-N 3.25Å; L387-E389 PolarHBondContact O-N 2.97Å; L387-I390 HydrophobicContact CD1-CB 4.45Å; L387-I390 HydrophobicContact CD1-CD1 4.48Å; L387-I390 WeakPolarHBondContact O-CB 3.18Å; L387-I390 PolarHBondContact O-N 2.73Å; L387-I390 VanDerWaalsContact O-N 3.08Å; L387-K391 HydrophobicContact CG-CD 4.36Å; L387-K391 HydrophobicContact CG-CG 4.2Å; L387-K391 WeakPolarHBondContact O-CG 3.22Å; L387-K391 PolarHBondContact O-N 2.61Å; L387-W401 HydrophobicContact CD1-CH2 4.47Å; L387-W401 HydrophobicContact CD1-CZ3 3.99Å
388	E	96.1	Very high	94.7	Very high	87 Å²	87	55.9 Å²	55.9	41%	0.407	31%	0.307	S	S	.	.	H	α-helix	trans	-65.4	-30.7	-176.6	-64.5	-55.2	130.7	0	0	112.3	E385 A386 K391 R392	E385-E388 HydrophobicContact CB-CB 4.37Å; E385-E388 PolarHBondContact O-N 2.86Å; E385-E388 VanDerWaalsContact O-N 3.08Å; A386-E388 VanDerWaalsContact C-N 3.28Å; A386-E388 PolarHBondContact O-N 2.69Å; E388-K391 IonicContact OE1-NZ 3.8Å; E388-K391 PolarHBondContact OE1-NZ 3.22Å; E388-R392 WeakPolarHBondContact O-CG 3.4Å; E388-R392 PolarHBondContact O-NH1 3.22Å
389	E	95.8	Very high	94.8	Very high	28 Å²	28	50.6 Å²	50.6	13%	0.131	28%	0.283	C	S	.	.	H	α-helix	trans	-68.2	-42.7	172.6	-159.8	-170.1	165.7	0	0	111.5	R372 L381 G382 E385 A386 L387 R392	R372-E389 IonicContact NH2-OE1 3.04Å; R372-E389 PolarHBondContact NH2-OE1 3.29Å; R372-E389 VanDerWaalsContact NH2-OE1 3.09Å; L381-E389 HydrophobicContact CD1-CB 4.41Å; L381-E389 HydrophobicContact CD1-CG 3.78Å; G382-E389 PolarHBondContact N-OE2 2.81Å; E385-E389 HydrophobicContact CB-CB 4.27Å; A386-E389 PolarHBondContact O-N 3.44Å; L387-E389 VanDerWaalsContact C-N 3.25Å; L387-E389 PolarHBondContact O-N 2.97Å; E389-R392 PolarHBondContact O-N 3.23Å
390	I	96.8	Very high	94.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.9	-44.8	179.5	-62.1	168.4	0	0	0	110.3	A210 W318 F373 L381 L387 R392 D393 F396 W401	A210-I390 HydrophobicContact CB-CG2 4.49Å; W318-I390 HydrophobicContact CD2-CD1 3.82Å; W318-I390 HydrophobicContact CE3-CD1 3.47Å; W318-I390 VanDerWaalsContact CE3-CD1 3.47Å; W318-I390 HydrophobicContact CH2-CD1 3.78Å; W318-I390 HydrophobicContact CZ2-CD1 4.09Å; W318-I390 HydrophobicContact CZ3-CD1 3.44Å; W318-I390 VanDerWaalsContact CZ3-CD1 3.44Å; F373-I390 HydrophobicContact CE1-CD1 3.89Å; F373-I390 HydrophobicContact CE1-CG1 3.99Å; F373-I390 HydrophobicContact CZ-CD1 4.17Å; F373-I390 HydrophobicContact CZ-CG1 4.1Å; F373-I390 HydrophobicContact CZ-CG2 3.96Å; L381-I390 HydrophobicContact CD2-CB 4.37Å; L381-I390 HydrophobicContact CD2-CG1 4.01Å; L381-I390 HydrophobicContact CD2-CG2 4.42Å; L381-I390 HydrophobicContact CG-CB 4.47Å; L381-I390 HydrophobicContact CG-CG1 3.79Å; L387-I390 HydrophobicContact CD1-CB 4.45Å; L387-I390 HydrophobicContact CD1-CD1 4.48Å; L387-I390 WeakPolarHBondContact O-CB 3.18Å; L387-I390 PolarHBondContact O-N 2.73Å; L387-I390 VanDerWaalsContact O-N 3.08Å; I390-R392 PolarHBondContact O-N 3.07Å; I390-R392 VanDerWaalsContact O-N 3.14Å; I390-D393 WeakPolarHBondContact O-CB 3.45Å; I390-D393 PolarHBondContact O-N 2.86Å; I390-D393 VanDerWaalsContact O-N 3.09Å; I390-F396 HydrophobicContact CG2-CD2 4.02Å; I390-F396 HydrophobicContact CG2-CE2 3.57Å; I390-F396 HydrophobicContact CG2-CZ 4.15Å; I390-F396 VanDerWaalsContact O-CD2 3.28Å; I390-F396 WeakPolarHBondContact O-CD2 3.43Å; I390-W401 HydrophobicContact CG2-CH2 4.19Å
391	K	96.7	Very high	94.7	Very high	57 Å²	57	47.7 Å²	47.7	25%	0.248	27%	0.269	C	S	.	.	H	α-helix	trans	-55.8	-31.1	179	-72.7	178.7	176.9	165.3	0	113.9	L387 E388 W401	L387-K391 HydrophobicContact CG-CD 4.36Å; L387-K391 HydrophobicContact CG-CG 4.2Å; L387-K391 WeakPolarHBondContact O-CG 3.22Å; L387-K391 PolarHBondContact O-N 2.61Å; E388-K391 IonicContact OE1-NZ 3.8Å; E388-K391 PolarHBondContact OE1-NZ 3.22Å; K391-W401 HydrophobicContact CB-CZ2 4.32Å; K391-W401 HydrophobicContact CD-CB 4.48Å; K391-W401 HydrophobicContact CD-CD2 4.27Å; K391-W401 HydrophobicContact CD-CG 4.14Å; K391-W401 HydrophobicContact CG-CD2 3.62Å; K391-W401 HydrophobicContact CG-CE3 4.08Å; K391-W401 HydrophobicContact CG-CG 3.9Å; K391-W401 HydrophobicContact CG-CH2 4.36Å; K391-W401 HydrophobicContact CG-CZ2 3.93Å; K391-W401 HydrophobicContact CG-CZ3 4.43Å
392	R	95.9	Very high	94.6	Very high	144 Å²	144	55.6 Å²	55.6	54%	0.543	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.6	-177	-65.8	-175.1	-55.7	-108.5	10.1	113.6	E385 E388 E389 I390	E385-R392 VanDerWaalsContact CD-NH2 3.27Å; E385-R392 IonicContact OE1-NH2 3.63Å; E385-R392 PolarHBondContact OE1-NH2 2.81Å; E385-R392 IonicContact OE2-CZ 2.89Å; E385-R392 IonicContact OE2-NH1 3.66Å; E385-R392 PolarHBondContact OE2-NH1 3.06Å; E385-R392 IonicContact OE2-NH2 2.7Å; E385-R392 PolarHBondContact OE2-NH2 3.48Å; E388-R392 WeakPolarHBondContact O-CG 3.4Å; E388-R392 PolarHBondContact O-NH1 3.22Å; E389-R392 PolarHBondContact O-N 3.23Å; I390-R392 PolarHBondContact O-N 3.07Å; I390-R392 VanDerWaalsContact O-N 3.14Å
393	D	97	Very high	94.7	Very high	1 Å²	1	59 Å²	59	1%	0.005	32%	0.321	C	S	.	.	S	Bend	trans	-66.8	137.3	179.4	-167	-85.1	0	0	0	110.6	V369 R372 L381 I390 F395 F396	V369-D393 HydrophobicContact CG2-CB 4.41Å; R372-D393 IonicContact CZ-OD2 3.48Å; R372-D393 IonicContact NH1-OD2 2.88Å; R372-D393 PolarHBondContact NH1-OD2 2.99Å; L381-D393 HydrophobicContact CD2-CB 4.2Å; I390-D393 WeakPolarHBondContact O-CB 3.45Å; I390-D393 PolarHBondContact O-N 2.86Å; I390-D393 VanDerWaalsContact O-N 3.09Å; D393-F395 PolarHBondContact O-N 3.47Å; D393-F395 PolarHBondContact OD1-N 2.96Å; D393-F395 VanDerWaalsContact OD1-N 3.12Å; D393-F396 HydrophobicContact CB-CD2 4.2Å; D393-F396 PolarHBondContact O-N 3.23Å
394	P	97.4	Very high	94.8	Very high	80 Å²	80	56 Å²	56	52%	0.519	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-54.2	-28.3	-178.3	-29.3	36.1	0	0	0	114.7	F396 A397	P394-F396 PolarHBondContact O-N 3.41Å; P394-A397 VanDerWaalsContact O-CB 3.25Å; P394-A397 WeakPolarHBondContact O-CB 3.37Å; P394-A397 PolarHBondContact O-N 3.01Å
395	F	97.8	Very high	95	Very high	12 Å²	12	51.2 Å²	51.2	5%	0.053	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-62.8	-28.3	176.5	-178.8	-103.9	0	0	0	112.8	Q203 M325 E365 A366 V369 D393	Q203-F395 HydrophobicContact CB-CE1 3.83Å; Q203-F395 HydrophobicContact CB-CZ 3.93Å; Q203-F395 HydrophobicContact CG-CD1 4.45Å; Q203-F395 HydrophobicContact CG-CE1 4.08Å; Q203-F395 PolarHBondContact NE2-O 3Å; M325-F395 HydrophobicContact CE-CD1 3.67Å; M325-F395 HydrophobicContact CE-CE1 3.35Å; M325-F395 HydrophobicContact CE-CZ 4.1Å; E365-F395 HydrophobicContact CB-CB 4.42Å; E365-F395 HydrophobicContact CB-CD2 4.31Å; A366-F395 HydrophobicContact CB-CD2 3.94Å; A366-F395 HydrophobicContact CB-CE2 3.68Å; V369-F395 HydrophobicContact CB-CB 3.83Å; V369-F395 HydrophobicContact CB-CG 4.31Å; V369-F395 HydrophobicContact CG1-CB 3.71Å; V369-F395 HydrophobicContact CG1-CD1 3.82Å; V369-F395 HydrophobicContact CG1-CD2 4.21Å; V369-F395 HydrophobicContact CG1-CG 3.63Å; V369-F395 HydrophobicContact CG2-CB 4.24Å; D393-F395 PolarHBondContact O-N 3.47Å; D393-F395 PolarHBondContact OD1-N 2.96Å; D393-F395 VanDerWaalsContact OD1-N 3.12Å
396	F	97.5	Very high	95.1	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.009	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-98.1	11.6	178.2	-60.7	-75	0	0	0	113.4	Q203 A206 A207 M325 V369 F373 I390 D393 P394 G398 L399 W401	Q203-F396 HydrophobicContact CG-CD1 3.82Å; Q203-F396 HydrophobicContact CG-CE1 4.32Å; A206-F396 HydrophobicContact CB-CE1 4.02Å; A206-F396 HydrophobicContact CB-CZ 4.12Å; A207-F396 HydrophobicContact CB-CD1 4.29Å; A207-F396 HydrophobicContact CB-CE1 4.18Å; M325-F396 HydrophobicContact CE-CZ 4.25Å; M325-F396 HydrophobicContact SD-CZ 4.44Å; V369-F396 HydrophobicContact CG2-CE2 3.99Å; F373-F396 HydrophobicContact CE2-CE2 4.43Å; I390-F396 HydrophobicContact CG2-CD2 4.02Å; I390-F396 HydrophobicContact CG2-CE2 3.57Å; I390-F396 HydrophobicContact CG2-CZ 4.15Å; I390-F396 VanDerWaalsContact O-CD2 3.28Å; I390-F396 WeakPolarHBondContact O-CD2 3.43Å; D393-F396 HydrophobicContact CB-CD2 4.2Å; D393-F396 PolarHBondContact O-N 3.23Å; P394-F396 PolarHBondContact O-N 3.41Å; F396-G398 PolarHBondContact O-N 2.93Å; F396-L399 HydrophobicContact CD1-CD2 4.24Å; F396-L399 WeakPolarHBondContact O-CB 3.19Å; F396-L399 PolarHBondContact O-N 3.24Å; F396-W401 HydrophobicContact CB-CZ2 3.67Å; F396-W401 HydrophobicContact CD1-CH2 4.03Å; F396-W401 AromaticContact CD1-CZ2 3.76Å; F396-W401 HydrophobicContact CD1-CZ2 3.76Å; F396-W401 HydrophobicContact CD2-CZ2 4.25Å; F396-W401 HydrophobicContact CE1-CH2 4.3Å; F396-W401 HydrophobicContact CE1-CZ2 4.47Å; F396-W401 HydrophobicContact CG-CH2 4.21Å; F396-W401 AromaticContact CG-CZ2 3.64Å; F396-W401 HydrophobicContact CG-CZ2 3.64Å
397	A	95	Very high	95.1	Very high	74 Å²	74	56.6 Å²	56.6	61%	0.612	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.2	133	178.8	0	0	0	0	0	111.3	P394 L399	P394-A397 VanDerWaalsContact O-CB 3.25Å; P394-A397 WeakPolarHBondContact O-CB 3.37Å; P394-A397 PolarHBondContact O-N 3.01Å; A397-L399 VanDerWaalsContact C-N 3.3Å; A397-L399 PolarHBondContact O-N 3.42Å
398	G	92.9	Very high	95	Very high	82 Å²	82	62.2 Å²	62.2	85%	0.845	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.2	-5.7	179.7	0	0	0	0	0	115.4	F396	F396-G398 PolarHBondContact O-N 2.93Å
399	L	94.4	Very high	94.9	Very high	31 Å²	31	58.8 Å²	58.8	16%	0.162	32%	0.317	C	S	.	.			trans	-75.2	134.4	176.7	-169.2	71.5	0	0	0	111.5	A207 F396 A397 W401 I404	A207-L399 HydrophobicContact CB-CD2 3.17Å; F396-L399 HydrophobicContact CD1-CD2 4.24Å; F396-L399 WeakPolarHBondContact O-CB 3.19Å; F396-L399 PolarHBondContact O-N 3.24Å; A397-L399 VanDerWaalsContact C-N 3.3Å; A397-L399 PolarHBondContact O-N 3.42Å; L399-W401 HydrophobicContact CD2-CD2 4.19Å; L399-W401 HydrophobicContact CD2-CH2 4.41Å; L399-W401 HydrophobicContact CD2-CZ2 4.01Å; L399-W401 PolarHBondContact O-N 3.47Å; L399-I404 HydrophobicContact CD1-CD1 4.18Å; L399-I404 HydrophobicContact CD2-CD1 4.07Å; L399-I404 HydrophobicContact CG-CD1 4.39Å
400	D	94.9	Very high	94.9	Very high	37 Å²	37	60.1 Å²	60.1	20%	0.198	33%	0.328	C	S	.	.			trans	-89.2	96.5	173.4	-179.8	-6.1	0	0	0	110.3	Q402 H403 I404 R407	D400-Q402 PolarHBondContact O-N 2.99Å; D400-Q402 PolarHBondContact OD1-N 3.25Å; D400-H403 PolarHBondContact OD1-N 3.31Å; D400-H403 IonicContact OD1-ND1 3.48Å; D400-H403 PolarHBondContact OD1-ND1 3.22Å; D400-H403 WeakPolarHBondContact OD2-CB 3.44Å; D400-H403 IonicContact OD2-CG 3.86Å; D400-H403 IonicContact OD2-ND1 3.63Å; D400-H403 PolarHBondContact OD2-ND1 2.98Å; D400-H403 VanDerWaalsContact OD2-ND1 3.11Å; D400-I404 WeakPolarHBondContact O-CB 3.25Å; D400-I404 PolarHBondContact O-N 2.67Å; D400-I404 VanDerWaalsContact O-N 3.17Å; D400-R407 IonicContact OD2-CZ 3.71Å; D400-R407 IonicContact OD2-NE 3.88Å; D400-R407 IonicContact OD2-NH2 3.6Å; D400-R407 PolarHBondContact OD2-NH2 3.27Å
401	W	95.5	Very high	94.6	Very high	31 Å²	31	61.8 Å²	61.8	12%	0.117	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-17.2	-179	-67.5	91.3	0	0	0	114.5	A207 A210 L211 L387 I390 K391 F396 L399	A207-W401 HydrophobicContact CB-CE3 4.14Å; A207-W401 HydrophobicContact CB-CH2 3.54Å; A207-W401 HydrophobicContact CB-CZ2 4.21Å; A207-W401 HydrophobicContact CB-CZ3 3.49Å; A207-W401 VanDerWaalsContact CB-CZ3 3.49Å; A210-W401 HydrophobicContact CB-CZ3 4.41Å; L211-W401 HydrophobicContact CD1-CE3 4.04Å; L211-W401 HydrophobicContact CD1-CZ3 4.49Å; L211-W401 HydrophobicContact CD2-CE3 4.33Å; L211-W401 HydrophobicContact CG-CE3 4.02Å; L211-W401 HydrophobicContact CG-CZ3 4.24Å; L387-W401 HydrophobicContact CD1-CH2 4.47Å; L387-W401 HydrophobicContact CD1-CZ3 3.99Å; I390-W401 HydrophobicContact CG2-CH2 4.19Å; K391-W401 HydrophobicContact CB-CZ2 4.32Å; K391-W401 HydrophobicContact CD-CB 4.48Å; K391-W401 HydrophobicContact CD-CD2 4.27Å; K391-W401 HydrophobicContact CD-CG 4.14Å; K391-W401 HydrophobicContact CG-CD2 3.62Å; K391-W401 HydrophobicContact CG-CE3 4.08Å; K391-W401 HydrophobicContact CG-CG 3.9Å; K391-W401 HydrophobicContact CG-CH2 4.36Å; K391-W401 HydrophobicContact CG-CZ2 3.93Å; K391-W401 HydrophobicContact CG-CZ3 4.43Å; F396-W401 HydrophobicContact CB-CZ2 3.67Å; F396-W401 HydrophobicContact CD1-CH2 4.03Å; F396-W401 AromaticContact CD1-CZ2 3.76Å; F396-W401 HydrophobicContact CD1-CZ2 3.76Å; F396-W401 HydrophobicContact CD2-CZ2 4.25Å; F396-W401 HydrophobicContact CE1-CH2 4.3Å; F396-W401 HydrophobicContact CE1-CZ2 4.47Å; F396-W401 HydrophobicContact CG-CH2 4.21Å; F396-W401 AromaticContact CG-CZ2 3.64Å; F396-W401 HydrophobicContact CG-CZ2 3.64Å; L399-W401 HydrophobicContact CD2-CD2 4.19Å; L399-W401 HydrophobicContact CD2-CH2 4.41Å; L399-W401 HydrophobicContact CD2-CZ2 4.01Å; L399-W401 PolarHBondContact O-N 3.47Å
402	Q	93.2	Very high	94.2	Very high	167 Å²	167	69 Å²	69	78%	0.78	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-42.6	-177	-69.3	-180	-6.7	0	0	111.2	D400	D400-Q402 PolarHBondContact O-N 2.99Å; D400-Q402 PolarHBondContact OD1-N 3.25Å
403	H	94.2	Very high	93.9	Very high	75 Å²	75	63.1 Å²	63.1	35%	0.347	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.5	17.2	-174.6	-45.3	94.4	0	0	0	113.1	D400 R405 E406 R407	D400-H403 PolarHBondContact OD1-N 3.31Å; D400-H403 IonicContact OD1-ND1 3.48Å; D400-H403 PolarHBondContact OD1-ND1 3.22Å; D400-H403 WeakPolarHBondContact OD2-CB 3.44Å; D400-H403 IonicContact OD2-CG 3.86Å; D400-H403 IonicContact OD2-ND1 3.63Å; D400-H403 PolarHBondContact OD2-ND1 2.98Å; D400-H403 VanDerWaalsContact OD2-ND1 3.11Å; H403-R405 PolarHBondContact O-N 3.24Å; H403-R405 VanDerWaalsContact O-N 3.16Å; H403-E406 HydrophobicContact CB-CB 4.34Å; H403-E406 IonicContact CD2-OE1 2.75Å; H403-E406 IonicContact CD2-OE2 3.11Å; H403-E406 PolarHBondContact CD2-OE2 3.32Å; H403-E406 IonicContact CG-OE2 3.69Å; H403-E406 WeakPolarHBondContact O-CB 3.43Å; H403-E406 PolarHBondContact O-N 3.1Å; H403-R407 PolarHBondContact O-N 3.21Å
404	I	95	Very high	93.4	Very high	3 Å²	3	68 Å²	68	2%	0.015	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.1	-38.7	-178.8	-169.8	168.8	0	0	0	112.4	W161 F204 A207 E208 L211 L399 D400 E406 R407	W161-I404 HydrophobicContact CH2-CG2 3.86Å; W161-I404 HydrophobicContact CZ2-CG2 4.46Å; F204-I404 HydrophobicContact CD2-CD1 4Å; F204-I404 HydrophobicContact CD2-CG1 3.82Å; F204-I404 HydrophobicContact CE2-CD1 4.13Å; F204-I404 HydrophobicContact CE2-CG1 3.51Å; F204-I404 HydrophobicContact CZ-CG1 4.22Å; A207-I404 HydrophobicContact CB-CD1 3.83Å; E208-I404 HydrophobicContact CG-CD1 3.8Å; E208-I404 HydrophobicContact CG-CG1 4.17Å; E208-I404 HydrophobicContact CG-CG2 4.49Å; L211-I404 HydrophobicContact CD1-CG2 3.65Å; L399-I404 HydrophobicContact CD1-CD1 4.18Å; L399-I404 HydrophobicContact CD2-CD1 4.07Å; L399-I404 HydrophobicContact CG-CD1 4.39Å; D400-I404 WeakPolarHBondContact O-CB 3.25Å; D400-I404 PolarHBondContact O-N 2.67Å; D400-I404 VanDerWaalsContact O-N 3.17Å; I404-E406 VanDerWaalsContact C-N 3.32Å; I404-E406 PolarHBondContact O-N 3.32Å; I404-R407 PolarHBondContact O-N 2.88Å
405	R	93.6	Very high	92.9	Very high	18 Å²	18	66.4 Å²	66.4	7%	0.068	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.4	-15.1	-178.6	-153.3	-178.3	-176.3	87.1	12.2	113.8	W161 D234 R236 H238 L239 H403	W161-R405 VanDerWaalsContact CE3-NH1 3.31Å; W161-R405 HydrophobicContact CH2-CB 4.13Å; W161-R405 HydrophobicContact CH2-CG 4.42Å; W161-R405 VanDerWaalsContact CZ3-NH1 3.29Å; D234-R405 IonicContact OD2-CZ 3.79Å; D234-R405 IonicContact OD2-NH2 2.72Å; D234-R405 PolarHBondContact OD2-NH2 3.25Å; R236-R405 PolarHBondContact NH1-O 2.77Å; R236-R405 PolarHBondContact NH2-O 3.04Å; H238-R405 HydrophobicContact CB-CG 4.15Å; H238-R405 PolarHBondContact CE1-O 3.07Å; H238-R405 PolarHBondContact NE2-O 3.19Å; L239-R405 PolarHBondContact O-NH1 3.29Å; L239-R405 PolarHBondContact O-NH2 3.36Å; H403-R405 PolarHBondContact O-N 3.24Å; H403-R405 VanDerWaalsContact O-N 3.16Å
406	E	92.1	Very high	92.4	Very high	139 Å²	139	72.6 Å²	72.6	65%	0.65	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-24.3	176.4	-61.8	174	-172.5	0	0	111.2	H403 I404	H403-E406 HydrophobicContact CB-CB 4.34Å; H403-E406 IonicContact CD2-OE1 2.75Å; H403-E406 IonicContact CD2-OE2 3.11Å; H403-E406 PolarHBondContact CD2-OE2 3.32Å; H403-E406 IonicContact CG-OE2 3.69Å; H403-E406 WeakPolarHBondContact O-CB 3.43Å; H403-E406 PolarHBondContact O-N 3.1Å; I404-E406 VanDerWaalsContact C-N 3.32Å; I404-E406 PolarHBondContact O-N 3.32Å
407	R	90.2	Very high	91.9	Very high	119 Å²	119	74.9 Å²	74.9	45%	0.449	41%	0.406	S	S	.	.	S	Bend	trans	-76	154.1	176.1	-64.4	177.8	-176.4	-158.5	-1	111	H238 D400 H403 I404 A409	H238-R407 PolarHBondContact CE1-O 3.43Å; H238-R407 PolarHBondContact NE2-O 3.23Å; H238-R407 VanDerWaalsContact NE2-O 3.15Å; D400-R407 IonicContact OD2-CZ 3.71Å; D400-R407 IonicContact OD2-NE 3.88Å; D400-R407 IonicContact OD2-NH2 3.6Å; D400-R407 PolarHBondContact OD2-NH2 3.27Å; H403-R407 PolarHBondContact O-N 3.21Å; I404-R407 PolarHBondContact O-N 2.88Å; R407-A409 PolarHBondContact O-N 3.49Å
408	P	93	Very high	91.3	Very high	119 Å²	119	77.4 Å²	77.4	77%	0.773	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-60.2	134	171.4	-22	33.5	0	0	0	111.2
409	A	94.7	Very high	91	Very high	16 Å²	16	77 Å²	77	13%	0.132	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-63.5	149	171.2	0	0	0	0	0	110.8	F204 R236 G237 R407 I411	F204-A409 HydrophobicContact CE1-CB 4.06Å; F204-A409 HydrophobicContact CZ-CB 4.09Å; R236-A409 WeakPolarHBondContact O-CB 3.41Å; G237-A409 WeakPolarHBondContact O-CB 3.44Å; R407-A409 PolarHBondContact O-N 3.49Å; A409-I411 PolarHBondContact O-N 3.01Å
410	P	94.1	Very high	90.7	Very high	55 Å²	55	76.2 Å²	76.2	36%	0.357	38%	0.382	S	S	.	.	S	Bend	trans	-67.7	-22.8	-175.6	27.6	-36.4	0	0	0	113.1	A201 F204 Y205	A201-P410 HydrophobicContact CB-CB 3.98Å; A201-P410 HydrophobicContact CB-CG 3.99Å; F204-P410 HydrophobicContact CB-CG 3.93Å; F204-P410 HydrophobicContact CD1-CG 3.7Å; F204-P410 VanDerWaalsContact CE1-CD 3.47Å; F204-P410 HydrophobicContact CE1-CG 4.38Å; F204-P410 VanDerWaalsContact CG-CD 3.48Å; F204-P410 HydrophobicContact CG-CG 3.82Å; Y205-P410 HydrophobicContact CE2-CG 3.94Å
411	I	91.8	Very high	90.4	Very high	36 Å²	36	75.4 Å²	75.4	19%	0.185	38%	0.378	C	S	.	.	S	Bend	trans	-117.7	118.7	176.9	-56.9	174.1	0	0	0	108	L190 L197 Y205 A409 I413	L190-I411 HydrophobicContact CD1-CD1 4.14Å; L190-I411 HydrophobicContact CD1-CG2 4.12Å; L190-I411 HydrophobicContact CD2-CD1 3.9Å; L190-I411 HydrophobicContact CG-CD1 4.4Å; L197-I411 HydrophobicContact CD2-CD1 3.65Å; Y205-I411 HydrophobicContact CE2-CD1 3.83Å; Y205-I411 HydrophobicContact CE2-CG1 4.26Å; Y205-I411 WeakPolarHBondContact OH-CB 3.34Å; A409-I411 PolarHBondContact O-N 3.01Å; I411-I413 PolarHBondContact O-N 2.74Å
412	R	87.7	Confident	90.1	Very high	209 Å²	209	77.1 Å²	77.1	79%	0.789	40%	0.395	S	S	*	.	P	Polyproline II helix	trans	-71.3	127	174.5	-178.7	176.9	172.7	140.1	3.6	109.5	D414	R412-D414 IonicContact NE-OD1 3.49Å; R412-D414 PolarHBondContact NE-OD1 2.87Å
413	I	89.1	Confident	89.8	Confident	20 Å²	20	70.1 Å²	70.1	10%	0.103	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-89.2	117.8	170.5	-53	-55.3	0	0	0	107.9	L233 G237 I411 V415 N423	L233-I413 HydrophobicContact CD1-CD1 4.04Å; G237-I413 VanDerWaalsContact CA-CG1 3.5Å; I411-I413 PolarHBondContact O-N 2.74Å; I413-V415 HydrophobicContact CB-CG2 4.41Å; I413-V415 HydrophobicContact CG2-CG2 3.51Å; I413-N423 WeakPolarHBondContact CG2-ND2 3.15Å
414	D	87.9	Confident	89.5	Confident	102 Å²	102	67.8 Å²	67.8	55%	0.545	35%	0.352	S	S	.	.	P	Polyproline II helix	trans	-83.4	116.8	172.3	-65.1	-41	0	0	0	109.1	R412 N423	R412-D414 IonicContact NE-OD1 3.49Å; R412-D414 PolarHBondContact NE-OD1 2.87Å; D414-N423 PolarHBondContact O-ND2 2.81Å
415	V	86.3	Confident	88.8	Confident	47 Å²	47	68.6 Å²	68.6	29%	0.285	36%	0.356	S	S	.	.			trans	-132.2	119.4	-178.9	-178	0	0	0	0	107.5	P183 I413 S417 D420	P183-V415 HydrophobicContact CB-CG1 3.83Å; P183-V415 HydrophobicContact CB-CG2 3.98Å; P183-V415 HydrophobicContact CG-CG1 4.12Å; P183-V415 HydrophobicContact CG-CG2 4.09Å; I413-V415 HydrophobicContact CB-CG2 4.41Å; I413-V415 HydrophobicContact CG2-CG2 3.51Å; V415-S417 WeakPolarHBondContact CG1-O 3.29Å; V415-D420 HydrophobicContact CG1-CB 3.88Å
416	N	86.8	Confident	88.2	Confident	142 Å²	142	75.2 Å²	75.2	76%	0.759	39%	0.388	S	S	*	.	S	Bend	trans	-88.3	-25.6	-175.3	-58.7	-70.4	0	0	0	113.1	D420	N416-D420 WeakPolarHBondContact CB-OD2 3.49Å; N416-D420 PolarHBondContact N-OD2 3.33Å; N416-D420 PolarHBondContact ND2-OD2 3.1Å
417	S	87	Confident	87.5	Confident	50 Å²	50	70.3 Å²	70.3	35%	0.35	37%	0.365	S	S	.	.	S	Bend	trans	-154.4	165.1	-178.1	64.2	0	0	0	0	111.6	V415 D419 D420	V415-S417 WeakPolarHBondContact CG1-O 3.29Å; S417-D419 WeakPolarHBondContact CB-OD1 3.29Å; S417-D419 PolarHBondContact O-N 2.73Å; S417-D419 VanDerWaalsContact O-N 3.16Å; S417-D419 PolarHBondContact OG-OD1 3.1Å; S417-D420 VanDerWaalsContact O-CB 3.25Å; S417-D420 WeakPolarHBondContact O-CB 3.21Å; S417-D420 PolarHBondContact O-N 2.98Å; S417-D420 VanDerWaalsContact O-N 3.07Å; S417-D420 PolarHBondContact OG-N 3.11Å
418	I	83.9	Confident	86.2	Confident	128 Å²	128	69.2 Å²	69.2	66%	0.656	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-17.6	179.9	59.5	169.4	0	0	0	113.8	V127 F181	V127-I418 HydrophobicContact CG2-CD1 4.14Å; V127-I418 HydrophobicContact CG2-CG1 4.41Å; F181-I418 WeakPolarHBondContact CD1-O 3.4Å
419	D	84.6	Confident	84.7	Confident	72 Å²	72	71.4 Å²	71.4	39%	0.385	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	14.1	178.5	62.1	-21	0	0	0	112.1	L105 L118 V127 S417 T421	L105-D419 HydrophobicContact CD1-CB 4.5Å; L118-D419 HydrophobicContact CD2-CB 4.01Å; V127-D419 HydrophobicContact CG2-CB 4.39Å; S417-D419 WeakPolarHBondContact CB-OD1 3.29Å; S417-D419 PolarHBondContact O-N 2.73Å; S417-D419 VanDerWaalsContact O-N 3.16Å; S417-D419 PolarHBondContact OG-OD1 3.1Å; D419-T421 PolarHBondContact O-N 3.1Å
420	D	88.9	Confident	83.1	Confident	16 Å²	16	72.1 Å²	72.1	9%	0.086	38%	0.381	C	S	.	.			trans	-62.7	128.4	178	-168.5	-20.3	0	0	0	110.3	F181 V415 N416 S417 S422	F181-D420 VanDerWaalsContact CZ-O 3.31Å; F181-D420 WeakPolarHBondContact CZ-O 3.38Å; V415-D420 HydrophobicContact CG1-CB 3.88Å; N416-D420 WeakPolarHBondContact CB-OD2 3.49Å; N416-D420 PolarHBondContact N-OD2 3.33Å; N416-D420 PolarHBondContact ND2-OD2 3.1Å; S417-D420 VanDerWaalsContact O-CB 3.25Å; S417-D420 WeakPolarHBondContact O-CB 3.21Å; S417-D420 PolarHBondContact O-N 2.98Å; S417-D420 VanDerWaalsContact O-N 3.07Å; S417-D420 PolarHBondContact OG-N 3.11Å; D420-S422 WeakPolarHBondContact OD1-CB 3.46Å; D420-S422 PolarHBondContact OD1-N 3.3Å; D420-S422 PolarHBondContact OD1-OG 2.98Å; D420-S422 PolarHBondContact OD2-OG 2.83Å
421	T	88.7	Confident	81.8	Confident	19 Å²	19	73.8 Å²	73.8	12%	0.117	39%	0.387	C	S	.	.			trans	-121.2	18.6	-179.1	53.4	0	0	0	0	112.8	K106 I108 L118 F181 D419 N423 F424	K106-T421 HydrophobicContact CD-CG2 4.07Å; K106-T421 VanDerWaalsContact CD-OG1 3.25Å; K106-T421 WeakPolarHBondContact CD-OG1 3.21Å; K106-T421 PolarHBondContact NZ-OG1 2.99Å; I108-T421 HydrophobicContact CG2-CG2 3.8Å; L118-T421 HydrophobicContact CD2-CG2 3.77Å; F181-T421 HydrophobicContact CZ-CG2 4.24Å; D419-T421 PolarHBondContact O-N 3.1Å; T421-N423 PolarHBondContact O-N 2.93Å; T421-F424 PolarHBondContact O-N 2.61Å; T421-F424 VanDerWaalsContact O-N 3.14Å
422	S	88.4	Confident	80.6	Confident	67 Å²	67	75.6 Å²	75.6	47%	0.469	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-17.9	178.6	58.9	0	0	0	0	114	D420 F424	D420-S422 WeakPolarHBondContact OD1-CB 3.46Å; D420-S422 PolarHBondContact OD1-N 3.3Å; D420-S422 PolarHBondContact OD1-OG 2.98Å; D420-S422 PolarHBondContact OD2-OG 2.83Å; S422-F424 VanDerWaalsContact C-N 3.35Å
423	N	88.5	Confident	79.3	Confident	21 Å²	21	73.1 Å²	73.1	11%	0.112	39%	0.391	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	7.1	174	-64.3	-47.2	0	0	0	114	P183 K193 I413 D414 T421	P183-N423 WeakPolarHBondContact O-CB 3.32Å; P183-N423 PolarHBondContact O-ND2 2.7Å; K193-N423 PolarHBondContact NZ-OD1 2.86Å; I413-N423 WeakPolarHBondContact CG2-ND2 3.15Å; D414-N423 PolarHBondContact O-ND2 2.81Å; T421-N423 PolarHBondContact O-N 2.93Å
424	F	86.8	Confident	77.9	Confident	26 Å²	26	73.2 Å²	73.2	11%	0.114	39%	0.392	C	S	.	.	S	Bend	trans	-114.4	152.9	177.9	-65.3	-94.2	0	0	0	111.1	I108 F181 L182 T421 S422	I108-F424 HydrophobicContact CB-CD1 3.85Å; I108-F424 HydrophobicContact CB-CE1 4.19Å; I108-F424 HydrophobicContact CB-CG 4.18Å; I108-F424 HydrophobicContact CD1-CE1 4.27Å; I108-F424 HydrophobicContact CG2-CG 4.42Å; I108-F424 WeakPolarHBondContact O-CD1 3.45Å; F181-F424 HydrophobicContact CD2-CZ 4.42Å; F181-F424 HydrophobicContact CE2-CD2 4.47Å; F181-F424 AromaticContact CE2-CE2 3.5Å; F181-F424 HydrophobicContact CE2-CE2 3.5Å; F181-F424 AromaticContact CE2-CZ 3.51Å; F181-F424 HydrophobicContact CE2-CZ 3.51Å; F181-F424 HydrophobicContact CZ-CD2 4.5Å; F181-F424 AromaticContact CZ-CE2 3.65Å; F181-F424 HydrophobicContact CZ-CE2 3.65Å; F181-F424 HydrophobicContact CZ-CZ 4.13Å; L182-F424 VanDerWaalsContact O-CZ 3.24Å; L182-F424 WeakPolarHBondContact O-CZ 3.12Å; T421-F424 PolarHBondContact O-N 2.61Å; T421-F424 VanDerWaalsContact O-N 3.14Å; S422-F424 VanDerWaalsContact C-N 3.35Å
425	D	80.4	Confident	76.3	Confident	19 Å²	19	78.1 Å²	78.1	10%	0.102	40%	0.403	C	S	.	.			trans	-61.3	143.3	170.4	-78.9	-18.1	0	0	0	111	R289 Y293 F427	R289-D425 IonicContact CZ-OD1 3.53Å; R289-D425 IonicContact NE-OD1 3.56Å; R289-D425 PolarHBondContact NE-OD1 3.4Å; R289-D425 IonicContact NE-OD2 2.72Å; R289-D425 PolarHBondContact NE-OD2 3.19Å; R289-D425 IonicContact NH2-OD1 2.85Å; R289-D425 PolarHBondContact NH2-OD1 3.03Å; Y293-D425 PolarHBondContact OH-OD2 3.41Å; D425-F427 HydrophobicContact CB-CE2 4.21Å; D425-F427 HydrophobicContact CB-CZ 4.14Å; D425-F427 WeakPolarHBondContact O-CD2 3.45Å; D425-F427 WeakPolarHBondContact O-CE2 3.33Å
426	E	80.3	Confident	74.4	Confident	158 Å²	158	84.6 Å²	84.6	74%	0.738	43%	0.427	S	S	*	.			trans	-83	131.1	172.3	-65.4	-168.5	164.5	0	0	110.8	P428	E426-P428 VanDerWaalsContact O-CD 3.27Å; E426-P428 WeakPolarHBondContact O-CD 3.28Å
427	F	77.3	Confident	72.2	Confident	35 Å²	35	86.9 Å²	86.9	15%	0.154	43%	0.43	C	S	.	.			trans	-111.1	90.1	173.7	-58.7	-83.5	0	0	0	108.8	V107 R110 Y293 D425 V430	V107-F427 HydrophobicContact CG1-CD2 4.23Å; V107-F427 HydrophobicContact CG1-CG 4.5Å; R110-F427 HydrophobicContact CB-CE1 4.18Å; R110-F427 HydrophobicContact CG-CD1 4.17Å; R110-F427 HydrophobicContact CG-CE1 4.12Å; Y293-F427 AromaticContact CE1-CE1 3.85Å; Y293-F427 HydrophobicContact CE1-CE1 3.85Å; Y293-F427 AromaticContact CE1-CZ 3.93Å; Y293-F427 HydrophobicContact CE1-CZ 3.93Å; Y293-F427 HydrophobicContact CE2-CE1 4.47Å; Y293-F427 AromaticContact CZ-CE1 3.74Å; Y293-F427 AromaticContact CZ-CZ 3.82Å; Y293-F427 VanDerWaalsContact OH-CZ 3.27Å; Y293-F427 WeakPolarHBondContact OH-CZ 3.4Å; D425-F427 HydrophobicContact CB-CE2 4.21Å; D425-F427 HydrophobicContact CB-CZ 4.14Å; D425-F427 WeakPolarHBondContact O-CD2 3.45Å; D425-F427 WeakPolarHBondContact O-CE2 3.33Å; F427-V430 HydrophobicContact CB-CG2 3.76Å; F427-V430 WeakPolarHBondContact O-CG2 3.32Å
428	P	64	Low	70.2	Confident	96 Å²	96	87.1 Å²	87.1	62%	0.623	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	154.4	172.1	25.4	-31.6	0	0	0	110.7	E426	E426-P428 VanDerWaalsContact O-CD 3.27Å; E426-P428 WeakPolarHBondContact O-CD 3.28Å
429	D	60.5	Low	68.2	Low	166 Å²	166	87.7 Å²	87.7	89%	0.888	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.7	25.4	172	-49.7	-41.4	0	0	0	117.9
430	V	62.8	Low	66.4	Low	31 Å²	31	88.6 Å²	88.6	19%	0.188	45%	0.453	C	S	.	.			trans	-94.2	126.6	176	-158	0	0	0	0	112.3	V107 R110 F427 L432	V107-V430 HydrophobicContact CB-CG2 4.42Å; V107-V430 HydrophobicContact CG2-CB 3.97Å; V107-V430 HydrophobicContact CG2-CG1 3.69Å; V107-V430 HydrophobicContact CG2-CG2 4.27Å; R110-V430 VanDerWaalsContact NH2-CG1 3.32Å; F427-V430 HydrophobicContact CB-CG2 3.76Å; F427-V430 WeakPolarHBondContact O-CG2 3.32Å; V430-L432 PolarHBondContact O-N 3.37Å
431	D	65.8	Low	64.6	Low	89 Å²	89	94.1 Å²	94.1	48%	0.476	48%	0.476	S	S	.	.			trans	-67.4	106.9	168.8	-172.8	3.4	0	0	0	110.3	R117 K433	R117-D431 PolarHBondContact NH2-O 3.22Å; D431-K433 PolarHBondContact O-N 2.98Å; D431-K433 VanDerWaalsContact OD1-CB 3.24Å; D431-K433 WeakPolarHBondContact OD1-CB 3.47Å; D431-K433 WeakPolarHBondContact OD1-CG 3.4Å; D431-K433 PolarHBondContact OD1-N 3.47Å
432	L	67.5	Low	63	Low	74 Å²	74	95.8 Å²	95.8	39%	0.387	49%	0.488	S	S	.	.			trans	-66.2	-14.6	176.9	-68	172.1	0	0	0	112.3	P104 V107 R117 V430 L434	P104-L432 WeakPolarHBondContact CG-O 3.19Å; V107-L432 HydrophobicContact CG2-CD2 4.16Å; R117-L432 PolarHBondContact NH1-O 3.38Å; V430-L432 PolarHBondContact O-N 3.37Å; L432-L434 PolarHBondContact O-N 3.48Å; L432-L434 VanDerWaalsContact O-N 3.07Å
433	K	60.6	Low	61.4	Low	157 Å²	157	93.5 Å²	93.5	68%	0.683	47%	0.47	S	S	*	.			trans	-67.5	113.4	177	-65.2	178.5	-178.5	174.3	0	110	D431 R435	D431-K433 PolarHBondContact O-N 2.98Å; D431-K433 VanDerWaalsContact OD1-CB 3.24Å; D431-K433 WeakPolarHBondContact OD1-CB 3.47Å; D431-K433 WeakPolarHBondContact OD1-CG 3.4Å; D431-K433 PolarHBondContact OD1-N 3.47Å; K433-R435 PolarHBondContact O-N 2.99Å
434	L	59.5	Low	59.6	Low	23 Å²	23	99.7 Å²	99.7	12%	0.12	50%	0.496	C	S	.	.			trans	-64.2	103.4	163.1	-69.4	160.6	0	0	0	106.8	V99 P104 R117 V132 L432 K436	V99-L434 HydrophobicContact CG1-CB 3.54Å; V99-L434 HydrophobicContact CG1-CD1 3.37Å; V99-L434 HydrophobicContact CG1-CD2 4.28Å; V99-L434 HydrophobicContact CG1-CG 3.87Å; P104-L434 HydrophobicContact CB-CD1 4.13Å; P104-L434 HydrophobicContact CB-CG 4.46Å; P104-L434 HydrophobicContact CG-CD1 4.01Å; P104-L434 HydrophobicContact CG-CG 4.27Å; R117-L434 VanDerWaalsContact NH1-CD2 3.33Å; R117-L434 VanDerWaalsContact NH1-CG 3.35Å; V132-L434 HydrophobicContact CG2-CD2 4.34Å; L432-L434 PolarHBondContact O-N 3.48Å; L432-L434 VanDerWaalsContact O-N 3.07Å; L434-K436 PolarHBondContact O-N 3.06Å
435	R	54.2	Low	58.2	Low	204 Å²	204	106.2 Å²	106.2	77%	0.77	52%	0.519	S	S	*	.			trans	-52.4	112.5	-175.6	-74.5	-174	172.5	-169.3	-1.7	109.8	K433 K437	K433-R435 PolarHBondContact O-N 2.99Å; R435-K437 PolarHBondContact O-N 3.33Å
436	K	46.5	Very low	56.9	Low	183 Å²	183	107.4 Å²	107.4	80%	0.796	53%	0.526	S	S	*	.			trans	-75	113.2	171.7	-71.2	-179.4	178.2	177.7	0	107.8	L434	L434-K436 PolarHBondContact O-N 3.06Å
437	K	39.9	Very low	55.5	Low	190 Å²	190	101.3 Å²	101.3	83%	0.826	50%	0.498	S	S	*	.			trans	55.5	103.1	174.9	-67.8	-177.4	174.9	-178.6	0	115.8	R435	R435-K437 PolarHBondContact O-N 3.33Å
438	P	44.3	Very low	54.4	Low	56 Å²	56	104.2 Å²	104.2	36%	0.364	51%	0.512	S	S	.	.			trans	-73	148.7	142.5	-6.1	27	0	0	0	108.1	S173 A440	S173-P438 WeakPolarHBondContact OG-CD 3.47Å; S173-P438 VanDerWaalsContact OG-CG 3.29Å; S173-P438 WeakPolarHBondContact OG-CG 3.39Å; P438-A440 PolarHBondContact O-N 2.95Å
439	D	42.5	Very low	54	Low	139 Å²	139	102.3 Å²	102.3	74%	0.743	50%	0.504	S	S	*	.			trans	-47.3	137.1	172.2	-68.7	-46.9	0	0	0	110.5	F441 P442	D439-F441 HydrophobicContact CB-CB 4.43Å; D439-F441 PolarHBondContact O-N 3.38Å; D439-P442 WeakPolarHBondContact O-CD 3.38Å
440	A	47.2	Very low	53.5	Low	91 Å²	91	97.8 Å²	97.8	75%	0.752	48%	0.478	S	S	*	.	S	Bend	trans	-67	23.7	-177.6	0	0	0	0	0	114.3	P438	P438-A440 PolarHBondContact O-N 2.95Å
441	F	51.5	Low	52.8	Low	133 Å²	133	98.5 Å²	98.5	58%	0.583	48%	0.484	S	S	*	.			trans	-108.1	-11.5	-165.7	-125.6	-97.6	0	0	0	118	D439	D439-F441 HydrophobicContact CB-CB 4.43Å; D439-F441 PolarHBondContact O-N 3.38Å
442	P	55.2	Low	52.2	Low	54 Å²	54	101.4 Å²	101.4	35%	0.351	50%	0.498	S	S	.	.	H	α-helix	trans	-82.8	-39.3	-174.3	26.7	-29.8	0	0	0	114.2	I136 D439 K444 R445 L446	I136-P442 HydrophobicContact CD1-CB 4.17Å; I136-P442 HydrophobicContact CD1-CG 4.29Å; D439-P442 WeakPolarHBondContact O-CD 3.38Å; P442-K444 PolarHBondContact O-N 2.71Å; P442-R445 PolarHBondContact O-N 3.2Å; P442-L446 WeakPolarHBondContact O-CB 3.44Å; P442-L446 PolarHBondContact O-N 2.97Å
443	I	53.6	Low	51.4	Low	19 Å²	19	101.2 Å²	101.2	10%	0.097	51%	0.508	C	S	.	.	H	α-helix	trans	-68	-42	-170.4	-57.1	177.3	0	0	0	111.9	K135 I136 L139 S172 R445 L446 I447 A469	K135-I443 HydrophobicContact CB-CD1 4Å; K135-I443 HydrophobicContact CD-CD1 4.14Å; I136-I443 HydrophobicContact CD1-CG1 4.42Å; I136-I443 HydrophobicContact CG1-CG1 3.91Å; L139-I443 HydrophobicContact CD1-CG2 3.69Å; S172-I443 VanDerWaalsContact O-CD1 3.23Å; S172-I443 WeakPolarHBondContact O-CD1 3.24Å; I443-R445 PolarHBondContact O-N 3.23Å; I443-L446 PolarHBondContact O-N 3.36Å; I443-I447 HydrophobicContact CG2-CD1 3.87Å; I443-I447 HydrophobicContact CG2-CG1 4.4Å; I443-I447 WeakPolarHBondContact O-CG1 3.28Å; I443-I447 PolarHBondContact O-N 3.2Å; I443-A469 HydrophobicContact CG2-CB 3.5Å; I443-A469 VanDerWaalsContact CG2-CB 3.5Å
444	K	52.3	Low	50.5	Low	151 Å²	151	100.1 Å²	100.1	66%	0.657	51%	0.509	S	S	*	.	H	α-helix	trans	-63.1	-43.7	179.9	-164.7	178.8	178.5	-175.2	0	112	P442 E448	P442-K444 PolarHBondContact O-N 2.71Å; K444-E448 WeakPolarHBondContact CE-OE1 3.36Å; K444-E448 WeakPolarHBondContact O-CB 3.47Å; K444-E448 VanDerWaalsContact O-CG 3.24Å; K444-E448 WeakPolarHBondContact O-CG 3.41Å; K444-E448 PolarHBondContact O-N 3.23Å
445	R	56.4	Low	49.7	Very low	162 Å²	162	103.9 Å²	103.9	61%	0.611	54%	0.535	S	S	*	.	H	α-helix	trans	-67.3	-33.9	175.4	-83.9	-172.1	173.6	178.2	0.3	113.1	P442 I443 E448 A449	P442-R445 PolarHBondContact O-N 3.2Å; I443-R445 PolarHBondContact O-N 3.23Å; R445-E448 PolarHBondContact O-N 2.75Å; R445-A449 WeakPolarHBondContact O-CB 3.38Å; R445-A449 PolarHBondContact O-N 3.24Å
446	L	52.5	Low	49.1	Very low	45 Å²	45	97.4 Å²	97.4	24%	0.236	52%	0.519	C	S	.	.	H	α-helix	trans	-69	-43.1	179	-157.9	103.9	0	0	0	111.3	I136 E140 P442 I443 A449 Q450	I136-L446 HydrophobicContact CG2-CD2 4.05Å; E140-L446 HydrophobicContact CG-CD2 3.63Å; E140-L446 WeakPolarHBondContact OE1-CD2 3.43Å; P442-L446 WeakPolarHBondContact O-CB 3.44Å; P442-L446 PolarHBondContact O-N 2.97Å; I443-L446 PolarHBondContact O-N 3.36Å; L446-A449 PolarHBondContact O-N 2.79Å; L446-Q450 WeakPolarHBondContact O-CB 3.35Å; L446-Q450 WeakPolarHBondContact O-CG 3.16Å; L446-Q450 PolarHBondContact O-N 3.35Å
447	I	52	Low	48.7	Very low	30 Å²	30	94.5 Å²	94.5	15%	0.154	52%	0.519	C	S	.	.	H	α-helix	trans	-61	-46.5	172.9	-65.9	168.9	0	0	0	109.9	I443 A449 Q450 C451 V465 A469	I443-I447 HydrophobicContact CG2-CD1 3.87Å; I443-I447 HydrophobicContact CG2-CG1 4.4Å; I443-I447 WeakPolarHBondContact O-CG1 3.28Å; I443-I447 PolarHBondContact O-N 3.2Å; I447-A449 PolarHBondContact O-N 3.33Å; I447-Q450 PolarHBondContact O-N 2.9Å; I447-C451 PolarHBondContact O-N 2.95Å; I447-C451 VanDerWaalsContact O-N 3.14Å; I447-C451 PolarHBondContact O-SG 3.3Å; I447-V465 HydrophobicContact CG2-CG1 4.38Å; I447-V465 WeakPolarHBondContact CG2-O 3.42Å; I447-A469 HydrophobicContact CD1-CB 4.41Å
448	E	53.8	Low	48.7	Very low	96 Å²	96	90 Å²	90	45%	0.449	52%	0.517	S	S	.	.	H	α-helix	trans	-61.4	-41.4	176.6	-73.2	167	-177.4	0	0	112.3	K444 R445 L452	K444-E448 WeakPolarHBondContact CE-OE1 3.36Å; K444-E448 WeakPolarHBondContact O-CB 3.47Å; K444-E448 VanDerWaalsContact O-CG 3.24Å; K444-E448 WeakPolarHBondContact O-CG 3.41Å; K444-E448 PolarHBondContact O-N 3.23Å; R445-E448 PolarHBondContact O-N 2.75Å; E448-L452 WeakPolarHBondContact O-CD1 3.1Å; E448-L452 WeakPolarHBondContact O-CG 3.32Å; E448-L452 PolarHBondContact O-N 2.65Å
449	A	55.3	Low	48.2	Very low	55 Å²	55	96.4 Å²	96.4	46%	0.455	54%	0.539	S	S	.	.	H	α-helix	trans	-70.8	-37.5	179.3	0	0	0	0	0	113.2	R445 L446 I447 L452 A453	R445-A449 WeakPolarHBondContact O-CB 3.38Å; R445-A449 PolarHBondContact O-N 3.24Å; L446-A449 PolarHBondContact O-N 2.79Å; I447-A449 PolarHBondContact O-N 3.33Å; A449-L452 PolarHBondContact O-N 2.74Å; A449-A453 WeakPolarHBondContact O-CB 3.35Å; A449-A453 PolarHBondContact O-N 2.94Å
450	Q	51.2	Low	47.7	Very low	72 Å²	72	99.2 Å²	99.2	34%	0.336	55%	0.548	S	S	.	.	H	α-helix	trans	-68.1	-37.2	176.4	-75.7	176.8	-8.8	0	0	112.2	L446 I447 L452 A453 N454	L446-Q450 WeakPolarHBondContact O-CB 3.35Å; L446-Q450 WeakPolarHBondContact O-CG 3.16Å; L446-Q450 PolarHBondContact O-N 3.35Å; I447-Q450 PolarHBondContact O-N 2.9Å; Q450-L452 VanDerWaalsContact C-N 3.27Å; Q450-L452 PolarHBondContact O-N 3.18Å; Q450-A453 PolarHBondContact O-N 3.46Å; Q450-N454 PolarHBondContact O-N 3.32Å
451	C	47.4	Very low	47.2	Very low	46 Å²	46	98.5 Å²	98.5	31%	0.311	55%	0.55	S	S	.	.	H	α-helix	trans	-61.4	-36	172.7	-66.5	0	0	0	0	112.9	I447 V465	I447-C451 PolarHBondContact O-N 2.95Å; I447-C451 VanDerWaalsContact O-N 3.14Å; I447-C451 PolarHBondContact O-SG 3.3Å; C451-V465 WeakPolarHBondContact SG-CB 3.23Å; C451-V465 WeakPolarHBondContact SG-CG1 3.49Å
452	L	53.3	Low	46.6	Very low	149 Å²	149	102 Å²	102	78%	0.78	57%	0.565	S	S	*	*	H	α-helix	trans	-77	-33.8	179.3	-73.2	164.2	0	0	0	112.2	E448 A449 Q450	E448-L452 WeakPolarHBondContact O-CD1 3.1Å; E448-L452 WeakPolarHBondContact O-CG 3.32Å; E448-L452 PolarHBondContact O-N 2.65Å; A449-L452 PolarHBondContact O-N 2.74Å; Q450-L452 VanDerWaalsContact C-N 3.27Å; Q450-L452 PolarHBondContact O-N 3.18Å
453	A	51.3	Low	45.5	Very low	71 Å²	71	102.6 Å²	102.6	59%	0.587	57%	0.569	S	S	*	*	H	α-helix	trans	-79.5	-33.3	-178.5	0	0	0	0	0	113.5	A449 Q450	A449-A453 WeakPolarHBondContact O-CB 3.35Å; A449-A453 PolarHBondContact O-N 2.94Å; Q450-A453 PolarHBondContact O-N 3.46Å
454	N	41.4	Very low	44.9	Very low	133 Å²	133	108.6 Å²	108.6	71%	0.711	60%	0.6	S	S	*	*	S	Bend	trans	-137.7	86.1	-179.4	-74.9	-40.9	0	0	0	110.9	Q450	Q450-N454 PolarHBondContact O-N 3.32Å
455	P	41.8	Very low	44.4	Very low	102 Å²	102	103.6 Å²	103.6	66%	0.662	58%	0.582	S	S	*	*	P	Polyproline II helix	trans	-64.7	131.9	175.3	24.8	-31.2	0	0	0	110.2
456	P	41.7	Very low	43.8	Very low	69 Å²	69	100.7 Å²	100.7	45%	0.448	58%	0.579	S	S	.	*	P	Polyproline II helix	trans	-65.3	144.3	-178.3	24.8	-32.3	0	0	0	111.1	A458 P463	P456-A458 PolarHBondContact O-N 3.47Å; P456-P463 HydrophobicContact CB-CB 4.44Å; P456-P463 HydrophobicContact CB-CG 4.27Å; P456-P463 HydrophobicContact CG-CB 3.92Å; P456-P463 HydrophobicContact CG-CG 3.62Å
457	P	37.8	Very low	43.6	Very low	121 Å²	121	102.3 Å²	102.3	79%	0.786	59%	0.587	S	S	*	*	P	Polyproline II helix	trans	-61.9	130.3	179.2	23.4	-30.9	0	0	0	110.8	K459	P457-K459 VanDerWaalsContact C-N 3.27Å; P457-K459 PolarHBondContact O-N 2.85Å
458	A	39.4	Very low	43.7	Very low	96 Å²	96	104.2 Å²	104.2	79%	0.793	60%	0.598	S	S	*	*	S	Bend	trans	-74.5	74.8	-179.6	0	0	0	0	0	111	P456	P456-A458 PolarHBondContact O-N 3.47Å
459	K	34.8	Very low	43.7	Very low	190 Å²	190	99.8 Å²	99.8	83%	0.826	58%	0.578	S	S	*	*	S	Bend	trans	174.4	124.6	157.6	-95.2	150.7	-168.8	-171.1	0	109	P457	P457-K459 VanDerWaalsContact C-N 3.27Å; P457-K459 PolarHBondContact O-N 2.85Å
460	Q	31.4	Very low	43.9	Very low	199 Å²	199	100.6 Å²	100.6	93%	0.93	57%	0.574	S	S	*	*	S	Bend	trans	80.3	108.3	175.9	-54	177.3	0.4	0	0	116.1
461	G	36.7	Very low	44.3	Very low	76 Å²	76	98.3 Å²	98.3	78%	0.784	56%	0.564	S	S	*	*	S	Bend	trans	95.3	129.5	169.2	0	0	0	0	0	115.1
462	K	38.5	Very low	45.1	Very low	206 Å²	206	96.9 Å²	96.9	90%	0.896	55%	0.554	S	S	*	*			trans	-60.8	133.2	172.7	-77.8	177.4	178.1	174.5	0	109.4	L464	K462-L464 PolarHBondContact O-N 3.11Å
463	P	34	Very low	45.9	Very low	67 Å²	67	89.9 Å²	89.9	44%	0.435	52%	0.517	S	S	.	.			trans	-59.1	136.3	174.9	-21.6	33.4	0	0	0	111.1	P456 V465	P456-P463 HydrophobicContact CB-CB 4.44Å; P456-P463 HydrophobicContact CB-CG 4.27Å; P456-P463 HydrophobicContact CG-CB 3.92Å; P456-P463 HydrophobicContact CG-CG 3.62Å; P463-V465 HydrophobicContact CB-CG2 3.35Å; P463-V465 PolarHBondContact O-N 3.46Å
464	L	40.9	Very low	46.2	Very low	145 Å²	145	88.8 Å²	88.8	76%	0.759	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-64.7	-7.7	176.2	-143.1	84.1	0	0	0	113.3	K462 D466	K462-L464 PolarHBondContact O-N 3.11Å; L464-D466 PolarHBondContact O-N 3.14Å
465	V	41	Very low	47.4	Very low	46 Å²	46	86 Å²	86	28%	0.279	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-84.8	3.2	-164.8	-105.6	0	0	0	0	115.7	I447 C451 P463	I447-V465 HydrophobicContact CG2-CG1 4.38Å; I447-V465 WeakPolarHBondContact CG2-O 3.42Å; C451-V465 WeakPolarHBondContact SG-CB 3.23Å; C451-V465 WeakPolarHBondContact SG-CG1 3.49Å; P463-V465 HydrophobicContact CB-CG2 3.35Å; P463-V465 PolarHBondContact O-N 3.46Å
466	D	43.9	Very low	48.9	Very low	101 Å²	101	81.2 Å²	81.2	54%	0.54	45%	0.454	S	S	.	.	G	3₁₀ helix	trans	-103.4	4	178.5	-97.4	-7.1	0	0	0	114.4	R27 L464	R27-D466 IonicContact CZ-OD1 2.79Å; R27-D466 IonicContact CZ-OD2 2.79Å; R27-D466 IonicContact NH2-OD1 3.75Å; R27-D466 PolarHBondContact NH2-OD1 3.06Å; R27-D466 IonicContact NH2-OD2 2.93Å; R27-D466 PolarHBondContact NH2-OD2 3.41Å; L464-D466 PolarHBondContact O-N 3.14Å
467	L	47.5	Very low	50.6	Low	78 Å²	78	82.1 Å²	82.1	41%	0.408	46%	0.459	S	S	.	.	S	Bend	trans	-94.2	108.9	-179.8	-72.8	154.2	0	0	0	109.6	A469 L471 V472	L467-A469 PolarHBondContact O-N 3.05Å; L467-L471 HydrophobicContact CD2-CB 4.26Å; L467-L471 HydrophobicContact CD2-CD1 4.1Å; L467-V472 HydrophobicContact CB-CG2 3.67Å
468	D	54.4	Low	52.6	Low	70 Å²	70	78.9 Å²	78.9	37%	0.374	43%	0.432	S	S	.	.			trans	-40	124.3	163.7	172.4	10.1	0	0	0	108.6	R35 D470 L471 V472	R35-D468 IonicContact CZ-OD2 3.42Å; R35-D468 IonicContact NH1-OD2 3.75Å; R35-D468 PolarHBondContact NH1-OD2 3.12Å; R35-D468 IonicContact NH2-OD2 2.65Å; D468-D470 PolarHBondContact O-N 3.35Å; D468-D470 PolarHBondContact OD1-N 3Å; D468-L471 HydrophobicContact CB-CD1 3.83Å; D468-L471 HydrophobicContact CB-CG 3.88Å; D468-L471 VanDerWaalsContact O-CA 3.32Å; D468-L471 WeakPolarHBondContact O-CA 3.29Å; D468-L471 WeakPolarHBondContact O-CB 3.44Å; D468-L471 PolarHBondContact O-N 3.04Å; D468-V472 PolarHBondContact O-N 3.47Å
469	A	53.8	Low	54.5	Low	4 Å²	4	75.5 Å²	75.5	3%	0.033	40%	0.4	C	S	.	.	H	α-helix	trans	-54.5	-27.6	-173.2	0	0	0	0	0	112.2	L139 I443 I447 L467 V472 F473	L139-A469 HydrophobicContact CD1-CB 3.9Å; I443-A469 HydrophobicContact CG2-CB 3.5Å; I443-A469 VanDerWaalsContact CG2-CB 3.5Å; I447-A469 HydrophobicContact CD1-CB 4.41Å; L467-A469 PolarHBondContact O-N 3.05Å; A469-V472 WeakPolarHBondContact O-CB 3.45Å; A469-V472 PolarHBondContact O-N 3.03Å; A469-F473 WeakPolarHBondContact O-CD2 3.4Å; A469-F473 PolarHBondContact O-N 3.45Å
470	D	59.1	Low	56.6	Low	71 Å²	71	67.3 Å²	67.3	38%	0.38	36%	0.364	S	S	.	.	H	α-helix	trans	-68.8	-32.4	173.2	-72.8	-18.5	0	0	0	113	K135 D468 V472 F473 M474	K135-D470 IonicContact NZ-OD1 3.95Å; K135-D470 PolarHBondContact NZ-OD1 2.82Å; D468-D470 PolarHBondContact O-N 3.35Å; D468-D470 PolarHBondContact OD1-N 3Å; D470-V472 VanDerWaalsContact C-N 3.29Å; D470-F473 CarbonylContact O-C 3.48Å; D470-F473 PolarHBondContact O-N 2.92Å; D470-M474 WeakPolarHBondContact O-CA 3.43Å; D470-M474 WeakPolarHBondContact O-CG 3.31Å; D470-M474 PolarHBondContact O-N 3.33Å
471	L	61.1	Low	58.6	Low	25 Å²	25	59.3 Å²	59.3	13%	0.131	33%	0.326	C	S	.	.	H	α-helix	trans	-62.1	-40.3	168.7	-62.2	172.8	0	0	0	111.2	R35 L467 D468 F473 M474	R35-L471 HydrophobicContact CB-CD2 3.94Å; R35-L471 HydrophobicContact CG-CD2 3.51Å; L467-L471 HydrophobicContact CD2-CB 4.26Å; L467-L471 HydrophobicContact CD2-CD1 4.1Å; D468-L471 HydrophobicContact CB-CD1 3.83Å; D468-L471 HydrophobicContact CB-CG 3.88Å; D468-L471 VanDerWaalsContact O-CA 3.32Å; D468-L471 WeakPolarHBondContact O-CA 3.29Å; D468-L471 WeakPolarHBondContact O-CB 3.44Å; D468-L471 PolarHBondContact O-N 3.04Å; L471-F473 PolarHBondContact O-N 3.47Å; L471-M474 HydrophobicContact CB-CE 3.95Å; L471-M474 HydrophobicContact CB-SD 4.5Å; L471-M474 HydrophobicContact CD2-CE 3.48Å; L471-M474 VanDerWaalsContact CD2-CE 3.48Å; L471-M474 HydrophobicContact CD2-CG 4.41Å; L471-M474 HydrophobicContact CD2-SD 3.38Å; L471-M474 WeakPolarHBondContact CD2-SD 3.38Å; L471-M474 HydrophobicContact CG-CE 4.34Å; L471-M474 HydrophobicContact CG-SD 4.49Å; L471-M474 PolarHBondContact O-N 2.82Å
472	V	63.9	Low	60.3	Low	15 Å²	15	59.2 Å²	59.2	9%	0.091	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-24.9	-179.6	-175.2	0	0	0	0	111.5	L139 V144 R148 L467 D468 A469 D470	L139-V472 HydrophobicContact CD2-CG1 4.36Å; V144-V472 HydrophobicContact CB-CG1 3.98Å; V144-V472 HydrophobicContact CG1-CG1 3.22Å; V144-V472 HydrophobicContact CG2-CG1 3.54Å; R148-V472 VanDerWaalsContact CZ-O 3.26Å; R148-V472 PolarHBondContact NE-O 3.21Å; R148-V472 VanDerWaalsContact NE-O 3.07Å; R148-V472 PolarHBondContact NH2-O 3.44Å; L467-V472 HydrophobicContact CB-CG2 3.67Å; D468-V472 PolarHBondContact O-N 3.47Å; A469-V472 WeakPolarHBondContact O-CB 3.45Å; A469-V472 PolarHBondContact O-N 3.03Å; D470-V472 VanDerWaalsContact C-N 3.29Å
473	F	69.8	Low	61.6	Low	3 Å²	3	49.6 Å²	49.6	1%	0.013	26%	0.264	C	S	.	.	T	Hydrogen-bonded Turn	trans	-116.5	17.1	177.6	-57.7	-66.9	0	0	0	113.5	K135 M138 V144 Q170 L175 A469 D470 L471 N475 Y476	K135-F473 HydrophobicContact CB-CE2 4.27Å; K135-F473 HydrophobicContact CD-CD2 4.09Å; K135-F473 HydrophobicContact CD-CE2 4.2Å; K135-F473 HydrophobicContact CG-CD2 4.21Å; K135-F473 HydrophobicContact CG-CE2 3.92Å; M138-F473 HydrophobicContact CB-CZ 4.29Å; V144-F473 HydrophobicContact CG1-CE1 4.28Å; V144-F473 HydrophobicContact CG2-CE1 4.25Å; V144-F473 HydrophobicContact CG2-CZ 3.98Å; Q170-F473 PolarHBondContact NE2-O 3.33Å; L175-F473 HydrophobicContact CD1-CD1 3.63Å; L175-F473 HydrophobicContact CD1-CE1 3.49Å; L175-F473 VanDerWaalsContact CD1-CE1 3.49Å; L175-F473 HydrophobicContact CD1-CG 4.3Å; L175-F473 HydrophobicContact CD1-CZ 4.05Å; L175-F473 HydrophobicContact CD2-CB 4.09Å; L175-F473 HydrophobicContact CD2-CD1 3.97Å; L175-F473 HydrophobicContact CD2-CD2 4.27Å; L175-F473 HydrophobicContact CD2-CG 3.84Å; L175-F473 HydrophobicContact CG-CD1 4.42Å; A469-F473 WeakPolarHBondContact O-CD2 3.4Å; A469-F473 PolarHBondContact O-N 3.45Å; D470-F473 CarbonylContact O-C 3.48Å; D470-F473 PolarHBondContact O-N 2.92Å; L471-F473 PolarHBondContact O-N 3.47Å; F473-N475 PolarHBondContact O-N 3.25Å; F473-Y476 WeakPolarHBondContact O-CB 3.34Å; F473-Y476 PolarHBondContact O-N 3.48Å
474	M	58.6	Low	63.1	Low	48 Å²	48	47 Å²	47	24%	0.236	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-28.9	-172.3	-100.5	-177.8	-41.8	0	0	115.5	L38 L39 D470 L471	L38-M474 HydrophobicContact CB-CE 4.34Å; L38-M474 HydrophobicContact CD1-CE 4.45Å; L39-M474 HydrophobicContact CD2-CG 4.2Å; L39-M474 HydrophobicContact CD2-SD 3.54Å; L39-M474 VanDerWaalsContact CD2-SD 3.54Å; L39-M474 HydrophobicContact CG-SD 3.88Å; D470-M474 WeakPolarHBondContact O-CA 3.43Å; D470-M474 WeakPolarHBondContact O-CG 3.31Å; D470-M474 PolarHBondContact O-N 3.33Å; L471-M474 HydrophobicContact CB-CE 3.95Å; L471-M474 HydrophobicContact CB-SD 4.5Å; L471-M474 HydrophobicContact CD2-CE 3.48Å; L471-M474 VanDerWaalsContact CD2-CE 3.48Å; L471-M474 HydrophobicContact CD2-CG 4.41Å; L471-M474 HydrophobicContact CD2-SD 3.38Å; L471-M474 WeakPolarHBondContact CD2-SD 3.38Å; L471-M474 HydrophobicContact CG-CE 4.34Å; L471-M474 HydrophobicContact CG-SD 4.49Å; L471-M474 PolarHBondContact O-N 2.82Å
475	N	65.3	Low	64	Low	73 Å²	73	40.8 Å²	40.8	39%	0.39	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102	7.2	-177.7	-65.6	-6.2	0	0	0	112.8	V42 R151 F473 T477	V42-N475 WeakPolarHBondContact CG1-OD1 3.37Å; V42-N475 WeakPolarHBondContact CG2-ND2 3.37Å; V42-N475 WeakPolarHBondContact CG2-OD1 3.45Å; R151-N475 VanDerWaalsContact NH1-CB 3.25Å; R151-N475 PolarHBondContact NH1-O 2.99Å; F473-N475 PolarHBondContact O-N 3.25Å; N475-T477 PolarHBondContact O-N 3.46Å; N475-T477 VanDerWaalsContact O-N 3.17Å
476	Y	73	Confident	65	Low	3 Å²	3	40.5 Å²	40.5	1%	0.012	21%	0.211	C	C	.	.			trans	-65.9	-23	-170.3	-169.3	-95.3	0	0	0	113	V147 R151 S168 F169 Q170 L175 Y176 L177 F473 F478	V147-Y476 HydrophobicContact CG1-CD2 4.12Å; V147-Y476 HydrophobicContact CG1-CE2 3.54Å; R151-Y476 HydrophobicContact CB-CE2 4.5Å; S168-Y476 WeakPolarHBondContact CB-O 3.24Å; S168-Y476 PolarHBondContact OG-O 3.43Å; F169-Y476 WeakPolarHBondContact O-CD1 3.45Å; F169-Y476 WeakPolarHBondContact O-CE1 3.45Å; Q170-Y476 HydrophobicContact CB-CD1 4.28Å; L175-Y476 HydrophobicContact CB-CD1 4.35Å; L175-Y476 HydrophobicContact CB-CE1 3.7Å; L175-Y476 HydrophobicContact CB-CE2 4.1Å; L175-Y476 WeakPolarHBondContact CB-OH 3.44Å; L175-Y476 HydrophobicContact CD1-CD2 4.24Å; L175-Y476 HydrophobicContact CD1-CE2 3.95Å; L175-Y476 HydrophobicContact CD2-CD1 4.06Å; L175-Y476 HydrophobicContact CD2-CD2 4.34Å; L175-Y476 HydrophobicContact CD2-CE1 4.26Å; L175-Y476 HydrophobicContact CD2-CG 4.08Å; L175-Y476 HydrophobicContact CG-CE1 4.48Å; L175-Y476 HydrophobicContact CG-CE2 4.43Å; Y176-Y476 WeakPolarHBondContact O-CE1 3.21Å; L177-Y476 HydrophobicContact CD2-CE1 4.21Å; L177-Y476 HydrophobicContact CD2-CE2 4.21Å; L177-Y476 WeakPolarHBondContact CD2-OH 3.49Å; L177-Y476 WeakPolarHBondContact CG-OH 2.99Å; F473-Y476 WeakPolarHBondContact O-CB 3.34Å; F473-Y476 PolarHBondContact O-N 3.48Å; Y476-F478 PolarHBondContact O-N 3.47Å
477	T	78	Confident	65.6	Low	87 Å²	87	41.3 Å²	41.3	53%	0.534	21%	0.206	S	C	.	.			trans	-78.3	119.8	-175.9	-54.8	0	0	0	0	113.1	S168 N475	S168-T477 VanDerWaalsContact O-CA 3.26Å; S168-T477 WeakPolarHBondContact O-CA 3.38Å; N475-T477 PolarHBondContact O-N 3.46Å; N475-T477 VanDerWaalsContact O-N 3.17Å
478	F	79.4	Confident	65.6	Low	53 Å²	53	42.8 Å²	42.8	23%	0.232	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	152.3	177.6	171.6	-96.7	0	0	0	111.2	M165 Y167 S168 Y476 R480	M165-F478 HydrophobicContact CE-CB 4.43Å; M165-F478 HydrophobicContact CE-CD1 3.49Å; M165-F478 VanDerWaalsContact CE-CD1 3.49Å; M165-F478 HydrophobicContact CE-CE1 3.88Å; M165-F478 HydrophobicContact CE-CG 4.1Å; Y167-F478 WeakPolarHBondContact CA-O 3.32Å; S168-F478 PolarHBondContact N-O 2.91Å; S168-F478 PolarHBondContact O-N 2.74Å; S168-F478 WeakPolarHBondContact OG-CB 2.99Å; S168-F478 PolarHBondContact OG-N 3.39Å; Y476-F478 PolarHBondContact O-N 3.47Å; F478-R480 HydrophobicContact CE1-CB 3.81Å; F478-R480 HydrophobicContact CZ-CB 4.09Å; F478-R480 HydrophobicContact CZ-CG 4.47Å
479	K	79	Confident	64.8	Low	26 Å²	26	42.6 Å²	42.6	11%	0.113	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	117.8	173	-58.1	-170.6	-176.5	-163.3	0	110.6	L92 T95 L97 Y166 Y167 L484	L92-K479 PolarHBondContact O-NZ 3.43Å; T95-K479 PolarHBondContact O-NZ 3.09Å; L97-K479 HydrophobicContact CD1-CD 4.15Å; L97-K479 HydrophobicContact CD1-CG 4.49Å; Y166-K479 CarbonylContact O-C 3.5Å; Y166-K479 WeakPolarHBondContact O-CA 3.22Å; Y167-K479 HydrophobicContact CD1-CB 4.3Å; Y167-K479 HydrophobicContact CD1-CG 4.26Å; K479-L484 HydrophobicContact CB-CD1 3.85Å; K479-L484 HydrophobicContact CB-CG 4.3Å; K479-L484 HydrophobicContact CD-CD1 3.9Å; K479-L484 HydrophobicContact CD-CD2 4.15Å; K479-L484 HydrophobicContact CD-CG 4.43Å
480	R	79.8	Confident	63.8	Low	17 Å²	17	47.5 Å²	47.5	6%	0.064	26%	0.26	C	S	.	.			trans	-74.1	145.8	177.1	-162.3	173.3	-72.1	-139	1.5	111.2	L154 A157 D158 K164 M165 Y166 F478 E482 G483 L484	L154-R480 PolarHBondContact O-NH2 2.9Å; A157-R480 PolarHBondContact O-NH1 2.79Å; A157-R480 VanDerWaalsContact O-NH1 3.12Å; A157-R480 PolarHBondContact O-NH2 3.05Å; D158-R480 IonicContact OD1-NH1 3.87Å; D158-R480 PolarHBondContact OD1-NH1 2.93Å; K164-R480 VanDerWaalsContact CE-CD 3.46Å; M165-R480 PolarHBondContact O-NE 3.31Å; Y166-R480 PolarHBondContact O-N 3.13Å; F478-R480 HydrophobicContact CE1-CB 3.81Å; F478-R480 HydrophobicContact CZ-CB 4.09Å; F478-R480 HydrophobicContact CZ-CG 4.47Å; R480-E482 WeakPolarHBondContact CD-OE2 3.46Å; R480-E482 PolarHBondContact O-N 2.76Å; R480-G483 PolarHBondContact O-N 2.88Å; R480-L484 PolarHBondContact O-N 3.42Å
481	F	73.6	Confident	62.4	Low	32 Å²	32	54.9 Å²	54.9	14%	0.14	28%	0.282	C	S	.	.	H	α-helix	trans	-58.4	-46.9	-178.2	-175.5	-94.3	0	0	0	113.4	K85 E86 F89 L484 T485	K85-F481 HydrophobicContact CB-CE1 4.4Å; K85-F481 HydrophobicContact CB-CZ 3.82Å; E86-F481 HydrophobicContact CG-CE2 4.39Å; E86-F481 WeakPolarHBondContact OE1-CE2 3.41Å; F89-F481 HydrophobicContact CB-CD2 3.8Å; F89-F481 HydrophobicContact CB-CE2 3.67Å; F89-F481 AromaticContact CD1-CD2 3.98Å; F89-F481 HydrophobicContact CD1-CD2 3.98Å; F89-F481 HydrophobicContact CD1-CE2 4.37Å; F89-F481 HydrophobicContact CD2-CB 4.2Å; F89-F481 AromaticContact CD2-CD2 3.51Å; F89-F481 HydrophobicContact CD2-CD2 3.51Å; F89-F481 HydrophobicContact CD2-CE2 4.29Å; F89-F481 HydrophobicContact CD2-CG 4.18Å; F89-F481 HydrophobicContact CE1-CD2 4.45Å; F89-F481 HydrophobicContact CE2-CB 4.07Å; F89-F481 HydrophobicContact CE2-CD2 4.03Å; F89-F481 AromaticContact CG-CD2 3.49Å; F89-F481 HydrophobicContact CG-CD2 3.49Å; F89-F481 VanDerWaalsContact CG-CD2 3.49Å; F89-F481 AromaticContact CG-CE2 3.88Å; F89-F481 HydrophobicContact CG-CE2 3.88Å; F89-F481 HydrophobicContact CZ-CD2 4.47Å; F481-L484 PolarHBondContact O-N 3.31Å; F481-T485 HydrophobicContact CD1-CG2 4.36Å; F481-T485 HydrophobicContact CE1-CG2 4.02Å; F481-T485 HydrophobicContact CE2-CG2 4.33Å; F481-T485 HydrophobicContact CZ-CG2 4.02Å; F481-T485 WeakPolarHBondContact O-CG2 3.46Å; F481-T485 PolarHBondContact O-N 3.3Å; F481-T485 VanDerWaalsContact O-N 3.07Å; F481-T485 PolarHBondContact O-OG1 2.92Å
482	E	72	Confident	60.8	Low	74 Å²	74	62.6 Å²	62.6	35%	0.346	32%	0.315	S	S	.	.	H	α-helix	trans	-67.8	-40.1	-177.6	-58.9	138.7	131	0	0	111.6	K164 R480 L484 T485 Q486	K164-E482 WeakPolarHBondContact CE-OE2 3.37Å; K164-E482 IonicContact NZ-OE1 3.64Å; K164-E482 PolarHBondContact NZ-OE1 3.3Å; K164-E482 IonicContact NZ-OE2 3.01Å; K164-E482 PolarHBondContact NZ-OE2 2.98Å; R480-E482 WeakPolarHBondContact CD-OE2 3.46Å; R480-E482 PolarHBondContact O-N 2.76Å; E482-L484 PolarHBondContact O-N 3.28Å; E482-T485 WeakPolarHBondContact CA-OG1 3.28Å; E482-T485 CarbonylContact O-C 3.51Å; E482-T485 PolarHBondContact O-N 2.82Å; E482-T485 PolarHBondContact O-OG1 3.1Å; E482-Q486 WeakPolarHBondContact O-CG 3.44Å; E482-Q486 PolarHBondContact O-N 3Å
483	G	66.5	Low	59	Low	4 Å²	4	68.5 Å²	68.5	4%	0.041	35%	0.351	C	S	.	.	H	α-helix	trans	-55.4	-42.4	177	0	0	0	0	0	111.9	Y166 Y167 R480	Y166-G483 VanDerWaalsContact CD1-CA 3.4Å; Y167-G483 PolarHBondContact OH-O 2.99Å; R480-G483 PolarHBondContact O-N 2.88Å
484	L	64.1	Low	57	Low	13 Å²	13	75.6 Å²	75.6	7%	0.068	39%	0.394	C	S	.	.	H	α-helix	trans	-73.1	-29.3	177	-70.6	-177	0	0	0	113.5	F89 L92 R93 Y167 K479 R480 F481 E482	F89-L484 HydrophobicContact CD2-CB 4.06Å; F89-L484 HydrophobicContact CD2-CD1 3.54Å; F89-L484 HydrophobicContact CD2-CG 4.35Å; F89-L484 HydrophobicContact CE2-CD1 3.65Å; L92-L484 HydrophobicContact CB-CB 4.35Å; L92-L484 HydrophobicContact CB-CD1 4.07Å; L92-L484 HydrophobicContact CB-CD2 3.75Å; L92-L484 HydrophobicContact CB-CG 4.28Å; L92-L484 HydrophobicContact CD1-CB 3.94Å; L92-L484 HydrophobicContact CD1-CD2 4.19Å; L92-L484 WeakPolarHBondContact CD1-O 3.45Å; R93-L484 HydrophobicContact CB-CD1 4.44Å; Y167-L484 HydrophobicContact CE1-CD2 3.95Å; Y167-L484 HydrophobicContact CE1-CG 4.32Å; K479-L484 HydrophobicContact CB-CD1 3.85Å; K479-L484 HydrophobicContact CB-CG 4.3Å; K479-L484 HydrophobicContact CD-CD1 3.9Å; K479-L484 HydrophobicContact CD-CD2 4.15Å; K479-L484 HydrophobicContact CD-CG 4.43Å; R480-L484 PolarHBondContact O-N 3.42Å; F481-L484 PolarHBondContact O-N 3.31Å; E482-L484 PolarHBondContact O-N 3.28Å
485	T	60	Low	55.5	Low	14 Å²	14	82.1 Å²	82.1	9%	0.086	45%	0.445	C	S	.	.	H	α-helix	trans	-97.3	0.2	-175	55.7	0	0	0	0	114.5	K85 F481 E482 R487 M488	K85-T485 HydrophobicContact CB-CG2 4.08Å; K85-T485 HydrophobicContact CG-CG2 4.37Å; F481-T485 HydrophobicContact CD1-CG2 4.36Å; F481-T485 HydrophobicContact CE1-CG2 4.02Å; F481-T485 HydrophobicContact CE2-CG2 4.33Å; F481-T485 HydrophobicContact CZ-CG2 4.02Å; F481-T485 WeakPolarHBondContact O-CG2 3.46Å; F481-T485 PolarHBondContact O-N 3.3Å; F481-T485 VanDerWaalsContact O-N 3.07Å; F481-T485 PolarHBondContact O-OG1 2.92Å; E482-T485 WeakPolarHBondContact CA-OG1 3.28Å; E482-T485 CarbonylContact O-C 3.51Å; E482-T485 PolarHBondContact O-N 2.82Å; E482-T485 PolarHBondContact O-OG1 3.1Å; T485-R487 PolarHBondContact O-N 3.39Å; T485-M488 PolarHBondContact O-N 2.77Å
486	Q	61.7	Low	55	Low	40 Å²	40	82.6 Å²	82.6	19%	0.187	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-51	-28.8	178.6	-90	170.8	12.3	0	0	114.5	H126 Y128 E482 M488 G489	H126-Q486 PolarHBondContact CD2-OE1 2.95Å; Y128-Q486 PolarHBondContact OH-OE1 2.81Å; E482-Q486 WeakPolarHBondContact O-CG 3.44Å; E482-Q486 PolarHBondContact O-N 3Å; Q486-M488 PolarHBondContact O-N 3.16Å; Q486-G489 PolarHBondContact O-N 3.1Å; Q486-G489 VanDerWaalsContact O-N 3.1Å
487	R	57.6	Low	54	Low	117 Å²	117	86.8 Å²	86.8	44%	0.442	47%	0.47	S	S	.	.	G	3₁₀ helix	trans	-55.7	-22.9	175.4	-75.5	-173.8	176.3	-170.9	0.6	114.2	D123 T124 T485	D123-R487 IonicContact OD2-CZ 2.87Å; D123-R487 IonicContact OD2-NE 2.77Å; D123-R487 IonicContact OD2-NH2 3.33Å; D123-R487 PolarHBondContact OD2-NH2 3.31Å; T124-R487 HydrophobicContact CG2-CG 3.97Å; T485-R487 PolarHBondContact O-N 3.39Å
488	M	46.9	Very low	52.7	Low	109 Å²	109	86.8 Å²	86.8	54%	0.537	47%	0.467	S	S	.	.	G	3₁₀ helix	trans	-89.4	-8.6	-176.6	-62.4	-71	-81.1	0	0	113.6	T485 Q486	T485-M488 PolarHBondContact O-N 2.77Å; Q486-M488 PolarHBondContact O-N 3.16Å
489	G	38.3	Very low	51.1	Low	67 Å²	67	88.8 Å²	88.8	69%	0.691	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-26.1	178.2	0	0	0	0	0	114.7	Q486 R491	Q486-G489 PolarHBondContact O-N 3.1Å; Q486-G489 VanDerWaalsContact O-N 3.1Å; G489-R491 PolarHBondContact O-N 3.34Å
490	C	32.6	Very low	49.4	Very low	107 Å²	107	92.7 Å²	92.7	72%	0.723	50%	0.504	S	S	*	.	S	Bend	trans	-89.8	14.6	-174.5	-105.9	0	0	0	0	115.3
491	R	29.4	Very low	47.3	Very low	226 Å²	226	97.7 Å²	97.7	85%	0.853	53%	0.533	S	S	*	.			trans	-106	26.5	-177.1	-86.9	-169.2	177.4	-172.4	-0.7	115.3	G489	G489-R491 PolarHBondContact O-N 3.34Å
492	K	27.2	Very low	45.5	Very low	187 Å²	187	102.4 Å²	102.4	81%	0.813	56%	0.561	S	S	*	*	S	Bend	trans	-125.4	135	167.1	-72.2	-172.3	175.4	-177.7	0	110.1
493	T	25.7	Very low	43.4	Very low	139 Å²	139	104.6 Å²	104.6	85%	0.853	58%	0.578	S	S	*	*			trans	77.8	75.7	179	71.1	0	0	0	0	117.9
494	V	28.4	Very low	41.5	Very low	152 Å²	152	113 Å²	113	92%	0.921	62%	0.622	S	S	*	*			trans	-124.2	105	136.5	-178.9	0	0	0	0	106.1
495	S	26.3	Very low	39.5	Very low	185 Å²	185	122.1 Å²	122.1	100%	1.294	67%	0.673	S	S	*	*			trans	-103	0	151.1	56.8	0	0	0	0	107.3

Retrieved 495 of 495 residues in 530.3 ms (Link to these results)

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