A0A3Q0KSR0_SCHMA Loading...

Transmembrane protein 209

AlphaFold DB (A0A5K4EVH5), UniProt , Accession A0A3Q0KSR0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 562 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	38.4	Very low	50.8	Low	244 Å²	244	138.8 Å²	138.8	100%	1.202	75%	0.75	S	S	*	*				0	108.6	0	-80.2	167.8	134.2	0	0	107.5
2	S	39.8	Very low	51.9	Low	125 Å²	125	136.4 Å²	136.4	87%	0.874	73%	0.73	S	S	*	*			trans	-75.6	121.3	-172.9	-66	0	0	0	0	111.8	Q4	S2-Q4 PolarHBondContact O-N 2.81Å
3	T	42.3	Very low	53	Low	133 Å²	133	140.3 Å²	140.3	82%	0.816	73%	0.728	S	S	*	*			trans	-87.3	93	163.8	34.5	0	0	0	0	108.8	V5	T3-V5 PolarHBondContact O-N 3.44Å; T3-V5 VanDerWaalsContact O-N 3.16Å
4	Q	44.2	Very low	54.1	Low	164 Å²	164	143.9 Å²	143.9	77%	0.766	73%	0.728	S	S	*	*			trans	-68.3	105.7	163.7	-99.5	-174.4	-21.3	0	0	108.3	S2 W6	S2-Q4 PolarHBondContact O-N 2.81Å; Q4-W6 PolarHBondContact O-N 2.98Å
5	V	48.9	Very low	55	Low	136 Å²	136	139.3 Å²	139.3	82%	0.824	71%	0.713	S	S	*	*			trans	-73.1	104.6	167.7	179.3	0	0	0	0	107.4	T3 A7	T3-V5 PolarHBondContact O-N 3.44Å; T3-V5 VanDerWaalsContact O-N 3.16Å; V5-A7 PolarHBondContact O-N 3.37Å
6	W	44.1	Very low	56	Low	218 Å²	218	138.3 Å²	138.3	83%	0.826	70%	0.702	S	S	*	*			trans	-66.7	113.3	173.2	-85.6	55.9	0	0	0	109.6	Q4 S8	Q4-W6 PolarHBondContact O-N 2.98Å; W6-S8 PolarHBondContact O-N 2.94Å
7	A	53.3	Low	57	Low	75 Å²	75	135.8 Å²	135.8	62%	0.62	69%	0.69	S	S	*	*			trans	-63	123.2	166.2	0	0	0	0	0	108.5	V5	V5-A7 PolarHBondContact O-N 3.37Å
8	S	52.2	Low	58	Low	65 Å²	65	134.2 Å²	134.2	46%	0.455	68%	0.679	S	S	.	*			trans	-58	132.7	-177.2	-168.9	0	0	0	0	110.5	W6 K10 I11	W6-S8 PolarHBondContact O-N 2.94Å; S8-K10 PolarHBondContact O-N 3.44Å; S8-I11 PolarHBondContact O-N 3.34Å
9	P	62.1	Low	58.7	Low	86 Å²	86	131.3 Å²	131.3	56%	0.558	67%	0.669	S	S	*	*	H	α-helix	trans	-57.9	-15.4	-175.3	16.8	-29.2	0	0	0	114.5	R13	P9-R13 WeakPolarHBondContact O-CG 3.5Å; P9-R13 PolarHBondContact O-N 3.41Å
10	K	66.5	Low	59.2	Low	170 Å²	170	131.2 Å²	131.2	74%	0.739	67%	0.666	S	S	*	*	H	α-helix	trans	-67.3	-35.4	170.8	-74.3	-176.6	177.3	177.7	0	113.2	S8 R14	S8-K10 PolarHBondContact O-N 3.44Å; K10-R14 PolarHBondContact O-N 3.06Å
11	I	67.6	Low	59.9	Low	111 Å²	111	129.8 Å²	129.8	57%	0.569	66%	0.659	S	S	*	*	H	α-helix	trans	-73.8	-41.3	-178.2	-60	174.8	0	0	0	110.1	S8 R13 R14 C15	S8-I11 PolarHBondContact O-N 3.34Å; I11-R13 PolarHBondContact O-N 3.45Å; I11-R14 PolarHBondContact O-N 3.04Å; I11-C15 PolarHBondContact O-N 3.49Å
12	E	63.6	Low	61.4	Low	110 Å²	110	124.8 Å²	124.8	51%	0.514	63%	0.626	S	S	.	*	H	α-helix	trans	-64.9	-39.8	178	-158.7	-167	143	0	0	112.1	C15 K16	E12-C15 PolarHBondContact O-N 3.27Å; E12-K16 PolarHBondContact O-N 3.24Å; E12-K16 IonicContact OE1-NZ 3.57Å; E12-K16 PolarHBondContact OE1-NZ 3.33Å
13	R	66.1	Low	62.9	Low	187 Å²	187	122.1 Å²	122.1	71%	0.706	61%	0.608	S	S	*	*	H	α-helix	trans	-62.8	-41.8	174	-73.3	-174.5	-166.7	-172.3	4.1	112.3	P9 I11 K16 I17	P9-R13 WeakPolarHBondContact O-CG 3.5Å; P9-R13 PolarHBondContact O-N 3.41Å; I11-R13 PolarHBondContact O-N 3.45Å; R13-K16 PolarHBondContact O-N 3.31Å; R13-I17 VanDerWaalsContact O-CG1 3.31Å; R13-I17 WeakPolarHBondContact O-CG1 3.27Å; R13-I17 PolarHBondContact O-N 3.47Å
14	R	68.3	Low	64.2	Low	190 Å²	190	120.1 Å²	120.1	72%	0.717	59%	0.592	S	S	*	*	H	α-helix	trans	-62.3	-43	175.9	-79.9	-167.4	179.5	-156.8	1.3	111.9	K10 I11 K16 I17 E18	K10-R14 PolarHBondContact O-N 3.06Å; I11-R14 PolarHBondContact O-N 3.04Å; R14-K16 PolarHBondContact O-N 3.35Å; R14-I17 PolarHBondContact O-N 3.24Å; R14-E18 PolarHBondContact O-N 3.47Å
15	C	67.7	Low	65.7	Low	76 Å²	76	116.8 Å²	116.8	51%	0.514	58%	0.579	S	S	.	*	H	α-helix	trans	-64.6	-39.8	178.7	-167.9	0	0	0	0	112.7	I11 E12 E18 T19	I11-C15 PolarHBondContact O-N 3.49Å; E12-C15 PolarHBondContact O-N 3.27Å; C15-E18 PolarHBondContact O-N 3.3Å; C15-T19 PolarHBondContact O-N 3.25Å; C15-T19 PolarHBondContact O-OG1 3.19Å
16	K	71	Confident	66.8	Low	123 Å²	123	113 Å²	113	54%	0.535	56%	0.559	S	S	.	*	H	α-helix	trans	-63.7	-41.5	173.7	-87.8	171.7	173.1	151	0	112.7	E12 R13 R14 T19 Q20	E12-K16 PolarHBondContact O-N 3.24Å; E12-K16 IonicContact OE1-NZ 3.57Å; E12-K16 PolarHBondContact OE1-NZ 3.33Å; R13-K16 PolarHBondContact O-N 3.31Å; R14-K16 PolarHBondContact O-N 3.35Å; K16-T19 WeakPolarHBondContact CA-OG1 3.31Å; K16-T19 PolarHBondContact O-N 3.16Å; K16-T19 PolarHBondContact O-OG1 3.43Å; K16-Q20 PolarHBondContact O-N 3.33Å
17	I	73.4	Confident	68	Low	96 Å²	96	105.3 Å²	105.3	49%	0.492	54%	0.542	S	S	.	.	H	α-helix	trans	-65.3	-44.2	176.8	-68	166.7	0	0	0	110.6	R13 R14 T19 Q20 I21	R13-I17 VanDerWaalsContact O-CG1 3.31Å; R13-I17 WeakPolarHBondContact O-CG1 3.27Å; R13-I17 PolarHBondContact O-N 3.47Å; R14-I17 PolarHBondContact O-N 3.24Å; I17-T19 PolarHBondContact O-N 3.36Å; I17-Q20 PolarHBondContact O-N 2.85Å; I17-I21 HydrophobicContact CG2-CD1 3.71Å; I17-I21 HydrophobicContact CG2-CG1 4.39Å; I17-I21 VanDerWaalsContact O-CG1 3.27Å; I17-I21 WeakPolarHBondContact O-CG1 3.44Å; I17-I21 PolarHBondContact O-N 2.89Å
18	E	74.2	Confident	68.9	Low	106 Å²	106	109.1 Å²	109.1	50%	0.495	54%	0.541	S	S	.	.	H	α-helix	trans	-63.9	-38	178.2	-77	-172.5	-164.6	0	0	113.3	R14 C15 I21 R22	R14-E18 PolarHBondContact O-N 3.47Å; C15-E18 PolarHBondContact O-N 3.3Å; E18-I21 PolarHBondContact O-N 3.32Å; E18-R22 VanDerWaalsContact O-CG 3.32Å; E18-R22 WeakPolarHBondContact O-CG 3.47Å; E18-R22 PolarHBondContact O-N 2.96Å; E18-R22 IonicContact OE2-NH2 3.45Å
19	T	72.2	Confident	69.9	Low	79 Å²	79	109.4 Å²	109.4	49%	0.485	53%	0.534	S	S	.	.	H	α-helix	trans	-70.1	-38.8	177.3	38.3	0	0	0	0	112.1	C15 K16 I17 R22 S23	C15-T19 PolarHBondContact O-N 3.25Å; C15-T19 PolarHBondContact O-OG1 3.19Å; K16-T19 WeakPolarHBondContact CA-OG1 3.31Å; K16-T19 PolarHBondContact O-N 3.16Å; K16-T19 PolarHBondContact O-OG1 3.43Å; I17-T19 PolarHBondContact O-N 3.36Å; T19-R22 PolarHBondContact O-N 3.19Å; T19-S23 PolarHBondContact O-N 3.38Å
20	Q	67.6	Low	70.5	Confident	130 Å²	130	113.4 Å²	113.4	61%	0.607	54%	0.538	S	S	*	.	H	α-helix	trans	-63	-43.3	171.2	-87.9	-170.8	-41.7	0	0	112.5	K16 I17 R22 S23 L24	K16-Q20 PolarHBondContact O-N 3.33Å; I17-Q20 PolarHBondContact O-N 2.85Å; Q20-R22 VanDerWaalsContact C-N 3.28Å; Q20-R22 PolarHBondContact O-N 2.89Å; Q20-S23 PolarHBondContact O-N 3.35Å; Q20-S23 PolarHBondContact O-OG 3.49Å; Q20-L24 WeakPolarHBondContact O-CB 3.4Å; Q20-L24 PolarHBondContact O-N 2.88Å
21	I	73.9	Confident	71.1	Confident	101 Å²	101	110 Å²	110	52%	0.518	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-39.2	176.7	-69.1	167.9	0	0	0	110.5	I17 E18 N25	I17-I21 HydrophobicContact CG2-CD1 3.71Å; I17-I21 HydrophobicContact CG2-CG1 4.39Å; I17-I21 VanDerWaalsContact O-CG1 3.27Å; I17-I21 WeakPolarHBondContact O-CG1 3.44Å; I17-I21 PolarHBondContact O-N 2.89Å; E18-I21 PolarHBondContact O-N 3.32Å; I21-N25 VanDerWaalsContact O-CB 3.3Å; I21-N25 WeakPolarHBondContact O-CB 3.49Å; I21-N25 PolarHBondContact O-N 3.29Å
22	R	71.1	Confident	71.3	Confident	139 Å²	139	106.7 Å²	106.7	53%	0.525	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-39.3	176.6	-73.2	178.2	-154.9	-158.2	7.7	112.9	E18 T19 Q20 S26	E18-R22 VanDerWaalsContact O-CG 3.32Å; E18-R22 WeakPolarHBondContact O-CG 3.47Å; E18-R22 PolarHBondContact O-N 2.96Å; E18-R22 IonicContact OE2-NH2 3.45Å; T19-R22 PolarHBondContact O-N 3.19Å; Q20-R22 VanDerWaalsContact C-N 3.28Å; Q20-R22 PolarHBondContact O-N 2.89Å; R22-S26 PolarHBondContact O-N 3.27Å; R22-S26 VanDerWaalsContact O-N 3.15Å
23	S	71.1	Confident	71.8	Confident	70 Å²	70	104.3 Å²	104.3	49%	0.49	51%	0.507	S	S	.	.	H	α-helix	trans	-73.2	-38.2	178.6	84.3	0	0	0	0	112.1	T19 Q20 N25 S26 A27	T19-S23 PolarHBondContact O-N 3.38Å; Q20-S23 PolarHBondContact O-N 3.35Å; Q20-S23 PolarHBondContact O-OG 3.49Å; S23-N25 VanDerWaalsContact C-N 3.35Å; S23-N25 PolarHBondContact O-N 2.87Å; S23-S26 PolarHBondContact O-N 3.46Å; S23-S26 PolarHBondContact O-OG 2.96Å; S23-A27 WeakPolarHBondContact O-CB 3.34Å; S23-A27 PolarHBondContact O-N 3.35Å
24	L	70	Confident	72.3	Confident	91 Å²	91	100.3 Å²	100.3	48%	0.476	50%	0.5	S	S	.	.	H	α-helix	trans	-60.7	-45.6	172.6	-84.7	158	0	0	0	110.8	Q20 S26 A27 Y28	Q20-L24 WeakPolarHBondContact O-CB 3.4Å; Q20-L24 PolarHBondContact O-N 2.88Å; L24-S26 VanDerWaalsContact C-N 3.3Å; L24-S26 PolarHBondContact O-N 3.27Å; L24-A27 PolarHBondContact O-N 2.91Å; L24-A27 VanDerWaalsContact O-N 3.15Å; L24-Y28 HydrophobicContact CB-CD2 4.46Å; L24-Y28 HydrophobicContact CB-CE2 4.4Å; L24-Y28 HydrophobicContact CD2-CE2 3.95Å; L24-Y28 WeakPolarHBondContact O-CD2 3.43Å; L24-Y28 PolarHBondContact O-N 3.47Å
25	N	75.1	Confident	72.7	Confident	94 Å²	94	95.3 Å²	95.3	50%	0.503	49%	0.49	S	S	.	.	H	α-helix	trans	-67.2	-28.7	-179.7	-156.5	0.1	0	0	0	112.7	I21 S23 K29	I21-N25 VanDerWaalsContact O-CB 3.3Å; I21-N25 WeakPolarHBondContact O-CB 3.49Å; I21-N25 PolarHBondContact O-N 3.29Å; S23-N25 VanDerWaalsContact C-N 3.35Å; S23-N25 PolarHBondContact O-N 2.87Å; N25-K29 VanDerWaalsContact O-CG 3.29Å; N25-K29 WeakPolarHBondContact O-CG 3.29Å; N25-K29 PolarHBondContact O-N 3.23Å
26	S	71.5	Confident	73.2	Confident	57 Å²	57	94.7 Å²	94.7	40%	0.399	48%	0.482	S	S	.	.	H	α-helix	trans	-73.9	-40.1	170.2	75.8	0	0	0	0	111.8	R22 S23 L24 K29 W30	R22-S26 PolarHBondContact O-N 3.27Å; R22-S26 VanDerWaalsContact O-N 3.15Å; S23-S26 PolarHBondContact O-N 3.46Å; S23-S26 PolarHBondContact O-OG 2.96Å; L24-S26 VanDerWaalsContact C-N 3.3Å; L24-S26 PolarHBondContact O-N 3.27Å; S26-K29 WeakPolarHBondContact O-CB 3.24Å; S26-K29 PolarHBondContact O-N 2.89Å; S26-W30 PolarHBondContact O-N 3.35Å
27	A	69.8	Low	73.5	Confident	56 Å²	56	92.8 Å²	92.8	46%	0.463	48%	0.48	S	S	.	.	H	α-helix	trans	-62.4	-44.1	177.5	0	0	0	0	0	112.3	S23 L24 K29 W30 L31	S23-A27 WeakPolarHBondContact O-CB 3.34Å; S23-A27 PolarHBondContact O-N 3.35Å; L24-A27 PolarHBondContact O-N 2.91Å; L24-A27 VanDerWaalsContact O-N 3.15Å; A27-K29 VanDerWaalsContact C-N 3.29Å; A27-K29 PolarHBondContact O-N 3.15Å; A27-W30 PolarHBondContact O-N 2.83Å; A27-L31 WeakPolarHBondContact O-CB 3.12Å; A27-L31 PolarHBondContact O-N 3.48Å
28	Y	72.1	Confident	73.8	Confident	154 Å²	154	89.7 Å²	89.7	60%	0.604	47%	0.472	S	S	*	.	H	α-helix	trans	-62.3	-34.9	176.1	-81.1	-69.1	0	0	0	112.8	L24 S32	L24-Y28 HydrophobicContact CB-CD2 4.46Å; L24-Y28 HydrophobicContact CB-CE2 4.4Å; L24-Y28 HydrophobicContact CD2-CE2 3.95Å; L24-Y28 WeakPolarHBondContact O-CD2 3.43Å; L24-Y28 PolarHBondContact O-N 3.47Å; Y28-S32 PolarHBondContact O-N 3.21Å; Y28-S32 VanDerWaalsContact O-N 3.13Å
29	K	73.6	Confident	73.9	Confident	72 Å²	72	89.5 Å²	89.5	31%	0.313	47%	0.472	S	S	.	.	H	α-helix	trans	-62.7	-47.1	175.1	-74.4	174.3	-176.5	-170.3	0	111.3	N25 S26 A27 S32 V33	N25-K29 VanDerWaalsContact O-CG 3.29Å; N25-K29 WeakPolarHBondContact O-CG 3.29Å; N25-K29 PolarHBondContact O-N 3.23Å; S26-K29 WeakPolarHBondContact O-CB 3.24Å; S26-K29 PolarHBondContact O-N 2.89Å; A27-K29 VanDerWaalsContact C-N 3.29Å; A27-K29 PolarHBondContact O-N 3.15Å; K29-S32 PolarHBondContact O-N 3.3Å; K29-S32 PolarHBondContact O-OG 3.48Å; K29-V33 PolarHBondContact O-N 3.15Å
30	W	75.1	Confident	74.1	Confident	169 Å²	169	88 Å²	88	64%	0.64	46%	0.464	S	S	*	.	H	α-helix	trans	-68.8	-39.1	178.5	-68	111.2	0	0	0	112.6	S26 A27 S32 V33 D34	S26-W30 PolarHBondContact O-N 3.35Å; A27-W30 PolarHBondContact O-N 2.83Å; W30-S32 VanDerWaalsContact C-N 3.27Å; W30-S32 PolarHBondContact O-N 3Å; W30-V33 PolarHBondContact O-N 2.98Å; W30-D34 PolarHBondContact O-N 3.4Å
31	L	77.6	Confident	74.7	Confident	98 Å²	98	85.2 Å²	85.2	51%	0.513	46%	0.456	S	S	.	.	H	α-helix	trans	-57.5	-40.5	175	-174.1	69.3	0	0	0	111.8	A27 V33 D34 V35	A27-L31 WeakPolarHBondContact O-CB 3.12Å; A27-L31 PolarHBondContact O-N 3.48Å; L31-V33 VanDerWaalsContact C-N 3.33Å; L31-V33 PolarHBondContact O-N 3.49Å; L31-D34 PolarHBondContact O-N 2.89Å; L31-V35 WeakPolarHBondContact O-CB 3.28Å; L31-V35 VanDerWaalsContact O-CG2 3.24Å; L31-V35 WeakPolarHBondContact O-CG2 3.35Å; L31-V35 PolarHBondContact O-N 2.94Å
32	S	72.8	Confident	74.8	Confident	43 Å²	43	84.7 Å²	84.7	30%	0.301	45%	0.454	S	S	.	.	H	α-helix	trans	-64.4	-37.8	177.1	77.1	0	0	0	0	112.7	Y28 K29 W30 L36	Y28-S32 PolarHBondContact O-N 3.21Å; Y28-S32 VanDerWaalsContact O-N 3.13Å; K29-S32 PolarHBondContact O-N 3.3Å; K29-S32 PolarHBondContact O-OG 3.48Å; W30-S32 VanDerWaalsContact C-N 3.27Å; W30-S32 PolarHBondContact O-N 3Å; S32-L36 WeakPolarHBondContact O-CB 3.3Å; S32-L36 PolarHBondContact O-N 3.38Å
33	V	74.2	Confident	75	Confident	59 Å²	59	82.4 Å²	82.4	36%	0.358	45%	0.451	S	S	.	.	H	α-helix	trans	-69.5	-45.1	177.8	176.2	0	0	0	0	110	K29 W30 L31 V35 L36 V37	K29-V33 PolarHBondContact O-N 3.15Å; W30-V33 PolarHBondContact O-N 2.98Å; L31-V33 VanDerWaalsContact C-N 3.33Å; L31-V33 PolarHBondContact O-N 3.49Å; V33-V35 VanDerWaalsContact C-N 3.35Å; V33-V35 PolarHBondContact O-N 3.27Å; V33-L36 PolarHBondContact O-N 3.4Å; V33-V37 HydrophobicContact CG1-CG2 4.32Å; V33-V37 VanDerWaalsContact O-CG2 3.31Å; V33-V37 WeakPolarHBondContact O-CG2 3.46Å; V33-V37 PolarHBondContact O-N 3.17Å
34	D	76.3	Confident	75.2	Confident	103 Å²	103	85.2 Å²	85.2	55%	0.551	46%	0.456	S	S	*	.	H	α-helix	trans	-63.6	-40.1	179.1	-68.4	-24.1	0	0	0	111.7	W30 L31 G38	W30-D34 PolarHBondContact O-N 3.4Å; L31-D34 PolarHBondContact O-N 2.89Å; D34-G38 PolarHBondContact O-N 3.12Å
35	V	77.7	Confident	75.4	Confident	85 Å²	85	88.2 Å²	88.2	52%	0.515	47%	0.466	S	S	.	.	H	α-helix	trans	-64	-43.5	173.7	171	0	0	0	0	110.9	L31 V33 G38 M39	L31-V35 WeakPolarHBondContact O-CB 3.28Å; L31-V35 VanDerWaalsContact O-CG2 3.24Å; L31-V35 WeakPolarHBondContact O-CG2 3.35Å; L31-V35 PolarHBondContact O-N 2.94Å; V33-V35 VanDerWaalsContact C-N 3.35Å; V33-V35 PolarHBondContact O-N 3.27Å; V35-G38 PolarHBondContact O-N 3.25Å; V35-M39 HydrophobicContact CG1-CG 4.45Å; V35-M39 WeakPolarHBondContact O-CB 3.33Å; V35-M39 VanDerWaalsContact O-CG 3.27Å; V35-M39 WeakPolarHBondContact O-CG 3.32Å; V35-M39 PolarHBondContact O-N 2.71Å
36	L	77.3	Confident	75.4	Confident	64 Å²	64	91.7 Å²	91.7	34%	0.335	47%	0.473	S	S	.	.	H	α-helix	trans	-64.8	-42.9	179.5	-160.7	77.5	0	0	0	111.8	S32 V33 M39 C40 L75 C78	S32-L36 WeakPolarHBondContact O-CB 3.3Å; S32-L36 PolarHBondContact O-N 3.38Å; V33-L36 PolarHBondContact O-N 3.4Å; L36-M39 PolarHBondContact O-N 3.39Å; L36-C40 PolarHBondContact O-N 3.44Å; L36-C40 VanDerWaalsContact O-N 3.07Å; L36-C40 PolarHBondContact O-SG 2.95Å; L36-L75 HydrophobicContact CD2-CD1 3.56Å; L36-L75 HydrophobicContact CG-CD1 3.84Å; L36-C78 HydrophobicContact CD2-CB 4.47Å
37	V	76.9	Confident	75.3	Confident	82 Å²	82	91.8 Å²	91.8	50%	0.497	47%	0.469	S	S	.	.	H	α-helix	trans	-65.4	-44.4	175.4	173	0	0	0	0	110.5	V33 M39 C40 V41	V33-V37 HydrophobicContact CG1-CG2 4.32Å; V33-V37 VanDerWaalsContact O-CG2 3.31Å; V33-V37 WeakPolarHBondContact O-CG2 3.46Å; V33-V37 PolarHBondContact O-N 3.17Å; V37-M39 VanDerWaalsContact C-N 3.33Å; V37-M39 PolarHBondContact O-N 3.25Å; V37-C40 WeakPolarHBondContact O-CB 3.38Å; V37-C40 PolarHBondContact O-N 2.87Å; V37-C40 VanDerWaalsContact O-N 3.13Å; V37-V41 WeakPolarHBondContact O-CG2 3.45Å; V37-V41 PolarHBondContact O-N 3.46Å
38	G	79.5	Confident	75.1	Confident	31 Å²	31	94.2 Å²	94.2	32%	0.32	47%	0.47	S	S	.	.	H	α-helix	trans	-58.5	-42.4	175.5	0	0	0	0	0	112.6	D34 V35 V41 L42	D34-G38 PolarHBondContact O-N 3.12Å; V35-G38 PolarHBondContact O-N 3.25Å; G38-V41 PolarHBondContact O-N 3.05Å; G38-L42 WeakPolarHBondContact O-CB 3.43Å; G38-L42 VanDerWaalsContact O-CG 3.31Å; G38-L42 WeakPolarHBondContact O-CG 3.27Å; G38-L42 PolarHBondContact O-N 3.33Å
39	M	77.6	Confident	74.7	Confident	103 Å²	103	90 Å²	90	51%	0.507	46%	0.462	S	S	.	.	H	α-helix	trans	-64.4	-38.5	174.6	-70.6	-59.4	-67.4	0	0	112.3	V35 L36 V37 L42 I43	V35-M39 HydrophobicContact CG1-CG 4.45Å; V35-M39 WeakPolarHBondContact O-CB 3.33Å; V35-M39 VanDerWaalsContact O-CG 3.27Å; V35-M39 WeakPolarHBondContact O-CG 3.32Å; V35-M39 PolarHBondContact O-N 2.71Å; L36-M39 PolarHBondContact O-N 3.39Å; V37-M39 VanDerWaalsContact C-N 3.33Å; V37-M39 PolarHBondContact O-N 3.25Å; M39-L42 PolarHBondContact O-N 3.09Å; M39-L42 HydrophobicContact SD-CD1 4.28Å; M39-I43 WeakPolarHBondContact O-CB 3.49Å; M39-I43 WeakPolarHBondContact O-CD1 3.19Å; M39-I43 WeakPolarHBondContact O-CG1 3.47Å; M39-I43 PolarHBondContact O-N 3.04Å
40	C	76.3	Confident	74.4	Confident	46 Å²	46	92.9 Å²	92.9	31%	0.311	48%	0.475	S	S	.	.	H	α-helix	trans	-64.8	-42.9	175.5	-65.4	0	0	0	0	112.1	L36 V37 I43 E44	L36-C40 PolarHBondContact O-N 3.44Å; L36-C40 VanDerWaalsContact O-N 3.07Å; L36-C40 PolarHBondContact O-SG 2.95Å; V37-C40 WeakPolarHBondContact O-CB 3.38Å; V37-C40 PolarHBondContact O-N 2.87Å; V37-C40 VanDerWaalsContact O-N 3.13Å; C40-I43 PolarHBondContact O-N 3.47Å; C40-E44 PolarHBondContact O-N 3.02Å
41	V	78.8	Confident	73.6	Confident	73 Å²	73	88.9 Å²	88.9	44%	0.442	46%	0.462	S	S	.	.	H	α-helix	trans	-65.2	-41.4	177.1	174.7	0	0	0	0	110.9	V37 G38 I43 E44 F45	V37-V41 WeakPolarHBondContact O-CG2 3.45Å; V37-V41 PolarHBondContact O-N 3.46Å; G38-V41 PolarHBondContact O-N 3.05Å; V41-I43 VanDerWaalsContact C-N 3.33Å; V41-I43 PolarHBondContact O-N 3.05Å; V41-E44 PolarHBondContact O-N 3.02Å; V41-F45 HydrophobicContact CG1-CD2 3.86Å; V41-F45 HydrophobicContact CG1-CE2 4.28Å; V41-F45 WeakPolarHBondContact O-CB 3.19Å; V41-F45 PolarHBondContact O-N 3.22Å
42	L	76.4	Confident	72.8	Confident	90 Å²	90	94.6 Å²	94.6	47%	0.471	48%	0.477	S	S	.	.	H	α-helix	trans	-62.5	-40.2	174.9	-74.8	170.8	0	0	0	111.7	G38 M39 F45 Y46	G38-L42 WeakPolarHBondContact O-CB 3.43Å; G38-L42 VanDerWaalsContact O-CG 3.31Å; G38-L42 WeakPolarHBondContact O-CG 3.27Å; G38-L42 PolarHBondContact O-N 3.33Å; M39-L42 PolarHBondContact O-N 3.09Å; M39-L42 HydrophobicContact SD-CD1 4.28Å; L42-F45 PolarHBondContact O-N 3.03Å; L42-Y46 HydrophobicContact CD2-CD2 4.24Å; L42-Y46 HydrophobicContact CD2-CE2 3.97Å; L42-Y46 WeakPolarHBondContact O-CB 3.25Å; L42-Y46 WeakPolarHBondContact O-CD2 3.38Å; L42-Y46 PolarHBondContact O-N 3.48Å
43	I	76.5	Confident	72.4	Confident	91 Å²	91	99.1 Å²	99.1	47%	0.467	50%	0.497	S	S	.	.	H	α-helix	trans	-62.2	-47.8	175.3	-73.4	167.6	0	0	0	110.3	M39 C40 V41 I47	M39-I43 WeakPolarHBondContact O-CB 3.49Å; M39-I43 WeakPolarHBondContact O-CD1 3.19Å; M39-I43 WeakPolarHBondContact O-CG1 3.47Å; M39-I43 PolarHBondContact O-N 3.04Å; C40-I43 PolarHBondContact O-N 3.47Å; V41-I43 VanDerWaalsContact C-N 3.33Å; V41-I43 PolarHBondContact O-N 3.05Å; I43-I47 HydrophobicContact CG2-CD1 3.74Å; I43-I47 HydrophobicContact CG2-CG1 4.34Å; I43-I47 WeakPolarHBondContact O-CB 3.41Å; I43-I47 VanDerWaalsContact O-CG1 3.25Å; I43-I47 WeakPolarHBondContact O-CG1 3.47Å; I43-I47 PolarHBondContact O-N 3.34Å
44	E	74.3	Confident	71.9	Confident	128 Å²	128	101.5 Å²	101.5	60%	0.598	50%	0.503	S	S	*	.	H	α-helix	trans	-63.1	-44	176.1	-86.2	-153.7	159.6	0	0	112.6	C40 V41 Q48	C40-E44 PolarHBondContact O-N 3.02Å; V41-E44 PolarHBondContact O-N 3.02Å; E44-Q48 WeakPolarHBondContact O-CB 3.27Å; E44-Q48 PolarHBondContact O-N 3.42Å
45	F	74.6	Confident	71	Confident	154 Å²	154	102.8 Å²	102.8	68%	0.675	52%	0.519	S	S	*	.	H	α-helix	trans	-70.9	-33.9	-176.3	-101.5	-90.6	0	0	0	113.8	V41 L42 P49	V41-F45 HydrophobicContact CG1-CD2 3.86Å; V41-F45 HydrophobicContact CG1-CE2 4.28Å; V41-F45 WeakPolarHBondContact O-CB 3.19Å; V41-F45 PolarHBondContact O-N 3.22Å; L42-F45 PolarHBondContact O-N 3.03Å; F45-P49 WeakPolarHBondContact O-CD 3.31Å; F45-P49 WeakPolarHBondContact O-CG 3.5Å
46	Y	75.2	Confident	70.2	Confident	168 Å²	168	103.2 Å²	103.2	66%	0.659	51%	0.514	S	S	*	.	H	α-helix	trans	-88.8	-41.7	179.3	-84.6	-86.3	0	0	0	112.3	L42 F50	L42-Y46 HydrophobicContact CD2-CD2 4.24Å; L42-Y46 HydrophobicContact CD2-CE2 3.97Å; L42-Y46 WeakPolarHBondContact O-CB 3.25Å; L42-Y46 WeakPolarHBondContact O-CD2 3.38Å; L42-Y46 PolarHBondContact O-N 3.48Å; Y46-F50 WeakPolarHBondContact O-CB 3.32Å; Y46-F50 PolarHBondContact O-N 3.19Å
47	I	68.5	Low	69.6	Low	59 Å²	59	104.2 Å²	104.2	30%	0.303	53%	0.525	S	S	.	.	H	α-helix	trans	-76.6	-42.1	-172.4	-60.3	-168.7	0	0	0	111.2	I43 F50 F51 Y64	I43-I47 HydrophobicContact CG2-CD1 3.74Å; I43-I47 HydrophobicContact CG2-CG1 4.34Å; I43-I47 WeakPolarHBondContact O-CB 3.41Å; I43-I47 VanDerWaalsContact O-CG1 3.25Å; I43-I47 WeakPolarHBondContact O-CG1 3.47Å; I43-I47 PolarHBondContact O-N 3.34Å; I47-F50 PolarHBondContact O-N 2.78Å; I47-F50 VanDerWaalsContact O-N 3.16Å; I47-F51 HydrophobicContact CG2-CD2 3.37Å; I47-F51 HydrophobicContact CG2-CE2 3.44Å; I47-F51 VanDerWaalsContact CG2-CE2 3.44Å; I47-F51 WeakPolarHBondContact O-CD2 3.4Å; I47-F51 PolarHBondContact O-N 3.03Å; I47-Y64 HydrophobicContact CG2-CE2 4.07Å
48	Q	65.5	Low	68.9	Low	107 Å²	107	106.2 Å²	106.2	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-63.3	-42.5	-174.8	-158.7	150.5	-54.9	0	0	114.4	E44 R52	E44-Q48 WeakPolarHBondContact O-CB 3.27Å; E44-Q48 PolarHBondContact O-N 3.42Å; Q48-R52 PolarHBondContact O-N 3.16Å
49	P	64.9	Low	68.5	Low	66 Å²	66	107.5 Å²	107.5	43%	0.429	55%	0.55	S	S	.	*	H	α-helix	trans	-73	-31	172	24.9	-29.5	0	0	0	113.1	F45 F51 R52 L53	F45-P49 WeakPolarHBondContact O-CD 3.31Å; F45-P49 WeakPolarHBondContact O-CG 3.5Å; P49-F51 VanDerWaalsContact C-N 3.32Å; P49-F51 PolarHBondContact O-N 2.83Å; P49-R52 PolarHBondContact O-N 3.43Å; P49-R52 VanDerWaalsContact O-N 3.17Å; P49-L53 PolarHBondContact O-N 3.04Å; P49-L53 VanDerWaalsContact O-N 3.14Å
50	F	65.9	Low	68	Low	131 Å²	131	110.4 Å²	110.4	58%	0.575	56%	0.556	S	S	*	*	H	α-helix	trans	-62.3	-40.7	176.3	-135.9	-89.9	0	0	0	111.6	Y46 I47 R52 L53 F54	Y46-F50 WeakPolarHBondContact O-CB 3.32Å; Y46-F50 PolarHBondContact O-N 3.19Å; I47-F50 PolarHBondContact O-N 2.78Å; I47-F50 VanDerWaalsContact O-N 3.16Å; F50-R52 VanDerWaalsContact C-N 3.34Å; F50-R52 PolarHBondContact O-N 3.31Å; F50-L53 PolarHBondContact O-N 3.4Å; F50-F54 AromaticContact CD1-CD2 3.97Å; F50-F54 HydrophobicContact CD1-CD2 3.97Å; F50-F54 HydrophobicContact CD1-CE2 4Å; F50-F54 HydrophobicContact CE1-CD2 4.02Å; F50-F54 AromaticContact CE1-CE2 3.61Å; F50-F54 HydrophobicContact CE1-CE2 3.61Å; F50-F54 HydrophobicContact CZ-CE2 4.24Å; F50-F54 PolarHBondContact O-N 3.35Å
51	F	59.5	Low	67.4	Low	85 Å²	85	114.6 Å²	114.6	37%	0.373	57%	0.573	S	S	.	*	H	α-helix	trans	-73.2	-22.6	176.2	-86.7	-82.2	0	0	0	113.9	I47 P49 F56 Y64	I47-F51 HydrophobicContact CG2-CD2 3.37Å; I47-F51 HydrophobicContact CG2-CE2 3.44Å; I47-F51 VanDerWaalsContact CG2-CE2 3.44Å; I47-F51 WeakPolarHBondContact O-CD2 3.4Å; I47-F51 PolarHBondContact O-N 3.03Å; P49-F51 VanDerWaalsContact C-N 3.32Å; P49-F51 PolarHBondContact O-N 2.83Å; F51-F56 AromaticContact CD1-CD2 3.98Å; F51-F56 HydrophobicContact CD1-CD2 3.98Å; F51-F56 HydrophobicContact CD1-CE2 4.35Å; F51-F56 HydrophobicContact CE1-CD2 4.01Å; F51-F56 HydrophobicContact CE1-CE2 4.26Å; F51-Y64 HydrophobicContact CD2-CE2 4.16Å; F51-Y64 HydrophobicContact CE1-CD2 4.37Å; F51-Y64 AromaticContact CE2-CD2 3.98Å; F51-Y64 HydrophobicContact CE2-CD2 3.98Å; F51-Y64 AromaticContact CE2-CE2 3.6Å; F51-Y64 HydrophobicContact CE2-CE2 3.6Å; F51-Y64 AromaticContact CZ-CD2 3.75Å; F51-Y64 HydrophobicContact CZ-CD2 3.75Å; F51-Y64 AromaticContact CZ-CE2 3.89Å; F51-Y64 HydrophobicContact CZ-CE2 3.89Å; F51-Y64 HydrophobicContact CZ-CG 4.46Å
52	R	60.6	Low	67.1	Low	219 Å²	219	114.1 Å²	114.1	83%	0.826	57%	0.572	S	S	*	*	H	α-helix	trans	-76.4	-24.4	170.6	-75	-156.9	-172.7	-158.9	5.1	113.2	Q48 P49 F50	Q48-R52 PolarHBondContact O-N 3.16Å; P49-R52 PolarHBondContact O-N 3.43Å; P49-R52 VanDerWaalsContact O-N 3.17Å; F50-R52 VanDerWaalsContact C-N 3.34Å; F50-R52 PolarHBondContact O-N 3.31Å
53	L	63.1	Low	67	Low	138 Å²	138	113.7 Å²	113.7	72%	0.723	58%	0.577	S	S	*	*	H	α-helix	trans	-79.2	-30	178.9	-99.9	140.6	0	0	0	113.1	P49 F50	P49-L53 PolarHBondContact O-N 3.04Å; P49-L53 VanDerWaalsContact O-N 3.14Å; F50-L53 PolarHBondContact O-N 3.4Å
54	F	64.4	Low	66.8	Low	109 Å²	109	112.5 Å²	112.5	48%	0.478	57%	0.567	S	S	.	*	S	Bend	trans	-110.7	109.5	-179.9	-69.6	-81.8	0	0	0	110.4	F50 F56	F50-F54 AromaticContact CD1-CD2 3.97Å; F50-F54 HydrophobicContact CD1-CD2 3.97Å; F50-F54 HydrophobicContact CD1-CE2 4Å; F50-F54 HydrophobicContact CE1-CD2 4.02Å; F50-F54 AromaticContact CE1-CE2 3.61Å; F50-F54 HydrophobicContact CE1-CE2 3.61Å; F50-F54 HydrophobicContact CZ-CE2 4.24Å; F50-F54 PolarHBondContact O-N 3.35Å; F54-F56 HydrophobicContact CB-CD2 3.66Å; F54-F56 HydrophobicContact CB-CE2 3.29Å; F54-F56 HydrophobicContact CB-CZ 3.88Å; F54-F56 HydrophobicContact CG-CE2 4.11Å; F54-F56 HydrophobicContact CG-CZ 4.35Å; F54-F56 WeakPolarHBondContact O-CD2 3.24Å; F54-F56 PolarHBondContact O-N 3.18Å
55	S	58.5	Low	66.9	Low	129 Å²	129	113 Å²	113	90%	0.902	57%	0.569	S	S	*	*			trans	-67.1	81.5	169.3	-69	0	0	0	0	109.5
56	F	59.2	Low	67.2	Low	94 Å²	94	112.8 Å²	112.8	41%	0.412	57%	0.568	S	S	.	*			trans	-72	145.2	178.1	-79.3	-75.8	0	0	0	111	F51 F54 W60	F51-F56 AromaticContact CD1-CD2 3.98Å; F51-F56 HydrophobicContact CD1-CD2 3.98Å; F51-F56 HydrophobicContact CD1-CE2 4.35Å; F51-F56 HydrophobicContact CE1-CD2 4.01Å; F51-F56 HydrophobicContact CE1-CE2 4.26Å; F54-F56 HydrophobicContact CB-CD2 3.66Å; F54-F56 HydrophobicContact CB-CE2 3.29Å; F54-F56 HydrophobicContact CB-CZ 3.88Å; F54-F56 HydrophobicContact CG-CE2 4.11Å; F54-F56 HydrophobicContact CG-CZ 4.35Å; F54-F56 WeakPolarHBondContact O-CD2 3.24Å; F54-F56 PolarHBondContact O-N 3.18Å; F56-W60 HydrophobicContact CB-CB 4.43Å
57	P	65.7	Low	67.4	Low	86 Å²	86	110.3 Å²	110.3	56%	0.558	57%	0.565	S	S	*	*			trans	-57.1	141.3	175.7	-19	29.8	0	0	0	111.1	G59 W60	P57-G59 PolarHBondContact O-N 3.46Å; P57-W60 PolarHBondContact O-N 3.34Å
58	V	61.7	Low	67.9	Low	124 Å²	124	111 Å²	111	75%	0.752	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-48.5	-26.5	-174.3	-162	0	0	0	0	114	W60 M61	V58-W60 VanDerWaalsContact C-N 3.28Å; V58-W60 PolarHBondContact O-N 3.01Å; V58-M61 PolarHBondContact O-N 3.47Å
59	G	71.1	Confident	68.6	Low	58 Å²	58	111.8 Å²	111.8	60%	0.598	58%	0.576	S	S	*	*	H	α-helix	trans	-63.9	-24.8	176.5	0	0	0	0	0	115.2	P57	P57-G59 PolarHBondContact O-N 3.46Å
60	W	67.1	Low	69.4	Low	163 Å²	163	112 Å²	112	62%	0.617	58%	0.579	S	S	*	*	H	α-helix	trans	-81.5	-18.2	-178.3	-75.3	56.2	0	0	0	113	F56 P57 V58 S62 S63 Y64	F56-W60 HydrophobicContact CB-CB 4.43Å; P57-W60 PolarHBondContact O-N 3.34Å; V58-W60 VanDerWaalsContact C-N 3.28Å; V58-W60 PolarHBondContact O-N 3.01Å; W60-S62 VanDerWaalsContact C-N 3.31Å; W60-S62 PolarHBondContact O-N 3.48Å; W60-S63 PolarHBondContact O-N 3.37Å; W60-Y64 WeakPolarHBondContact O-CB 3.45Å; W60-Y64 PolarHBondContact O-N 2.87Å
61	M	64.8	Low	70	Confident	135 Å²	135	109 Å²	109	67%	0.665	58%	0.575	S	S	*	*	H	α-helix	trans	-63.3	-36	177	-72.1	-179	88.4	0	0	111.9	V58 Y64 E65	V58-M61 PolarHBondContact O-N 3.47Å; M61-Y64 PolarHBondContact O-N 3.09Å; M61-E65 PolarHBondContact O-N 2.87Å
62	S	72.6	Confident	71	Confident	63 Å²	63	111.2 Å²	111.2	44%	0.441	58%	0.584	S	S	.	*	H	α-helix	trans	-67.4	-42.1	177.6	-178.3	0	0	0	0	112.6	W60 Y64 K66	W60-S62 VanDerWaalsContact C-N 3.31Å; W60-S62 PolarHBondContact O-N 3.48Å; S62-Y64 VanDerWaalsContact C-N 3.28Å; S62-Y64 PolarHBondContact O-N 2.87Å; S62-K66 WeakPolarHBondContact O-CG 3.28Å; S62-K66 PolarHBondContact O-N 2.89Å
63	S	74.1	Confident	72	Confident	80 Å²	80	104.7 Å²	104.7	56%	0.559	57%	0.569	S	S	*	*	H	α-helix	trans	-64.8	-36.2	175.7	-63.1	0	0	0	0	111.5	W60 K66 L67	W60-S63 PolarHBondContact O-N 3.37Å; S63-K66 PolarHBondContact O-N 3.41Å; S63-L67 PolarHBondContact O-N 3.38Å
64	Y	71.9	Confident	72.9	Confident	66 Å²	66	103.9 Å²	103.9	26%	0.259	56%	0.564	S	S	.	*	H	α-helix	trans	-71.2	-42.2	178.2	-176.4	-110.2	0	0	0	112.8	I47 F51 W60 M61 S62 K66 L67 I68	I47-Y64 HydrophobicContact CG2-CE2 4.07Å; F51-Y64 HydrophobicContact CD2-CE2 4.16Å; F51-Y64 HydrophobicContact CE1-CD2 4.37Å; F51-Y64 AromaticContact CE2-CD2 3.98Å; F51-Y64 HydrophobicContact CE2-CD2 3.98Å; F51-Y64 AromaticContact CE2-CE2 3.6Å; F51-Y64 HydrophobicContact CE2-CE2 3.6Å; F51-Y64 AromaticContact CZ-CD2 3.75Å; F51-Y64 HydrophobicContact CZ-CD2 3.75Å; F51-Y64 AromaticContact CZ-CE2 3.89Å; F51-Y64 HydrophobicContact CZ-CE2 3.89Å; F51-Y64 HydrophobicContact CZ-CG 4.46Å; W60-Y64 WeakPolarHBondContact O-CB 3.45Å; W60-Y64 PolarHBondContact O-N 2.87Å; M61-Y64 PolarHBondContact O-N 3.09Å; S62-Y64 VanDerWaalsContact C-N 3.28Å; S62-Y64 PolarHBondContact O-N 2.87Å; Y64-K66 VanDerWaalsContact C-N 3.27Å; Y64-K66 PolarHBondContact O-N 2.88Å; Y64-L67 WeakPolarHBondContact O-CB 3.33Å; Y64-L67 PolarHBondContact O-N 2.8Å; Y64-L67 VanDerWaalsContact O-N 3.09Å; Y64-I68 HydrophobicContact CD1-CD1 3.55Å; Y64-I68 HydrophobicContact CD1-CG1 4.35Å; Y64-I68 HydrophobicContact CE1-CD1 3.05Å; Y64-I68 HydrophobicContact CE1-CG1 3.97Å; Y64-I68 HydrophobicContact CE2-CD1 4.16Å; Y64-I68 HydrophobicContact CE2-CG1 4.2Å; Y64-I68 HydrophobicContact CG-CD1 4.29Å; Y64-I68 PolarHBondContact O-N 2.9Å
65	E	76.4	Confident	73.7	Confident	140 Å²	140	100.8 Å²	100.8	65%	0.654	55%	0.553	S	S	*	*	H	α-helix	trans	-57.9	-41.7	172.5	-84.5	-169.5	151.8	0	0	111.5	M61 I68 L69	M61-E65 PolarHBondContact O-N 2.87Å; E65-I68 PolarHBondContact O-N 3.49Å; E65-L69 VanDerWaalsContact O-CB 3.27Å; E65-L69 WeakPolarHBondContact O-CB 3.25Å; E65-L69 PolarHBondContact O-N 3.36Å
66	K	79.6	Confident	74.7	Confident	149 Å²	149	97.9 Å²	97.9	65%	0.648	53%	0.53	S	S	*	.	H	α-helix	trans	-64.6	-38.7	174.7	-70.3	177.9	-176.1	-179.8	0	112.3	S62 S63 Y64 L69 S70	S62-K66 WeakPolarHBondContact O-CG 3.28Å; S62-K66 PolarHBondContact O-N 2.89Å; S63-K66 PolarHBondContact O-N 3.41Å; Y64-K66 VanDerWaalsContact C-N 3.27Å; Y64-K66 PolarHBondContact O-N 2.88Å; K66-L69 PolarHBondContact O-N 3.26Å; K66-S70 WeakPolarHBondContact O-CB 3.48Å; K66-S70 PolarHBondContact O-N 2.96Å
67	L	80.4	Confident	75.9	Confident	115 Å²	115	96.1 Å²	96.1	60%	0.602	53%	0.533	S	S	*	.	H	α-helix	trans	-66.6	-44.3	177.7	-164.9	85.4	0	0	0	111.6	S63 Y64 S70 S71	S63-L67 PolarHBondContact O-N 3.38Å; Y64-L67 WeakPolarHBondContact O-CB 3.33Å; Y64-L67 PolarHBondContact O-N 2.8Å; Y64-L67 VanDerWaalsContact O-N 3.09Å; L67-S70 WeakPolarHBondContact O-CB 3.48Å; L67-S70 PolarHBondContact O-N 3.39Å; L67-S71 PolarHBondContact O-N 3.41Å; L67-S71 PolarHBondContact O-OG 2.86Å
68	I	79.2	Confident	76.6	Confident	73 Å²	73	94.2 Å²	94.2	37%	0.374	52%	0.521	S	S	.	.	H	α-helix	trans	-63.5	-45.8	174.9	-68.9	166.5	0	0	0	110.4	Y64 E65 S70 S71 F72	Y64-I68 HydrophobicContact CD1-CD1 3.55Å; Y64-I68 HydrophobicContact CD1-CG1 4.35Å; Y64-I68 HydrophobicContact CE1-CD1 3.05Å; Y64-I68 HydrophobicContact CE1-CG1 3.97Å; Y64-I68 HydrophobicContact CE2-CD1 4.16Å; Y64-I68 HydrophobicContact CE2-CG1 4.2Å; Y64-I68 HydrophobicContact CG-CD1 4.29Å; Y64-I68 PolarHBondContact O-N 2.9Å; E65-I68 PolarHBondContact O-N 3.49Å; I68-S70 VanDerWaalsContact C-N 3.28Å; I68-S70 PolarHBondContact O-N 3.08Å; I68-S71 PolarHBondContact O-N 3.4Å; I68-S71 PolarHBondContact O-OG 2.9Å; I68-F72 WeakPolarHBondContact O-CB 3.46Å; I68-F72 PolarHBondContact O-N 3.37Å
69	L	80.6	Confident	77.5	Confident	124 Å²	124	92.1 Å²	92.1	65%	0.649	51%	0.505	S	S	*	.	H	α-helix	trans	-62.6	-41.8	-179.8	-161	72.1	0	0	0	110.3	E65 K66 F72 T73	E65-L69 VanDerWaalsContact O-CB 3.27Å; E65-L69 WeakPolarHBondContact O-CB 3.25Å; E65-L69 PolarHBondContact O-N 3.36Å; K66-L69 PolarHBondContact O-N 3.26Å; L69-F72 PolarHBondContact O-N 3.46Å; L69-T73 PolarHBondContact O-N 2.91Å; L69-T73 PolarHBondContact O-OG1 3.3Å
70	S	81.7	Confident	78	Confident	70 Å²	70	93 Å²	93	49%	0.49	50%	0.501	S	S	.	.	H	α-helix	trans	-59.6	-47	174.2	-179.1	0	0	0	0	112.2	K66 L67 I68 F72 T73 L74	K66-S70 WeakPolarHBondContact O-CB 3.48Å; K66-S70 PolarHBondContact O-N 2.96Å; L67-S70 WeakPolarHBondContact O-CB 3.48Å; L67-S70 PolarHBondContact O-N 3.39Å; I68-S70 VanDerWaalsContact C-N 3.28Å; I68-S70 PolarHBondContact O-N 3.08Å; S70-F72 VanDerWaalsContact C-N 3.35Å; S70-T73 VanDerWaalsContact C-OG1 3.31Å; S70-T73 VanDerWaalsContact CA-OG1 3.25Å; S70-T73 WeakPolarHBondContact CA-OG1 3.34Å; S70-T73 PolarHBondContact O-N 2.73Å; S70-T73 PolarHBondContact O-OG1 2.95Å; S70-L74 PolarHBondContact O-N 2.95Å
71	S	77.8	Confident	78.8	Confident	70 Å²	70	92.5 Å²	92.5	49%	0.49	50%	0.5	S	S	.	.	H	α-helix	trans	-66.6	-37.7	179.4	67.4	0	0	0	0	111.6	L67 I68 L74 L75	L67-S71 PolarHBondContact O-N 3.41Å; L67-S71 PolarHBondContact O-OG 2.86Å; I68-S71 PolarHBondContact O-N 3.4Å; I68-S71 PolarHBondContact O-OG 2.9Å; S71-L74 PolarHBondContact O-N 3.2Å; S71-L75 WeakPolarHBondContact O-CB 3.41Å; S71-L75 PolarHBondContact O-N 3.05Å
72	F	80.8	Confident	79.4	Confident	131 Å²	131	89.4 Å²	89.4	58%	0.575	48%	0.484	S	S	*	.	H	α-helix	trans	-67.2	-39.4	175.5	-157.6	-93.8	0	0	0	112.3	I68 L69 S70 L75 T76	I68-F72 WeakPolarHBondContact O-CB 3.46Å; I68-F72 PolarHBondContact O-N 3.37Å; L69-F72 PolarHBondContact O-N 3.46Å; S70-F72 VanDerWaalsContact C-N 3.35Å; F72-L75 PolarHBondContact O-N 2.95Å; F72-T76 HydrophobicContact CD1-CG2 4.36Å; F72-T76 HydrophobicContact CE1-CG2 4.11Å; F72-T76 PolarHBondContact O-N 3.49Å; F72-T76 PolarHBondContact O-OG1 3.47Å
73	T	81.7	Confident	79.7	Confident	81 Å²	81	90.8 Å²	90.8	50%	0.497	49%	0.485	S	S	.	.	H	α-helix	trans	-64.2	-39.2	171.5	33.8	0	0	0	0	112.6	L69 S70 T76 A77	L69-T73 PolarHBondContact O-N 2.91Å; L69-T73 PolarHBondContact O-OG1 3.3Å; S70-T73 VanDerWaalsContact C-OG1 3.31Å; S70-T73 VanDerWaalsContact CA-OG1 3.25Å; S70-T73 WeakPolarHBondContact CA-OG1 3.34Å; S70-T73 PolarHBondContact O-N 2.73Å; S70-T73 PolarHBondContact O-OG1 2.95Å; T73-T76 VanDerWaalsContact CA-OG1 3.31Å; T73-T76 WeakPolarHBondContact CA-OG1 3.45Å; T73-T76 PolarHBondContact O-OG1 3.06Å; T73-T76 VanDerWaalsContact O-OG1 3.08Å; T73-A77 WeakPolarHBondContact O-CB 3.39Å; T73-A77 PolarHBondContact O-N 3.49Å
74	L	82.5	Confident	79.9	Confident	121 Å²	121	93.2 Å²	93.2	63%	0.634	49%	0.486	S	S	*	.	H	α-helix	trans	-66	-41.6	176.5	-157.3	91.3	0	0	0	110.8	S70 S71 A77 C78	S70-L74 PolarHBondContact O-N 2.95Å; S71-L74 PolarHBondContact O-N 3.2Å; L74-A77 PolarHBondContact O-N 2.89Å; L74-C78 WeakPolarHBondContact O-CB 3.25Å; L74-C78 PolarHBondContact O-N 2.89Å; L74-C78 PolarHBondContact O-SG 3.25Å; L74-C78 VanDerWaalsContact O-SG 3.33Å
75	L	79.4	Confident	80.2	Confident	45 Å²	45	92.5 Å²	92.5	24%	0.236	49%	0.489	C	S	.	.	H	α-helix	trans	-63.7	-46.2	178.2	-171.7	71.4	0	0	0	111.6	L36 S71 F72 A77 C78 I79	L36-L75 HydrophobicContact CD2-CD1 3.56Å; L36-L75 HydrophobicContact CG-CD1 3.84Å; S71-L75 WeakPolarHBondContact O-CB 3.41Å; S71-L75 PolarHBondContact O-N 3.05Å; F72-L75 PolarHBondContact O-N 2.95Å; L75-A77 VanDerWaalsContact C-N 3.35Å; L75-A77 PolarHBondContact O-N 2.77Å; L75-C78 PolarHBondContact O-N 3.41Å; L75-I79 HydrophobicContact CG-CD1 4.01Å; L75-I79 VanDerWaalsContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 3.23Å
76	T	81.4	Confident	80.2	Confident	68 Å²	68	90 Å²	90	42%	0.417	48%	0.479	S	S	.	.	H	α-helix	trans	-64.7	-37.8	176.4	37.4	0	0	0	0	112.1	F72 T73 I79 S80	F72-T76 HydrophobicContact CD1-CG2 4.36Å; F72-T76 HydrophobicContact CE1-CG2 4.11Å; F72-T76 PolarHBondContact O-N 3.49Å; F72-T76 PolarHBondContact O-OG1 3.47Å; T73-T76 VanDerWaalsContact CA-OG1 3.31Å; T73-T76 WeakPolarHBondContact CA-OG1 3.45Å; T73-T76 PolarHBondContact O-OG1 3.06Å; T73-T76 VanDerWaalsContact O-OG1 3.08Å; T76-I79 PolarHBondContact O-N 3.37Å; T76-S80 VanDerWaalsContact O-CB 3.25Å; T76-S80 WeakPolarHBondContact O-CB 3.12Å; T76-S80 PolarHBondContact O-N 3.39Å
77	A	82.4	Confident	80.1	Confident	57 Å²	57	86.9 Å²	86.9	47%	0.471	47%	0.469	S	S	.	.	H	α-helix	trans	-62.8	-44.4	172.2	0	0	0	0	0	112.2	T73 L74 L75 S80 Y81	T73-A77 WeakPolarHBondContact O-CB 3.39Å; T73-A77 PolarHBondContact O-N 3.49Å; L74-A77 PolarHBondContact O-N 2.89Å; L75-A77 VanDerWaalsContact C-N 3.35Å; L75-A77 PolarHBondContact O-N 2.77Å; A77-S80 PolarHBondContact O-N 3.29Å; A77-Y81 WeakPolarHBondContact O-CB 3.39Å; A77-Y81 PolarHBondContact O-N 3.13Å
78	C	81.2	Confident	79.9	Confident	46 Å²	46	83.3 Å²	83.3	31%	0.311	45%	0.453	S	S	.	.	H	α-helix	trans	-62	-46.3	175.8	-74.5	0	0	0	0	112.1	L36 L74 L75 S80 Y81 H82	L36-C78 HydrophobicContact CD2-CB 4.47Å; L74-C78 WeakPolarHBondContact O-CB 3.25Å; L74-C78 PolarHBondContact O-N 2.89Å; L74-C78 PolarHBondContact O-SG 3.25Å; L74-C78 VanDerWaalsContact O-SG 3.33Å; L75-C78 PolarHBondContact O-N 3.41Å; C78-S80 PolarHBondContact O-N 3.43Å; C78-Y81 PolarHBondContact O-N 2.91Å; C78-H82 PolarHBondContact O-CD2 2.9Å; C78-H82 PolarHBondContact O-N 2.89Å
79	I	80.9	Confident	79.6	Confident	80 Å²	80	82.1 Å²	82.1	41%	0.41	45%	0.451	S	S	.	.	H	α-helix	trans	-61.9	-45.1	177.1	-67.3	166.2	0	0	0	110.3	L75 T76 Y81 H82 I83	L75-I79 HydrophobicContact CG-CD1 4.01Å; L75-I79 VanDerWaalsContact O-CG1 3.28Å; L75-I79 WeakPolarHBondContact O-CG1 3.43Å; L75-I79 PolarHBondContact O-N 3.23Å; T76-I79 PolarHBondContact O-N 3.37Å; I79-Y81 PolarHBondContact O-N 2.98Å; I79-H82 PolarHBondContact O-N 2.92Å; I79-I83 HydrophobicContact CG2-CD1 3.84Å; I79-I83 HydrophobicContact CG2-CG1 4.42Å; I79-I83 WeakPolarHBondContact O-CG1 3.11Å; I79-I83 PolarHBondContact O-N 2.91Å
80	S	82.2	Confident	79.1	Confident	75 Å²	75	80 Å²	80	52%	0.524	44%	0.444	S	S	.	.	H	α-helix	trans	-60.2	-44	177	-175.4	0	0	0	0	111.9	T76 A77 C78 H82 I83 F84	T76-S80 VanDerWaalsContact O-CB 3.25Å; T76-S80 WeakPolarHBondContact O-CB 3.12Å; T76-S80 PolarHBondContact O-N 3.39Å; A77-S80 PolarHBondContact O-N 3.29Å; C78-S80 PolarHBondContact O-N 3.43Å; S80-H82 PolarHBondContact O-N 3.27Å; S80-I83 PolarHBondContact O-N 3.45Å; S80-F84 WeakPolarHBondContact O-CB 3.31Å; S80-F84 PolarHBondContact O-N 2.95Å
81	Y	83	Confident	78.3	Confident	154 Å²	154	81.4 Å²	81.4	60%	0.604	45%	0.445	S	S	*	.	H	α-helix	trans	-60.8	-43.7	175.3	-179.7	-101.2	0	0	0	111.8	A77 C78 I79 F84 V85	A77-Y81 WeakPolarHBondContact O-CB 3.39Å; A77-Y81 PolarHBondContact O-N 3.13Å; C78-Y81 PolarHBondContact O-N 2.91Å; I79-Y81 PolarHBondContact O-N 2.98Å; Y81-F84 WeakPolarHBondContact O-CB 3.47Å; Y81-F84 PolarHBondContact O-N 3.29Å; Y81-V85 HydrophobicContact CD1-CG2 4.26Å; Y81-V85 HydrophobicContact CE1-CG2 3.87Å; Y81-V85 HydrophobicContact CE2-CG2 4.31Å; Y81-V85 WeakPolarHBondContact O-CG2 3.47Å; Y81-V85 PolarHBondContact O-N 2.86Å
82	H	77.2	Confident	77.4	Confident	70 Å²	70	82.4 Å²	82.4	32%	0.324	45%	0.448	S	S	.	.	H	α-helix	trans	-65.1	-40.7	176.5	-82.4	-70.7	0	0	0	112.7	C78 I79 S80 F84 V85 I86	C78-H82 PolarHBondContact O-CD2 2.9Å; C78-H82 PolarHBondContact O-N 2.89Å; I79-H82 PolarHBondContact O-N 2.92Å; S80-H82 PolarHBondContact O-N 3.27Å; H82-F84 VanDerWaalsContact C-N 3.34Å; H82-V85 PolarHBondContact O-N 2.81Å; H82-I86 VanDerWaalsContact O-CG1 3.24Å; H82-I86 WeakPolarHBondContact O-CG1 3.31Å; H82-I86 PolarHBondContact O-N 3.39Å
83	I	78.4	Confident	76.1	Confident	91 Å²	91	84.1 Å²	84.1	47%	0.467	45%	0.451	S	S	.	.	H	α-helix	trans	-61.2	-44.2	173.6	-68.6	169.6	0	0	0	110.2	I79 S80 V85 I86 I87	I79-I83 HydrophobicContact CG2-CD1 3.84Å; I79-I83 HydrophobicContact CG2-CG1 4.42Å; I79-I83 WeakPolarHBondContact O-CG1 3.11Å; I79-I83 PolarHBondContact O-N 2.91Å; S80-I83 PolarHBondContact O-N 3.45Å; I83-V85 PolarHBondContact O-N 3.29Å; I83-I86 PolarHBondContact O-N 2.92Å; I83-I87 HydrophobicContact CG2-CD1 3.65Å; I83-I87 HydrophobicContact CG2-CG1 4.33Å; I83-I87 WeakPolarHBondContact O-CG1 3.37Å; I83-I87 PolarHBondContact O-N 2.96Å
84	F	79.5	Confident	74.7	Confident	131 Å²	131	90.3 Å²	90.3	58%	0.575	47%	0.465	S	S	*	.	H	α-helix	trans	-61.1	-43.3	176.9	179.9	-96.4	0	0	0	112.4	S80 Y81 H82 I86 I87 S88	S80-F84 WeakPolarHBondContact O-CB 3.31Å; S80-F84 PolarHBondContact O-N 2.95Å; Y81-F84 WeakPolarHBondContact O-CB 3.47Å; Y81-F84 PolarHBondContact O-N 3.29Å; H82-F84 VanDerWaalsContact C-N 3.34Å; F84-I86 VanDerWaalsContact C-N 3.33Å; F84-I86 PolarHBondContact O-N 2.93Å; F84-I87 PolarHBondContact O-N 2.97Å; F84-S88 WeakPolarHBondContact CE1-OG 3.42Å; F84-S88 VanDerWaalsContact O-CB 3.28Å; F84-S88 WeakPolarHBondContact O-CB 3.05Å; F84-S88 PolarHBondContact O-N 3.33Å; F84-S88 PolarHBondContact O-OG 2.92Å
85	V	78.6	Confident	73.2	Confident	52 Å²	52	91.6 Å²	91.6	32%	0.315	47%	0.47	S	S	.	.	H	α-helix	trans	-64	-39	175.7	171.4	0	0	0	0	111.2	Y81 H82 I83 S89	Y81-V85 HydrophobicContact CD1-CG2 4.26Å; Y81-V85 HydrophobicContact CE1-CG2 3.87Å; Y81-V85 HydrophobicContact CE2-CG2 4.31Å; Y81-V85 WeakPolarHBondContact O-CG2 3.47Å; Y81-V85 PolarHBondContact O-N 2.86Å; H82-V85 PolarHBondContact O-N 2.81Å; I83-V85 PolarHBondContact O-N 3.29Å; V85-S89 WeakPolarHBondContact O-CB 2.96Å; V85-S89 PolarHBondContact O-N 2.95Å; V85-S89 PolarHBondContact O-OG 3.48Å
86	I	75.8	Confident	71.6	Confident	86 Å²	86	95.7 Å²	95.7	44%	0.441	49%	0.492	S	S	.	.	H	α-helix	trans	-64.5	-48.9	176.1	-68.9	164.8	0	0	0	110.6	H82 I83 F84 S89 T90	H82-I86 VanDerWaalsContact O-CG1 3.24Å; H82-I86 WeakPolarHBondContact O-CG1 3.31Å; H82-I86 PolarHBondContact O-N 3.39Å; I83-I86 PolarHBondContact O-N 2.92Å; F84-I86 VanDerWaalsContact C-N 3.33Å; F84-I86 PolarHBondContact O-N 2.93Å; I86-S89 PolarHBondContact O-N 3.42Å; I86-S89 PolarHBondContact O-OG 3.43Å; I86-T90 PolarHBondContact O-N 3.18Å; I86-T90 VanDerWaalsContact O-N 3.12Å; I86-T90 PolarHBondContact O-OG1 3.44Å
87	I	76.7	Confident	69.8	Low	85 Å²	85	97 Å²	97	44%	0.436	50%	0.504	S	S	.	.	H	α-helix	trans	-63.8	-42.6	179.2	-68.2	170.9	0	0	0	111.4	I83 F84 S89 T90 L91	I83-I87 HydrophobicContact CG2-CD1 3.65Å; I83-I87 HydrophobicContact CG2-CG1 4.33Å; I83-I87 WeakPolarHBondContact O-CG1 3.37Å; I83-I87 PolarHBondContact O-N 2.96Å; F84-I87 PolarHBondContact O-N 2.97Å; I87-S89 VanDerWaalsContact C-N 3.29Å; I87-S89 PolarHBondContact O-N 2.89Å; I87-T90 PolarHBondContact O-N 2.83Å; I87-T90 VanDerWaalsContact O-N 3.17Å; I87-T90 PolarHBondContact O-OG1 3.36Å; I87-L91 HydrophobicContact CG2-CD1 3.86Å; I87-L91 PolarHBondContact O-N 3.07Å
88	S	76.6	Confident	67.9	Low	40 Å²	40	97.3 Å²	97.3	28%	0.28	51%	0.512	S	S	.	.	H	α-helix	trans	-62.2	-39.6	176.9	-60.3	0	0	0	0	111	F84 T90 L91 V92	F84-S88 WeakPolarHBondContact CE1-OG 3.42Å; F84-S88 VanDerWaalsContact O-CB 3.28Å; F84-S88 WeakPolarHBondContact O-CB 3.05Å; F84-S88 PolarHBondContact O-N 3.33Å; F84-S88 PolarHBondContact O-OG 2.92Å; S88-T90 VanDerWaalsContact C-N 3.31Å; S88-T90 PolarHBondContact O-N 2.89Å; S88-L91 PolarHBondContact O-N 3.13Å; S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 3.44Å; S88-V92 VanDerWaalsContact O-N 3.09Å
89	S	74.3	Confident	66	Low	47 Å²	47	102.5 Å²	102.5	33%	0.329	54%	0.537	S	S	.	.	H	α-helix	trans	-68.5	-26.1	177	73.9	0	0	0	0	114	V85 I86 I87	V85-S89 WeakPolarHBondContact O-CB 2.96Å; V85-S89 PolarHBondContact O-N 2.95Å; V85-S89 PolarHBondContact O-OG 3.48Å; I86-S89 PolarHBondContact O-N 3.42Å; I86-S89 PolarHBondContact O-OG 3.43Å; I87-S89 VanDerWaalsContact C-N 3.29Å; I87-S89 PolarHBondContact O-N 2.89Å
90	T	68.3	Low	63.9	Low	80 Å²	80	103.3 Å²	103.3	49%	0.491	55%	0.55	S	S	.	.	H	α-helix	trans	-84.9	-33.3	175.4	55.3	0	0	0	0	112.7	I86 I87 S88 R93 R94	I86-T90 PolarHBondContact O-N 3.18Å; I86-T90 VanDerWaalsContact O-N 3.12Å; I86-T90 PolarHBondContact O-OG1 3.44Å; I87-T90 PolarHBondContact O-N 2.83Å; I87-T90 VanDerWaalsContact O-N 3.17Å; I87-T90 PolarHBondContact O-OG1 3.36Å; S88-T90 VanDerWaalsContact C-N 3.31Å; S88-T90 PolarHBondContact O-N 2.89Å; T90-R93 PolarHBondContact O-N 3.5Å; T90-R94 PolarHBondContact O-N 2.99Å
91	L	64.9	Low	61.8	Low	99 Å²	99	108.1 Å²	108.1	52%	0.518	56%	0.563	S	S	.	*	H	α-helix	trans	-66.3	-44.7	174.2	-95.9	153.8	0	0	0	112.3	I87 S88 R93 R94 M95	I87-L91 HydrophobicContact CG2-CD1 3.86Å; I87-L91 PolarHBondContact O-N 3.07Å; S88-L91 PolarHBondContact O-N 3.13Å; L91-R93 VanDerWaalsContact C-N 3.26Å; L91-R93 PolarHBondContact O-N 3.17Å; L91-R94 PolarHBondContact O-N 3.43Å; L91-M95 PolarHBondContact O-N 3.37Å
92	V	60.1	Low	59.4	Low	92 Å²	92	108 Å²	108	56%	0.558	57%	0.574	S	S	*	*	H	α-helix	trans	-60.1	-38.9	175.7	173.8	0	0	0	0	110.8	S88 R94 M95 D96	S88-V92 WeakPolarHBondContact O-CG2 3.39Å; S88-V92 PolarHBondContact O-N 3.44Å; S88-V92 VanDerWaalsContact O-N 3.09Å; V92-R94 VanDerWaalsContact C-N 3.29Å; V92-R94 PolarHBondContact O-N 3.28Å; V92-M95 PolarHBondContact O-N 3.14Å; V92-D96 PolarHBondContact O-N 3.34Å
93	R	52.7	Low	57.4	Low	166 Å²	166	113.6 Å²	113.6	63%	0.626	60%	0.6	S	S	*	*	H	α-helix	trans	-66.7	-24.3	174.7	-84.4	-174.6	-178.5	173.1	4.3	114.5	T90 L91	T90-R93 PolarHBondContact O-N 3.5Å; L91-R93 VanDerWaalsContact C-N 3.26Å; L91-R93 PolarHBondContact O-N 3.17Å
94	R	52.7	Low	55.2	Low	211 Å²	211	114.8 Å²	114.8	80%	0.796	62%	0.616	S	S	*	*	H	α-helix	trans	-82.1	-32.4	177.3	-109.2	-174.4	-169.3	-179.9	4.1	112.7	T90 L91 V92	T90-R94 PolarHBondContact O-N 2.99Å; L91-R94 PolarHBondContact O-N 3.43Å; V92-R94 VanDerWaalsContact C-N 3.29Å; V92-R94 PolarHBondContact O-N 3.28Å
95	M	50.4	Low	52.9	Low	149 Å²	149	113.2 Å²	113.2	73%	0.734	63%	0.628	S	S	*	*	H	α-helix	trans	-73.5	-34.8	179.8	-81.8	168.8	89.1	0	0	112.8	L91 V92 S97 G98	L91-M95 PolarHBondContact O-N 3.37Å; V92-M95 PolarHBondContact O-N 3.14Å; M95-S97 VanDerWaalsContact C-N 3.28Å; M95-S97 PolarHBondContact O-N 3.16Å; M95-G98 PolarHBondContact O-N 3.42Å
96	D	45.6	Very low	50.7	Low	130 Å²	130	118.9 Å²	118.9	70%	0.695	66%	0.655	S	S	*	*	H	α-helix	trans	-68.7	-25.4	175.7	-78.8	-24	0	0	0	113.3	V92 G98	V92-D96 PolarHBondContact O-N 3.34Å; D96-G98 VanDerWaalsContact C-N 3.3Å; D96-G98 PolarHBondContact O-N 3.23Å
97	S	45.3	Very low	48.4	Very low	96 Å²	96	126.6 Å²	126.6	67%	0.671	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-14	176.8	-176.8	0	0	0	0	113.6	M95	M95-S97 VanDerWaalsContact C-N 3.28Å; M95-S97 PolarHBondContact O-N 3.16Å
98	G	41.1	Very low	46.3	Very low	63 Å²	63	130.8 Å²	130.8	65%	0.649	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-12.9	-174.7	0	0	0	0	0	114.9	M95 D96	M95-G98 PolarHBondContact O-N 3.42Å; D96-G98 VanDerWaalsContact C-N 3.3Å; D96-G98 PolarHBondContact O-N 3.23Å
99	N	41.3	Very low	44.1	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	73%	0.728	S	S	*	*	S	Bend	trans	-112.5	12.8	-166.6	-142.7	17.6	0	0	0	115.1
100	S	37.6	Very low	42.2	Very low	97 Å²	97	140.4 Å²	140.4	68%	0.678	75%	0.748	S	S	*	*			trans	-103.6	13.5	-179.9	89.3	0	0	0	0	114.9	N102	S100-N102 VanDerWaalsContact C-N 3.33Å; S100-N102 PolarHBondContact O-N 2.88Å; S100-N102 VanDerWaalsContact O-N 3.16Å
101	H	37.2	Very low	40.5	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	76%	0.763	S	S	*	*			trans	-82.7	77.8	168.1	-91.3	25.8	0	0	0	109.6
102	N	33.2	Very low	39	Very low	153 Å²	153	143.5 Å²	143.5	82%	0.818	78%	0.778	S	S	*	*	S	Bend	trans	173.7	72.8	157.2	-88.7	-22	0	0	0	109.2	S100	S100-N102 VanDerWaalsContact C-N 3.33Å; S100-N102 PolarHBondContact O-N 2.88Å; S100-N102 VanDerWaalsContact O-N 3.16Å
103	Q	34.3	Very low	37.6	Very low	186 Å²	186	147.2 Å²	147.2	87%	0.869	79%	0.794	S	S	*	*	S	Bend	trans	-169.6	134	148	-107.7	161	58.7	0	0	111.7
104	S	33.6	Very low	36.5	Very low	116 Å²	116	146.5 Å²	146.5	81%	0.811	80%	0.803	S	S	*	*			trans	70.5	82.4	162	45.8	0	0	0	0	118.3
105	A	31	Very low	35.5	Very low	99 Å²	99	146.1 Å²	146.1	82%	0.818	81%	0.807	S	S	*	*			trans	-64.4	127.4	146	0	0	0	0	0	110.6
106	L	32.2	Very low	34.4	Very low	171 Å²	171	144.2 Å²	144.2	90%	0.895	81%	0.808	S	S	*	*			trans	-167.2	90.4	150.7	-103.3	156	0	0	0	106.8
107	R	27.7	Very low	33.7	Very low	248 Å²	248	146 Å²	146	94%	0.936	82%	0.816	S	S	*	*			trans	-101.1	127.8	169.5	-79.7	-174.9	-175.3	173	2.6	108.3
108	L	31.9	Very low	33.1	Very low	173 Å²	173	147.7 Å²	147.7	91%	0.906	82%	0.822	S	S	*	*			trans	-125.3	133	157.7	-95.4	162.8	0	0	0	109.5
109	H	30.6	Very low	32.5	Very low	181 Å²	181	147.7 Å²	147.7	84%	0.838	82%	0.822	S	S	*	*			trans	-63.1	145.2	-175.5	-94.4	-116.8	0	0	0	114.2
110	S	34.8	Very low	32	Very low	108 Å²	108	146.6 Å²	146.6	76%	0.755	82%	0.824	S	S	*	*				179.1	122.7	119.3	36.6	0	0	0	0	113.6
111	S	32.1	Very low	31.5	Very low	115 Å²	115	147.2 Å²	147.2	80%	0.804	83%	0.828	S	S	*	*			trans	67.2	123.2	140.6	-42.8	0	0	0	0	121.7
112	P	32.7	Very low	31.1	Very low	128 Å²	128	146.8 Å²	146.8	83%	0.831	83%	0.829	S	S	*	*			trans	-99.1	127.2	175	35.7	-26.1	0	0	0	112.3
113	L	32.2	Very low	30.9	Very low	171 Å²	171	148.3 Å²	148.3	90%	0.895	83%	0.828	S	S	*	*			trans	-147.6	102.9	163.5	-107.1	162.9	0	0	0	110.4
114	N	28.4	Very low	30.6	Very low	151 Å²	151	145.1 Å²	145.1	81%	0.807	83%	0.825	S	S	*	*			trans	30.1	107.2	143.4	-137	2	0	0	0	118.4
115	K	32	Very low	30.4	Very low	203 Å²	203	145.4 Å²	145.4	88%	0.883	83%	0.827	S	S	*	*			trans	-170.6	114.7	140.2	-104.4	163.7	-171.6	-175.3	0	110.8	L117	K115-L117 PolarHBondContact O-N 3.46Å
116	S	27.7	Very low	30.3	Very low	108 Å²	108	145 Å²	145	76%	0.755	82%	0.818	S	S	*	*			trans	-17.1	119	150.6	166	0	0	0	0	114.2
117	L	31.3	Very low	30.2	Very low	167 Å²	167	144.6 Å²	144.6	87%	0.874	82%	0.816	S	S	*	*			trans	-155.7	101.7	156.2	-147.2	77.8	0	0	0	110.8	K115	K115-L117 PolarHBondContact O-N 3.46Å
118	V	32.3	Very low	30.3	Very low	132 Å²	132	141.2 Å²	141.2	80%	0.8	82%	0.816	S	S	*	*			trans	2.2	118.3	145.4	-175.9	0	0	0	0	116.6
119	G	28.4	Very low	30.2	Very low	63 Å²	63	142 Å²	142	65%	0.649	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-92	163	160.1	0	0	0	0	0	111.9
120	P	30.9	Very low	30.1	Very low	133 Å²	133	141.2 Å²	141.2	86%	0.864	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-87.3	155.9	-134.5	32.2	-35.8	0	0	0	116.5
121	S	27.3	Very low	30	Very low	111 Å²	111	141.6 Å²	141.6	78%	0.776	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-62.6	153.1	178.1	57.7	0	0	0	0	115.5
122	M	28.7	Very low	29.9	Very low	166 Å²	166	143.8 Å²	143.8	82%	0.818	82%	0.818	S	S	*	*			trans	-145.8	131	141.8	-97.1	-164.2	-74.7	0	0	109.2
123	F	29.2	Very low	29.7	Very low	185 Å²	185	144.2 Å²	144.2	81%	0.811	81%	0.814	S	S	*	*			trans	85.4	78.2	174.2	-54	-73.7	0	0	0	118.3
124	C	28.5	Very low	29.7	Very low	119 Å²	119	143.5 Å²	143.5	80%	0.804	81%	0.809	S	S	*	*			trans	-91	116	140.6	-78.8	0	0	0	0	108.3
125	S	29.1	Very low	29.7	Very low	121 Å²	121	141.1 Å²	141.1	85%	0.846	80%	0.804	S	S	*	*			trans	-101.4	91.3	157.5	-69.7	0	0	0	0	107.2
126	S	28.9	Very low	29.5	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	80%	0.796	S	S	*	*			trans	-146.8	76.1	171.5	58.9	0	0	0	0	108.2
127	L	28.5	Very low	29.6	Very low	163 Å²	163	137.1 Å²	137.1	85%	0.853	80%	0.8	S	S	*	*			trans	-151.8	75.7	169.1	-77.7	-177.2	0	0	0	109.4
128	L	29.9	Very low	29.4	Very low	176 Å²	176	133.1 Å²	133.1	92%	0.921	80%	0.799	S	S	*	*			trans	-151.5	67.4	154.3	-86.5	-174.1	0	0	0	108.6
129	K	30.1	Very low	29.3	Very low	190 Å²	190	131.7 Å²	131.7	83%	0.826	80%	0.802	S	S	*	*	S	Bend	trans	-159.3	140.1	153.4	-130.6	153.2	-178.1	171.2	0	105.7
130	D	29.7	Very low	29.2	Very low	164 Å²	164	134.9 Å²	134.9	88%	0.877	81%	0.809	S	S	*	*			trans	93.4	83.7	-175.8	-48.5	-20.2	0	0	0	114.8
131	S	31.8	Very low	29.2	Very low	116 Å²	116	138.5 Å²	138.5	81%	0.811	81%	0.811	S	S	*	*				179.4	86.1	117.2	-165	0	0	0	0	108.1
132	L	30.3	Very low	29.4	Very low	161 Å²	161	136.5 Å²	136.5	84%	0.843	81%	0.808	S	S	*	*			trans	-78.6	149.1	149.4	-89.9	157	0	0	0	107.3
133	D	28.7	Very low	29.3	Very low	137 Å²	137	136 Å²	136	73%	0.733	81%	0.809	S	S	*	*			trans	97.3	136	166.3	-54.6	-31.8	0	0	0	119.2
134	I	31.8	Very low	29.4	Very low	157 Å²	157	133.3 Å²	133.3	81%	0.805	81%	0.813	S	S	*	*			trans	101.8	81.5	160.2	-47	178.2	0	0	0	116.8
135	S	29.1	Very low	29.4	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	81%	0.807	S	S	*	*			trans	16.3	137.1	132.8	77.5	0	0	0	0	122.7
136	S	28.1	Very low	29.5	Very low	102 Å²	102	136.7 Å²	136.7	71%	0.713	81%	0.811	S	S	*	*				101.4	142.5	126.6	90	0	0	0	0	119.9
137	C	29	Very low	29.5	Very low	125 Å²	125	140.4 Å²	140.4	85%	0.845	82%	0.819	S	S	*	*			trans	93	111.9	158.3	-58	0	0	0	0	115.9
138	G	26.4	Very low	29.6	Very low	83 Å²	83	140.6 Å²	140.6	86%	0.856	82%	0.819	S	S	*	*			trans	-87.1	177.3	-172.9	0	0	0	0	0	114.7
139	A	31.2	Very low	29.5	Very low	103 Å²	103	137.5 Å²	137.5	85%	0.851	81%	0.807	S	S	*	*			trans	-157	127.5	151.1	0	0	0	0	0	108.5
140	T	26.1	Very low	29.6	Very low	129 Å²	129	134.2 Å²	134.2	79%	0.791	81%	0.808	S	S	*	*			trans	-81	178.8	-177.5	-44.1	0	0	0	0	111.2
141	F	30.8	Very low	29.7	Very low	210 Å²	210	130.2 Å²	130.2	92%	0.921	81%	0.805	S	S	*	*			trans	105.7	124.4	173	-62.3	-72.2	0	0	0	113.1
142	G	30.5	Very low	29.6	Very low	68 Å²	68	130.3 Å²	130.3	70%	0.701	81%	0.806	S	S	*	*			cis	-177.6	142.5	0.5	0	0	0	0	0	110.6
143	N	27.9	Very low	30	Very low	157 Å²	157	128.3 Å²	128.3	84%	0.84	80%	0.803	S	S	*	*			trans	11.1	132.3	159.9	-60.8	-6.8	0	0	0	122.1
144	S	30.4	Very low	30.1	Very low	128 Å²	128	126.2 Å²	126.2	90%	0.895	81%	0.805	S	S	*	*				-149.2	132.2	119.6	61.6	0	0	0	0	110.5
145	S	28.8	Very low	30.2	Very low	98 Å²	98	130.6 Å²	130.6	69%	0.685	81%	0.811	S	S	*	*			trans	-102.2	143.3	-169.1	-38.2	0	0	0	0	110.7
146	F	31.9	Very low	30.5	Very low	212 Å²	212	130.9 Å²	130.9	93%	0.93	81%	0.813	S	S	*	*			trans	-146.9	104.4	151	-101.3	-82.4	0	0	0	108.2
147	E	27.7	Very low	30.8	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.794	82%	0.816	S	S	*	*			trans	-88.8	135.2	164.2	-81.4	-176.9	138.3	0	0	109.1
148	I	32.3	Very low	31.2	Very low	166 Å²	166	131 Å²	131	85%	0.851	82%	0.815	S	S	*	*			trans	-134.1	110.5	147.7	-61.5	-178.6	0	0	0	106.6
149	T	26.4	Very low	31.8	Very low	111 Å²	111	132.1 Å²	132.1	68%	0.681	81%	0.807	S	S	*	*			trans	-108.6	131.2	174.7	-46.8	0	0	0	0	107.9
150	S	32.8	Very low	31.9	Very low	122 Å²	122	137 Å²	137	85%	0.853	81%	0.805	S	S	*	*			trans	165.4	138.5	140.4	48	0	0	0	0	112.2
151	G	32.6	Very low	32.5	Very low	79 Å²	79	135.8 Å²	135.8	81%	0.814	81%	0.808	S	S	*	*			trans	125.1	69.4	155.4	0	0	0	0	0	117.9
152	S	29.4	Very low	32.4	Very low	118 Å²	118	132 Å²	132	83%	0.825	80%	0.797	S	S	*	*			trans	-87	170.3	141.1	-72.2	0	0	0	0	108.1
153	P	37.8	Very low	32.7	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	81%	0.805	S	S	*	*			cis	-151.8	172.3	27.1	39.7	-16.4	0	0	0	119.2
154	A	31.7	Very low	33.1	Very low	94 Å²	94	131.4 Å²	131.4	78%	0.777	80%	0.799	S	S	*	*			trans	49.6	129.1	138.1	0	0	0	0	0	124.6
155	R	33.6	Very low	33.2	Very low	249 Å²	249	132.8 Å²	132.8	94%	0.94	80%	0.795	S	S	*	*			trans	173.6	141.7	135.7	-97.8	174.2	-179	-154.9	0.4	108.1
156	S	35.7	Very low	33.3	Very low	105 Å²	105	134.8 Å²	134.8	73%	0.734	80%	0.803	S	S	*	*			cis	-176	139.1	-1.7	48	0	0	0	0	109
157	A	34.4	Very low	33.2	Very low	93 Å²	93	133.7 Å²	133.7	77%	0.769	80%	0.801	S	S	*	*			trans	28.1	145.8	142.5	0	0	0	0	0	121.7
158	V	37.8	Very low	33.4	Very low	138 Å²	138	131.5 Å²	131.5	84%	0.836	80%	0.804	S	S	*	*				-167.8	156.4	65.5	165.7	0	0	0	0	111.5
159	P	37.3	Very low	33.3	Very low	106 Å²	106	131.4 Å²	131.4	69%	0.688	80%	0.804	S	S	*	*			trans	-126.3	-170.2	-155.4	41.6	-23.7	0	0	0	117.5
160	Y	34.2	Very low	33.6	Very low	205 Å²	205	131.5 Å²	131.5	80%	0.804	81%	0.809	S	S	*	*			trans	89.4	119.8	146.2	-112	-89.8	0	0	0	122.4	D162	Y160-D162 HydrophobicContact CE1-CB 4.26Å
161	A	37.7	Very low	33.3	Very low	103 Å²	103	133.7 Å²	133.7	85%	0.851	81%	0.805	S	S	*	*				-166.9	135.6	121.2	0	0	0	0	0	111.1
162	D	30.1	Very low	33.3	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	81%	0.808	S	S	*	*			trans	-114.7	-173.8	-169.7	-166.5	0.7	0	0	0	109.9	Y160	Y160-D162 HydrophobicContact CE1-CB 4.26Å
163	V	37.2	Very low	33.6	Very low	145 Å²	145	139.5 Å²	139.5	88%	0.879	80%	0.804	S	S	*	*			trans	103	123.9	173.7	-171.1	0	0	0	0	113.5
164	G	35.4	Very low	33.5	Very low	68 Å²	68	139 Å²	139	70%	0.701	80%	0.801	S	S	*	*			cis	-177.8	153.1	3.6	0	0	0	0	0	112.4
165	I	32.1	Very low	33.5	Very low	157 Å²	157	140.5 Å²	140.5	81%	0.805	79%	0.794	S	S	*	*			trans	-46.2	144.7	176	-55.3	167.7	0	0	0	113.4
166	T	31.9	Very low	33.6	Very low	140 Å²	140	138 Å²	138	86%	0.859	79%	0.785	S	S	*	*				-172.7	146.5	89.5	35.2	0	0	0	0	115.3
167	Q	28.6	Very low	33.5	Very low	190 Å²	190	139.2 Å²	139.2	89%	0.888	78%	0.777	S	S	*	*			trans	-72.2	154.1	171.6	-62.6	165.7	-31.5	0	0	113.8
168	S	33.4	Very low	33.5	Very low	123 Å²	123	142.2 Å²	142.2	86%	0.86	78%	0.775	S	S	*	*			trans	-169.7	137.8	133.4	58.7	0	0	0	0	113.9
169	I	29.7	Very low	33.2	Very low	165 Å²	165	141.2 Å²	141.2	85%	0.846	77%	0.774	S	S	*	*			trans	-68.4	149.4	178.2	-72.5	154.6	0	0	0	113.3
170	S	32.1	Very low	33.1	Very low	113 Å²	113	139.3 Å²	139.3	79%	0.79	77%	0.774	S	S	*	*			trans	-173.6	122.2	139.5	-179.5	0	0	0	0	112.1
171	E	26.5	Very low	32.8	Very low	167 Å²	167	138 Å²	138	78%	0.78	78%	0.779	S	S	*	*			trans	-68.4	157.1	169	-66.5	167.2	133.4	0	0	112.7
172	N	33.2	Very low	32.6	Very low	163 Å²	163	136.1 Å²	136.1	87%	0.872	77%	0.77	S	S	*	*				-178.4	115.6	128	-91.1	-21.7	0	0	0	112.3
173	Q	34.3	Very low	32.5	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	78%	0.775	S	S	*	*			trans	-98.5	159.2	151.5	-102.7	-105.9	-15.9	0	0	106.8
174	P	36	Very low	32.3	Very low	109 Å²	109	136 Å²	136	71%	0.708	77%	0.774	S	S	*	*				-159.6	148.9	84.1	37.3	-14.8	0	0	0	119.2
175	I	32.5	Very low	32	Very low	125 Å²	125	137.7 Å²	137.7	64%	0.641	78%	0.775	S	S	*	*				33.3	157.2	121.9	-48.6	178.1	0	0	0	122.1
176	W	35.1	Very low	32.3	Very low	198 Å²	198	135.2 Å²	135.2	75%	0.75	77%	0.769	S	S	*	*			trans	114.2	130.6	153	-64.2	79.2	0	0	0	112.9
177	K	34	Very low	32.1	Very low	129 Å²	129	136.8 Å²	136.8	56%	0.561	77%	0.767	S	S	*	*			cis	-179.6	151.2	3	-122.9	-165.3	177.6	178	0	111
178	Q	33.6	Very low	32.2	Very low	157 Å²	157	135.2 Å²	135.2	73%	0.734	76%	0.759	S	S	*	*			trans	48.9	148.8	134	-74.9	175.4	-15.4	0	0	121.2
179	S	31.9	Very low	32	Very low	116 Å²	116	133.9 Å²	133.9	81%	0.811	74%	0.742	S	S	*	*			cis	175	164.7	16.7	39.1	0	0	0	0	111.5
180	G	34.7	Very low	31.9	Very low	67 Å²	67	133.5 Å²	133.5	69%	0.691	74%	0.737	S	S	*	*			trans	127.2	94.7	151.5	0	0	0	0	0	115.5
181	I	29.3	Very low	31.8	Very low	176 Å²	176	132.9 Å²	132.9	90%	0.903	73%	0.733	S	S	*	*				73.7	124.9	75.3	-58.1	172.8	0	0	0	115.6
182	G	33.7	Very low	31.9	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	73%	0.732	S	S	*	*			trans	143.3	75.6	155.7	0	0	0	0	0	115.6
183	T	27	Very low	32	Very low	131 Å²	131	130.6 Å²	130.6	80%	0.804	73%	0.729	S	S	*	*				43.2	126.1	98.6	48.4	0	0	0	0	119.2
184	V	32.9	Very low	31.6	Very low	142 Å²	142	130.4 Å²	130.4	86%	0.861	73%	0.733	S	S	*	*				147.5	120.2	125.2	171.9	0	0	0	0	113.6
185	S	30.3	Very low	31.3	Very low	104 Å²	104	133.2 Å²	133.2	73%	0.727	74%	0.742	S	S	*	*			trans	-77.4	-159.4	168.3	-43.7	0	0	0	0	112.1
186	P	38.1	Very low	31.4	Very low	104 Å²	104	132.2 Å²	132.2	68%	0.675	75%	0.746	S	S	*	*			cis	-139.5	-175	-17.6	35.7	-13.5	0	0	0	115.5
187	Q	28	Very low	31.2	Very low	173 Å²	173	129.7 Å²	129.7	81%	0.808	74%	0.742	S	S	*	*			trans	81.9	144.8	139.5	-91.9	176.2	-15	0	0	124.7
188	H	30.9	Very low	31.2	Very low	158 Å²	158	129.2 Å²	129.2	73%	0.731	75%	0.752	S	S	*	*			trans	83	139.9	150.5	-118.8	-113.9	0	0	0	117.9
189	N	27.9	Very low	30.8	Very low	94 Å²	94	128.8 Å²	128.8	50%	0.503	75%	0.75	S	S	.	*			cis	-175	154.7	-14	-118.8	7.8	0	0	0	108
190	Q	28.6	Very low	30.6	Very low	157 Å²	157	129.9 Å²	129.9	73%	0.734	76%	0.756	S	S	*	*			trans	49.9	130	141.5	-61.1	172	-2.1	0	0	118.6
191	S	30	Very low	30.3	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	76%	0.759	S	S	*	*				174.7	142.9	73.2	28.7	0	0	0	0	114.8
192	H	29	Very low	30	Very low	165 Å²	165	126.4 Å²	126.4	76%	0.764	75%	0.748	S	S	*	*			trans	64.5	114.2	137.2	-59.3	-58.6	0	0	0	124.3
193	S	33.5	Very low	29.6	Very low	117 Å²	117	133.3 Å²	133.3	82%	0.818	76%	0.761	S	S	*	*				151.7	104.4	114.1	52.4	0	0	0	0	110.7
194	N	25.9	Very low	29.4	Very low	152 Å²	152	138 Å²	138	81%	0.813	76%	0.764	S	S	*	*				56.3	106.8	77.9	-81.8	-9	0	0	0	117.1
195	L	30.9	Very low	29.2	Very low	168 Å²	168	137.9 Å²	137.9	88%	0.88	76%	0.763	S	S	*	*			trans	168.3	139.4	133.5	-114.1	75	0	0	0	107.4
196	S	33.9	Very low	28.9	Very low	104 Å²	104	138.9 Å²	138.9	73%	0.727	77%	0.77	S	S	*	*			cis	-174.4	143.4	-7.5	31.1	0	0	0	0	106.6
197	Q	31	Very low	28.2	Very low	145 Å²	145	137.3 Å²	137.3	68%	0.678	77%	0.772	S	S	*	*			trans	-63.8	178	-178.2	-117.7	179.9	-7.1	0	0	114.7	H199	Q197-H199 PolarHBondContact NE2-NE2 2.98Å; Q197-H199 PolarHBondContact OE1-NE2 3.28Å
198	P	33.4	Very low	28.1	Very low	119 Å²	119	134.9 Å²	134.9	77%	0.773	78%	0.775	S	S	*	*				-151.9	149.2	54.4	37.6	-13.5	0	0	0	121.5
199	H	25.8	Very low	27.9	Very low	147 Å²	147	133.8 Å²	133.8	68%	0.681	78%	0.781	S	S	*	*			trans	26.5	125.6	134.8	-70.3	-61.4	0	0	0	125.1	Q197	Q197-H199 PolarHBondContact NE2-NE2 2.98Å; Q197-H199 PolarHBondContact OE1-NE2 3.28Å
200	C	29.1	Very low	27.8	Very low	139 Å²	139	132.9 Å²	132.9	94%	0.939	80%	0.795	S	S	*	*				-176.3	142.2	118	-113.2	0	0	0	0	107.7
201	G	27.9	Very low	27.8	Very low	73 Å²	73	132.2 Å²	132.2	75%	0.753	80%	0.801	S	S	*	*			cis	176.8	130.8	2.6	0	0	0	0	0	105.8
202	S	22.6	Very low	27.5	Very low	97 Å²	97	135.3 Å²	135.3	68%	0.678	80%	0.804	S	S	*	*			trans	-80.2	139.3	-172.8	156.5	0	0	0	0	112.5
203	F	25.2	Very low	27.6	Very low	210 Å²	210	135.1 Å²	135.1	92%	0.921	80%	0.804	S	S	*	*			trans	-131.7	114.1	149.8	-89.7	-82.4	0	0	0	110
204	R	22.3	Very low	27.5	Very low	229 Å²	229	136.9 Å²	136.9	86%	0.864	80%	0.804	S	S	*	*			trans	-84.6	137.9	163.6	-72	-177.3	-177.1	-174.8	0.6	108.7
205	V	29.3	Very low	27.8	Very low	140 Å²	140	134.7 Å²	134.7	85%	0.848	79%	0.791	S	S	*	*			trans	-136.3	115.1	152.8	179.1	0	0	0	0	108.1
206	S	23.8	Very low	28	Very low	125 Å²	125	128.2 Å²	128.2	87%	0.874	76%	0.76	S	S	*	*			trans	-76.4	143.3	163.6	-83	0	0	0	0	110.1
207	G	24.3	Very low	28.3	Very low	70 Å²	70	127 Å²	127	72%	0.722	75%	0.745	S	S	*	*			trans	148.4	108.3	151.2	0	0	0	0	0	116.6
208	S	25.8	Very low	29.4	Very low	123 Å²	123	121.6 Å²	121.6	86%	0.86	72%	0.721	S	S	*	*			trans	112.3	122.6	148.3	-49.5	0	0	0	0	116.7
209	P	27	Very low	30.1	Very low	134 Å²	134	119.3 Å²	119.3	87%	0.87	70%	0.702	S	S	*	*			trans	-90.1	138.1	174.7	35	-28.4	0	0	0	111.2
210	G	24	Very low	30.9	Very low	76 Å²	76	115.3 Å²	115.3	78%	0.784	69%	0.685	S	S	*	*			trans	117	105.6	164.6	0	0	0	0	0	114.7
211	V	28.6	Very low	31.7	Very low	143 Å²	143	110 Å²	110	87%	0.867	65%	0.652	S	S	*	*				-159.5	133.9	123.8	173.8	0	0	0	0	107.3
212	Q	25.2	Very low	32.6	Very low	166 Å²	166	106.7 Å²	106.7	78%	0.776	62%	0.617	S	S	*	*			trans	-76.3	118	-178.8	-171	177	8.2	0	0	109.8
213	E	31.4	Very low	33.3	Very low	161 Å²	161	102.5 Å²	102.5	75%	0.752	59%	0.587	S	S	*	*			trans	-132.2	100.8	165.9	-78.4	-165.9	168.4	0	0	110.5	L215	E213-L215 PolarHBondContact O-N 3.41Å
214	N	29.6	Very low	33.9	Very low	154 Å²	154	93.8 Å²	93.8	82%	0.824	55%	0.552	S	S	*	*			trans	-72.3	103.6	166.4	-72.8	-29	0	0	0	108.7
215	L	34	Very low	34.4	Very low	105 Å²	105	88.4 Å²	88.4	55%	0.55	54%	0.539	S	S	.	.			trans	-119	98.5	165.2	-84	154.3	0	0	0	108.6	E213 D219	E213-L215 PolarHBondContact O-N 3.41Å; L215-D219 WeakPolarHBondContact CA-OD2 3.34Å; L215-D219 HydrophobicContact CD2-CB 4.07Å
216	S	34.4	Very low	34.4	Very low	32 Å²	32	86.6 Å²	86.6	22%	0.224	53%	0.528	C	S	.	.			trans	-130.8	97	166.5	162.4	0	0	0	0	108	D219 E355 T394	S216-D219 VanDerWaalsContact C-OD1 3.25Å; S216-D219 WeakPolarHBondContact CA-OD2 3.44Å; S216-D219 PolarHBondContact N-OD2 3.48Å; S216-D219 VanDerWaalsContact O-OD2 3.08Å; S216-E355 PolarHBondContact OG-OE1 2.9Å; S216-T394 VanDerWaalsContact O-CG2 3.24Å; S216-T394 WeakPolarHBondContact O-CG2 3.36Å
217	L	40	Very low	34.4	Very low	79 Å²	79	87.8 Å²	87.8	41%	0.414	52%	0.524	S	S	.	.	S	Bend	cis	128.1	11.3	28.4	-80	174.1	0	0	0	115.8	D219 E355	L217-D219 HydrophobicContact CB-CB 4.22Å; L217-D219 HydrophobicContact CD2-CB 3.9Å; L217-D219 HydrophobicContact CG-CB 3.84Å; L217-D219 PolarHBondContact N-OD1 2.89Å; L217-D219 VanDerWaalsContact N-OD1 3.15Å; L217-D219 PolarHBondContact N-OD2 3.2Å; L217-D219 PolarHBondContact O-N 2.92Å; L217-E355 WeakPolarHBondContact CA-OE2 3.23Å; L217-E355 WeakPolarHBondContact CB-OE2 3.4Å
218	L	53.2	Low	34.6	Very low	31 Å²	31	89.6 Å²	89.6	16%	0.162	53%	0.526	C	S	.	.	S	Bend		-48.3	-27.6	121	-93.3	166.1	0	0	0	109.5	L220 A221 T394 V397	L218-L220 CarbonylContact O-C 3.51Å; L218-L220 VanDerWaalsContact O-C 3.26Å; L218-L220 PolarHBondContact O-N 3.24Å; L218-A221 HydrophobicContact CB-CB 4.3Å; L218-A221 HydrophobicContact CD2-CB 3.79Å; L218-A221 WeakPolarHBondContact CD2-O 3.47Å; L218-A221 CarbonylContact O-C 3.53Å; L218-A221 WeakPolarHBondContact O-CA 3.39Å; L218-A221 PolarHBondContact O-N 2.81Å; L218-T394 HydrophobicContact CB-CG2 3.93Å; L218-T394 HydrophobicContact CD1-CG2 4.24Å; L218-T394 HydrophobicContact CG-CG2 4.24Å; L218-V397 HydrophobicContact CD1-CB 3.4Å; L218-V397 VanDerWaalsContact CD1-CB 3.4Å; L218-V397 HydrophobicContact CD1-CG1 4.16Å; L218-V397 HydrophobicContact CD1-CG2 3.27Å; L218-V397 HydrophobicContact CD2-CB 3.59Å; L218-V397 HydrophobicContact CD2-CG1 3.41Å; L218-V397 VanDerWaalsContact CD2-CG1 3.41Å; L218-V397 HydrophobicContact CD2-CG2 4.14Å; L218-V397 HydrophobicContact CG-CB 3.92Å; L218-V397 HydrophobicContact CG-CG1 4.3Å; L218-V397 HydrophobicContact CG-CG2 4.27Å
219	D	49.2	Very low	34.5	Very low	71 Å²	71	87.8 Å²	87.8	38%	0.38	53%	0.527	S	S	.	.	S	Bend		-72	-1	-98.5	-115.1	-4.5	0	0	0	112	L215 S216 L217	L215-D219 WeakPolarHBondContact CA-OD2 3.34Å; L215-D219 HydrophobicContact CD2-CB 4.07Å; S216-D219 VanDerWaalsContact C-OD1 3.25Å; S216-D219 WeakPolarHBondContact CA-OD2 3.44Å; S216-D219 PolarHBondContact N-OD2 3.48Å; S216-D219 VanDerWaalsContact O-OD2 3.08Å; L217-D219 HydrophobicContact CB-CB 4.22Å; L217-D219 HydrophobicContact CD2-CB 3.9Å; L217-D219 HydrophobicContact CG-CB 3.84Å; L217-D219 PolarHBondContact N-OD1 2.89Å; L217-D219 VanDerWaalsContact N-OD1 3.15Å; L217-D219 PolarHBondContact N-OD2 3.2Å; L217-D219 PolarHBondContact O-N 2.92Å
220	L	43.1	Very low	34.6	Very low	63 Å²	63	89.3 Å²	89.3	33%	0.33	53%	0.527	S	S	.	.	S	Bend	trans	-106.2	15.6	159.5	-84.4	137.5	0	0	0	107.9	L218 L222 S223 I225	L218-L220 CarbonylContact O-C 3.51Å; L218-L220 VanDerWaalsContact O-C 3.26Å; L218-L220 PolarHBondContact O-N 3.24Å; L220-L222 PolarHBondContact O-N 3Å; L220-S223 WeakPolarHBondContact CB-OG 3.38Å; L220-S223 VanDerWaalsContact CD2-CB 3.4Å; L220-S223 WeakPolarHBondContact CD2-OG 3.47Å; L220-S223 PolarHBondContact O-N 3.25Å; L220-S223 PolarHBondContact O-OG 2.88Å; L220-I225 HydrophobicContact CD2-CB 3.4Å; L220-I225 VanDerWaalsContact CD2-CB 3.4Å; L220-I225 HydrophobicContact CD2-CD1 3.23Å; L220-I225 HydrophobicContact CD2-CG1 3.52Å; L220-I225 HydrophobicContact CD2-CG2 4.33Å; L220-I225 HydrophobicContact CG-CD1 4.34Å
221	A	44.2	Very low	34.8	Very low	28 Å²	28	88.8 Å²	88.8	23%	0.231	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	36.5	-46.5	-146.1	0	0	0	0	0	117	L218	L218-A221 HydrophobicContact CB-CB 4.3Å; L218-A221 HydrophobicContact CD2-CB 3.79Å; L218-A221 WeakPolarHBondContact CD2-O 3.47Å; L218-A221 CarbonylContact O-C 3.53Å; L218-A221 WeakPolarHBondContact O-CA 3.39Å; L218-A221 PolarHBondContact O-N 2.81Å
222	L	47.4	Very low	34.8	Very low	4 Å²	4	87.9 Å²	87.9	2%	0.021	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-166.7	17.1	-173.8	-76.8	-175.5	0	0	0	113	L220 R351 F401 Y458 T461 R462	L220-L222 PolarHBondContact O-N 3Å; L222-R351 PolarHBondContact O-NH1 3.07Å; L222-F401 HydrophobicContact CD2-CZ 4.25Å; L222-Y458 HydrophobicContact CB-CD2 4.12Å; L222-Y458 HydrophobicContact CB-CE2 3.54Å; L222-Y458 HydrophobicContact CD1-CD1 4.32Å; L222-Y458 HydrophobicContact CD1-CD2 3.16Å; L222-Y458 HydrophobicContact CD1-CE1 4.48Å; L222-Y458 HydrophobicContact CD1-CE2 3.37Å; L222-Y458 HydrophobicContact CD1-CG 3.65Å; L222-Y458 VanDerWaalsContact CD1-O 3.28Å; L222-Y458 WeakPolarHBondContact CD1-O 3.26Å; L222-Y458 HydrophobicContact CD2-CD2 3.23Å; L222-Y458 HydrophobicContact CD2-CE2 3.43Å; L222-Y458 VanDerWaalsContact CD2-CE2 3.43Å; L222-Y458 HydrophobicContact CD2-CG 4.36Å; L222-Y458 HydrophobicContact CG-CD2 3.64Å; L222-Y458 HydrophobicContact CG-CE2 3.61Å; L222-Y458 PolarHBondContact O-OH 2.91Å; L222-T461 WeakPolarHBondContact CD1-OG1 3.39Å; L222-R462 HydrophobicContact CD1-CG 3.8Å
223	S	37	Very low	34.9	Very low	9 Å²	9	86.2 Å²	86.2	6%	0.063	52%	0.523	C	S	.	.			trans	-70.2	155.1	-161.4	-51.5	0	0	0	0	116.8	L220 I225 R351	L220-S223 WeakPolarHBondContact CB-OG 3.38Å; L220-S223 VanDerWaalsContact CD2-CB 3.4Å; L220-S223 WeakPolarHBondContact CD2-OG 3.47Å; L220-S223 PolarHBondContact O-N 3.25Å; L220-S223 PolarHBondContact O-OG 2.88Å; S223-I225 VanDerWaalsContact CB-CG1 3.49Å; S223-I225 WeakPolarHBondContact OG-CD1 3.1Å; S223-I225 WeakPolarHBondContact OG-CG1 3.47Å; S223-R351 PolarHBondContact O-NH1 3.34Å; S223-R351 PolarHBondContact O-NH2 3.15Å
224	P	37.4	Very low	34.9	Very low	27 Å²	27	86.2 Å²	86.2	18%	0.175	53%	0.527	C	S	.	.				-93.3	89.2	125.2	33	-16	0	0	0	108.1	V226 G552 N554	P224-V226 PolarHBondContact O-N 3.23Å; P224-G552 WeakPolarHBondContact CD-O 3.37Å; P224-G552 WeakPolarHBondContact CG-O 3.17Å; P224-N554 HydrophobicContact CB-CB 3.45Å; P224-N554 VanDerWaalsContact CB-CB 3.45Å; P224-N554 HydrophobicContact CG-CB 3.28Å
225	I	34.6	Very low	35.1	Very low	115 Å²	115	83.5 Å²	83.5	59%	0.59	52%	0.517	S	S	*	.			trans	-86.4	105.6	168.5	-81.6	173.2	0	0	0	104.6	L220 S223 N227	L220-I225 HydrophobicContact CD2-CB 3.4Å; L220-I225 VanDerWaalsContact CD2-CB 3.4Å; L220-I225 HydrophobicContact CD2-CD1 3.23Å; L220-I225 HydrophobicContact CD2-CG1 3.52Å; L220-I225 HydrophobicContact CD2-CG2 4.33Å; L220-I225 HydrophobicContact CG-CD1 4.34Å; S223-I225 VanDerWaalsContact CB-CG1 3.49Å; S223-I225 WeakPolarHBondContact OG-CD1 3.1Å; S223-I225 WeakPolarHBondContact OG-CG1 3.47Å; I225-N227 HydrophobicContact CG2-CB 4.35Å; I225-N227 PolarHBondContact O-N 3.34Å
226	V	27.5	Very low	35.3	Very low	102 Å²	102	84.6 Å²	84.6	62%	0.618	53%	0.531	S	S	*	.			trans	-83	102.8	168.1	-154.1	0	0	0	0	106.4	P224 P550	P224-V226 PolarHBondContact O-N 3.23Å; V226-P550 HydrophobicContact CG2-CB 4.12Å
227	N	24.3	Very low	35.3	Very low	150 Å²	150	93 Å²	93	80%	0.802	56%	0.564	S	S	*	*			trans	-148.8	70.5	160.2	-113.7	10	0	0	0	108.3	I225	I225-N227 HydrophobicContact CG2-CB 4.35Å; I225-N227 PolarHBondContact O-N 3.34Å
228	S	27.8	Very low	34.9	Very low	108 Å²	108	92.8 Å²	92.8	76%	0.755	58%	0.581	S	S	*	*			trans	-123.2	86.4	158.8	-49.1	0	0	0	0	106.7	L230	S228-L230 VanDerWaalsContact C-N 3.26Å; S228-L230 PolarHBondContact O-N 2.94Å
229	G	25.5	Very low	33.9	Very low	86 Å²	86	97.3 Å²	97.3	89%	0.887	62%	0.615	S	S	*	*			trans	-65	93	160	0	0	0	0	0	108.1
230	L	29	Very low	33.2	Very low	166 Å²	166	97.1 Å²	97.1	87%	0.869	63%	0.63	S	S	*	*			trans	-110.7	108.8	157.3	-98.1	155.4	0	0	0	105.9	S228	S228-L230 VanDerWaalsContact C-N 3.26Å; S228-L230 PolarHBondContact O-N 2.94Å
231	G	27.5	Very low	32.7	Very low	64 Å²	64	103.8 Å²	103.8	66%	0.66	66%	0.659	S	S	*	*			trans	-58.6	151	-168.3	0	0	0	0	0	113.7	V233	G231-V233 PolarHBondContact O-N 3.31Å
232	S	28	Very low	32.6	Very low	124 Å²	124	106.8 Å²	106.8	87%	0.867	68%	0.684	S	S	*	*			trans	-59	104.4	157.3	62.5	0	0	0	0	108.5
233	V	27.5	Very low	32	Very low	132 Å²	132	112.9 Å²	112.9	80%	0.8	72%	0.724	S	S	*	*			trans	-102.8	86.1	159.9	-177.9	0	0	0	0	106.4	G231	G231-V233 PolarHBondContact O-N 3.31Å
234	L	31.9	Very low	31.8	Very low	160 Å²	160	115.9 Å²	115.9	84%	0.838	76%	0.756	S	S	*	*			trans	-136.3	115.3	156.6	-79.3	174.8	0	0	0	107
235	P	33.7	Very low	31.8	Very low	97 Å²	97	123.9 Å²	123.9	63%	0.63	79%	0.792	S	S	*	*			trans	-81.7	133.3	173.7	31.5	-28	0	0	0	109.2	F237	P235-F237 PolarHBondContact O-N 3.46Å
236	P	37.2	Very low	31.6	Very low	129 Å²	129	123.8 Å²	123.8	84%	0.838	80%	0.801	S	S	*	*			trans	-82.8	111.3	166.8	30.5	-25.3	0	0	0	108.6
237	F	35.4	Very low	32	Very low	207 Å²	207	124.9 Å²	124.9	91%	0.908	81%	0.813	S	S	*	*			trans	-71.5	140.5	158.1	-87.6	-90.7	0	0	0	109.2	P235	P235-F237 PolarHBondContact O-N 3.46Å
238	G	32.5	Very low	32.3	Very low	75 Å²	75	120.8 Å²	120.8	77%	0.773	81%	0.806	S	S	*	*			trans	135.2	81.1	160.4	0	0	0	0	0	114.7
239	S	31.6	Very low	32.4	Very low	127 Å²	127	122.7 Å²	122.7	89%	0.888	81%	0.808	S	S	*	*			trans	-51.5	147.9	164.6	47.4	0	0	0	0	114.8
240	G	33.3	Very low	32.6	Very low	66 Å²	66	124.4 Å²	124.4	68%	0.68	80%	0.796	S	S	*	*			trans	152.7	98.2	154.8	0	0	0	0	0	114.1
241	E	34.4	Very low	32.5	Very low	203 Å²	203	128.5 Å²	128.5	95%	0.949	80%	0.799	S	S	*	*			trans	37.8	139.4	133	-59.8	175.7	156.5	0	0	119.3
242	A	40.5	Very low	32.6	Very low	92 Å²	92	135.6 Å²	135.6	76%	0.76	81%	0.806	S	S	*	*			cis	-173.5	172.9	-4.3	0	0	0	0	0	104.7
243	P	34.6	Very low	32.5	Very low	132 Å²	132	134.6 Å²	134.6	86%	0.857	80%	0.799	S	S	*	*			trans	-99.8	158	-146.7	38	-35.1	0	0	0	115.8
244	G	33.9	Very low	32.6	Very low	72 Å²	72	133.4 Å²	133.4	74%	0.742	79%	0.792	S	S	*	*			trans	-177.6	108.8	168.9	0	0	0	0	0	115.9
245	Q	37.1	Very low	32.2	Very low	195 Å²	195	131.8 Å²	131.8	91%	0.911	79%	0.789	S	S	*	*			trans	86.5	113.4	143.8	-55.5	-172.8	18.7	0	0	121.3
246	S	30.6	Very low	31.9	Very low	113 Å²	113	138.5 Å²	138.5	79%	0.79	80%	0.802	S	S	*	*			trans	-2.3	125.8	153.8	64	0	0	0	0	120.9
247	S	35.1	Very low	31.5	Very low	125 Å²	125	137.7 Å²	137.7	87%	0.874	80%	0.8	S	S	*	*				-161.2	134.2	123.3	-110	0	0	0	0	110.9
248	G	30.2	Very low	31	Very low	63 Å²	63	132.9 Å²	132.9	65%	0.649	79%	0.792	S	S	*	*			trans	-69.3	149.5	-174.7	0	0	0	0	0	113.4
249	N	30.3	Very low	30.8	Very low	149 Å²	149	134 Å²	134	80%	0.797	79%	0.785	S	S	*	*				179.4	125	113.8	-93	-36.7	0	0	0	111.5
250	I	31.3	Very low	30.7	Very low	122 Å²	122	138 Å²	138	63%	0.626	79%	0.787	S	S	*	*			trans	65.5	85	140.9	-53.4	167.6	0	0	0	115.6	R252	I250-R252 HydrophobicContact CG2-CG 3.76Å; I250-R252 PolarHBondContact O-N 3.48Å; I250-R252 VanDerWaalsContact O-N 3.14Å
251	R	26.6	Very low	30.4	Very low	252 Å²	252	142.6 Å²	142.6	95%	0.951	80%	0.795	S	S	*	*			trans	-65.9	98.5	147.7	-102.7	-175.5	175.2	-164	-0.4	108.2	S253	R251-S253 PolarHBondContact O-N 3.42Å
252	R	28.8	Very low	30.2	Very low	212 Å²	212	138.7 Å²	138.7	80%	0.8	79%	0.785	S	S	*	*			trans	-76.9	95.5	162.5	-92	173.6	-174.7	168.7	2.3	108.7	I250 V254	I250-R252 HydrophobicContact CG2-CG 3.76Å; I250-R252 PolarHBondContact O-N 3.48Å; I250-R252 VanDerWaalsContact O-N 3.14Å; R252-V254 HydrophobicContact CB-CG2 4.21Å; R252-V254 PolarHBondContact O-N 3.43Å
253	S	26.2	Very low	29.5	Very low	103 Å²	103	139.8 Å²	139.8	72%	0.72	79%	0.787	S	S	*	*			trans	-67.6	102.4	155	52.8	0	0	0	0	108.1	R251 T255	R251-S253 PolarHBondContact O-N 3.42Å; S253-T255 PolarHBondContact O-N 3.16Å
254	V	28.6	Very low	29.1	Very low	107 Å²	107	137.2 Å²	137.2	65%	0.648	78%	0.784	S	S	*	*			trans	-91.9	85.6	172.6	-169.7	0	0	0	0	107.6	R252 W256	R252-V254 HydrophobicContact CB-CG2 4.21Å; R252-V254 PolarHBondContact O-N 3.43Å; V254-W256 HydrophobicContact CG1-CB 4.42Å; V254-W256 HydrophobicContact CG1-CG 4.09Å
255	T	25.3	Very low	28.9	Very low	126 Å²	126	138.8 Å²	138.8	77%	0.773	78%	0.78	S	S	*	*			trans	-76.3	108.5	155.4	47.5	0	0	0	0	106.9	S253	S253-T255 PolarHBondContact O-N 3.16Å
256	W	27.3	Very low	28.5	Very low	238 Å²	238	132.8 Å²	132.8	90%	0.902	76%	0.759	S	S	*	*			trans	-121.2	126.9	167.3	-94.4	60.2	0	0	0	110.1	V254	V254-W256 HydrophobicContact CG1-CB 4.42Å; V254-W256 HydrophobicContact CG1-CG 4.09Å
257	S	26.9	Very low	28.8	Very low	113 Å²	113	131.9 Å²	131.9	79%	0.79	75%	0.751	S	S	*	*			trans	-71.2	139.7	-169.6	-37.1	0	0	0	0	112.8
258	S	25.6	Very low	28.8	Very low	106 Å²	106	133.4 Å²	133.4	74%	0.741	74%	0.737	S	S	*	*			trans	-18	157.4	155.2	-58.4	0	0	0	0	117.4
259	P	28.2	Very low	28.9	Very low	97 Å²	97	137.7 Å²	137.7	63%	0.63	74%	0.735	S	S	*	*			cis	-150.4	124	47.2	37.1	-13.7	0	0	0	117.9
260	F	30.4	Very low	29.2	Very low	213 Å²	213	136.6 Å²	136.6	93%	0.934	73%	0.725	S	S	*	*	S	Bend	trans	-132.6	50.3	146.5	-83.3	-75.9	0	0	0	109.4
261	L	26.7	Very low	29.6	Very low	162 Å²	162	134.2 Å²	134.2	85%	0.848	71%	0.709	S	S	*	*			trans	-146.6	73.6	170	-76.4	177.5	0	0	0	109.1
262	T	29.1	Very low	30.2	Very low	120 Å²	120	127.6 Å²	127.6	74%	0.736	69%	0.689	S	S	*	*	S	Bend	trans	-137.5	106.9	156.2	50.2	0	0	0	0	107.1
263	S	26.5	Very low	30.4	Very low	115 Å²	115	121 Å²	121	80%	0.804	68%	0.679	S	S	*	*	S	Bend	trans	42.5	106.3	152.9	58.8	0	0	0	0	118.7
264	G	26.5	Very low	31	Very low	78 Å²	78	117.3 Å²	117.3	80%	0.804	66%	0.655	S	S	*	*				77.8	54.7	127.3	0	0	0	0	0	118.7
265	T	29.1	Very low	31.7	Very low	106 Å²	106	116 Å²	116	65%	0.65	64%	0.639	S	S	*	*			trans	-151.9	110.8	142.5	43.7	0	0	0	0	107.9
266	S	29.2	Very low	32.3	Very low	68 Å²	68	116.7 Å²	116.7	48%	0.476	64%	0.637	S	S	.	*			trans	-53.5	147.1	168.3	-179.7	0	0	0	0	109.5	R268 Y269	S266-R268 PolarHBondContact O-N 3.35Å; S266-R268 WeakPolarHBondContact OG-CB 3.48Å; S266-Y269 PolarHBondContact O-N 3.43Å
267	P	37.2	Very low	33.1	Very low	94 Å²	94	111.9 Å²	111.9	61%	0.61	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-49.2	-19.2	171.7	-24.1	31.5	0	0	0	113.5	Y269 Q270	P267-Y269 VanDerWaalsContact C-N 3.26Å; P267-Y269 PolarHBondContact O-N 3.27Å; P267-Q270 PolarHBondContact O-N 3.2Å
268	R	35.8	Very low	33.9	Very low	158 Å²	158	112.3 Å²	112.3	60%	0.596	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-51.3	-28.1	176.3	-159.8	172	-171.3	150.3	3.9	116	S266	S266-R268 PolarHBondContact O-N 3.35Å; S266-R268 WeakPolarHBondContact OG-CB 3.48Å
269	Y	31.8	Very low	35.2	Very low	152 Å²	152	111.3 Å²	111.3	60%	0.596	61%	0.614	S	S	*	*	G	3₁₀ helix	trans	-99.2	-15.5	-177.5	-68.9	-78	0	0	0	114.8	S266 P267 Q272	S266-Y269 PolarHBondContact O-N 3.43Å; P267-Y269 VanDerWaalsContact C-N 3.26Å; P267-Y269 PolarHBondContact O-N 3.27Å; Y269-Q272 PolarHBondContact O-N 3.41Å
270	Q	37.1	Very low	36.9	Very low	127 Å²	127	107 Å²	107	59%	0.593	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-25.9	-176.8	-79.1	-178.3	-20.4	0	0	113.2	P267 Q272	P267-Q270 PolarHBondContact O-N 3.2Å; Q270-Q272 VanDerWaalsContact C-N 3.34Å
271	Y	39.2	Very low	38.5	Very low	72 Å²	72	100.2 Å²	100.2	28%	0.282	56%	0.563	S	S	.	*	T	Hydrogen-bonded Turn	trans	-74.7	-25.1	176	-68.8	-78.6	0	0	0	112.8	A273 Y275 V397	Y271-A273 PolarHBondContact O-N 2.92Å; Y271-Y275 WeakPolarHBondContact O-CD2 3.41Å; Y271-V397 HydrophobicContact CD1-CG2 3.84Å; Y271-V397 HydrophobicContact CE1-CG2 4.1Å; Y271-V397 HydrophobicContact CG-CG2 4.18Å
272	Q	38.2	Very low	40.5	Very low	113 Å²	113	92.6 Å²	92.6	53%	0.528	52%	0.523	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-22.5	-171.5	-151	152.6	8.4	0	0	113.2	Y269 Q270	Y269-Q272 PolarHBondContact O-N 3.41Å; Q270-Q272 VanDerWaalsContact C-N 3.34Å
273	A	33.4	Very low	42.6	Very low	73 Å²	73	88.3 Å²	88.3	60%	0.603	50%	0.495	S	S	*	.	S	Bend	trans	-90	-15.8	178.3	0	0	0	0	0	114.1	Y271	Y271-A273 PolarHBondContact O-N 2.92Å
274	A	38.2	Very low	44.9	Very low	25 Å²	25	88 Å²	88	21%	0.207	48%	0.48	C	S	.	.	S	Bend	trans	-82.4	-13	-174.8	0	0	0	0	0	114.3	S471	A274-S471 VanDerWaalsContact O-O 3.08Å
275	Y	44.3	Very low	47.2	Very low	81 Å²	81	85.6 Å²	85.6	32%	0.318	45%	0.447	S	S	.	.			trans	-100.1	32.7	-172.4	-76.1	-89.3	0	0	0	115.4	Y271 P396 A400	Y271-Y275 WeakPolarHBondContact O-CD2 3.41Å; Y275-P396 VanDerWaalsContact CZ-O 3.28Å; Y275-P396 PolarHBondContact OH-O 2.92Å; Y275-A400 HydrophobicContact CE1-CB 3.88Å; Y275-A400 WeakPolarHBondContact OH-CB 3.49Å
276	I	38.6	Very low	49.5	Very low	140 Å²	140	80.8 Å²	80.8	72%	0.718	42%	0.418	S	S	*	.			trans	-96.7	11.6	-179.9	-51.6	179	0	0	0	112.8
277	Q	42.2	Very low	51.9	Low	137 Å²	137	80.6 Å²	80.6	64%	0.64	41%	0.411	S	S	*	.			trans	-111.1	115.7	169.3	-71.2	-155.9	-28.3	0	0	112.5	T279	Q277-T279 PolarHBondContact O-N 3.32Å; Q277-T279 VanDerWaalsContact O-N 3.16Å
278	P	45.4	Very low	53.9	Low	121 Å²	121	79.4 Å²	79.4	79%	0.786	40%	0.399	S	S	*	.			trans	-79.3	11.6	-171.3	30.6	-34.3	0	0	0	115.2
279	T	52.5	Low	55.7	Low	86 Å²	86	72.6 Å²	72.6	53%	0.528	38%	0.376	S	S	.	.			trans	-139.2	112.1	-175.7	56.7	0	0	0	0	112.2	Q277 P281	Q277-T279 PolarHBondContact O-N 3.32Å; Q277-T279 VanDerWaalsContact O-N 3.16Å; T279-P281 WeakPolarHBondContact O-CD 3.46Å
280	N	63.7	Low	57.4	Low	7 Å²	7	67.3 Å²	67.3	4%	0.037	36%	0.357	C	S	.	.			trans	-69.1	121.8	169	-177	-21.9	0	0	0	109.9	C282 Q283 Q284 D403 H453 R473	N280-C282 PolarHBondContact O-N 3.29Å; N280-C282 VanDerWaalsContact O-N 3.08Å; N280-C282 VanDerWaalsContact OD1-CB 3.23Å; N280-C282 WeakPolarHBondContact OD1-CB 3.48Å; N280-C282 PolarHBondContact OD1-N 3.13Å; N280-Q283 HydrophobicContact CB-CB 4.25Å; N280-Q283 WeakPolarHBondContact O-CB 3.3Å; N280-Q283 PolarHBondContact O-N 3.27Å; N280-Q284 PolarHBondContact O-N 3.01Å; N280-D403 WeakPolarHBondContact CB-O 3.22Å; N280-D403 PolarHBondContact ND2-O 3.11Å; N280-H453 PolarHBondContact ND2-CE1 3.25Å; N280-H453 PolarHBondContact ND2-ND1 2.77Å; N280-R473 PolarHBondContact ND2-NH1 3.36Å
281	P	64.1	Low	58.9	Low	70 Å²	70	67.8 Å²	67.8	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-54.2	-30	177.5	-26.3	34.1	0	0	0	114.1	T279 Q284 Y285	T279-P281 WeakPolarHBondContact O-CD 3.46Å; P281-Q284 PolarHBondContact O-N 3.27Å; P281-Y285 WeakPolarHBondContact O-CB 3.5Å; P281-Y285 PolarHBondContact O-N 2.93Å
282	C	68.9	Low	60	Low	2 Å²	2	67.1 Å²	67.1	1%	0.014	36%	0.363	C	S	.	.	H	α-helix	trans	-66.9	-39.6	176.7	-159.5	0	0	0	0	112.3	N280 Y285 L286 F404 R482	N280-C282 PolarHBondContact O-N 3.29Å; N280-C282 VanDerWaalsContact O-N 3.08Å; N280-C282 VanDerWaalsContact OD1-CB 3.23Å; N280-C282 WeakPolarHBondContact OD1-CB 3.48Å; N280-C282 PolarHBondContact OD1-N 3.13Å; C282-Y285 PolarHBondContact O-N 3.27Å; C282-L286 WeakPolarHBondContact O-CG 3.48Å; C282-L286 PolarHBondContact O-N 3.06Å; C282-F404 HydrophobicContact CB-CE2 4.49Å; C282-R482 PolarHBondContact SG-NH2 2.82Å; C282-R482 VanDerWaalsContact SG-NH2 3.44Å
283	Q	72.3	Confident	60.9	Low	30 Å²	30	66.6 Å²	66.6	14%	0.14	36%	0.363	C	S	.	.	H	α-helix	trans	-67.8	-40.9	178.1	-171.4	-178.5	4.6	0	0	110.8	N280 L286 N287 F404	N280-Q283 HydrophobicContact CB-CB 4.25Å; N280-Q283 WeakPolarHBondContact O-CB 3.3Å; N280-Q283 PolarHBondContact O-N 3.27Å; Q283-L286 PolarHBondContact O-N 3.43Å; Q283-N287 PolarHBondContact O-N 3.39Å; Q283-N287 PolarHBondContact O-ND2 2.83Å; Q283-N287 VanDerWaalsContact O-ND2 3.12Å; Q283-F404 WeakPolarHBondContact CB-O 3.31Å; Q283-F404 WeakPolarHBondContact CG-O 3.16Å
284	Q	74.8	Confident	61.9	Low	108 Å²	108	68 Å²	68	51%	0.505	37%	0.369	S	S	.	.	H	α-helix	trans	-60.9	-47.5	173.6	-176.9	174	-3.3	0	0	111.1	N280 P281 L286 N287 D288	N280-Q284 PolarHBondContact O-N 3.01Å; P281-Q284 PolarHBondContact O-N 3.27Å; Q284-L286 VanDerWaalsContact C-N 3.34Å; Q284-L286 PolarHBondContact O-N 3.27Å; Q284-N287 WeakPolarHBondContact O-CB 3.3Å; Q284-N287 PolarHBondContact O-N 3.26Å; Q284-N287 VanDerWaalsContact O-N 3.16Å; Q284-D288 WeakPolarHBondContact CG-OD2 3.09Å; Q284-D288 PolarHBondContact O-N 3.2Å
285	Y	76.1	Confident	62.2	Low	27 Å²	27	68.5 Å²	68.5	11%	0.106	38%	0.376	C	S	.	.	H	α-helix	trans	-59.6	-41.6	177.8	178.7	-114.6	0	0	0	113.2	P281 C282 D288 S289 R482 L483 Q499 V502	P281-Y285 WeakPolarHBondContact O-CB 3.5Å; P281-Y285 PolarHBondContact O-N 2.93Å; C282-Y285 PolarHBondContact O-N 3.27Å; Y285-D288 PolarHBondContact O-N 2.87Å; Y285-S289 WeakPolarHBondContact CE2-OG 3.36Å; Y285-S289 VanDerWaalsContact O-CB 3.29Å; Y285-S289 WeakPolarHBondContact O-CB 2.91Å; Y285-S289 PolarHBondContact O-N 3.17Å; Y285-S289 PolarHBondContact O-OG 3.23Å; Y285-R482 HydrophobicContact CD1-CB 4.03Å; Y285-R482 VanDerWaalsContact CD1-CD 3.49Å; Y285-R482 HydrophobicContact CD1-CG 4.14Å; Y285-R482 HydrophobicContact CD2-CB 4.03Å; Y285-R482 HydrophobicContact CE1-CB 4.01Å; Y285-R482 HydrophobicContact CE1-CG 4.34Å; Y285-R482 HydrophobicContact CE2-CB 4.15Å; Y285-R482 HydrophobicContact CG-CB 3.97Å; Y285-R482 HydrophobicContact CG-CG 4.36Å; Y285-L483 VanDerWaalsContact CD2-O 3.29Å; Y285-L483 WeakPolarHBondContact CD2-O 3.2Å; Y285-L483 WeakPolarHBondContact CE2-O 3.41Å; Y285-Q499 HydrophobicContact CE1-CG 4.1Å; Y285-V502 HydrophobicContact CD1-CG2 3.87Å; Y285-V502 HydrophobicContact CE1-CG2 3.25Å
286	L	77.5	Confident	61.8	Low	6 Å²	6	70.7 Å²	70.7	3%	0.031	40%	0.4	C	S	.	.	H	α-helix	trans	-60.5	-47.6	174	-77.4	173.3	0	0	0	111.5	C282 Q283 Q284 D288 S289 Q290 F404 P445 I449 V502	C282-L286 WeakPolarHBondContact O-CG 3.48Å; C282-L286 PolarHBondContact O-N 3.06Å; Q283-L286 PolarHBondContact O-N 3.43Å; Q284-L286 VanDerWaalsContact C-N 3.34Å; Q284-L286 PolarHBondContact O-N 3.27Å; L286-D288 VanDerWaalsContact C-N 3.32Å; L286-D288 PolarHBondContact O-N 3.04Å; L286-S289 PolarHBondContact O-N 2.98Å; L286-Q290 WeakPolarHBondContact O-CB 3.48Å; L286-Q290 WeakPolarHBondContact O-CG 3.44Å; L286-Q290 PolarHBondContact O-N 3.03Å; L286-F404 HydrophobicContact CD1-CE1 4.44Å; L286-F404 HydrophobicContact CD1-CE2 3.84Å; L286-F404 HydrophobicContact CD1-CZ 3.71Å; L286-P445 HydrophobicContact CD1-CB 3.99Å; L286-P445 HydrophobicContact CD1-CG 4.35Å; L286-P445 HydrophobicContact CD2-CB 4.42Å; L286-I449 HydrophobicContact CD1-CG2 4.38Å; L286-I449 HydrophobicContact CD2-CG2 4.18Å; L286-V502 HydrophobicContact CD2-CG1 3.5Å; L286-V502 VanDerWaalsContact CD2-CG1 3.5Å; L286-V502 HydrophobicContact CD2-CG2 4.31Å
287	N	79.6	Confident	61.5	Low	63 Å²	63	68.1 Å²	68.1	34%	0.337	40%	0.4	S	S	.	.	H	α-helix	trans	-61.5	-41.1	178.6	-65.3	-28.4	0	0	0	111.8	Q283 Q284 Q290 K291	Q283-N287 PolarHBondContact O-N 3.39Å; Q283-N287 PolarHBondContact O-ND2 2.83Å; Q283-N287 VanDerWaalsContact O-ND2 3.12Å; Q284-N287 WeakPolarHBondContact O-CB 3.3Å; Q284-N287 PolarHBondContact O-N 3.26Å; Q284-N287 VanDerWaalsContact O-N 3.16Å; N287-Q290 PolarHBondContact O-N 2.9Å; N287-K291 WeakPolarHBondContact O-CG 3.37Å; N287-K291 PolarHBondContact O-N 3.11Å; N287-K291 VanDerWaalsContact O-N 3.16Å
288	D	77.8	Confident	61	Low	69 Å²	69	70.3 Å²	70.3	37%	0.369	41%	0.408	S	S	.	.	H	α-helix	trans	-73.3	-37.6	-179	-67.7	-25.5	0	0	0	111.7	Q284 Y285 L286 Q290 K291 S292	Q284-D288 WeakPolarHBondContact CG-OD2 3.09Å; Q284-D288 PolarHBondContact O-N 3.2Å; Y285-D288 PolarHBondContact O-N 2.87Å; L286-D288 VanDerWaalsContact C-N 3.32Å; L286-D288 PolarHBondContact O-N 3.04Å; D288-Q290 VanDerWaalsContact C-N 3.29Å; D288-Q290 PolarHBondContact O-N 3.12Å; D288-K291 PolarHBondContact O-N 3.49Å; D288-K291 IonicContact OD1-NZ 2.83Å; D288-K291 PolarHBondContact OD1-NZ 3.5Å; D288-S292 PolarHBondContact O-N 2.83Å
289	S	73.6	Confident	60.4	Low	15 Å²	15	70.3 Å²	70.3	11%	0.105	40%	0.4	C	S	.	.	H	α-helix	trans	-62.7	-36.1	172.4	-59.2	0	0	0	0	111.8	Y285 L286 S292 L293 V502	Y285-S289 WeakPolarHBondContact CE2-OG 3.36Å; Y285-S289 VanDerWaalsContact O-CB 3.29Å; Y285-S289 WeakPolarHBondContact O-CB 2.91Å; Y285-S289 PolarHBondContact O-N 3.17Å; Y285-S289 PolarHBondContact O-OG 3.23Å; L286-S289 PolarHBondContact O-N 2.98Å; S289-S292 PolarHBondContact O-N 3.23Å; S289-S292 PolarHBondContact O-OG 2.52Å; S289-L293 PolarHBondContact O-N 3.08Å; S289-L293 VanDerWaalsContact O-N 3.16Å; S289-V502 VanDerWaalsContact OG-CG2 3.29Å; S289-V502 WeakPolarHBondContact OG-CG2 3.44Å
290	Q	67.9	Low	59.5	Low	42 Å²	42	71.8 Å²	71.8	20%	0.196	41%	0.411	C	S	.	.	H	α-helix	trans	-69.9	-36	177	-74.1	167.3	7.4	0	0	113.6	L286 N287 D288 S292 L293 S294 H443	L286-Q290 WeakPolarHBondContact O-CB 3.48Å; L286-Q290 WeakPolarHBondContact O-CG 3.44Å; L286-Q290 PolarHBondContact O-N 3.03Å; N287-Q290 PolarHBondContact O-N 2.9Å; D288-Q290 VanDerWaalsContact C-N 3.29Å; D288-Q290 PolarHBondContact O-N 3.12Å; Q290-S292 PolarHBondContact O-N 2.72Å; Q290-L293 PolarHBondContact O-N 2.93Å; Q290-S294 PolarHBondContact O-N 3.33Å; Q290-S294 PolarHBondContact O-OG 3.36Å; Q290-H443 HydrophobicContact CG-CB 4.45Å; Q290-H443 PolarHBondContact NE2-O 3.41Å
291	K	68.5	Low	58	Low	136 Å²	136	78 Å²	78	59%	0.591	45%	0.445	S	S	*	.	H	α-helix	trans	-61.9	-35.4	171.4	-68	170.1	-165.1	158.7	0	111	N287 D288 S294 G295	N287-K291 WeakPolarHBondContact O-CG 3.37Å; N287-K291 PolarHBondContact O-N 3.11Å; N287-K291 VanDerWaalsContact O-N 3.16Å; D288-K291 PolarHBondContact O-N 3.49Å; D288-K291 IonicContact OD1-NZ 2.83Å; D288-K291 PolarHBondContact OD1-NZ 3.5Å; K291-S294 PolarHBondContact O-N 3.09Å; K291-S294 PolarHBondContact O-OG 3.24Å; K291-G295 PolarHBondContact O-N 3.01Å
292	S	61.6	Low	56.5	Low	59 Å²	59	79 Å²	79	41%	0.413	45%	0.453	S	S	.	.	H	α-helix	trans	-71.9	-28.8	177.8	77.4	0	0	0	0	113.4	D288 S289 Q290	D288-S292 PolarHBondContact O-N 2.83Å; S289-S292 PolarHBondContact O-N 3.23Å; S289-S292 PolarHBondContact O-OG 2.52Å; Q290-S292 PolarHBondContact O-N 2.72Å
293	L	57.3	Low	55	Low	102 Å²	102	86.7 Å²	86.7	53%	0.534	49%	0.492	S	S	.	.	H	α-helix	trans	-75.4	-22.5	175.5	-74.4	159.9	0	0	0	113.4	S289 Q290	S289-L293 PolarHBondContact O-N 3.08Å; S289-L293 VanDerWaalsContact O-N 3.16Å; Q290-L293 PolarHBondContact O-N 2.93Å
294	S	54.1	Low	53.1	Low	103 Å²	103	90.6 Å²	90.6	72%	0.72	52%	0.518	S	S	*	.	S	Bend	trans	-95.9	-3.2	-180	41.6	0	0	0	0	114.2	Q290 K291	Q290-S294 PolarHBondContact O-N 3.33Å; Q290-S294 PolarHBondContact O-OG 3.36Å; K291-S294 PolarHBondContact O-N 3.09Å; K291-S294 PolarHBondContact O-OG 3.24Å
295	G	45.1	Very low	51.1	Low	35 Å²	35	91.2 Å²	91.2	36%	0.361	53%	0.532	S	S	.	.	S	Bend	trans	-94.3	169.4	168.9	0	0	0	0	0	112.9	K291 A297	K291-G295 PolarHBondContact O-N 3.01Å; G295-A297 PolarHBondContact O-N 2.91Å
296	P	36.8	Very low	49.2	Very low	126 Å²	126	97.1 Å²	97.1	82%	0.818	57%	0.565	S	S	*	*	S	Bend	trans	-55.3	129.9	170.5	24.6	-31	0	0	0	108.3	F298	P296-F298 PolarHBondContact O-N 3.2Å
297	A	32.6	Very low	47.2	Very low	87 Å²	87	101.9 Å²	101.9	72%	0.719	60%	0.599	S	S	*	*			trans	-37.7	116.3	-171.5	0	0	0	0	0	111	G295 I299	G295-A297 PolarHBondContact O-N 2.91Å; A297-I299 PolarHBondContact O-N 2.96Å
298	F	31.5	Very low	45	Very low	182 Å²	182	102 Å²	102	80%	0.798	61%	0.614	S	S	*	*			trans	-64.1	89.4	165.1	-118.8	-87.9	0	0	0	106.1	P296 P300	P296-F298 PolarHBondContact O-N 3.2Å; F298-P300 VanDerWaalsContact O-CD 3.23Å; F298-P300 WeakPolarHBondContact O-CD 3.41Å
299	I	32.6	Very low	42.9	Very low	121 Å²	121	108.3 Å²	108.3	62%	0.621	64%	0.639	S	S	*	*			trans	-62.9	116.7	157.7	-57	175.4	0	0	0	103.2	A297 N301	A297-I299 PolarHBondContact O-N 2.96Å; I299-N301 PolarHBondContact O-N 3.28Å
300	P	33.5	Very low	41.1	Very low	118 Å²	118	113.1 Å²	113.1	77%	0.766	67%	0.672	S	S	*	*			trans	-63.5	95	164.1	-10	26.6	0	0	0	104.6	F298 S302	F298-P300 VanDerWaalsContact O-CD 3.23Å; F298-P300 WeakPolarHBondContact O-CD 3.41Å; P300-S302 PolarHBondContact O-N 3.38Å
301	N	31.4	Very low	39.7	Very low	138 Å²	138	119 Å²	119	74%	0.738	71%	0.705	S	S	*	*			trans	-52.7	131.5	172	-85.3	-18.6	0	0	0	106.6	I299 I303	I299-N301 PolarHBondContact O-N 3.28Å; N301-I303 PolarHBondContact O-N 3.21Å
302	S	32.8	Very low	38.8	Very low	89 Å²	89	122.4 Å²	122.4	62%	0.622	71%	0.714	S	S	*	*			trans	-23.1	130.7	169.5	46.6	0	0	0	0	112.2	P300 T304	P300-S302 PolarHBondContact O-N 3.38Å; S302-T304 PolarHBondContact O-N 3.15Å
303	I	37	Very low	38.4	Very low	165 Å²	165	128.6 Å²	128.6	85%	0.846	74%	0.737	S	S	*	*			trans	-52.2	93.4	156.7	-59.9	167.5	0	0	0	105.6	N301	N301-I303 PolarHBondContact O-N 3.21Å
304	T	33.2	Very low	38.8	Very low	112 Å²	112	128.8 Å²	128.8	69%	0.687	74%	0.737	S	S	*	*			trans	-70.6	121.8	158.7	33.2	0	0	0	0	104.2	S302 D306	S302-T304 PolarHBondContact O-N 3.15Å; T304-D306 PolarHBondContact O-N 3.34Å
305	P	33.5	Very low	40.1	Very low	121 Å²	121	127.2 Å²	127.2	79%	0.786	72%	0.721	S	S	*	*			trans	-74.9	86.3	-176.2	29.7	-30.6	0	0	0	107.3	S307	P305-S307 PolarHBondContact O-N 3.37Å
306	D	35.3	Very low	42.1	Very low	151 Å²	151	129.9 Å²	129.9	81%	0.807	72%	0.724	S	S	*	*			trans	-75.3	123.4	167.9	-161.7	8.5	0	0	0	109	T304	T304-D306 PolarHBondContact O-N 3.34Å
307	S	35.9	Very low	44.7	Very low	106 Å²	106	126 Å²	126	74%	0.741	69%	0.693	S	S	*	*			trans	-63.7	135	-165.6	55.5	0	0	0	0	113.6	P305	P305-S307 PolarHBondContact O-N 3.37Å
308	G	32.3	Very low	47.5	Very low	64 Å²	64	123.9 Å²	123.9	66%	0.66	67%	0.672	S	S	*	*			trans	105.9	80.1	147.1	0	0	0	0	0	116.8
309	K	34.3	Very low	50.4	Low	202 Å²	202	115.2 Å²	115.2	88%	0.878	64%	0.635	S	S	*	*	S	Bend		166.5	92.3	124	-87.1	155.9	-173.1	173.6	0	110.9
310	S	35.9	Very low	53.3	Low	117 Å²	117	112.8 Å²	112.8	82%	0.818	62%	0.623	S	S	*	*			trans	44.3	77	164.4	67	0	0	0	0	116.3	R312	S310-R312 PolarHBondContact O-N 3.09Å
311	D	39.2	Very low	56.1	Low	165 Å²	165	111.3 Å²	111.3	88%	0.882	61%	0.605	S	S	*	*			trans	-64.3	103.5	158.5	-73.9	-42.5	0	0	0	108.2	E313	D311-E313 PolarHBondContact O-N 2.62Å; D311-E313 VanDerWaalsContact O-N 3.09Å
312	R	49.3	Very low	59	Low	208 Å²	208	105.1 Å²	105.1	79%	0.785	57%	0.572	S	S	*	*			trans	-57.8	114.6	156.4	-80.7	-179.2	170.2	-179.7	-2.6	105.3	S310 I314	S310-R312 PolarHBondContact O-N 3.09Å; R312-I314 PolarHBondContact O-N 3.35Å
313	E	53.1	Low	61.9	Low	188 Å²	188	101.3 Å²	101.3	88%	0.879	54%	0.544	S	S	*	.			trans	-40.3	112.9	169.1	-78.2	179	154.7	0	0	108.5	D311 N315	D311-E313 PolarHBondContact O-N 2.62Å; D311-E313 VanDerWaalsContact O-N 3.09Å; E313-N315 VanDerWaalsContact C-N 3.35Å; E313-N315 PolarHBondContact O-N 3.29Å
314	I	66.7	Low	64.6	Low	106 Å²	106	99.6 Å²	99.6	54%	0.544	54%	0.535	S	S	.	.			trans	-64.2	104.9	174.2	-62.9	173.7	0	0	0	104.7	R312 E316 L489 I515	R312-I314 PolarHBondContact O-N 3.35Å; I314-E316 HydrophobicContact CG2-CG 3.93Å; I314-E316 PolarHBondContact O-N 2.79Å; I314-L489 HydrophobicContact CG1-CD1 4.48Å; I314-L489 HydrophobicContact CG2-CD1 4.27Å; I314-I515 HydrophobicContact CG2-CD1 3.57Å; I314-I515 HydrophobicContact CG2-CG1 4.16Å
315	N	79.5	Confident	67.4	Low	71 Å²	71	99.4 Å²	99.4	38%	0.38	53%	0.527	S	S	.	.			trans	-74.3	83	-178.1	-168	-17.1	0	0	0	108.3	E313 R514 I515	E313-N315 VanDerWaalsContact C-N 3.35Å; E313-N315 PolarHBondContact O-N 3.29Å; N315-R514 HydrophobicContact CB-CG 4.34Å; N315-I515 PolarHBondContact O-N 3.16Å; N315-I515 VanDerWaalsContact O-N 3.11Å
316	E	87.7	Confident	70.2	Confident	90 Å²	90	96.3 Å²	96.3	42%	0.421	50%	0.503	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	134.2	169.1	-60.4	-153.7	158.1	0	0	109.7	I314 K508 I515 N517	I314-E316 HydrophobicContact CG2-CG 3.93Å; I314-E316 PolarHBondContact O-N 2.79Å; E316-K508 IonicContact OE1-NZ 3.51Å; E316-K508 PolarHBondContact OE1-NZ 2.72Å; E316-K508 IonicContact OE2-NZ 3.77Å; E316-K508 PolarHBondContact OE2-NZ 3.39Å; E316-I515 CarbonylContact C-O 3.58Å; E316-I515 VanDerWaalsContact CA-O 3.25Å; E316-I515 WeakPolarHBondContact CA-O 3.24Å; E316-I515 HydrophobicContact CG-CB 4.29Å; E316-N517 PolarHBondContact OE2-ND2 3.06Å; E316-N517 PolarHBondContact OE2-OD1 3.02Å
317	R	91.3	Very high	72.9	Confident	46 Å²	46	97 Å²	97	17%	0.174	50%	0.502	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	152.3	178.2	-71.6	-167.9	171.8	-152.7	-13.9	111.1	E325 I515 Y516 N517	R317-E325 IonicContact CZ-OE1 3.74Å; R317-E325 IonicContact NH1-OE1 2.65Å; R317-E325 PolarHBondContact NH1-OE1 2.97Å; R317-E325 IonicContact NH1-OE2 2.74Å; R317-E325 PolarHBondContact NH1-OE2 3.12Å; R317-I515 PolarHBondContact N-O 2.93Å; R317-Y516 HydrophobicContact CB-CD1 3.97Å; R317-Y516 HydrophobicContact CB-CE1 3.89Å; R317-Y516 CarbonylContact O-C 3.55Å; R317-Y516 WeakPolarHBondContact O-CA 3.45Å; R317-N517 PolarHBondContact O-N 3Å
318	S	92	Very high	75.6	Confident	41 Å²	41	92.9 Å²	92.9	29%	0.287	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	149.1	170.4	-178	0	0	0	0	111.1	D320 E321	S318-D320 PolarHBondContact O-N 3.49Å; S318-D320 PolarHBondContact OG-N 3.2Å; S318-E321 PolarHBondContact O-N 3.5Å
319	E	92.4	Very high	78.5	Confident	1 Å²	1	92 Å²	92	1%	0.005	46%	0.455	C	S	.	.	H	α-helix	trans	-62.3	-33	169.3	72.6	168.8	141.3	0	0	112.7	E321 Y322 W323 N517 L518 I519 H527 L531	E319-E321 VanDerWaalsContact C-N 3.26Å; E319-E321 PolarHBondContact O-N 2.95Å; E319-Y322 WeakPolarHBondContact O-CB 3.31Å; E319-Y322 PolarHBondContact O-N 3.36Å; E319-W323 PolarHBondContact O-N 3.41Å; E319-W323 PolarHBondContact OE2-NE1 3.45Å; E319-N517 PolarHBondContact N-O 3.02Å; E319-L518 HydrophobicContact CB-CD2 3.81Å; E319-L518 HydrophobicContact CG-CD2 4.44Å; E319-L518 WeakPolarHBondContact OE2-CD2 3.11Å; E319-I519 HydrophobicContact CG-CG1 4.39Å; E319-I519 VanDerWaalsContact OE1-CB 3.26Å; E319-I519 WeakPolarHBondContact OE1-CB 3.15Å; E319-I519 WeakPolarHBondContact OE1-CD1 3.4Å; E319-I519 WeakPolarHBondContact OE1-CG1 3.32Å; E319-I519 PolarHBondContact OE1-N 3.31Å; E319-H527 IonicContact OE1-ND1 2.72Å; E319-H527 PolarHBondContact OE1-ND1 3.21Å; E319-H527 WeakPolarHBondContact OE2-CB 3.2Å; E319-H527 IonicContact OE2-CE1 3.4Å; E319-H527 IonicContact OE2-CG 3.97Å; E319-H527 IonicContact OE2-ND1 3.25Å; E319-H527 PolarHBondContact OE2-ND1 2.77Å; E319-L531 HydrophobicContact CB-CD1 4.34Å
320	D	92.6	Very high	81.3	Confident	70 Å²	70	90.3 Å²	90.3	37%	0.374	45%	0.448	S	S	.	.	H	α-helix	trans	-62	-37.7	180	-74.1	-30.2	0	0	0	111.1	S318 Y322 W323 I324	S318-D320 PolarHBondContact O-N 3.49Å; S318-D320 PolarHBondContact OG-N 3.2Å; D320-Y322 VanDerWaalsContact C-N 3.3Å; D320-Y322 PolarHBondContact O-N 3.07Å; D320-W323 PolarHBondContact O-N 3.31Å; D320-I324 WeakPolarHBondContact O-CB 3.38Å; D320-I324 WeakPolarHBondContact O-CD1 3.27Å; D320-I324 WeakPolarHBondContact O-CG1 3.15Å; D320-I324 PolarHBondContact O-N 2.77Å
321	E	92.2	Very high	84	Confident	86 Å²	86	88.8 Å²	88.8	40%	0.402	44%	0.437	S	S	.	.	H	α-helix	trans	-59.6	-42.8	174.2	-69.2	170.1	-150.9	0	0	111.1	S318 E319 I324 E325	S318-E321 PolarHBondContact O-N 3.5Å; E319-E321 VanDerWaalsContact C-N 3.26Å; E319-E321 PolarHBondContact O-N 2.95Å; E321-I324 PolarHBondContact O-N 2.84Å; E321-E325 VanDerWaalsContact O-CB 3.26Å; E321-E325 WeakPolarHBondContact O-CB 3.42Å; E321-E325 WeakPolarHBondContact O-CG 3.17Å; E321-E325 PolarHBondContact O-N 3.34Å
322	Y	93.3	Very high	86.6	Confident	9 Å²	9	82.2 Å²	82.2	4%	0.035	40%	0.402	C	S	.	.	H	α-helix	trans	-63.1	-46.3	177.6	-177.9	-94.8	0	0	0	111.7	E319 D320 E325 N326 L511 Y516 L531 H534 Y535	E319-Y322 WeakPolarHBondContact O-CB 3.31Å; E319-Y322 PolarHBondContact O-N 3.36Å; D320-Y322 VanDerWaalsContact C-N 3.3Å; D320-Y322 PolarHBondContact O-N 3.07Å; Y322-E325 PolarHBondContact O-N 3.19Å; Y322-N326 WeakPolarHBondContact O-CB 3.46Å; Y322-N326 PolarHBondContact O-N 3.26Å; Y322-N326 VanDerWaalsContact O-N 3.08Å; Y322-N326 PolarHBondContact O-ND2 3.18Å; Y322-L511 HydrophobicContact CD2-CD1 4.4Å; Y322-L511 HydrophobicContact CE2-CD1 3.84Å; Y322-Y516 AromaticContact CD2-CE1 3.89Å; Y322-Y516 HydrophobicContact CD2-CE1 3.89Å; Y322-Y516 AromaticContact CD2-CZ 3.91Å; Y322-Y516 HydrophobicContact CG-CE1 4.17Å; Y322-L531 HydrophobicContact CD1-CD1 3.57Å; Y322-L531 HydrophobicContact CD1-CD2 4.39Å; Y322-L531 HydrophobicContact CD1-CG 3.67Å; Y322-L531 HydrophobicContact CE1-CD1 4.1Å; Y322-L531 HydrophobicContact CE1-CD2 4.32Å; Y322-L531 HydrophobicContact CE1-CG 3.65Å; Y322-L531 HydrophobicContact CG-CD1 3.9Å; Y322-L531 HydrophobicContact CG-CG 4.19Å; Y322-H534 AromaticContact CE1-ND1 3.55Å; Y322-H534 AromaticContact CZ-ND1 3.69Å; Y322-H534 PolarHBondContact OH-ND1 3.4Å; Y322-H534 VanDerWaalsContact OH-ND1 3.13Å; Y322-Y535 WeakPolarHBondContact OH-CA 3.37Å; Y322-Y535 PolarHBondContact OH-N 3.44Å
323	W	94.3	Very high	88.7	Confident	8 Å²	8	73 Å²	73	3%	0.03	37%	0.369	C	S	.	.	H	α-helix	trans	-65.4	-40.3	-178.9	-59.8	126.5	0	0	0	111.6	E319 D320 N326 Q327 V328 L333 W336 L530 L531 H534	E319-W323 PolarHBondContact O-N 3.41Å; E319-W323 PolarHBondContact OE2-NE1 3.45Å; D320-W323 PolarHBondContact O-N 3.31Å; W323-N326 CarbonylContact O-C 3.55Å; W323-N326 PolarHBondContact O-N 3.13Å; W323-Q327 PolarHBondContact O-N 3.38Å; W323-V328 HydrophobicContact CB-CB 4.37Å; W323-V328 HydrophobicContact CE3-CB 4.17Å; W323-V328 HydrophobicContact CE3-CG1 4.2Å; W323-V328 HydrophobicContact CE3-CG2 4.16Å; W323-V328 PolarHBondContact O-N 3.3Å; W323-L333 HydrophobicContact CD2-CD1 4.22Å; W323-L333 HydrophobicContact CD2-CD2 4.4Å; W323-L333 HydrophobicContact CE3-CD1 4.43Å; W323-L333 HydrophobicContact CG-CD2 4.34Å; W323-L333 HydrophobicContact CH2-CD1 3.96Å; W323-L333 HydrophobicContact CZ2-CD1 3.7Å; W323-L333 HydrophobicContact CZ3-CD1 4.32Å; W323-W336 HydrophobicContact CZ3-CZ3 4.41Å; W323-L530 HydrophobicContact CH2-CB 4.14Å; W323-L531 HydrophobicContact CH2-CB 3.77Å; W323-L531 HydrophobicContact CH2-CD1 4.22Å; W323-L531 HydrophobicContact CH2-CG 4.07Å; W323-L531 HydrophobicContact CZ2-CB 3.78Å; W323-L531 HydrophobicContact CZ2-CD1 3.71Å; W323-L531 HydrophobicContact CZ2-CG 4.02Å; W323-H534 HydrophobicContact CZ3-CB 4.34Å
324	I	93.3	Very high	90.7	Very high	129 Å²	129	67.9 Å²	67.9	66%	0.662	35%	0.347	S	S	*	.	H	α-helix	trans	-65.8	-47.4	175.3	-67	165.1	0	0	0	110.9	D320 E321 N326 Q327	D320-I324 WeakPolarHBondContact O-CB 3.38Å; D320-I324 WeakPolarHBondContact O-CD1 3.27Å; D320-I324 WeakPolarHBondContact O-CG1 3.15Å; D320-I324 PolarHBondContact O-N 2.77Å; E321-I324 PolarHBondContact O-N 2.84Å; I324-N326 PolarHBondContact O-N 3.34Å; I324-Q327 PolarHBondContact O-N 3.26Å
325	E	92.2	Very high	92	Very high	109 Å²	109	65.5 Å²	65.5	51%	0.509	33%	0.331	S	S	.	.	H	α-helix	trans	-56.9	-33.2	177.2	-79	177	172.2	0	0	111.9	R317 E321 Y322	R317-E325 IonicContact CZ-OE1 3.74Å; R317-E325 IonicContact NH1-OE1 2.65Å; R317-E325 PolarHBondContact NH1-OE1 2.97Å; R317-E325 IonicContact NH1-OE2 2.74Å; R317-E325 PolarHBondContact NH1-OE2 3.12Å; E321-E325 VanDerWaalsContact O-CB 3.26Å; E321-E325 WeakPolarHBondContact O-CB 3.42Å; E321-E325 WeakPolarHBondContact O-CG 3.17Å; E321-E325 PolarHBondContact O-N 3.34Å; Y322-E325 PolarHBondContact O-N 3.19Å
326	N	92	Very high	92.8	Very high	55 Å²	55	62.6 Å²	62.6	29%	0.294	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	10.5	179.5	-71.2	-91.1	0	0	0	114.2	Y322 W323 I324 V328	Y322-N326 WeakPolarHBondContact O-CB 3.46Å; Y322-N326 PolarHBondContact O-N 3.26Å; Y322-N326 VanDerWaalsContact O-N 3.08Å; Y322-N326 PolarHBondContact O-ND2 3.18Å; W323-N326 CarbonylContact O-C 3.55Å; W323-N326 PolarHBondContact O-N 3.13Å; I324-N326 PolarHBondContact O-N 3.34Å; N326-V328 VanDerWaalsContact C-N 3.27Å; N326-V328 HydrophobicContact CB-CG2 4.1Å; N326-V328 PolarHBondContact O-N 3.05Å
327	Q	92	Very high	93.1	Very high	167 Å²	167	58.8 Å²	58.8	78%	0.78	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	37.6	178.6	-52.9	175.9	15	0	0	113.7	W323 I324	W323-Q327 PolarHBondContact O-N 3.38Å; I324-Q327 PolarHBondContact O-N 3.26Å
328	V	92.3	Very high	93.3	Very high	18 Å²	18	60.2 Å²	60.2	11%	0.109	31%	0.309	C	S	.	.			trans	-95.7	120.1	178.2	-178.6	0	0	0	0	109.2	W323 N326 D332 L333 W336	W323-V328 HydrophobicContact CB-CB 4.37Å; W323-V328 HydrophobicContact CE3-CB 4.17Å; W323-V328 HydrophobicContact CE3-CG1 4.2Å; W323-V328 HydrophobicContact CE3-CG2 4.16Å; W323-V328 PolarHBondContact O-N 3.3Å; N326-V328 VanDerWaalsContact C-N 3.27Å; N326-V328 HydrophobicContact CB-CG2 4.1Å; N326-V328 PolarHBondContact O-N 3.05Å; V328-D332 HydrophobicContact CG1-CB 3.92Å; V328-L333 HydrophobicContact CG1-CB 4.45Å; V328-W336 HydrophobicContact CB-CH2 4.38Å; V328-W336 HydrophobicContact CB-CZ3 4.25Å; V328-W336 HydrophobicContact CG1-CE3 4.03Å; V328-W336 HydrophobicContact CG1-CH2 3.79Å; V328-W336 HydrophobicContact CG1-CZ3 3.44Å; V328-W336 VanDerWaalsContact CG1-CZ3 3.44Å; V328-W336 HydrophobicContact CG2-CH2 3.67Å; V328-W336 HydrophobicContact CG2-CZ3 3.71Å
329	S	93.1	Very high	93.4	Very high	45 Å²	45	59.3 Å²	59.3	32%	0.315	30%	0.301	S	S	.	.			trans	-75.4	157.7	175.7	72.8	0	0	0	0	111.5	S331 D332 L333	S329-S331 PolarHBondContact O-N 3.34Å; S329-S331 PolarHBondContact OG-OG 2.97Å; S329-D332 WeakPolarHBondContact CB-OD2 3.32Å; S329-D332 PolarHBondContact N-OD2 2.77Å; S329-D332 WeakPolarHBondContact O-CB 3.48Å; S329-D332 PolarHBondContact O-N 3.02Å; S329-D332 VanDerWaalsContact O-N 3.08Å; S329-D332 PolarHBondContact OG-N 3.41Å; S329-D332 PolarHBondContact OG-OD2 3.31Å; S329-L333 PolarHBondContact O-N 3.33Å
330	K	92	Very high	93.6	Very high	168 Å²	168	59.3 Å²	59.3	73%	0.73	30%	0.301	S	S	*	.	H	α-helix	trans	-58.5	-37.2	173.4	-67.9	-173.3	178.6	-177.1	0	112.1	D332 L333 D334	K330-D332 VanDerWaalsContact C-N 3.35Å; K330-L333 PolarHBondContact O-N 2.9Å; K330-D334 PolarHBondContact O-N 2.92Å
331	S	93.3	Very high	93.8	Very high	84 Å²	84	59 Å²	59	59%	0.587	29%	0.294	S	S	*	.	H	α-helix	trans	-63.4	-37.9	174.5	37.3	0	0	0	0	113.1	S329 R335	S329-S331 PolarHBondContact O-N 3.34Å; S329-S331 PolarHBondContact OG-OG 2.97Å; S331-R335 WeakPolarHBondContact O-CB 3.06Å; S331-R335 PolarHBondContact O-N 3.38Å; S331-R335 VanDerWaalsContact O-N 3.11Å
332	D	93.7	Very high	93.9	Very high	27 Å²	27	59.5 Å²	59.5	14%	0.144	30%	0.295	C	S	.	.	H	α-helix	trans	-64.6	-46.3	173.5	-69.4	-50.7	0	0	0	110.5	V328 S329 K330 D334 R335 W336	V328-D332 HydrophobicContact CG1-CB 3.92Å; S329-D332 WeakPolarHBondContact CB-OD2 3.32Å; S329-D332 PolarHBondContact N-OD2 2.77Å; S329-D332 WeakPolarHBondContact O-CB 3.48Å; S329-D332 PolarHBondContact O-N 3.02Å; S329-D332 VanDerWaalsContact O-N 3.08Å; S329-D332 PolarHBondContact OG-N 3.41Å; S329-D332 PolarHBondContact OG-OD2 3.31Å; K330-D332 VanDerWaalsContact C-N 3.35Å; D332-D334 PolarHBondContact O-N 3.31Å; D332-R335 PolarHBondContact O-N 2.8Å; D332-R335 IonicContact OD1-CZ 3.68Å; D332-R335 IonicContact OD1-NH2 2.69Å; D332-R335 PolarHBondContact OD1-NH2 2.85Å; D332-W336 HydrophobicContact CB-CD2 4.47Å; D332-W336 HydrophobicContact CB-CZ2 4.23Å; D332-W336 WeakPolarHBondContact O-CB 3.28Å; D332-W336 VanDerWaalsContact O-CD1 3.26Å; D332-W336 PolarHBondContact O-N 3.16Å
333	L	94.1	Very high	93.9	Very high	16 Å²	16	59.3 Å²	59.3	8%	0.084	29%	0.294	C	S	.	.	H	α-helix	trans	-62.1	-41.2	-179.6	-172.7	61	0	0	0	112.5	W323 V328 S329 K330 W336 T337 L530	W323-L333 HydrophobicContact CD2-CD1 4.22Å; W323-L333 HydrophobicContact CD2-CD2 4.4Å; W323-L333 HydrophobicContact CE3-CD1 4.43Å; W323-L333 HydrophobicContact CG-CD2 4.34Å; W323-L333 HydrophobicContact CH2-CD1 3.96Å; W323-L333 HydrophobicContact CZ2-CD1 3.7Å; W323-L333 HydrophobicContact CZ3-CD1 4.32Å; V328-L333 HydrophobicContact CG1-CB 4.45Å; S329-L333 PolarHBondContact O-N 3.33Å; K330-L333 PolarHBondContact O-N 2.9Å; L333-W336 PolarHBondContact O-N 2.9Å; L333-T337 WeakPolarHBondContact O-CB 3.47Å; L333-T337 PolarHBondContact O-N 3.49Å; L333-T337 PolarHBondContact O-OG1 2.6Å; L333-L530 HydrophobicContact CD1-CD1 3.81Å
334	D	94.1	Very high	93.9	Very high	79 Å²	79	59 Å²	59	42%	0.422	29%	0.293	S	S	.	.	H	α-helix	trans	-64.8	-42.7	175.6	-78.1	-30.7	0	0	0	111.9	K330 D332 T337 L338 K523	K330-D334 PolarHBondContact O-N 2.92Å; D332-D334 PolarHBondContact O-N 3.31Å; D334-T337 WeakPolarHBondContact O-CB 3.29Å; D334-T337 PolarHBondContact O-N 2.95Å; D334-L338 PolarHBondContact O-N 2.69Å; D334-K523 IonicContact OD1-NZ 3.57Å; D334-K523 PolarHBondContact OD1-NZ 3.45Å
335	R	94.7	Very high	94	Very high	57 Å²	57	53.5 Å²	53.5	22%	0.215	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-47	174.4	176	177.6	61.7	177.7	-9.9	111.5	S331 D332 T337 L338 N339 N562	S331-R335 WeakPolarHBondContact O-CB 3.06Å; S331-R335 PolarHBondContact O-N 3.38Å; S331-R335 VanDerWaalsContact O-N 3.11Å; D332-R335 PolarHBondContact O-N 2.8Å; D332-R335 IonicContact OD1-CZ 3.68Å; D332-R335 IonicContact OD1-NH2 2.69Å; D332-R335 PolarHBondContact OD1-NH2 2.85Å; R335-T337 VanDerWaalsContact C-N 3.27Å; R335-T337 PolarHBondContact O-N 3.48Å; R335-L338 WeakPolarHBondContact O-CB 3.47Å; R335-L338 PolarHBondContact O-N 2.58Å; R335-N339 PolarHBondContact O-N 3.27Å; R335-N562 VanDerWaalsContact NH1-CB 3.25Å; R335-N562 VanDerWaalsContact NH1-CG 3.28Å; R335-N562 PolarHBondContact NH1-OD1 2.94Å
336	W	95.7	Very high	94	Very high	9 Å²	9	49.6 Å²	49.6	3%	0.034	25%	0.254	C	S	.	.	H	α-helix	trans	-63.5	-36.5	178.8	-62.9	-10	0	0	0	111.2	W323 V328 D332 L333 L338 N339 L340 L530 H534 I558 F559	W323-W336 HydrophobicContact CZ3-CZ3 4.41Å; V328-W336 HydrophobicContact CB-CH2 4.38Å; V328-W336 HydrophobicContact CB-CZ3 4.25Å; V328-W336 HydrophobicContact CG1-CE3 4.03Å; V328-W336 HydrophobicContact CG1-CH2 3.79Å; V328-W336 HydrophobicContact CG1-CZ3 3.44Å; V328-W336 VanDerWaalsContact CG1-CZ3 3.44Å; V328-W336 HydrophobicContact CG2-CH2 3.67Å; V328-W336 HydrophobicContact CG2-CZ3 3.71Å; D332-W336 HydrophobicContact CB-CD2 4.47Å; D332-W336 HydrophobicContact CB-CZ2 4.23Å; D332-W336 WeakPolarHBondContact O-CB 3.28Å; D332-W336 VanDerWaalsContact O-CD1 3.26Å; D332-W336 PolarHBondContact O-N 3.16Å; L333-W336 PolarHBondContact O-N 2.9Å; W336-L338 PolarHBondContact O-N 3.26Å; W336-N339 PolarHBondContact O-N 2.84Å; W336-L340 WeakPolarHBondContact O-CB 3.36Å; W336-L340 PolarHBondContact O-N 3.02Å; W336-L530 HydrophobicContact CB-CD1 4.1Å; W336-L530 HydrophobicContact CB-CD2 3.97Å; W336-H534 AromaticContact CH2-CD2 3.87Å; W336-H534 AromaticContact CH2-NE2 3.95Å; W336-H534 AromaticContact CZ3-CD2 3.61Å; W336-I558 HydrophobicContact CB-CG2 4.26Å; W336-F559 AromaticContact CD2-CD1 3.78Å; W336-F559 HydrophobicContact CD2-CD1 3.78Å; W336-F559 HydrophobicContact CD2-CE1 4.39Å; W336-F559 AromaticContact CE3-CD1 3.63Å; W336-F559 HydrophobicContact CE3-CD1 3.63Å; W336-F559 AromaticContact CE3-CE1 3.96Å; W336-F559 HydrophobicContact CE3-CE1 3.96Å; W336-F559 HydrophobicContact CG-CD1 4.36Å; W336-F559 HydrophobicContact CH2-CD1 4.09Å; W336-F559 HydrophobicContact CZ2-CB 4.36Å; W336-F559 HydrophobicContact CZ2-CD1 4.25Å; W336-F559 AromaticContact CZ3-CD1 3.79Å; W336-F559 HydrophobicContact CZ3-CD1 3.79Å; W336-F559 HydrophobicContact CZ3-CE1 4.25Å
337	T	95.5	Very high	93.9	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	25%	0.245	C	C	.	.	H	α-helix	trans	-61	-44.4	173.2	-61.8	0	0	0	0	111.3	L333 D334 R335 L340 R341 Y526 L530	L333-T337 WeakPolarHBondContact O-CB 3.47Å; L333-T337 PolarHBondContact O-N 3.49Å; L333-T337 PolarHBondContact O-OG1 2.6Å; D334-T337 WeakPolarHBondContact O-CB 3.29Å; D334-T337 PolarHBondContact O-N 2.95Å; R335-T337 VanDerWaalsContact C-N 3.27Å; R335-T337 PolarHBondContact O-N 3.48Å; T337-L340 PolarHBondContact O-N 2.97Å; T337-R341 WeakPolarHBondContact O-CG 3.33Å; T337-R341 PolarHBondContact O-N 3.14Å; T337-Y526 HydrophobicContact CG2-CD2 4.44Å; T337-Y526 HydrophobicContact CG2-CG 4.26Å; T337-L530 WeakPolarHBondContact OG1-CD1 3.41Å
338	L	94.7	Very high	94	Very high	75 Å²	75	40.1 Å²	40.1	39%	0.393	21%	0.209	S	C	.	.	H	α-helix	trans	-64.2	-43.8	175.2	-179.7	63	0	0	0	112.3	D334 R335 W336 L340 R341 K342 C423	D334-L338 PolarHBondContact O-N 2.69Å; R335-L338 WeakPolarHBondContact O-CB 3.47Å; R335-L338 PolarHBondContact O-N 2.58Å; W336-L338 PolarHBondContact O-N 3.26Å; L338-L340 VanDerWaalsContact C-N 3.34Å; L338-R341 PolarHBondContact O-N 3.22Å; L338-K342 WeakPolarHBondContact O-CG 3.43Å; L338-K342 PolarHBondContact O-N 2.93Å; L338-C423 HydrophobicContact CD1-CB 4.38Å
339	N	95.1	Very high	94.1	Very high	23 Å²	23	39.3 Å²	39.3	12%	0.123	20%	0.204	C	C	.	.	H	α-helix	trans	-63.2	-40.6	177.4	-73.4	-14.5	0	0	0	111.8	R335 W336 K342 W343 W557 I558	R335-N339 PolarHBondContact O-N 3.27Å; W336-N339 PolarHBondContact O-N 2.84Å; N339-K342 WeakPolarHBondContact O-CB 3.47Å; N339-K342 PolarHBondContact O-N 2.73Å; N339-W343 PolarHBondContact O-N 3.49Å; N339-W557 HydrophobicContact CB-CE3 4.45Å; N339-W557 HydrophobicContact CB-CH2 4.11Å; N339-W557 HydrophobicContact CB-CZ3 3.68Å; N339-W557 WeakPolarHBondContact O-CH2 3.26Å; N339-I558 HydrophobicContact CB-CB 4.27Å; N339-I558 HydrophobicContact CB-CG1 4.29Å; N339-I558 HydrophobicContact CB-CG2 3.95Å; N339-I558 PolarHBondContact ND2-O 2.82Å
340	L	96.2	Very high	94	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-43.8	174.4	176.9	64.9	0	0	0	111.3	W336 T337 L338 K342 W343 L344 Y526 I529 L530 I558	W336-L340 WeakPolarHBondContact O-CB 3.36Å; W336-L340 PolarHBondContact O-N 3.02Å; T337-L340 PolarHBondContact O-N 2.97Å; L338-L340 VanDerWaalsContact C-N 3.34Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 3.23Å; L340-W343 HydrophobicContact CD1-CE3 4.08Å; L340-W343 PolarHBondContact O-N 3.12Å; L340-W343 VanDerWaalsContact O-N 3.15Å; L340-L344 HydrophobicContact CD1-CD1 4.05Å; L340-L344 HydrophobicContact CD1-CG 4.02Å; L340-L344 HydrophobicContact CD2-CD1 4.33Å; L340-L344 HydrophobicContact CG-CD1 3.83Å; L340-L344 HydrophobicContact CG-CG 4.26Å; L340-L344 WeakPolarHBondContact O-CB 2.79Å; L340-L344 WeakPolarHBondContact O-CG 3.34Å; L340-L344 PolarHBondContact O-N 3.42Å; L340-Y526 HydrophobicContact CD2-CD1 4.14Å; L340-Y526 WeakPolarHBondContact CD2-O 3.44Å; L340-I529 HydrophobicContact CD1-CG2 3.74Å; L340-I529 HydrophobicContact CD2-CB 3.83Å; L340-I529 HydrophobicContact CD2-CG2 3.77Å; L340-I529 HydrophobicContact CG-CG2 4.4Å; L340-L530 HydrophobicContact CB-CD2 3.94Å; L340-L530 HydrophobicContact CB-CG 4.47Å; L340-L530 HydrophobicContact CD2-CD2 3.98Å; L340-L530 HydrophobicContact CD2-CG 3.77Å; L340-L530 HydrophobicContact CG-CD2 4.45Å; L340-I558 HydrophobicContact CB-CD1 4.42Å; L340-I558 HydrophobicContact CB-CG2 4.34Å; L340-I558 HydrophobicContact CD1-CD1 3.98Å
341	R	95.9	Very high	94	Very high	65 Å²	65	39.3 Å²	39.3	25%	0.245	19%	0.193	C	C	.	.	H	α-helix	trans	-58.9	-43	175.5	-75.2	176.1	68.8	179.6	7.1	111.9	T337 L338 H345 C423 L424 Y526	T337-R341 WeakPolarHBondContact O-CG 3.33Å; T337-R341 PolarHBondContact O-N 3.14Å; L338-R341 PolarHBondContact O-N 3.22Å; R341-H345 WeakPolarHBondContact O-CB 3.41Å; R341-H345 PolarHBondContact O-N 2.86Å; R341-C423 HydrophobicContact CB-CB 4.35Å; R341-C423 PolarHBondContact NE-O 2.88Å; R341-C423 PolarHBondContact NH2-O 2.96Å; R341-L424 VanDerWaalsContact NH2-C 3.29Å; R341-L424 PolarHBondContact NH2-O 3.07Å; R341-Y526 HydrophobicContact CG-CD1 3.95Å; R341-Y526 HydrophobicContact CG-CE1 3.5Å; R341-Y526 HydrophobicContact CG-CE2 4.39Å
342	K	94	Very high	93.9	Very high	96 Å²	96	35.6 Å²	35.6	42%	0.417	17%	0.166	S	C	.	.	H	α-helix	trans	-59.4	-46.3	173.2	-74.4	172.1	-179.6	178.4	0	111.6	L338 N339 L340 G346 C423 W557	L338-K342 WeakPolarHBondContact O-CG 3.43Å; L338-K342 PolarHBondContact O-N 2.93Å; N339-K342 WeakPolarHBondContact O-CB 3.47Å; N339-K342 PolarHBondContact O-N 2.73Å; L340-K342 VanDerWaalsContact C-N 3.32Å; L340-K342 PolarHBondContact O-N 3.23Å; K342-G346 PolarHBondContact O-N 2.82Å; K342-C423 HydrophobicContact CG-CB 4.26Å; K342-C423 WeakPolarHBondContact CG-SG 3.26Å; K342-W557 HydrophobicContact CB-CH2 4.38Å
343	W	94.1	Very high	93.9	Very high	5 Å²	5	34.6 Å²	34.6	2%	0.019	16%	0.161	C	C	.	.	H	α-helix	trans	-63.7	-49.3	179.9	-177.6	83.7	0	0	0	112	N339 L340 G346 T347 I348 F455 Y458 F533 L553 N554 V555 W557 I558	N339-W343 PolarHBondContact O-N 3.49Å; L340-W343 HydrophobicContact CD1-CE3 4.08Å; L340-W343 PolarHBondContact O-N 3.12Å; L340-W343 VanDerWaalsContact O-N 3.15Å; W343-G346 PolarHBondContact O-N 3.24Å; W343-T347 HydrophobicContact CZ2-CG2 4.18Å; W343-T347 PolarHBondContact NE1-OG1 3.13Å; W343-T347 WeakPolarHBondContact O-CA 2.82Å; W343-T347 WeakPolarHBondContact O-CB 3.38Å; W343-T347 PolarHBondContact O-N 3.03Å; W343-T347 PolarHBondContact O-OG1 2.86Å; W343-I348 HydrophobicContact CH2-CD1 4.19Å; W343-I348 HydrophobicContact CZ3-CD1 4.04Å; W343-F455 HydrophobicContact CH2-CE2 4.42Å; W343-F455 HydrophobicContact CZ3-CD2 4.27Å; W343-F455 HydrophobicContact CZ3-CE2 4.25Å; W343-Y458 HydrophobicContact CH2-CD1 4.06Å; W343-Y458 AromaticContact CH2-CE1 3.64Å; W343-Y458 HydrophobicContact CH2-CE1 3.64Å; W343-Y458 AromaticContact CZ2-CE1 3.75Å; W343-Y458 HydrophobicContact CZ2-CE1 3.75Å; W343-Y458 AromaticContact CZ2-CZ 3.92Å; W343-F533 HydrophobicContact CH2-CZ 4.4Å; W343-F533 HydrophobicContact CZ3-CE2 4.36Å; W343-L553 PolarHBondContact NE1-O 2.87Å; W343-N554 PolarHBondContact NE1-O 3.02Å; W343-V555 HydrophobicContact CD2-CG1 3.79Å; W343-V555 HydrophobicContact CE3-CG1 4.27Å; W343-V555 HydrophobicContact CG-CG1 4.37Å; W343-V555 HydrophobicContact CH2-CG1 3.88Å; W343-V555 HydrophobicContact CZ2-CG1 3.33Å; W343-V555 HydrophobicContact CZ3-CG1 4.3Å; W343-W557 HydrophobicContact CB-CH2 4.46Å; W343-W557 HydrophobicContact CB-CZ2 3.86Å; W343-W557 AromaticContact CD1-NE1 3.99Å; W343-W557 HydrophobicContact CG-CZ2 4.38Å; W343-I558 HydrophobicContact CB-CD1 3.93Å; W343-I558 HydrophobicContact CB-CG1 4.46Å; W343-I558 HydrophobicContact CD2-CD1 4.45Å; W343-I558 HydrophobicContact CG-CD1 4.06Å
344	L	95.1	Very high	93.7	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-60.7	-46.6	178.6	-72.9	168.7	0	0	0	111.6	L340 I348 I349 L424 L451 F455 Y526 I529	L340-L344 HydrophobicContact CD1-CD1 4.05Å; L340-L344 HydrophobicContact CD1-CG 4.02Å; L340-L344 HydrophobicContact CD2-CD1 4.33Å; L340-L344 HydrophobicContact CG-CD1 3.83Å; L340-L344 HydrophobicContact CG-CG 4.26Å; L340-L344 WeakPolarHBondContact O-CB 2.79Å; L340-L344 WeakPolarHBondContact O-CG 3.34Å; L340-L344 PolarHBondContact O-N 3.42Å; L344-I348 HydrophobicContact CD2-CD1 3.79Å; L344-I348 WeakPolarHBondContact O-CB 3.1Å; L344-I348 PolarHBondContact O-N 2.83Å; L344-I348 VanDerWaalsContact O-N 3.1Å; L344-I349 PolarHBondContact O-N 3.21Å; L344-I349 VanDerWaalsContact O-N 3.16Å; L344-L424 HydrophobicContact CB-CD1 4.18Å; L344-L451 HydrophobicContact CD1-CD1 4.22Å; L344-L451 HydrophobicContact CD1-CD2 4.14Å; L344-L451 HydrophobicContact CD1-CG 4.43Å; L344-F455 HydrophobicContact CD2-CD2 4.2Å; L344-Y526 HydrophobicContact CD1-CD1 4.17Å; L344-Y526 HydrophobicContact CD1-CE1 4.05Å; L344-I529 HydrophobicContact CD1-CD1 4.24Å
345	H	94.6	Very high	93.5	Very high	13 Å²	13	34.1 Å²	34.1	6%	0.06	16%	0.158	C	C	.	.	I	π-helix	trans	-59.4	-55.7	177.4	178.3	-103.5	0	0	0	111.8	R341 I349 R350 L418 A419 E421 L424	R341-H345 WeakPolarHBondContact O-CB 3.41Å; R341-H345 PolarHBondContact O-N 2.86Å; H345-I349 PolarHBondContact O-N 2.58Å; H345-R350 VanDerWaalsContact O-CB 3.29Å; H345-R350 WeakPolarHBondContact O-CB 3.33Å; H345-R350 PolarHBondContact O-N 3.08Å; H345-L418 PolarHBondContact CD2-O 3.44Å; H345-A419 PolarHBondContact NE2-O 2.96Å; H345-E421 PolarHBondContact CD2-O 3.24Å; H345-E421 PolarHBondContact CE1-O 3.31Å; H345-E421 PolarHBondContact NE2-O 3.4Å; H345-L424 HydrophobicContact CB-CD2 4.02Å; H345-L424 HydrophobicContact CB-CG 4.03Å
346	G	91.4	Very high	93.3	Very high	27 Å²	27	31.4 Å²	31.4	28%	0.278	15%	0.148	S	C	.	.	I	π-helix	trans	-77.2	-31.6	-172.7	0	0	0	0	0	114.6	K342 W343	K342-G346 PolarHBondContact O-N 2.82Å; W343-G346 PolarHBondContact O-N 3.24Å
347	T	90.9	Very high	93	Very high	20 Å²	20	33.7 Å²	33.7	12%	0.123	16%	0.161	C	C	.	.	I	π-helix	trans	-90.6	-34.4	-174.4	-48.5	0	0	0	0	112.1	W343 R351 Y458	W343-T347 HydrophobicContact CZ2-CG2 4.18Å; W343-T347 PolarHBondContact NE1-OG1 3.13Å; W343-T347 WeakPolarHBondContact O-CA 2.82Å; W343-T347 WeakPolarHBondContact O-CB 3.38Å; W343-T347 PolarHBondContact O-N 3.03Å; W343-T347 PolarHBondContact O-OG1 2.86Å; T347-R351 WeakPolarHBondContact O-CD 3.33Å; T347-R351 WeakPolarHBondContact O-CG 3.42Å; T347-R351 PolarHBondContact O-NE 3.31Å; T347-Y458 HydrophobicContact CG2-CE2 3.71Å
348	I	93.2	Very high	92.6	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.015	17%	0.165	C	C	.	.	I	π-helix	trans	-109.8	-71.2	-174.1	-48.6	-173.4	0	0	0	109.7	W343 L344 R350 R351 I352 F401 L454 F455 Y458	W343-I348 HydrophobicContact CH2-CD1 4.19Å; W343-I348 HydrophobicContact CZ3-CD1 4.04Å; L344-I348 HydrophobicContact CD2-CD1 3.79Å; L344-I348 WeakPolarHBondContact O-CB 3.1Å; L344-I348 PolarHBondContact O-N 2.83Å; L344-I348 VanDerWaalsContact O-N 3.1Å; I348-R350 PolarHBondContact O-N 3.07Å; I348-R351 PolarHBondContact O-N 3.34Å; I348-I352 HydrophobicContact CG2-CD1 3.65Å; I348-I352 VanDerWaalsContact O-CG1 3.32Å; I348-I352 WeakPolarHBondContact O-CG1 3.35Å; I348-I352 PolarHBondContact O-N 3.47Å; I348-F401 HydrophobicContact CG2-CE1 4.37Å; I348-L454 HydrophobicContact CG2-CB 4.1Å; I348-F455 HydrophobicContact CD1-CD2 4.38Å; I348-Y458 HydrophobicContact CB-CD2 4.46Å; I348-Y458 HydrophobicContact CD1-CD1 4.08Å; I348-Y458 HydrophobicContact CD1-CD2 3.9Å; I348-Y458 HydrophobicContact CD1-CG 3.63Å; I348-Y458 HydrophobicContact CG1-CD2 3.57Å; I348-Y458 HydrophobicContact CG1-CE2 4.09Å; I348-Y458 HydrophobicContact CG1-CG 3.88Å
349	I	94	Very high	92.1	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.005	15%	0.146	C	C	.	.	I	π-helix	trans	-63.6	-49.1	-165.3	-72	164.1	0	0	0	111.9	L344 H345 R351 I352 V353 L418 A419 L424 L451 L454	L344-I349 PolarHBondContact O-N 3.21Å; L344-I349 VanDerWaalsContact O-N 3.16Å; H345-I349 PolarHBondContact O-N 2.58Å; I349-R351 VanDerWaalsContact C-N 3.28Å; I349-R351 PolarHBondContact O-N 2.89Å; I349-I352 PolarHBondContact O-N 3.49Å; I349-V353 WeakPolarHBondContact O-CG2 3.34Å; I349-V353 PolarHBondContact O-N 2.69Å; I349-L418 HydrophobicContact CG2-CB 4.13Å; I349-A419 HydrophobicContact CG2-CB 3.91Å; I349-L424 HydrophobicContact CD1-CD1 4.32Å; I349-L424 HydrophobicContact CD1-CD2 3.36Å; I349-L424 HydrophobicContact CD1-CG 4.46Å; I349-L451 HydrophobicContact CD1-CD1 3.79Å; I349-L454 HydrophobicContact CD1-CD1 4.32Å; I349-L454 HydrophobicContact CG1-CD1 3.78Å
350	R	92.7	Very high	91.8	Very high	137 Å²	137	30.6 Å²	30.6	52%	0.517	15%	0.145	S	C	.	.	H	α-helix	trans	-62.9	-35.2	-179.8	-166.7	169.9	95.8	170.9	7.7	112.5	H345 I348 N354	H345-R350 VanDerWaalsContact O-CB 3.29Å; H345-R350 WeakPolarHBondContact O-CB 3.33Å; H345-R350 PolarHBondContact O-N 3.08Å; I348-R350 PolarHBondContact O-N 3.07Å; R350-N354 WeakPolarHBondContact O-CB 3.32Å; R350-N354 PolarHBondContact O-N 2.98Å; R350-N354 PolarHBondContact O-OD1 3.48Å
351	R	90.5	Very high	91.3	Very high	77 Å²	77	36.5 Å²	36.5	29%	0.291	17%	0.168	S	C	.	.	H	α-helix	trans	-70.2	-43.3	178.9	-61.4	-165.8	-173.3	-175.8	-0.9	111.4	L222 S223 T347 I348 I349 N354 E355	L222-R351 PolarHBondContact O-NH1 3.07Å; S223-R351 PolarHBondContact O-NH1 3.34Å; S223-R351 PolarHBondContact O-NH2 3.15Å; T347-R351 WeakPolarHBondContact O-CD 3.33Å; T347-R351 WeakPolarHBondContact O-CG 3.42Å; T347-R351 PolarHBondContact O-NE 3.31Å; I348-R351 PolarHBondContact O-N 3.34Å; I349-R351 VanDerWaalsContact C-N 3.28Å; I349-R351 PolarHBondContact O-N 2.89Å; R351-N354 PolarHBondContact O-N 3.23Å; R351-E355 WeakPolarHBondContact O-CB 3.45Å; R351-E355 PolarHBondContact O-N 3.24Å
352	I	92	Very high	90.6	Very high	6 Å²	6	36.2 Å²	36.2	3%	0.031	17%	0.171	C	C	.	.	H	α-helix	trans	-58.8	-48.7	175.2	-68	169.1	0	0	0	110.2	I348 I349 E355 I356 L398 F401 L415 L454	I348-I352 HydrophobicContact CG2-CD1 3.65Å; I348-I352 VanDerWaalsContact O-CG1 3.32Å; I348-I352 WeakPolarHBondContact O-CG1 3.35Å; I348-I352 PolarHBondContact O-N 3.47Å; I349-I352 PolarHBondContact O-N 3.49Å; I352-E355 PolarHBondContact O-N 2.78Å; I352-I356 HydrophobicContact CG2-CD1 3.91Å; I352-I356 VanDerWaalsContact O-CG1 3.32Å; I352-I356 WeakPolarHBondContact O-CG1 3.42Å; I352-I356 PolarHBondContact O-N 3.37Å; I352-L398 HydrophobicContact CG2-CD1 3.78Å; I352-F401 HydrophobicContact CD1-CB 4.07Å; I352-F401 HydrophobicContact CD1-CD1 3.31Å; I352-F401 HydrophobicContact CD1-CD2 4.37Å; I352-F401 HydrophobicContact CD1-CE1 3.74Å; I352-F401 HydrophobicContact CD1-CG 3.67Å; I352-F401 HydrophobicContact CD1-CZ 4.43Å; I352-F401 HydrophobicContact CG1-CD1 4.19Å; I352-F401 HydrophobicContact CG1-CD2 4.42Å; I352-F401 HydrophobicContact CG1-CE1 4.49Å; I352-F401 HydrophobicContact CG1-CG 4.15Å; I352-L415 HydrophobicContact CG2-CD1 4.06Å; I352-L454 HydrophobicContact CD1-CD2 3.91Å
353	V	93.1	Very high	89.9	Confident	6 Å²	6	32.1 Å²	32.1	4%	0.036	15%	0.154	C	C	.	.	H	α-helix	trans	-62	-46.8	179.2	168.6	0	0	0	0	112	I349 E355 I356 D357 L415 H416 A419	I349-V353 WeakPolarHBondContact O-CG2 3.34Å; I349-V353 PolarHBondContact O-N 2.69Å; V353-E355 PolarHBondContact O-N 2.92Å; V353-I356 WeakPolarHBondContact O-CB 3.4Å; V353-I356 PolarHBondContact O-N 3.43Å; V353-I356 VanDerWaalsContact O-N 3.16Å; V353-D357 PolarHBondContact O-N 2.84Å; V353-L415 HydrophobicContact CG2-CB 3.8Å; V353-L415 WeakPolarHBondContact CG2-O 3.3Å; V353-H416 VanDerWaalsContact CG1-ND1 3.35Å; V353-H416 WeakPolarHBondContact CG1-ND1 3.4Å; V353-A419 HydrophobicContact CB-CB 4.01Å; V353-A419 HydrophobicContact CG1-CB 4.14Å; V353-A419 HydrophobicContact CG2-CB 3.7Å
354	N	91.1	Very high	89.3	Confident	79 Å²	79	36.6 Å²	36.6	42%	0.422	18%	0.175	S	C	.	.	H	α-helix	trans	-59.4	-34.8	176.4	-71	-2.6	0	0	0	112.5	R350 R351 T358	R350-N354 WeakPolarHBondContact O-CB 3.32Å; R350-N354 PolarHBondContact O-N 2.98Å; R350-N354 PolarHBondContact O-OD1 3.48Å; R351-N354 PolarHBondContact O-N 3.23Å; N354-T358 WeakPolarHBondContact O-CB 3.49Å; N354-T358 PolarHBondContact O-N 3.33Å; N354-T358 PolarHBondContact O-OG1 3.18Å
355	E	88.9	Confident	88.6	Confident	6 Å²	6	44.2 Å²	44.2	3%	0.028	21%	0.21	C	C	.	.	H	α-helix	trans	-73.2	-40.2	177.5	-167.4	59.1	-156.2	0	0	111.7	S216 L217 R351 I352 V353 D357 T358 I359 T394 L398	S216-E355 PolarHBondContact OG-OE1 2.9Å; L217-E355 WeakPolarHBondContact CA-OE2 3.23Å; L217-E355 WeakPolarHBondContact CB-OE2 3.4Å; R351-E355 WeakPolarHBondContact O-CB 3.45Å; R351-E355 PolarHBondContact O-N 3.24Å; I352-E355 PolarHBondContact O-N 2.78Å; V353-E355 PolarHBondContact O-N 2.92Å; E355-D357 VanDerWaalsContact C-N 3.34Å; E355-D357 PolarHBondContact O-N 3.43Å; E355-T358 PolarHBondContact O-N 3.03Å; E355-I359 HydrophobicContact CG-CD1 4.06Å; E355-I359 WeakPolarHBondContact O-CG1 3.24Å; E355-I359 PolarHBondContact O-N 2.88Å; E355-T394 WeakPolarHBondContact OE1-CB 3.48Å; E355-T394 WeakPolarHBondContact OE1-CG2 3.26Å; E355-T394 PolarHBondContact OE1-OG1 3.12Å; E355-L398 HydrophobicContact CG-CD2 4.29Å
356	I	90	Very high	87.5	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-55.9	-50.7	170.9	-68.5	165	0	0	0	109.8	I352 V353 T358 I359 N360 I373 L398 L402 V412 L415	I352-I356 HydrophobicContact CG2-CD1 3.91Å; I352-I356 VanDerWaalsContact O-CG1 3.32Å; I352-I356 WeakPolarHBondContact O-CG1 3.42Å; I352-I356 PolarHBondContact O-N 3.37Å; V353-I356 WeakPolarHBondContact O-CB 3.4Å; V353-I356 PolarHBondContact O-N 3.43Å; V353-I356 VanDerWaalsContact O-N 3.16Å; I356-T358 VanDerWaalsContact C-N 3.3Å; I356-T358 PolarHBondContact O-N 3.44Å; I356-I359 PolarHBondContact O-N 2.77Å; I356-N360 WeakPolarHBondContact O-CB 3.46Å; I356-N360 PolarHBondContact O-N 2.67Å; I356-I373 HydrophobicContact CG1-CG2 4.31Å; I356-I373 HydrophobicContact CG2-CB 4.13Å; I356-I373 HydrophobicContact CG2-CG2 3.91Å; I356-L398 HydrophobicContact CG1-CD1 4Å; I356-L398 HydrophobicContact CG1-CD2 3.82Å; I356-L398 HydrophobicContact CG1-CG 4.44Å; I356-L402 HydrophobicContact CD1-CD2 4.1Å; I356-V412 HydrophobicContact CG2-CG1 4.11Å; I356-L415 HydrophobicContact CD1-CD1 4.02Å
357	D	90.7	Very high	86.3	Confident	56 Å²	56	48.9 Å²	48.9	30%	0.299	26%	0.255	S	S	.	.	H	α-helix	trans	-60	-41.8	178.8	-73.2	-34.1	0	0	0	111.8	V353 E355 N360 R361 H416	V353-D357 PolarHBondContact O-N 2.84Å; E355-D357 VanDerWaalsContact C-N 3.34Å; E355-D357 PolarHBondContact O-N 3.43Å; D357-N360 PolarHBondContact O-N 3.23Å; D357-R361 VanDerWaalsContact O-CG 3.32Å; D357-R361 WeakPolarHBondContact O-CG 3.49Å; D357-R361 PolarHBondContact O-N 3.33Å; D357-H416 IonicContact OD1-CE1 2.72Å; D357-H416 PolarHBondContact OD1-CE1 3.22Å; D357-H416 IonicContact OD1-NE2 3.72Å; D357-H416 IonicContact OD2-CE1 3.89Å
358	T	87.2	Confident	84.9	Confident	24 Å²	24	48.8 Å²	48.8	15%	0.147	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-44	-179.8	-60.6	0	0	0	0	111.6	N354 E355 I356 R361 N362	N354-T358 WeakPolarHBondContact O-CB 3.49Å; N354-T358 PolarHBondContact O-N 3.33Å; N354-T358 PolarHBondContact O-OG1 3.18Å; E355-T358 PolarHBondContact O-N 3.03Å; I356-T358 VanDerWaalsContact C-N 3.3Å; I356-T358 PolarHBondContact O-N 3.44Å; T358-R361 PolarHBondContact OG1-NH2 3.3Å; T358-N362 PolarHBondContact O-N 3.46Å; T358-N362 VanDerWaalsContact O-N 3.09Å; T358-N362 PolarHBondContact O-ND2 2.85Å; T358-N362 PolarHBondContact O-OD1 2.99Å
359	I	83.9	Confident	83.5	Confident	1 Å²	1	54.1 Å²	54.1	1%	0.005	29%	0.287	C	S	.	.	H	α-helix	trans	-67.6	-41.9	177	-67.7	169.6	0	0	0	110.9	E355 I356 N362 L363 I373 L392 L395 L398	E355-I359 HydrophobicContact CG-CD1 4.06Å; E355-I359 WeakPolarHBondContact O-CG1 3.24Å; E355-I359 PolarHBondContact O-N 2.88Å; I356-I359 PolarHBondContact O-N 2.77Å; I359-N362 PolarHBondContact O-N 3.47Å; I359-L363 HydrophobicContact CG2-CD1 3.86Å; I359-L363 HydrophobicContact CG2-CG 4.26Å; I359-L363 VanDerWaalsContact O-CG 3.3Å; I359-L363 WeakPolarHBondContact O-CG 3.38Å; I359-L363 PolarHBondContact O-N 3.2Å; I359-I373 HydrophobicContact CB-CD1 3.94Å; I359-I373 HydrophobicContact CD1-CD1 4.34Å; I359-I373 HydrophobicContact CG2-CD1 3.62Å; I359-I373 HydrophobicContact CG2-CG1 4.43Å; I359-L392 HydrophobicContact CG1-CD2 4.33Å; I359-L392 HydrophobicContact CG2-CD1 4.19Å; I359-L392 HydrophobicContact CG2-CD2 4.04Å; I359-L395 HydrophobicContact CD1-CB 4.26Å; I359-L395 HydrophobicContact CD1-CD1 4.18Å; I359-L398 HydrophobicContact CD1-CD2 3.56Å
360	N	88.3	Confident	81.9	Confident	20 Å²	20	63.3 Å²	63.3	11%	0.107	33%	0.326	C	S	.	.	H	α-helix	trans	-60.2	-46.6	176.9	-80.1	-8.9	0	0	0	111.3	I356 D357 N362 L363 E364 L372 I373	I356-N360 WeakPolarHBondContact O-CB 3.46Å; I356-N360 PolarHBondContact O-N 2.67Å; D357-N360 PolarHBondContact O-N 3.23Å; N360-N362 VanDerWaalsContact C-N 3.32Å; N360-N362 PolarHBondContact O-N 2.87Å; N360-L363 WeakPolarHBondContact O-CB 3.27Å; N360-L363 PolarHBondContact O-N 3.3Å; N360-L363 VanDerWaalsContact O-N 3.08Å; N360-E364 WeakPolarHBondContact O-CG 3.27Å; N360-E364 PolarHBondContact O-N 3.5Å; N360-L372 HydrophobicContact CB-CD2 4.14Å; N360-I373 PolarHBondContact ND2-O 3.43Å; N360-I373 VanDerWaalsContact OD1-CB 3.26Å; N360-I373 WeakPolarHBondContact OD1-CB 3.49Å; N360-I373 WeakPolarHBondContact OD1-CG1 3.3Å; N360-I373 PolarHBondContact OD1-N 3.1Å
361	R	85.6	Confident	80.9	Confident	124 Å²	124	57.9 Å²	57.9	47%	0.468	31%	0.309	S	S	.	.	H	α-helix	trans	-56.3	-45.5	173.3	-72.9	-170.1	-47.6	-102.8	-2.8	112.3	D357 T358 L363 E364 E365	D357-R361 VanDerWaalsContact O-CG 3.32Å; D357-R361 WeakPolarHBondContact O-CG 3.49Å; D357-R361 PolarHBondContact O-N 3.33Å; T358-R361 PolarHBondContact OG1-NH2 3.3Å; R361-L363 VanDerWaalsContact C-N 3.26Å; R361-L363 PolarHBondContact O-N 3.02Å; R361-E364 PolarHBondContact O-N 3.25Å; R361-E365 WeakPolarHBondContact O-CG 3.21Å; R361-E365 PolarHBondContact O-N 3.18Å
362	N	80.8	Confident	80.4	Confident	58 Å²	58	55.4 Å²	55.4	31%	0.31	30%	0.301	S	S	.	.	H	α-helix	trans	-63.7	-31.9	178.7	-65.5	-14.3	0	0	0	112.4	T358 I359 N360 A366 L392	T358-N362 PolarHBondContact O-N 3.46Å; T358-N362 VanDerWaalsContact O-N 3.09Å; T358-N362 PolarHBondContact O-ND2 2.85Å; T358-N362 PolarHBondContact O-OD1 2.99Å; I359-N362 PolarHBondContact O-N 3.47Å; N360-N362 VanDerWaalsContact C-N 3.32Å; N360-N362 PolarHBondContact O-N 2.87Å; N362-A366 WeakPolarHBondContact O-CB 3.31Å; N362-A366 PolarHBondContact O-N 3.15Å; N362-L392 HydrophobicContact CB-CD2 4.19Å
363	L	79.1	Confident	79.9	Confident	11 Å²	11	55.3 Å²	55.3	6%	0.058	30%	0.301	C	S	.	.	H	α-helix	trans	-75.6	-37.9	176.6	-71.8	171	0	0	0	112.4	I359 N360 R361 A366 G367 G368 T371 L372 L392	I359-L363 HydrophobicContact CG2-CD1 3.86Å; I359-L363 HydrophobicContact CG2-CG 4.26Å; I359-L363 VanDerWaalsContact O-CG 3.3Å; I359-L363 WeakPolarHBondContact O-CG 3.38Å; I359-L363 PolarHBondContact O-N 3.2Å; N360-L363 WeakPolarHBondContact O-CB 3.27Å; N360-L363 PolarHBondContact O-N 3.3Å; N360-L363 VanDerWaalsContact O-N 3.08Å; R361-L363 VanDerWaalsContact C-N 3.26Å; R361-L363 PolarHBondContact O-N 3.02Å; L363-A366 CarbonylContact O-C 3.56Å; L363-A366 PolarHBondContact O-N 2.86Å; L363-G367 PolarHBondContact O-N 2.88Å; L363-G368 PolarHBondContact O-N 3.48Å; L363-G368 VanDerWaalsContact O-N 3.16Å; L363-T371 WeakPolarHBondContact CD1-O 3.21Å; L363-L372 HydrophobicContact CB-CD2 3.99Å; L363-L392 HydrophobicContact CD2-CD1 3.96Å; L363-L392 HydrophobicContact CG-CD1 4.43Å
364	E	82.7	Confident	79.3	Confident	98 Å²	98	55.5 Å²	55.5	46%	0.458	30%	0.304	S	S	.	.	H	α-helix	trans	-62.1	-46.7	172.7	-68.9	174.4	174.2	0	0	110.5	N360 R361 A366 G367 L372	N360-E364 WeakPolarHBondContact O-CG 3.27Å; N360-E364 PolarHBondContact O-N 3.5Å; R361-E364 PolarHBondContact O-N 3.25Å; E364-A366 PolarHBondContact O-N 2.88Å; E364-G367 WeakPolarHBondContact O-CA 3.3Å; E364-G367 PolarHBondContact O-N 3.33Å; E364-L372 HydrophobicContact CG-CD1 4.23Å; E364-L372 HydrophobicContact CG-CD2 3.59Å
365	E	79.1	Confident	78.7	Confident	162 Å²	162	56.6 Å²	56.6	76%	0.757	32%	0.318	S	S	*	.	H	α-helix	trans	-61.9	-30.1	175.7	-72.3	178.8	-171.7	0	0	112.8	R361 G367	R361-E365 WeakPolarHBondContact O-CG 3.21Å; R361-E365 PolarHBondContact O-N 3.18Å; E365-G367 PolarHBondContact O-N 3.41Å
366	A	72.4	Confident	78.3	Confident	69 Å²	69	56.9 Å²	56.9	57%	0.57	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	2	173.9	0	0	0	0	0	113.9	N362 L363 E364	N362-A366 WeakPolarHBondContact O-CB 3.31Å; N362-A366 PolarHBondContact O-N 3.15Å; L363-A366 CarbonylContact O-C 3.56Å; L363-A366 PolarHBondContact O-N 2.86Å; E364-A366 PolarHBondContact O-N 2.88Å
367	G	65.5	Low	77.9	Confident	69 Å²	69	59.6 Å²	59.6	71%	0.711	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	30.3	172.7	0	0	0	0	0	115.2	L363 E364 E365	L363-G367 PolarHBondContact O-N 2.88Å; E364-G367 WeakPolarHBondContact O-CA 3.3Å; E364-G367 PolarHBondContact O-N 3.33Å; E365-G367 PolarHBondContact O-N 3.41Å
368	G	63.2	Low	77.4	Confident	18 Å²	18	58 Å²	58	19%	0.186	33%	0.33	C	S	.	.			trans	-129.5	66	-171.2	0	0	0	0	0	116.4	L363 K370 T371	L363-G368 PolarHBondContact O-N 3.48Å; L363-G368 VanDerWaalsContact O-N 3.16Å; G368-K370 PolarHBondContact O-N 2.98Å; G368-K370 VanDerWaalsContact O-N 3.12Å; G368-T371 PolarHBondContact O-N 3.24Å; G368-T371 PolarHBondContact O-OG1 3.1Å
369	D	62.1	Low	77	Confident	114 Å²	114	59.4 Å²	59.4	61%	0.61	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-56.3	-30	177.6	-58.3	-9	0	0	0	113.7	T371 L372	D369-T371 PolarHBondContact O-N 2.98Å; D369-T371 VanDerWaalsContact O-N 3.17Å; D369-L372 WeakPolarHBondContact O-CG 3.25Å
370	K	62.1	Low	76.8	Confident	194 Å²	194	61.6 Å²	61.6	84%	0.843	36%	0.358	S	S	*	.	G	3₁₀ helix	trans	-73.2	-3	179	-66	-174.8	-179.7	179.5	0	114	G368 T376	G368-K370 PolarHBondContact O-N 2.98Å; G368-K370 VanDerWaalsContact O-N 3.12Å; K370-T376 PolarHBondContact O-OG1 3.41Å
371	T	71.2	Confident	76.3	Confident	23 Å²	23	60.8 Å²	60.8	14%	0.141	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-114.8	5.6	-172.6	65.6	0	0	0	0	113.4	L363 G368 D369 T376 F384	L363-T371 WeakPolarHBondContact CD1-O 3.21Å; G368-T371 PolarHBondContact O-N 3.24Å; G368-T371 PolarHBondContact O-OG1 3.1Å; D369-T371 PolarHBondContact O-N 2.98Å; D369-T371 VanDerWaalsContact O-N 3.17Å; T371-T376 WeakPolarHBondContact CA-OG1 3.08Å; T371-T376 PolarHBondContact O-OG1 2.93Å; T371-F384 HydrophobicContact CG2-CD2 4.41Å; T371-F384 HydrophobicContact CG2-CE1 4.24Å; T371-F384 HydrophobicContact CG2-CE2 3.44Å; T371-F384 VanDerWaalsContact CG2-CE2 3.44Å; T371-F384 HydrophobicContact CG2-CZ 3.35Å
372	L	80.2	Confident	75.9	Confident	25 Å²	25	58.5 Å²	58.5	13%	0.131	35%	0.348	C	S	.	.			trans	-63.9	141.6	-179.4	-56.3	177.2	0	0	0	111.7	N360 L363 E364 D369 G374 S375 T376	N360-L372 HydrophobicContact CB-CD2 4.14Å; L363-L372 HydrophobicContact CB-CD2 3.99Å; E364-L372 HydrophobicContact CG-CD1 4.23Å; E364-L372 HydrophobicContact CG-CD2 3.59Å; D369-L372 WeakPolarHBondContact O-CG 3.25Å; L372-G374 PolarHBondContact O-N 2.87Å; L372-S375 PolarHBondContact O-N 3.4Å; L372-T376 PolarHBondContact N-OG1 3.35Å; L372-T376 VanDerWaalsContact O-CB 3.28Å; L372-T376 WeakPolarHBondContact O-CB 3.38Å; L372-T376 PolarHBondContact O-N 2.91Å; L372-T376 PolarHBondContact O-OG1 2.98Å
373	I	79.8	Confident	75.6	Confident	5 Å²	5	61.7 Å²	61.7	3%	0.026	36%	0.361	C	S	.	.	B	Isolated β-bridge	trans	-63.2	124.9	172	-60.5	175.1	0	0	0	107.9	I356 I359 N360 L381 L395 L398 L402 V412	I356-I373 HydrophobicContact CG1-CG2 4.31Å; I356-I373 HydrophobicContact CG2-CB 4.13Å; I356-I373 HydrophobicContact CG2-CG2 3.91Å; I359-I373 HydrophobicContact CB-CD1 3.94Å; I359-I373 HydrophobicContact CD1-CD1 4.34Å; I359-I373 HydrophobicContact CG2-CD1 3.62Å; I359-I373 HydrophobicContact CG2-CG1 4.43Å; N360-I373 PolarHBondContact ND2-O 3.43Å; N360-I373 VanDerWaalsContact OD1-CB 3.26Å; N360-I373 WeakPolarHBondContact OD1-CB 3.49Å; N360-I373 WeakPolarHBondContact OD1-CG1 3.3Å; N360-I373 PolarHBondContact OD1-N 3.1Å; I373-L381 HydrophobicContact CG1-CD1 4.14Å; I373-L381 HydrophobicContact CG1-CD2 4.05Å; I373-L395 HydrophobicContact CD1-CD1 4.25Å; I373-L398 HydrophobicContact CD1-CD2 3.76Å; I373-L402 HydrophobicContact CG2-CD1 3.6Å; I373-V412 HydrophobicContact CG2-CG2 3.8Å
374	G	81.2	Confident	75.3	Confident	10 Å²	10	63.4 Å²	63.4	10%	0.103	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	107.7	-38.6	-173.9	0	0	0	0	0	112.9	L372 Q408 G409	L372-G374 PolarHBondContact O-N 2.87Å; G374-Q408 CarbonylContact O-C 3.6Å; G374-G409 WeakPolarHBondContact O-CA 3.34Å; G374-G409 PolarHBondContact O-N 2.9Å
375	S	79.5	Confident	74.7	Confident	102 Å²	102	59.3 Å²	59.3	71%	0.713	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-17.9	175.7	-52.5	0	0	0	0	113	L372	L372-S375 PolarHBondContact O-N 3.4Å
376	T	80.1	Confident	74.2	Confident	11 Å²	11	56.2 Å²	56.2	7%	0.067	35%	0.346	C	S	.	.	B	Isolated β-bridge	trans	-107.6	146.7	-173.1	-52.3	0	0	0	0	111.7	K370 T371 L372 T380 L381	K370-T376 PolarHBondContact O-OG1 3.41Å; T371-T376 WeakPolarHBondContact CA-OG1 3.08Å; T371-T376 PolarHBondContact O-OG1 2.93Å; L372-T376 PolarHBondContact N-OG1 3.35Å; L372-T376 VanDerWaalsContact O-CB 3.28Å; L372-T376 WeakPolarHBondContact O-CB 3.38Å; L372-T376 PolarHBondContact O-N 2.91Å; L372-T376 PolarHBondContact O-OG1 2.98Å; T376-T380 HydrophobicContact CG2-CG2 3.45Å; T376-T380 VanDerWaalsContact CG2-CG2 3.45Å; T376-L381 HydrophobicContact CG2-CD2 4.21Å; T376-L381 HydrophobicContact CG2-CG 4.13Å
377	S	80.5	Confident	73.8	Confident	58 Å²	58	59.7 Å²	59.7	41%	0.406	36%	0.355	S	S	.	.			trans	-67.9	148.7	175.4	85.4	0	0	0	0	112	A379 T380 L381	S377-A379 VanDerWaalsContact C-N 3.25Å; S377-A379 PolarHBondContact O-N 3.42Å; S377-T380 WeakPolarHBondContact O-CB 3.46Å; S377-T380 PolarHBondContact O-N 3.16Å; S377-T380 VanDerWaalsContact O-N 3.13Å; S377-T380 PolarHBondContact OG-N 3.42Å; S377-T380 PolarHBondContact OG-OG1 3.4Å; S377-L381 PolarHBondContact O-N 3.16Å
378	L	81.8	Confident	73.7	Confident	21 Å²	21	60.7 Å²	60.7	11%	0.11	34%	0.339	C	S	.	.	H	α-helix	trans	-57	-38.7	177.4	-171.7	77.2	0	0	0	112.5	T380 L381 Q382 L399 L402 D403	L378-T380 VanDerWaalsContact C-N 3.32Å; L378-T380 PolarHBondContact O-N 2.97Å; L378-L381 PolarHBondContact O-N 3.02Å; L378-Q382 HydrophobicContact CG-CG 4.47Å; L378-Q382 WeakPolarHBondContact O-CB 3.28Å; L378-Q382 VanDerWaalsContact O-CG 3.3Å; L378-Q382 WeakPolarHBondContact O-CG 3.32Å; L378-Q382 PolarHBondContact O-N 2.96Å; L378-L399 HydrophobicContact CD1-CD2 3.52Å; L378-L402 HydrophobicContact CD1-CB 4.16Å; L378-D403 HydrophobicContact CD2-CB 3.76Å; L378-D403 WeakPolarHBondContact CD2-OD1 3.2Å
379	A	78.2	Confident	73.4	Confident	54 Å²	54	62.2 Å²	62.2	45%	0.446	34%	0.34	S	S	.	.	H	α-helix	trans	-62	-41.4	179.1	0	0	0	0	0	111.7	S377 Q382 Q383	S377-A379 VanDerWaalsContact C-N 3.25Å; S377-A379 PolarHBondContact O-N 3.42Å; A379-Q382 PolarHBondContact O-N 2.89Å; A379-Q383 WeakPolarHBondContact O-CG 3.47Å; A379-Q383 PolarHBondContact O-N 3.41Å
380	T	79.1	Confident	73.2	Confident	48 Å²	48	65 Å²	65	29%	0.294	35%	0.35	S	S	.	.	H	α-helix	trans	-65.9	-43.2	175.2	-55.5	0	0	0	0	110.7	T376 S377 L378 Q382 Q383 F384	T376-T380 HydrophobicContact CG2-CG2 3.45Å; T376-T380 VanDerWaalsContact CG2-CG2 3.45Å; S377-T380 WeakPolarHBondContact O-CB 3.46Å; S377-T380 PolarHBondContact O-N 3.16Å; S377-T380 VanDerWaalsContact O-N 3.13Å; S377-T380 PolarHBondContact OG-N 3.42Å; S377-T380 PolarHBondContact OG-OG1 3.4Å; L378-T380 VanDerWaalsContact C-N 3.32Å; L378-T380 PolarHBondContact O-N 2.97Å; T380-Q382 VanDerWaalsContact C-N 3.33Å; T380-Q382 PolarHBondContact O-N 2.79Å; T380-Q383 WeakPolarHBondContact O-CB 3.44Å; T380-Q383 PolarHBondContact O-N 3.47Å; T380-F384 HydrophobicContact CG2-CD2 3.77Å; T380-F384 HydrophobicContact CG2-CE2 3.44Å; T380-F384 VanDerWaalsContact CG2-CE2 3.44Å; T380-F384 WeakPolarHBondContact O-CD2 3.34Å; T380-F384 PolarHBondContact O-N 2.8Å
381	L	78.7	Confident	73.1	Confident	2 Å²	2	63.9 Å²	63.9	1%	0.01	34%	0.341	C	S	.	.	H	α-helix	trans	-63.1	-36.5	175.5	-65.8	171.7	0	0	0	112.6	I373 T376 S377 L378 F384 S385 L399	I373-L381 HydrophobicContact CG1-CD1 4.14Å; I373-L381 HydrophobicContact CG1-CD2 4.05Å; T376-L381 HydrophobicContact CG2-CD2 4.21Å; T376-L381 HydrophobicContact CG2-CG 4.13Å; S377-L381 PolarHBondContact O-N 3.16Å; L378-L381 PolarHBondContact O-N 3.02Å; L381-F384 PolarHBondContact O-N 3.44Å; L381-S385 WeakPolarHBondContact O-CB 3.42Å; L381-S385 PolarHBondContact O-N 3.38Å; L381-L399 HydrophobicContact CB-CD2 3.79Å; L381-L399 HydrophobicContact CD1-CD2 4.4Å
382	Q	77.4	Confident	72.9	Confident	76 Å²	76	63.4 Å²	63.4	36%	0.355	34%	0.337	S	S	.	.	H	α-helix	trans	-65.2	-40.8	173.9	-75.4	171.1	-21.1	0	0	112.1	L378 A379 T380 F384 S385 S386 L399	L378-Q382 HydrophobicContact CG-CG 4.47Å; L378-Q382 WeakPolarHBondContact O-CB 3.28Å; L378-Q382 VanDerWaalsContact O-CG 3.3Å; L378-Q382 WeakPolarHBondContact O-CG 3.32Å; L378-Q382 PolarHBondContact O-N 2.96Å; A379-Q382 PolarHBondContact O-N 2.89Å; T380-Q382 VanDerWaalsContact C-N 3.33Å; T380-Q382 PolarHBondContact O-N 2.79Å; Q382-F384 VanDerWaalsContact C-N 3.35Å; Q382-S385 WeakPolarHBondContact O-CB 3.32Å; Q382-S385 PolarHBondContact O-N 2.93Å; Q382-S386 PolarHBondContact O-N 3.1Å; Q382-S386 VanDerWaalsContact O-N 3.07Å; Q382-S386 PolarHBondContact O-OG 3.31Å; Q382-L399 HydrophobicContact CG-CD1 4Å
383	Q	74.3	Confident	72.2	Confident	125 Å²	125	65.2 Å²	65.2	58%	0.584	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-43.2	172.5	-72	176.2	-4.5	0	0	111.1	A379 T380 S385 S386 L387	A379-Q383 WeakPolarHBondContact O-CG 3.47Å; A379-Q383 PolarHBondContact O-N 3.41Å; T380-Q383 WeakPolarHBondContact O-CB 3.44Å; T380-Q383 PolarHBondContact O-N 3.47Å; Q383-S385 VanDerWaalsContact C-N 3.35Å; Q383-S385 PolarHBondContact O-N 2.7Å; Q383-S386 WeakPolarHBondContact O-CB 3.32Å; Q383-S386 PolarHBondContact O-N 3.28Å; Q383-S386 VanDerWaalsContact O-N 3.15Å; Q383-L387 WeakPolarHBondContact O-CG 3.27Å; Q383-L387 PolarHBondContact O-N 2.95Å
384	F	71.9	Confident	72	Confident	48 Å²	48	65.2 Å²	65.2	21%	0.211	35%	0.351	C	S	.	.	H	α-helix	trans	-61.8	-41.5	175	-81.6	-64.6	0	0	0	112.7	T371 T380 L381 Q382 S386 L387 K388	T371-F384 HydrophobicContact CG2-CD2 4.41Å; T371-F384 HydrophobicContact CG2-CE1 4.24Å; T371-F384 HydrophobicContact CG2-CE2 3.44Å; T371-F384 VanDerWaalsContact CG2-CE2 3.44Å; T371-F384 HydrophobicContact CG2-CZ 3.35Å; T380-F384 HydrophobicContact CG2-CD2 3.77Å; T380-F384 HydrophobicContact CG2-CE2 3.44Å; T380-F384 VanDerWaalsContact CG2-CE2 3.44Å; T380-F384 WeakPolarHBondContact O-CD2 3.34Å; T380-F384 PolarHBondContact O-N 2.8Å; L381-F384 PolarHBondContact O-N 3.44Å; Q382-F384 VanDerWaalsContact C-N 3.35Å; F384-S386 PolarHBondContact O-N 3.21Å; F384-L387 PolarHBondContact O-N 2.94Å; F384-K388 HydrophobicContact CD1-CD 4.5Å; F384-K388 PolarHBondContact O-N 2.76Å
385	S	71.5	Confident	71.9	Confident	11 Å²	11	64.8 Å²	64.8	8%	0.077	35%	0.346	C	S	.	.	H	α-helix	trans	-58.3	-37.9	174.3	-177.8	0	0	0	0	112	L381 Q382 Q383 Y389 P396	L381-S385 WeakPolarHBondContact O-CB 3.42Å; L381-S385 PolarHBondContact O-N 3.38Å; Q382-S385 WeakPolarHBondContact O-CB 3.32Å; Q382-S385 PolarHBondContact O-N 2.93Å; Q383-S385 VanDerWaalsContact C-N 3.35Å; Q383-S385 PolarHBondContact O-N 2.7Å; S385-Y389 WeakPolarHBondContact O-CB 3.17Å; S385-Y389 PolarHBondContact O-N 3.12Å; S385-P396 WeakPolarHBondContact OG-CG 3.09Å
386	S	68.5	Low	71.9	Confident	97 Å²	97	60.7 Å²	60.7	68%	0.678	32%	0.317	S	S	*	.	H	α-helix	trans	-73.1	-39.2	178.5	-55.7	0	0	0	0	112.8	Q382 Q383 F384	Q382-S386 PolarHBondContact O-N 3.1Å; Q382-S386 VanDerWaalsContact O-N 3.07Å; Q382-S386 PolarHBondContact O-OG 3.31Å; Q383-S386 WeakPolarHBondContact O-CB 3.32Å; Q383-S386 PolarHBondContact O-N 3.28Å; Q383-S386 VanDerWaalsContact O-N 3.15Å; F384-S386 PolarHBondContact O-N 3.21Å
387	L	63.7	Low	71.9	Confident	142 Å²	142	60.3 Å²	60.3	74%	0.743	32%	0.315	S	S	*	.	H	α-helix	trans	-85.1	-31.8	-173.9	-66.4	172.2	0	0	0	113.8	Q383 F384	Q383-L387 WeakPolarHBondContact O-CG 3.27Å; Q383-L387 PolarHBondContact O-N 2.95Å; F384-L387 PolarHBondContact O-N 2.94Å
388	K	62.3	Low	72.3	Confident	90 Å²	90	57.9 Å²	57.9	39%	0.391	30%	0.297	S	S	.	.	S	Bend	trans	-120.5	25.8	-173.2	-67.2	-170.7	178.7	-177.6	0	113.4	F384 Q390 Y391	F384-K388 HydrophobicContact CD1-CD 4.5Å; F384-K388 PolarHBondContact O-N 2.76Å; K388-Q390 PolarHBondContact O-N 3.33Å; K388-Y391 HydrophobicContact CB-CD2 4.23Å; K388-Y391 PolarHBondContact O-N 3.49Å
389	Y	58.1	Low	72.5	Confident	51 Å²	51	57.2 Å²	57.2	20%	0.2	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-48.9	-31.6	-176	-161.3	-83.8	0	0	0	114.2	S385 Y391 L392 P396	S385-Y389 WeakPolarHBondContact O-CB 3.17Å; S385-Y389 PolarHBondContact O-N 3.12Å; Y389-Y391 PolarHBondContact O-N 2.98Å; Y389-L392 PolarHBondContact O-N 3.42Å; Y389-P396 HydrophobicContact CD2-CG 4.18Å; Y389-P396 HydrophobicContact CE2-CG 3.43Å; Y389-P396 VanDerWaalsContact CE2-CG 3.43Å
390	Q	57.1	Low	72.8	Confident	173 Å²	173	54.8 Å²	54.8	81%	0.808	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	-23.2	179.3	-65.3	-174.9	4.2	0	0	113.9	K388	K388-Q390 PolarHBondContact O-N 3.33Å
391	Y	60.5	Low	73.4	Confident	170 Å²	170	52.8 Å²	52.8	67%	0.667	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.2	-20	-177	-58.3	-77.1	0	0	0	113.3	K388 Y389	K388-Y391 HydrophobicContact CB-CD2 4.23Å; K388-Y391 PolarHBondContact O-N 3.49Å; Y389-Y391 PolarHBondContact O-N 2.98Å
392	L	67.4	Low	73.9	Confident	12 Å²	12	52.7 Å²	52.7	6%	0.063	26%	0.261	C	S	.	.			trans	-135.4	70.3	-174.3	-62	175.7	0	0	0	111.2	I359 N362 L363 Y389 T394 L395	I359-L392 HydrophobicContact CG1-CD2 4.33Å; I359-L392 HydrophobicContact CG2-CD1 4.19Å; I359-L392 HydrophobicContact CG2-CD2 4.04Å; N362-L392 HydrophobicContact CB-CD2 4.19Å; L363-L392 HydrophobicContact CD2-CD1 3.96Å; L363-L392 HydrophobicContact CG-CD1 4.43Å; Y389-L392 PolarHBondContact O-N 3.42Å; L392-T394 PolarHBondContact O-N 2.86Å; L392-L395 HydrophobicContact CB-CB 3.97Å; L392-L395 HydrophobicContact CB-CD2 4.35Å; L392-L395 HydrophobicContact CD1-CD2 3.98Å; L392-L395 PolarHBondContact O-N 3.02Å
393	P	65.3	Low	74.3	Confident	64 Å²	64	49.6 Å²	49.6	42%	0.416	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-22.8	-173.9	27	-34.8	0	0	0	113.9
394	T	75.6	Confident	74.7	Confident	4 Å²	4	43.6 Å²	43.6	3%	0.025	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-20.6	-175.8	54.4	0	0	0	0	113.5	S216 L218 E355 L392 P396 V397 L398	S216-T394 VanDerWaalsContact O-CG2 3.24Å; S216-T394 WeakPolarHBondContact O-CG2 3.36Å; L218-T394 HydrophobicContact CB-CG2 3.93Å; L218-T394 HydrophobicContact CD1-CG2 4.24Å; L218-T394 HydrophobicContact CG-CG2 4.24Å; E355-T394 WeakPolarHBondContact OE1-CB 3.48Å; E355-T394 WeakPolarHBondContact OE1-CG2 3.26Å; E355-T394 PolarHBondContact OE1-OG1 3.12Å; L392-T394 PolarHBondContact O-N 2.86Å; T394-P396 VanDerWaalsContact C-CD 3.42Å; T394-V397 PolarHBondContact O-N 2.9Å; T394-V397 VanDerWaalsContact O-N 3.09Å; T394-L398 PolarHBondContact O-N 3.41Å; T394-L398 VanDerWaalsContact O-N 3.13Å
395	L	78.6	Confident	75.3	Confident	2 Å²	2	42 Å²	42	1%	0.01	21%	0.212	C	C	.	.	H	α-helix	trans	-52.7	-44.2	-176.3	-179.6	62.4	0	0	0	113.1	I359 I373 L392 V397 L398 L399	I359-L395 HydrophobicContact CD1-CB 4.26Å; I359-L395 HydrophobicContact CD1-CD1 4.18Å; I373-L395 HydrophobicContact CD1-CD1 4.25Å; L392-L395 HydrophobicContact CB-CB 3.97Å; L392-L395 HydrophobicContact CB-CD2 4.35Å; L392-L395 HydrophobicContact CD1-CD2 3.98Å; L392-L395 PolarHBondContact O-N 3.02Å; L395-V397 VanDerWaalsContact C-N 3.29Å; L395-V397 PolarHBondContact O-N 3.49Å; L395-L398 PolarHBondContact O-N 2.71Å; L395-L399 HydrophobicContact CD1-CD1 4.34Å; L395-L399 HydrophobicContact CD1-CD2 4.27Å; L395-L399 HydrophobicContact CD1-CG 3.99Å; L395-L399 HydrophobicContact CG-CD1 4Å; L395-L399 HydrophobicContact CG-CG 4.15Å; L395-L399 WeakPolarHBondContact O-CB 3.42Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 2.84Å
396	P	79.2	Confident	75.8	Confident	15 Å²	15	49.4 Å²	49.4	10%	0.097	24%	0.243	C	C	.	.	H	α-helix	trans	-56.2	-39	178.6	-21.3	28.1	0	0	0	114.2	Y275 S385 Y389 T394 L399	Y275-P396 VanDerWaalsContact CZ-O 3.28Å; Y275-P396 PolarHBondContact OH-O 2.92Å; S385-P396 WeakPolarHBondContact OG-CG 3.09Å; Y389-P396 HydrophobicContact CD2-CG 4.18Å; Y389-P396 HydrophobicContact CE2-CG 3.43Å; Y389-P396 VanDerWaalsContact CE2-CG 3.43Å; T394-P396 VanDerWaalsContact C-CD 3.42Å; P396-L399 PolarHBondContact O-N 3.45Å
397	V	81.1	Confident	76.6	Confident	4 Å²	4	47.4 Å²	47.4	2%	0.024	23%	0.225	C	C	.	.	H	α-helix	trans	-79.9	-37.1	-179.4	-171.6	0	0	0	0	110.9	L218 Y271 T394 L395 L399 A400 F401 T461	L218-V397 HydrophobicContact CD1-CB 3.4Å; L218-V397 VanDerWaalsContact CD1-CB 3.4Å; L218-V397 HydrophobicContact CD1-CG1 4.16Å; L218-V397 HydrophobicContact CD1-CG2 3.27Å; L218-V397 HydrophobicContact CD2-CB 3.59Å; L218-V397 HydrophobicContact CD2-CG1 3.41Å; L218-V397 VanDerWaalsContact CD2-CG1 3.41Å; L218-V397 HydrophobicContact CD2-CG2 4.14Å; L218-V397 HydrophobicContact CG-CB 3.92Å; L218-V397 HydrophobicContact CG-CG1 4.3Å; L218-V397 HydrophobicContact CG-CG2 4.27Å; Y271-V397 HydrophobicContact CD1-CG2 3.84Å; Y271-V397 HydrophobicContact CE1-CG2 4.1Å; Y271-V397 HydrophobicContact CG-CG2 4.18Å; T394-V397 PolarHBondContact O-N 2.9Å; T394-V397 VanDerWaalsContact O-N 3.09Å; L395-V397 VanDerWaalsContact C-N 3.29Å; L395-V397 PolarHBondContact O-N 3.49Å; V397-L399 PolarHBondContact O-N 2.87Å; V397-A400 PolarHBondContact O-N 3.23Å; V397-A400 VanDerWaalsContact O-N 3.12Å; V397-F401 HydrophobicContact CG1-CE2 4.2Å; V397-F401 VanDerWaalsContact O-CD2 3.29Å; V397-F401 WeakPolarHBondContact O-CD2 3.5Å; V397-T461 HydrophobicContact CG1-CG2 3.85Å
398	L	87.4	Confident	77.9	Confident	6 Å²	6	40.9 Å²	40.9	3%	0.031	19%	0.19	C	C	.	.	H	α-helix	trans	-58	-38.8	170.8	-179.1	63.1	0	0	0	111	I352 E355 I356 I359 I373 T394 L395 A400 F401 L402	I352-L398 HydrophobicContact CG2-CD1 3.78Å; E355-L398 HydrophobicContact CG-CD2 4.29Å; I356-L398 HydrophobicContact CG1-CD1 4Å; I356-L398 HydrophobicContact CG1-CD2 3.82Å; I356-L398 HydrophobicContact CG1-CG 4.44Å; I359-L398 HydrophobicContact CD1-CD2 3.56Å; I373-L398 HydrophobicContact CD1-CD2 3.76Å; T394-L398 PolarHBondContact O-N 3.41Å; T394-L398 VanDerWaalsContact O-N 3.13Å; L395-L398 PolarHBondContact O-N 2.71Å; L398-A400 VanDerWaalsContact C-N 3.26Å; L398-A400 PolarHBondContact O-N 3Å; L398-F401 WeakPolarHBondContact O-CB 3.02Å; L398-F401 PolarHBondContact O-N 3.01Å; L398-L402 HydrophobicContact CD1-CD1 4.47Å; L398-L402 HydrophobicContact CD1-CG 4.37Å; L398-L402 HydrophobicContact CD2-CD1 4.19Å; L398-L402 HydrophobicContact CG-CD1 3.88Å; L398-L402 HydrophobicContact CG-CG 4.19Å; L398-L402 WeakPolarHBondContact O-CG 3.3Å; L398-L402 PolarHBondContact O-N 3.48Å
399	L	86.5	Confident	79.1	Confident	7 Å²	7	36.9 Å²	36.9	4%	0.037	18%	0.175	C	C	.	.	H	α-helix	trans	-59.7	-31.4	177	-73.3	171.9	0	0	0	112.7	L378 L381 Q382 L395 P396 V397 F401 L402 D403	L378-L399 HydrophobicContact CD1-CD2 3.52Å; L381-L399 HydrophobicContact CB-CD2 3.79Å; L381-L399 HydrophobicContact CD1-CD2 4.4Å; Q382-L399 HydrophobicContact CG-CD1 4Å; L395-L399 HydrophobicContact CD1-CD1 4.34Å; L395-L399 HydrophobicContact CD1-CD2 4.27Å; L395-L399 HydrophobicContact CD1-CG 3.99Å; L395-L399 HydrophobicContact CG-CD1 4Å; L395-L399 HydrophobicContact CG-CG 4.15Å; L395-L399 WeakPolarHBondContact O-CB 3.42Å; L395-L399 WeakPolarHBondContact O-CG 3.47Å; L395-L399 PolarHBondContact O-N 2.84Å; P396-L399 PolarHBondContact O-N 3.45Å; V397-L399 PolarHBondContact O-N 2.87Å; L399-F401 VanDerWaalsContact C-N 3.31Å; L399-F401 PolarHBondContact O-N 3.14Å; L399-L402 PolarHBondContact O-N 2.88Å; L399-D403 WeakPolarHBondContact O-CA 3.29Å; L399-D403 WeakPolarHBondContact O-CB 3.29Å; L399-D403 PolarHBondContact O-N 3.28Å
400	A	85.7	Confident	80.8	Confident	4 Å²	4	34.5 Å²	34.5	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-64.1	-35.9	171.9	0	0	0	0	0	113.3	Y275 V397 L398 H453 T457	Y275-A400 HydrophobicContact CE1-CB 3.88Å; Y275-A400 WeakPolarHBondContact OH-CB 3.49Å; V397-A400 PolarHBondContact O-N 3.23Å; V397-A400 VanDerWaalsContact O-N 3.12Å; L398-A400 VanDerWaalsContact C-N 3.26Å; L398-A400 PolarHBondContact O-N 3Å; A400-H453 PolarHBondContact O-NE2 3.26Å; A400-T457 HydrophobicContact CB-CG2 3.73Å
401	F	90.2	Very high	82.5	Confident	5 Å²	5	26.3 Å²	26.3	2%	0.022	13%	0.127	C	C	.	.	H	α-helix	trans	-70.9	-37	176.4	-67.7	-83.4	0	0	0	111.1	L222 I348 I352 V397 L398 L399 H453 L454 T457	L222-F401 HydrophobicContact CD2-CZ 4.25Å; I348-F401 HydrophobicContact CG2-CE1 4.37Å; I352-F401 HydrophobicContact CD1-CB 4.07Å; I352-F401 HydrophobicContact CD1-CD1 3.31Å; I352-F401 HydrophobicContact CD1-CD2 4.37Å; I352-F401 HydrophobicContact CD1-CE1 3.74Å; I352-F401 HydrophobicContact CD1-CG 3.67Å; I352-F401 HydrophobicContact CD1-CZ 4.43Å; I352-F401 HydrophobicContact CG1-CD1 4.19Å; I352-F401 HydrophobicContact CG1-CD2 4.42Å; I352-F401 HydrophobicContact CG1-CE1 4.49Å; I352-F401 HydrophobicContact CG1-CG 4.15Å; V397-F401 HydrophobicContact CG1-CE2 4.2Å; V397-F401 VanDerWaalsContact O-CD2 3.29Å; V397-F401 WeakPolarHBondContact O-CD2 3.5Å; L398-F401 WeakPolarHBondContact O-CB 3.02Å; L398-F401 PolarHBondContact O-N 3.01Å; L399-F401 VanDerWaalsContact C-N 3.31Å; L399-F401 PolarHBondContact O-N 3.14Å; F401-H453 PolarHBondContact O-CD2 3.28Å; F401-H453 PolarHBondContact O-NE2 3.45Å; F401-L454 HydrophobicContact CB-CD2 4.25Å; F401-L454 HydrophobicContact CD1-CD2 4.03Å; F401-T457 HydrophobicContact CD1-CG2 3.56Å; F401-T457 HydrophobicContact CD2-CG2 4.04Å; F401-T457 HydrophobicContact CE1-CG2 3.65Å; F401-T457 HydrophobicContact CE2-CG2 4.1Å; F401-T457 HydrophobicContact CG-CG2 3.78Å; F401-T457 HydrophobicContact CZ-CG2 3.92Å
402	L	90.3	Very high	84	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-81.1	-22.1	-179.6	-62.3	-179.8	0	0	0	114.1	I356 I373 L378 L398 L399 F404 Q408 L411 V412 L415	I356-L402 HydrophobicContact CD1-CD2 4.1Å; I373-L402 HydrophobicContact CG2-CD1 3.6Å; L378-L402 HydrophobicContact CD1-CB 4.16Å; L398-L402 HydrophobicContact CD1-CD1 4.47Å; L398-L402 HydrophobicContact CD1-CG 4.37Å; L398-L402 HydrophobicContact CD2-CD1 4.19Å; L398-L402 HydrophobicContact CG-CD1 3.88Å; L398-L402 HydrophobicContact CG-CG 4.19Å; L398-L402 WeakPolarHBondContact O-CG 3.3Å; L398-L402 PolarHBondContact O-N 3.48Å; L399-L402 PolarHBondContact O-N 2.88Å; L402-F404 PolarHBondContact O-N 3.16Å; L402-Q408 PolarHBondContact O-NE2 2.83Å; L402-L411 HydrophobicContact CD2-CD2 4.16Å; L402-V412 HydrophobicContact CD2-CG2 4.35Å; L402-L415 HydrophobicContact CD2-CD1 4.18Å
403	D	85.8	Confident	85.2	Confident	11 Å²	11	20 Å²	20	6%	0.059	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	59.1	176.4	-178.8	38.9	0	0	0	111.1	N280 L378 L399 R473	N280-D403 WeakPolarHBondContact CB-O 3.22Å; N280-D403 PolarHBondContact ND2-O 3.11Å; L378-D403 HydrophobicContact CD2-CB 3.76Å; L378-D403 WeakPolarHBondContact CD2-OD1 3.2Å; L399-D403 WeakPolarHBondContact O-CA 3.29Å; L399-D403 WeakPolarHBondContact O-CB 3.29Å; L399-D403 PolarHBondContact O-N 3.28Å; D403-R473 IonicContact OD2-CZ 2.59Å; D403-R473 IonicContact OD2-NH1 2.84Å; D403-R473 IonicContact OD2-NH2 3.76Å; D403-R473 PolarHBondContact OD2-NH2 3.46Å
404	F	82.1	Confident	86.6	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121	-39.7	-179	178.2	-121.8	0	0	0	111.6	C282 Q283 L286 L402 L411 P445 I449 I450 H453	C282-F404 HydrophobicContact CB-CE2 4.49Å; Q283-F404 WeakPolarHBondContact CB-O 3.31Å; Q283-F404 WeakPolarHBondContact CG-O 3.16Å; L286-F404 HydrophobicContact CD1-CE1 4.44Å; L286-F404 HydrophobicContact CD1-CE2 3.84Å; L286-F404 HydrophobicContact CD1-CZ 3.71Å; L402-F404 PolarHBondContact O-N 3.16Å; F404-L411 HydrophobicContact CB-CD2 4.26Å; F404-L411 HydrophobicContact CD1-CD1 4.14Å; F404-P445 HydrophobicContact CD1-CG 4.17Å; F404-P445 HydrophobicContact CE1-CB 3.58Å; F404-P445 HydrophobicContact CE1-CG 3.23Å; F404-P445 HydrophobicContact CZ-CB 3.58Å; F404-P445 HydrophobicContact CZ-CG 3.77Å; F404-I449 HydrophobicContact CE2-CG2 3.95Å; F404-I449 HydrophobicContact CZ-CB 4.27Å; F404-I449 HydrophobicContact CZ-CG2 3.65Å; F404-I450 HydrophobicContact CD1-CG1 4.34Å; F404-I450 HydrophobicContact CE1-CB 4.33Å; F404-I450 HydrophobicContact CE1-CG1 3.53Å; F404-I450 HydrophobicContact CZ-CG1 4.21Å; F404-H453 HydrophobicContact CD2-CB 3.56Å; F404-H453 AromaticContact CD2-CD2 3.67Å; F404-H453 AromaticContact CD2-CG 3.3Å; F404-H453 AromaticContact CD2-ND1 3.69Å; F404-H453 HydrophobicContact CE2-CB 3.61Å; F404-H453 AromaticContact CE2-CG 3.92Å; F404-H453 HydrophobicContact CG-CB 4.3Å; F404-H453 AromaticContact CG-CD2 3.7Å; F404-H453 AromaticContact CG-CG 3.84Å; F404-H453 HydrophobicContact CZ-CB 4.37Å
405	M	83.8	Confident	87.5	Confident	14 Å²	14	16.8 Å²	16.8	7%	0.069	8%	0.084	C	C	.	.			trans	-148	157	-177.2	61.3	-167.7	-71	0	0	112	D407 Q408 Y410 L411 L444 P445	M405-D407 HydrophobicContact CE-CB 3.91Å; M405-D407 WeakPolarHBondContact CE-O 3.28Å; M405-Q408 PolarHBondContact O-NE2 3.43Å; M405-Y410 HydrophobicContact CE-CD1 3.32Å; M405-Y410 HydrophobicContact CE-CE1 4.07Å; M405-Y410 HydrophobicContact CE-CG 4.13Å; M405-Y410 HydrophobicContact SD-CD1 3.78Å; M405-Y410 HydrophobicContact SD-CE1 4.26Å; M405-L411 HydrophobicContact CG-CB 3.92Å; M405-L411 HydrophobicContact CG-CD2 4.13Å; M405-L411 HydrophobicContact CG-CG 4.46Å; M405-L411 HydrophobicContact SD-CB 3.75Å; M405-L411 HydrophobicContact SD-CD1 4.17Å; M405-L411 HydrophobicContact SD-CG 4.39Å; M405-L444 HydrophobicContact CE-CD2 3.57Å; M405-P445 HydrophobicContact CE-CG 4.2Å; M405-P445 HydrophobicContact SD-CG 3.69Å
406	K	82.9	Confident	88.3	Confident	167 Å²	167	19.6 Å²	19.6	73%	0.726	10%	0.097	S	C	*	.	S	Bend	trans	-72.8	-35.8	179.7	-57.7	-170.5	179.4	177	0	112.1	Q408	K406-Q408 PolarHBondContact O-N 3.35Å
407	D	85.9	Confident	89	Confident	55 Å²	55	20.7 Å²	20.7	29%	0.294	10%	0.101	S	C	.	.			trans	-79.3	85.7	179.2	-173	-9.8	0	0	0	109.9	M405 G409 Y410 L411 L444	M405-D407 HydrophobicContact CE-CB 3.91Å; M405-D407 WeakPolarHBondContact CE-O 3.28Å; D407-G409 VanDerWaalsContact C-N 3.28Å; D407-G409 PolarHBondContact OD1-N 3.33Å; D407-Y410 PolarHBondContact OD1-N 2.91Å; D407-Y410 VanDerWaalsContact OD1-N 3.1Å; D407-L411 PolarHBondContact O-N 3.21Å; D407-L444 HydrophobicContact CB-CD2 4.45Å
408	Q	89.7	Confident	89.7	Confident	5 Å²	5	20.7 Å²	20.7	2%	0.023	10%	0.101	C	C	.	.	H	α-helix	trans	-68.1	-29.1	179.2	-67.8	-66.7	-56	0	0	111.9	G374 L402 M405 K406 L411 V412	G374-Q408 CarbonylContact O-C 3.6Å; L402-Q408 PolarHBondContact O-NE2 2.83Å; M405-Q408 PolarHBondContact O-NE2 3.43Å; K406-Q408 PolarHBondContact O-N 3.35Å; Q408-L411 PolarHBondContact O-N 3.16Å; Q408-V412 VanDerWaalsContact O-CB 3.3Å; Q408-V412 WeakPolarHBondContact O-CB 3.37Å; Q408-V412 WeakPolarHBondContact O-CG2 3.49Å; Q408-V412 PolarHBondContact O-N 2.92Å
409	G	89	Confident	90	Very high	6 Å²	6	21 Å²	21	6%	0.062	11%	0.105	C	C	.	.	H	α-helix	trans	-63.3	-49.9	179.9	0	0	0	0	0	111.1	G374 D407 N413	G374-G409 WeakPolarHBondContact O-CA 3.34Å; G374-G409 PolarHBondContact O-N 2.9Å; D407-G409 VanDerWaalsContact C-N 3.28Å; D407-G409 PolarHBondContact OD1-N 3.33Å; G409-N413 VanDerWaalsContact O-CB 3.24Å; G409-N413 WeakPolarHBondContact O-CB 3.5Å; G409-N413 PolarHBondContact O-N 3.47Å
410	Y	92.1	Very high	90.1	Very high	1 Å²	1	30.9 Å²	30.9	0%	0.004	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-48.7	173.4	173	-92.2	0	0	0	112.5	M405 D407 V412 R414 G432 W440 L444 P445 I450	M405-Y410 HydrophobicContact CE-CD1 3.32Å; M405-Y410 HydrophobicContact CE-CE1 4.07Å; M405-Y410 HydrophobicContact CE-CG 4.13Å; M405-Y410 HydrophobicContact SD-CD1 3.78Å; M405-Y410 HydrophobicContact SD-CE1 4.26Å; D407-Y410 PolarHBondContact OD1-N 2.91Å; D407-Y410 VanDerWaalsContact OD1-N 3.1Å; Y410-V412 PolarHBondContact O-N 3.46Å; Y410-R414 HydrophobicContact CE1-CB 4.46Å; Y410-R414 VanDerWaalsContact O-CB 3.28Å; Y410-R414 WeakPolarHBondContact O-CB 3.28Å; Y410-R414 PolarHBondContact O-N 3.41Å; Y410-G432 WeakPolarHBondContact OH-CA 3.24Å; Y410-W440 HydrophobicContact CE2-CB 4.14Å; Y410-W440 AromaticContact CZ-CD1 3.88Å; Y410-L444 HydrophobicContact CD1-CB 4.44Å; Y410-L444 HydrophobicContact CD1-CD1 4.34Å; Y410-L444 HydrophobicContact CD2-CD1 3.69Å; Y410-L444 HydrophobicContact CE1-CB 4.16Å; Y410-L444 HydrophobicContact CE2-CD1 4.04Å; Y410-L444 HydrophobicContact CG-CD1 3.85Å; Y410-P445 PolarHBondContact OH-O 3.17Å; Y410-I450 HydrophobicContact CE1-CD1 4.19Å
411	L	92.9	Very high	90.1	Very high	1 Å²	1	34.1 Å²	34.1	1%	0.005	16%	0.156	C	C	.	.	H	α-helix	trans	-60.3	-50.9	-176.5	-178.9	58.9	0	0	0	111.3	L402 F404 M405 D407 Q408 R414 L415 I450	L402-L411 HydrophobicContact CD2-CD2 4.16Å; F404-L411 HydrophobicContact CB-CD2 4.26Å; F404-L411 HydrophobicContact CD1-CD1 4.14Å; M405-L411 HydrophobicContact CG-CB 3.92Å; M405-L411 HydrophobicContact CG-CD2 4.13Å; M405-L411 HydrophobicContact CG-CG 4.46Å; M405-L411 HydrophobicContact SD-CB 3.75Å; M405-L411 HydrophobicContact SD-CD1 4.17Å; M405-L411 HydrophobicContact SD-CG 4.39Å; D407-L411 PolarHBondContact O-N 3.21Å; Q408-L411 PolarHBondContact O-N 3.16Å; L411-R414 PolarHBondContact O-N 2.86Å; L411-L415 HydrophobicContact CD1-CD1 4.36Å; L411-L415 HydrophobicContact CD1-CG 4.3Å; L411-L415 HydrophobicContact CG-CD1 4.14Å; L411-L415 HydrophobicContact CG-CG 4.48Å; L411-L415 VanDerWaalsContact O-CG 3.27Å; L411-L415 WeakPolarHBondContact O-CG 3.19Å; L411-L415 PolarHBondContact O-N 2.93Å; L411-I450 HydrophobicContact CD1-CG1 4.5Å; L411-I450 HydrophobicContact CD1-CG2 4.32Å
412	V	93.1	Very high	89.8	Confident	9 Å²	9	38.3 Å²	38.3	6%	0.055	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-48.8	-177.4	172.5	0	0	0	0	110	I356 I373 L402 Q408 Y410 R414 L415 H416	I356-V412 HydrophobicContact CG2-CG1 4.11Å; I373-V412 HydrophobicContact CG2-CG2 3.8Å; L402-V412 HydrophobicContact CD2-CG2 4.35Å; Q408-V412 VanDerWaalsContact O-CB 3.3Å; Q408-V412 WeakPolarHBondContact O-CB 3.37Å; Q408-V412 WeakPolarHBondContact O-CG2 3.49Å; Q408-V412 PolarHBondContact O-N 2.92Å; Y410-V412 PolarHBondContact O-N 3.46Å; V412-R414 VanDerWaalsContact C-N 3.26Å; V412-R414 PolarHBondContact O-N 3.5Å; V412-L415 PolarHBondContact O-N 2.89Å; V412-L415 VanDerWaalsContact O-N 3.14Å; V412-H416 PolarHBondContact O-CD2 3.19Å; V412-H416 PolarHBondContact O-N 2.82Å
413	N	93.2	Very high	89.6	Confident	40 Å²	40	39.2 Å²	39.2	21%	0.214	19%	0.188	C	C	.	.	H	α-helix	trans	-55.5	-43.6	175	179.8	71.6	0	0	0	111.5	G409 L415 H416 E417 S433 W438	G409-N413 VanDerWaalsContact O-CB 3.24Å; G409-N413 WeakPolarHBondContact O-CB 3.5Å; G409-N413 PolarHBondContact O-N 3.47Å; N413-L415 PolarHBondContact O-N 3.48Å; N413-H416 WeakPolarHBondContact O-CB 3.43Å; N413-H416 PolarHBondContact O-N 3.1Å; N413-E417 PolarHBondContact ND2-OE1 3.21Å; N413-E417 WeakPolarHBondContact O-CG 3.23Å; N413-E417 PolarHBondContact O-N 2.84Å; N413-S433 PolarHBondContact ND2-OG 2.99Å; N413-W438 HydrophobicContact CB-CB 4.34Å; N413-W438 HydrophobicContact CB-CG 4.32Å
414	R	94.5	Very high	89.8	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-67.1	-37.8	179.8	-170.8	52.5	175.4	161.8	4.2	112.6	Y410 L411 V412 H416 E417 L418 E426 D447 I450	Y410-R414 HydrophobicContact CE1-CB 4.46Å; Y410-R414 VanDerWaalsContact O-CB 3.28Å; Y410-R414 WeakPolarHBondContact O-CB 3.28Å; Y410-R414 PolarHBondContact O-N 3.41Å; L411-R414 PolarHBondContact O-N 2.86Å; V412-R414 VanDerWaalsContact C-N 3.26Å; V412-R414 PolarHBondContact O-N 3.5Å; R414-H416 VanDerWaalsContact C-N 3.34Å; R414-E417 WeakPolarHBondContact CD-OE2 3.28Å; R414-E417 IonicContact CZ-OE2 2.74Å; R414-E417 IonicContact NE-OE2 3.43Å; R414-E417 IonicContact NH1-OE2 3.9Å; R414-E417 PolarHBondContact NH1-OE2 3.39Å; R414-E417 PolarHBondContact O-N 3.11Å; R414-L418 HydrophobicContact CG-CD1 4.25Å; R414-L418 HydrophobicContact CG-CG 4.46Å; R414-L418 WeakPolarHBondContact O-CB 3.41Å; R414-L418 WeakPolarHBondContact O-CG 3.29Å; R414-L418 PolarHBondContact O-N 2.99Å; R414-E426 PolarHBondContact NH2-O 3.1Å; R414-D447 IonicContact CZ-OD1 2.91Å; R414-D447 IonicContact CZ-OD2 2.81Å; R414-D447 IonicContact NE-OD1 3.84Å; R414-D447 PolarHBondContact NE-OD1 3.39Å; R414-D447 IonicContact NE-OD2 2.88Å; R414-D447 VanDerWaalsContact NH2-CG 3.29Å; R414-D447 IonicContact NH2-OD1 3.21Å; R414-D447 PolarHBondContact NH2-OD1 3.24Å; R414-D447 IonicContact NH2-OD2 3.41Å; R414-D447 PolarHBondContact NH2-OD2 2.93Å; R414-I450 HydrophobicContact CG-CD1 4.05Å
415	L	94.7	Very high	90.2	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-61.4	-42.8	173.8	-69.7	173.5	0	0	0	111.3	I352 V353 I356 L402 L411 V412 N413 L418 A419 I450 L454	I352-L415 HydrophobicContact CG2-CD1 4.06Å; V353-L415 HydrophobicContact CG2-CB 3.8Å; V353-L415 WeakPolarHBondContact CG2-O 3.3Å; I356-L415 HydrophobicContact CD1-CD1 4.02Å; L402-L415 HydrophobicContact CD2-CD1 4.18Å; L411-L415 HydrophobicContact CD1-CD1 4.36Å; L411-L415 HydrophobicContact CD1-CG 4.3Å; L411-L415 HydrophobicContact CG-CD1 4.14Å; L411-L415 HydrophobicContact CG-CG 4.48Å; L411-L415 VanDerWaalsContact O-CG 3.27Å; L411-L415 WeakPolarHBondContact O-CG 3.19Å; L411-L415 PolarHBondContact O-N 2.93Å; V412-L415 PolarHBondContact O-N 2.89Å; V412-L415 VanDerWaalsContact O-N 3.14Å; N413-L415 PolarHBondContact O-N 3.48Å; L415-L418 PolarHBondContact O-N 2.83Å; L415-A419 VanDerWaalsContact O-CB 3.3Å; L415-A419 WeakPolarHBondContact O-CB 3.27Å; L415-A419 PolarHBondContact O-N 3.4Å; L415-I450 HydrophobicContact CD2-CG2 4.44Å; L415-L454 HydrophobicContact CD2-CD1 3.52Å; L415-L454 HydrophobicContact CD2-CD2 4.28Å; L415-L454 HydrophobicContact CD2-CG 4.47Å
416	H	94.6	Very high	90.5	Very high	61 Å²	61	46.2 Å²	46.2	28%	0.282	22%	0.22	S	C	.	.	H	α-helix	trans	-60.3	-45.7	174.1	-77.3	-75.6	0	0	0	112.2	V353 D357 V412 N413 R414 L418 A419 R420	V353-H416 VanDerWaalsContact CG1-ND1 3.35Å; V353-H416 WeakPolarHBondContact CG1-ND1 3.4Å; D357-H416 IonicContact OD1-CE1 2.72Å; D357-H416 PolarHBondContact OD1-CE1 3.22Å; D357-H416 IonicContact OD1-NE2 3.72Å; D357-H416 IonicContact OD2-CE1 3.89Å; V412-H416 PolarHBondContact O-CD2 3.19Å; V412-H416 PolarHBondContact O-N 2.82Å; N413-H416 WeakPolarHBondContact O-CB 3.43Å; N413-H416 PolarHBondContact O-N 3.1Å; R414-H416 VanDerWaalsContact C-N 3.34Å; H416-L418 PolarHBondContact O-N 3.48Å; H416-A419 PolarHBondContact O-N 3.21Å; H416-R420 PolarHBondContact O-N 3.46Å
417	E	94.2	Very high	91	Very high	39 Å²	39	39.6 Å²	39.6	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-60	-45	176.2	-72.1	175.1	-174.3	0	0	112.1	N413 R414 A419 R420 S433	N413-E417 PolarHBondContact ND2-OE1 3.21Å; N413-E417 WeakPolarHBondContact O-CG 3.23Å; N413-E417 PolarHBondContact O-N 2.84Å; R414-E417 WeakPolarHBondContact CD-OE2 3.28Å; R414-E417 IonicContact CZ-OE2 2.74Å; R414-E417 IonicContact NE-OE2 3.43Å; R414-E417 IonicContact NH1-OE2 3.9Å; R414-E417 PolarHBondContact NH1-OE2 3.39Å; R414-E417 PolarHBondContact O-N 3.11Å; E417-A419 VanDerWaalsContact C-N 3.28Å; E417-A419 PolarHBondContact O-N 2.95Å; E417-R420 WeakPolarHBondContact O-CB 3.49Å; E417-R420 PolarHBondContact O-N 2.65Å; E417-S433 VanDerWaalsContact CD-OG 3.23Å; E417-S433 PolarHBondContact OE1-OG 3.12Å; E417-S433 WeakPolarHBondContact OE2-CA 3.46Å; E417-S433 VanDerWaalsContact OE2-CB 3.29Å; E417-S433 WeakPolarHBondContact OE2-CB 3.04Å; E417-S433 PolarHBondContact OE2-OG 3.4Å; E417-S433 VanDerWaalsContact OE2-OG 3.06Å
418	L	94.5	Very high	91.4	Very high	4 Å²	4	39 Å²	39	2%	0.021	19%	0.185	C	C	.	.	H	α-helix	trans	-67.3	-28.1	177.5	-70.3	174.5	0	0	0	112.9	H345 I349 R414 L415 H416 L424 F427	H345-L418 PolarHBondContact CD2-O 3.44Å; I349-L418 HydrophobicContact CG2-CB 4.13Å; R414-L418 HydrophobicContact CG-CD1 4.25Å; R414-L418 HydrophobicContact CG-CG 4.46Å; R414-L418 WeakPolarHBondContact O-CB 3.41Å; R414-L418 WeakPolarHBondContact O-CG 3.29Å; R414-L418 PolarHBondContact O-N 2.99Å; L415-L418 PolarHBondContact O-N 2.83Å; H416-L418 PolarHBondContact O-N 3.48Å; L418-L424 HydrophobicContact CB-CD2 4.39Å; L418-F427 HydrophobicContact CD2-CB 4.28Å; L418-F427 HydrophobicContact CD2-CD2 4.5Å
419	A	93.6	Very high	91.6	Very high	13 Å²	13	41.5 Å²	41.5	11%	0.107	19%	0.194	C	C	.	.	H	α-helix	trans	-81.9	-23.7	177.9	0	0	0	0	0	113.7	H345 I349 V353 L415 H416 E417 E421	H345-A419 PolarHBondContact NE2-O 2.96Å; I349-A419 HydrophobicContact CG2-CB 3.91Å; V353-A419 HydrophobicContact CB-CB 4.01Å; V353-A419 HydrophobicContact CG1-CB 4.14Å; V353-A419 HydrophobicContact CG2-CB 3.7Å; L415-A419 VanDerWaalsContact O-CB 3.3Å; L415-A419 WeakPolarHBondContact O-CB 3.27Å; L415-A419 PolarHBondContact O-N 3.4Å; H416-A419 PolarHBondContact O-N 3.21Å; E417-A419 VanDerWaalsContact C-N 3.28Å; E417-A419 PolarHBondContact O-N 2.95Å; A419-E421 PolarHBondContact O-N 3.16Å
420	R	89	Confident	91.8	Very high	214 Å²	214	44 Å²	44	81%	0.808	21%	0.206	S	C	*	.	H	α-helix	trans	-56.2	-50.9	-171	-175.5	176.4	177.6	164.3	-0.4	113.6	H416 E417	H416-R420 PolarHBondContact O-N 3.46Å; E417-R420 WeakPolarHBondContact O-CB 3.49Å; E417-R420 PolarHBondContact O-N 2.65Å
421	E	85.3	Confident	91.7	Very high	72 Å²	72	45.3 Å²	45.3	34%	0.336	22%	0.215	S	C	.	.	S	Bend	trans	-103.6	156.8	-177.6	-65.5	-168.4	168.9	0	0	112	H345 A419 Q425	H345-E421 PolarHBondContact CD2-O 3.24Å; H345-E421 PolarHBondContact CE1-O 3.31Å; H345-E421 PolarHBondContact NE2-O 3.4Å; A419-E421 PolarHBondContact O-N 3.16Å; E421-Q425 HydrophobicContact CB-CB 3.99Å; E421-Q425 WeakPolarHBondContact OE2-CB 3.48Å; E421-Q425 PolarHBondContact OE2-OE1 2.98Å
422	T	84.5	Confident	91.7	Very high	93 Å²	93	45.3 Å²	45.3	57%	0.571	22%	0.216	S	C	*	.	G	3₁₀ helix	trans	-67.2	145.3	178.4	66.2	0	0	0	0	111.2	L424 Q425	T422-L424 VanDerWaalsContact C-N 3.35Å; T422-L424 PolarHBondContact O-N 2.88Å; T422-Q425 WeakPolarHBondContact O-CG 3.48Å; T422-Q425 PolarHBondContact O-NE2 3.38Å; T422-Q425 PolarHBondContact OG1-NE2 2.79Å
423	C	86.5	Confident	91.6	Very high	18 Å²	18	45.1 Å²	45.1	12%	0.122	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	63.8	28.7	171	-40.3	0	0	0	0	115.3	L338 R341 K342 Q425	L338-C423 HydrophobicContact CD1-CB 4.38Å; R341-C423 HydrophobicContact CB-CB 4.35Å; R341-C423 PolarHBondContact NE-O 2.88Å; R341-C423 PolarHBondContact NH2-O 2.96Å; K342-C423 HydrophobicContact CG-CB 4.26Å; K342-C423 WeakPolarHBondContact CG-SG 3.26Å; C423-Q425 PolarHBondContact O-N 3.5Å
424	L	90.7	Very high	91.4	Very high	0 Å²	0	51 Å²	51	0%	0	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	59.4	43.2	177.6	-52	174.6	0	0	0	113.5	R341 L344 H345 I349 L418 T422 E426 F427 L451 Y526	R341-L424 VanDerWaalsContact NH2-C 3.29Å; R341-L424 PolarHBondContact NH2-O 3.07Å; L344-L424 HydrophobicContact CB-CD1 4.18Å; H345-L424 HydrophobicContact CB-CD2 4.02Å; H345-L424 HydrophobicContact CB-CG 4.03Å; I349-L424 HydrophobicContact CD1-CD1 4.32Å; I349-L424 HydrophobicContact CD1-CD2 3.36Å; I349-L424 HydrophobicContact CD1-CG 4.46Å; L418-L424 HydrophobicContact CB-CD2 4.39Å; T422-L424 VanDerWaalsContact C-N 3.35Å; T422-L424 PolarHBondContact O-N 2.88Å; L424-E426 VanDerWaalsContact C-N 3.28Å; L424-E426 PolarHBondContact O-N 2.63Å; L424-F427 HydrophobicContact CB-CB 4.02Å; L424-F427 WeakPolarHBondContact O-CB 3.38Å; L424-F427 PolarHBondContact O-N 3.17Å; L424-F427 VanDerWaalsContact O-N 3.15Å; L424-L451 HydrophobicContact CD1-CD1 4.26Å; L424-L451 HydrophobicContact CD1-CD2 4.46Å; L424-Y526 HydrophobicContact CD1-CE1 4.22Å
425	Q	89	Confident	91.1	Very high	111 Å²	111	52.1 Å²	52.1	52%	0.519	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-35.8	-179.6	-81.9	173.2	70.2	0	0	113.1	E421 T422 C423 F427	E421-Q425 HydrophobicContact CB-CB 3.99Å; E421-Q425 WeakPolarHBondContact OE2-CB 3.48Å; E421-Q425 PolarHBondContact OE2-OE1 2.98Å; T422-Q425 WeakPolarHBondContact O-CG 3.48Å; T422-Q425 PolarHBondContact O-NE2 3.38Å; T422-Q425 PolarHBondContact OG1-NE2 2.79Å; C423-Q425 PolarHBondContact O-N 3.5Å; Q425-F427 PolarHBondContact O-N 2.87Å
426	E	90.9	Very high	90.7	Very high	62 Å²	62	58.7 Å²	58.7	29%	0.29	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	2.6	176	-75.6	-62.3	156.9	0	0	114.7	R414 L424 R428	R414-E426 PolarHBondContact NH2-O 3.1Å; L424-E426 VanDerWaalsContact C-N 3.28Å; L424-E426 PolarHBondContact O-N 2.63Å; E426-R428 PolarHBondContact O-N 3.45Å; E426-R428 IonicContact OE2-CZ 3.91Å; E426-R428 IonicContact OE2-NH2 3.18Å; E426-R428 PolarHBondContact OE2-NH2 3.48Å
427	F	93.9	Very high	90.4	Very high	28 Å²	28	63 Å²	63	12%	0.123	31%	0.307	C	S	.	.			trans	-65.4	129.6	-179.2	177.9	-97.7	0	0	0	112.2	L418 L424 Q425 W429 D447 L451 I525 Y526	L418-F427 HydrophobicContact CD2-CB 4.28Å; L418-F427 HydrophobicContact CD2-CD2 4.5Å; L424-F427 HydrophobicContact CB-CB 4.02Å; L424-F427 WeakPolarHBondContact O-CB 3.38Å; L424-F427 PolarHBondContact O-N 3.17Å; L424-F427 VanDerWaalsContact O-N 3.15Å; Q425-F427 PolarHBondContact O-N 2.87Å; F427-W429 HydrophobicContact CE1-CB 3.68Å; F427-W429 HydrophobicContact CZ-CB 4.08Å; F427-D447 WeakPolarHBondContact CA-OD2 3.37Å; F427-D447 HydrophobicContact CD2-CB 3.51Å; F427-D447 HydrophobicContact CE2-CB 3.4Å; F427-D447 HydrophobicContact CG-CB 4.47Å; F427-D447 HydrophobicContact CZ-CB 4.28Å; F427-L451 HydrophobicContact CD2-CD2 4.48Å; F427-L451 HydrophobicContact CE2-CB 4.43Å; F427-L451 HydrophobicContact CE2-CD2 3.86Å; F427-L451 HydrophobicContact CZ-CD2 4.38Å; F427-I525 HydrophobicContact CE1-CG2 4.5Å; F427-I525 HydrophobicContact CZ-CG2 3.83Å; F427-Y526 AromaticContact CD1-CE2 3.87Å; F427-Y526 HydrophobicContact CD1-CE2 3.87Å; F427-Y526 AromaticContact CD1-CZ 3.96Å; F427-Y526 WeakPolarHBondContact CD1-OH 3.3Å; F427-Y526 WeakPolarHBondContact CD2-OH 3.42Å; F427-Y526 AromaticContact CE1-CE2 3.58Å; F427-Y526 HydrophobicContact CE1-CE2 3.58Å; F427-Y526 AromaticContact CE1-CZ 3.87Å; F427-Y526 WeakPolarHBondContact CG-OH 3.48Å; F427-Y526 HydrophobicContact CZ-CE2 4.14Å
428	R	93.9	Very high	90	Very high	43 Å²	43	65.8 Å²	65.8	16%	0.162	32%	0.316	C	S	.	.			trans	-127.3	108.2	177.1	-59.8	-177.1	-169.6	124.8	9.6	108.8	E426 D430 S431 G432 K434 D447	E426-R428 PolarHBondContact O-N 3.45Å; E426-R428 IonicContact OE2-CZ 3.91Å; E426-R428 IonicContact OE2-NH2 3.18Å; E426-R428 PolarHBondContact OE2-NH2 3.48Å; R428-D430 VanDerWaalsContact C-N 3.33Å; R428-D430 PolarHBondContact O-N 2.83Å; R428-S431 WeakPolarHBondContact CB-OG 3.35Å; R428-S431 PolarHBondContact O-N 3.29Å; R428-G432 PolarHBondContact NH1-O 2.89Å; R428-K434 VanDerWaalsContact CZ-CD 3.42Å; R428-D447 PolarHBondContact N-OD2 2.64Å; R428-D447 VanDerWaalsContact O-CB 3.27Å; R428-D447 WeakPolarHBondContact O-CB 3.47Å
429	W	93.5	Very high	89.9	Confident	57 Å²	57	68.2 Å²	68.2	22%	0.216	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-35.9	-167.2	71	-78.3	0	0	0	113.8	F427 S448 P504 P505 P522	F427-W429 HydrophobicContact CE1-CB 3.68Å; F427-W429 HydrophobicContact CZ-CB 4.08Å; W429-S448 VanDerWaalsContact CA-OG 3.28Å; W429-S448 WeakPolarHBondContact CA-OG 3.38Å; W429-S448 WeakPolarHBondContact O-CB 3.24Å; W429-S448 PolarHBondContact O-OG 3.06Å; W429-P504 HydrophobicContact CH2-CB 3.79Å; W429-P504 HydrophobicContact CZ3-CB 3.79Å; W429-P505 HydrophobicContact CE3-CG 4.04Å; W429-P505 HydrophobicContact CZ3-CG 4.34Å; W429-P505 WeakPolarHBondContact O-CG 3.38Å; W429-P522 HydrophobicContact CB-CB 4.26Å; W429-P522 VanDerWaalsContact CG-CA 3.43Å; W429-P522 HydrophobicContact CG-CB 3.93Å
430	D	92.4	Very high	89.8	Confident	57 Å²	57	70.4 Å²	70.4	31%	0.305	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	3.4	-174.8	60.4	-9.7	0	0	0	114.1	R428 Q503	R428-D430 VanDerWaalsContact C-N 3.33Å; R428-D430 PolarHBondContact O-N 2.83Å; D430-Q503 PolarHBondContact O-NE2 2.75Å; D430-Q503 PolarHBondContact O-OE1 2.84Å
431	S	91.8	Very high	89.9	Confident	29 Å²	29	65.4 Å²	65.4	20%	0.203	32%	0.321	C	S	.	.			trans	-147.7	-163	-176.2	52.2	0	0	0	0	109.6	R428 S446 D447	R428-S431 WeakPolarHBondContact CB-OG 3.35Å; R428-S431 PolarHBondContact O-N 3.29Å; S431-S446 CarbonylContact O-C 3.56Å; S431-S446 VanDerWaalsContact O-CA 3.26Å; S431-S446 WeakPolarHBondContact O-CA 3.29Å; S431-D447 PolarHBondContact O-N 2.97Å
432	G	91.3	Very high	89.8	Confident	2 Å²	2	69.2 Å²	69.2	2%	0.021	34%	0.339	C	S	.	.			trans	-146.5	-138.2	-175.2	0	0	0	0	0	113.5	Y410 R428 W440	Y410-G432 WeakPolarHBondContact OH-CA 3.24Å; R428-G432 PolarHBondContact NH1-O 2.89Å; G432-W440 VanDerWaalsContact N-CG 3.33Å
433	S	90.9	Very high	89.9	Confident	5 Å²	5	69.4 Å²	69.4	4%	0.035	33%	0.333	C	S	.	.			trans	-60.4	143.3	-178.2	-179.8	0	0	0	0	113.1	N413 E417 S435 W438 W440	N413-S433 PolarHBondContact ND2-OG 2.99Å; E417-S433 VanDerWaalsContact CD-OG 3.23Å; E417-S433 PolarHBondContact OE1-OG 3.12Å; E417-S433 WeakPolarHBondContact OE2-CA 3.46Å; E417-S433 VanDerWaalsContact OE2-CB 3.29Å; E417-S433 WeakPolarHBondContact OE2-CB 3.04Å; E417-S433 PolarHBondContact OE2-OG 3.4Å; E417-S433 VanDerWaalsContact OE2-OG 3.06Å; S433-S435 WeakPolarHBondContact OG-CB 3.29Å; S433-S435 PolarHBondContact OG-N 2.86Å; S433-W438 WeakPolarHBondContact CB-O 3.46Å; S433-W438 PolarHBondContact OG-O 2.85Å; S433-W440 WeakPolarHBondContact O-CB 3.35Å; S433-W440 PolarHBondContact O-N 3.33Å
434	K	89.4	Confident	90	Very high	162 Å²	162	69 Å²	69	70%	0.704	33%	0.33	S	S	*	.			trans	-101.6	12.3	169.2	-86.6	175.5	-159.6	172.2	0	111.8	R428	R428-K434 VanDerWaalsContact CZ-CD 3.42Å
435	S	87.6	Confident	90.1	Very high	24 Å²	24	69.2 Å²	69.2	17%	0.168	33%	0.332	C	S	.	.			trans	-61.9	145.9	-179.3	177.8	0	0	0	0	111.2	S433 E437 W438 P439	S433-S435 WeakPolarHBondContact OG-CB 3.29Å; S433-S435 PolarHBondContact OG-N 2.86Å; S435-E437 PolarHBondContact OG-N 2.95Å; S435-W438 PolarHBondContact OG-N 2.8Å; S435-P439 VanDerWaalsContact O-CA 3.28Å; S435-P439 WeakPolarHBondContact O-CA 3.31Å; S435-P439 WeakPolarHBondContact O-CB 3.49Å
436	T	87.6	Confident	90.3	Very high	139 Å²	139	64 Å²	64	85%	0.853	31%	0.307	S	S	*	.	S	Bend	trans	-71	-34.3	173	47.9	0	0	0	0	111.9
437	E	87.2	Confident	90.5	Very high	151 Å²	151	61 Å²	61	71%	0.706	29%	0.294	S	S	*	.	S	Bend	trans	-82.4	-40.1	-178	-64.6	-178.2	179	0	0	111.6	S435 P439	S435-E437 PolarHBondContact OG-N 2.95Å; E437-P439 VanDerWaalsContact C-CD 3.43Å; E437-P439 WeakPolarHBondContact O-CD 3.48Å
438	W	87.6	Confident	90.5	Very high	98 Å²	98	59.9 Å²	59.9	37%	0.371	29%	0.289	S	S	.	.	S	Bend	trans	-127.3	62.1	-176.6	-56.5	102.6	0	0	0	111.8	N413 S433 S435	N413-W438 HydrophobicContact CB-CB 4.34Å; N413-W438 HydrophobicContact CB-CG 4.32Å; S433-W438 WeakPolarHBondContact CB-O 3.46Å; S433-W438 PolarHBondContact OG-O 2.85Å; S435-W438 PolarHBondContact OG-N 2.8Å
439	P	91.6	Very high	90.5	Very high	54 Å²	54	57.9 Å²	57.9	35%	0.351	28%	0.282	S	S	.	.			trans	-67.2	143.5	-178.5	28	-34.5	0	0	0	110.9	S435 E437	S435-P439 VanDerWaalsContact O-CA 3.28Å; S435-P439 WeakPolarHBondContact O-CA 3.31Å; S435-P439 WeakPolarHBondContact O-CB 3.49Å; E437-P439 VanDerWaalsContact C-CD 3.43Å; E437-P439 WeakPolarHBondContact O-CD 3.48Å
440	W	91.9	Very high	90.6	Very high	60 Å²	60	55.2 Å²	55.2	23%	0.227	27%	0.272	C	S	.	.			trans	-62.3	141.1	169.4	-178.8	73.9	0	0	0	111.1	Y410 G432 S433 L444	Y410-W440 HydrophobicContact CE2-CB 4.14Å; Y410-W440 AromaticContact CZ-CD1 3.88Å; G432-W440 VanDerWaalsContact N-CG 3.33Å; S433-W440 WeakPolarHBondContact O-CB 3.35Å; S433-W440 PolarHBondContact O-N 3.33Å; W440-L444 PolarHBondContact NE1-O 2.76Å
441	K	89.8	Confident	90.7	Very high	108 Å²	108	52.8 Å²	52.8	47%	0.47	26%	0.258	S	S	.	.			trans	-134	157.6	178.8	-61.6	174.6	-173.9	171.4	0	107.7	H443 L444	K441-H443 WeakPolarHBondContact CD-CE1 3.41Å; K441-H443 PolarHBondContact O-N 3.12Å; K441-H443 VanDerWaalsContact O-N 3.1Å; K441-L444 HydrophobicContact CB-CD1 4.07Å; K441-L444 HydrophobicContact CB-CG 4.22Å; K441-L444 HydrophobicContact CG-CD1 4.32Å; K441-L444 WeakPolarHBondContact O-CA 3.45Å; K441-L444 WeakPolarHBondContact O-CB 2.76Å; K441-L444 PolarHBondContact O-N 3.07Å
442	E	84.9	Confident	90.9	Very high	153 Å²	153	51.5 Å²	51.5	72%	0.715	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.6	-176.1	-64.3	177.7	-177.5	0	0	114.2	L444	E442-L444 VanDerWaalsContact C-N 3.26Å; E442-L444 PolarHBondContact O-N 3.09Å
443	H	85.2	Confident	91	Very high	96 Å²	96	51.7 Å²	51.7	44%	0.444	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	4.3	173.3	70.9	-92.2	0	0	0	113.4	Q290 K441	Q290-H443 HydrophobicContact CG-CB 4.45Å; Q290-H443 PolarHBondContact NE2-O 3.41Å; K441-H443 WeakPolarHBondContact CD-CE1 3.41Å; K441-H443 PolarHBondContact O-N 3.12Å; K441-H443 VanDerWaalsContact O-N 3.1Å
444	L	89.7	Confident	91.1	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.052	25%	0.248	C	C	.	.	S	Bend	trans	-105.7	142.2	175	-60	174.2	0	0	0	108.6	M405 D407 Y410 W440 K441 E442 S446	M405-L444 HydrophobicContact CE-CD2 3.57Å; D407-L444 HydrophobicContact CB-CD2 4.45Å; Y410-L444 HydrophobicContact CD1-CB 4.44Å; Y410-L444 HydrophobicContact CD1-CD1 4.34Å; Y410-L444 HydrophobicContact CD2-CD1 3.69Å; Y410-L444 HydrophobicContact CE1-CB 4.16Å; Y410-L444 HydrophobicContact CE2-CD1 4.04Å; Y410-L444 HydrophobicContact CG-CD1 3.85Å; W440-L444 PolarHBondContact NE1-O 2.76Å; K441-L444 HydrophobicContact CB-CD1 4.07Å; K441-L444 HydrophobicContact CB-CG 4.22Å; K441-L444 HydrophobicContact CG-CD1 4.32Å; K441-L444 WeakPolarHBondContact O-CA 3.45Å; K441-L444 WeakPolarHBondContact O-CB 2.76Å; K441-L444 PolarHBondContact O-N 3.07Å; E442-L444 VanDerWaalsContact C-N 3.26Å; E442-L444 PolarHBondContact O-N 3.09Å; L444-S446 PolarHBondContact O-N 3.25Å
445	P	91.1	Very high	91.4	Very high	5 Å²	5	43.8 Å²	43.8	3%	0.032	22%	0.215	C	C	.	.			trans	-63.7	138.4	-179.4	24.6	-31.3	0	0	0	110.9	L286 F404 M405 Y410 I449 I450	L286-P445 HydrophobicContact CD1-CB 3.99Å; L286-P445 HydrophobicContact CD1-CG 4.35Å; L286-P445 HydrophobicContact CD2-CB 4.42Å; F404-P445 HydrophobicContact CD1-CG 4.17Å; F404-P445 HydrophobicContact CE1-CB 3.58Å; F404-P445 HydrophobicContact CE1-CG 3.23Å; F404-P445 HydrophobicContact CZ-CB 3.58Å; F404-P445 HydrophobicContact CZ-CG 3.77Å; M405-P445 HydrophobicContact CE-CG 4.2Å; M405-P445 HydrophobicContact SD-CG 3.69Å; Y410-P445 PolarHBondContact OH-O 3.17Å; P445-I449 HydrophobicContact CB-CB 4.17Å; P445-I449 HydrophobicContact CB-CG2 4.45Å; P445-I450 HydrophobicContact CB-CG1 4.24Å; P445-I450 HydrophobicContact CG-CD1 4.48Å; P445-I450 HydrophobicContact CG-CG1 4.17Å
446	S	93.5	Very high	91.6	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	21%	0.207	C	C	.	.			trans	-69.1	162.9	168.1	57.9	0	0	0	0	111	S431 L444 S448 I449 I450 P505	S431-S446 CarbonylContact O-C 3.56Å; S431-S446 VanDerWaalsContact O-CA 3.26Å; S431-S446 WeakPolarHBondContact O-CA 3.29Å; L444-S446 PolarHBondContact O-N 3.25Å; S446-S448 PolarHBondContact O-N 2.72Å; S446-S448 VanDerWaalsContact O-N 3.17Å; S446-I449 PolarHBondContact O-N 3.04Å; S446-I449 VanDerWaalsContact O-N 3.07Å; S446-I450 PolarHBondContact O-N 2.93Å; S446-I450 VanDerWaalsContact O-N 3.12Å; S446-P505 WeakPolarHBondContact OG-CG 3.27Å
447	D	95.1	Very high	91.8	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60.1	-31.1	-178.7	-65.3	-12.9	0	0	0	113	R414 F427 R428 S431 I449 I450 L451	R414-D447 IonicContact CZ-OD1 2.91Å; R414-D447 IonicContact CZ-OD2 2.81Å; R414-D447 IonicContact NE-OD1 3.84Å; R414-D447 PolarHBondContact NE-OD1 3.39Å; R414-D447 IonicContact NE-OD2 2.88Å; R414-D447 VanDerWaalsContact NH2-CG 3.29Å; R414-D447 IonicContact NH2-OD1 3.21Å; R414-D447 PolarHBondContact NH2-OD1 3.24Å; R414-D447 IonicContact NH2-OD2 3.41Å; R414-D447 PolarHBondContact NH2-OD2 2.93Å; F427-D447 WeakPolarHBondContact CA-OD2 3.37Å; F427-D447 HydrophobicContact CD2-CB 3.51Å; F427-D447 HydrophobicContact CE2-CB 3.4Å; F427-D447 HydrophobicContact CG-CB 4.47Å; F427-D447 HydrophobicContact CZ-CB 4.28Å; R428-D447 PolarHBondContact N-OD2 2.64Å; R428-D447 VanDerWaalsContact O-CB 3.27Å; R428-D447 WeakPolarHBondContact O-CB 3.47Å; S431-D447 PolarHBondContact O-N 2.97Å; D447-I449 VanDerWaalsContact C-N 3.28Å; D447-I449 PolarHBondContact O-N 3.16Å; D447-I450 PolarHBondContact O-N 3.31Å; D447-L451 WeakPolarHBondContact O-CB 3.39Å; D447-L451 PolarHBondContact O-N 3.37Å
448	S	95.1	Very high	92.1	Very high	4 Å²	4	29 Å²	29	3%	0.028	13%	0.134	C	C	.	.	H	α-helix	trans	-64.4	-36	179.3	-56.5	0	0	0	0	111.8	W429 S446 L452	W429-S448 VanDerWaalsContact CA-OG 3.28Å; W429-S448 WeakPolarHBondContact CA-OG 3.38Å; W429-S448 WeakPolarHBondContact O-CB 3.24Å; W429-S448 PolarHBondContact O-OG 3.06Å; S446-S448 PolarHBondContact O-N 2.72Å; S446-S448 VanDerWaalsContact O-N 3.17Å; S448-L452 PolarHBondContact O-N 3.29Å; S448-L452 VanDerWaalsContact O-N 3.09Å
449	I	93.7	Very high	92.2	Very high	1 Å²	1	24.3 Å²	24.3	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-73	-43.9	175.4	-49.7	-46.1	0	0	0	110.4	L286 F404 P445 S446 D447 L451 L452 H453 P505 F507	L286-I449 HydrophobicContact CD1-CG2 4.38Å; L286-I449 HydrophobicContact CD2-CG2 4.18Å; F404-I449 HydrophobicContact CE2-CG2 3.95Å; F404-I449 HydrophobicContact CZ-CB 4.27Å; F404-I449 HydrophobicContact CZ-CG2 3.65Å; P445-I449 HydrophobicContact CB-CB 4.17Å; P445-I449 HydrophobicContact CB-CG2 4.45Å; S446-I449 PolarHBondContact O-N 3.04Å; S446-I449 VanDerWaalsContact O-N 3.07Å; D447-I449 VanDerWaalsContact C-N 3.28Å; D447-I449 PolarHBondContact O-N 3.16Å; I449-L451 VanDerWaalsContact C-N 3.3Å; I449-L451 PolarHBondContact O-N 2.81Å; I449-L452 PolarHBondContact O-N 2.69Å; I449-H453 PolarHBondContact O-N 3.02Å; I449-P505 HydrophobicContact CD1-CB 3.62Å; I449-P505 HydrophobicContact CG1-CB 4.38Å; I449-F507 HydrophobicContact CD1-CE1 4.14Å; I449-F507 HydrophobicContact CD1-CZ 3.59Å
450	I	94.6	Very high	92.1	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.005	10%	0.102	C	C	.	.	H	α-helix	trans	-55.2	-50.5	175	-67.5	165.7	0	0	0	109.3	F404 Y410 L411 R414 L415 P445 S446 D447 L452 H453 L454	F404-I450 HydrophobicContact CD1-CG1 4.34Å; F404-I450 HydrophobicContact CE1-CB 4.33Å; F404-I450 HydrophobicContact CE1-CG1 3.53Å; F404-I450 HydrophobicContact CZ-CG1 4.21Å; Y410-I450 HydrophobicContact CE1-CD1 4.19Å; L411-I450 HydrophobicContact CD1-CG1 4.5Å; L411-I450 HydrophobicContact CD1-CG2 4.32Å; R414-I450 HydrophobicContact CG-CD1 4.05Å; L415-I450 HydrophobicContact CD2-CG2 4.44Å; P445-I450 HydrophobicContact CB-CG1 4.24Å; P445-I450 HydrophobicContact CG-CD1 4.48Å; P445-I450 HydrophobicContact CG-CG1 4.17Å; S446-I450 PolarHBondContact O-N 2.93Å; S446-I450 VanDerWaalsContact O-N 3.12Å; D447-I450 PolarHBondContact O-N 3.31Å; I450-L452 PolarHBondContact O-N 2.92Å; I450-H453 WeakPolarHBondContact O-CB 3.43Å; I450-H453 PolarHBondContact O-N 3.27Å; I450-H453 VanDerWaalsContact O-N 3.12Å; I450-L454 HydrophobicContact CG2-CD1 3.86Å; I450-L454 HydrophobicContact CG2-CG 4.13Å; I450-L454 VanDerWaalsContact O-CG 3.29Å; I450-L454 WeakPolarHBondContact O-CG 3.35Å; I450-L454 PolarHBondContact O-N 3.36Å
451	L	95.2	Very high	91.8	Very high	5 Å²	5	20.6 Å²	20.6	3%	0.026	10%	0.098	C	C	.	.	H	α-helix	trans	-62.3	-41.4	-177.2	-170.9	64	0	0	0	112	L344 I349 L424 F427 D447 I449 L454 F455 I525 Y526	L344-L451 HydrophobicContact CD1-CD1 4.22Å; L344-L451 HydrophobicContact CD1-CD2 4.14Å; L344-L451 HydrophobicContact CD1-CG 4.43Å; I349-L451 HydrophobicContact CD1-CD1 3.79Å; L424-L451 HydrophobicContact CD1-CD1 4.26Å; L424-L451 HydrophobicContact CD1-CD2 4.46Å; F427-L451 HydrophobicContact CD2-CD2 4.48Å; F427-L451 HydrophobicContact CE2-CB 4.43Å; F427-L451 HydrophobicContact CE2-CD2 3.86Å; F427-L451 HydrophobicContact CZ-CD2 4.38Å; D447-L451 WeakPolarHBondContact O-CB 3.39Å; D447-L451 PolarHBondContact O-N 3.37Å; I449-L451 VanDerWaalsContact C-N 3.3Å; I449-L451 PolarHBondContact O-N 2.81Å; L451-L454 PolarHBondContact O-N 3.26Å; L451-F455 WeakPolarHBondContact O-CB 3.45Å; L451-F455 PolarHBondContact O-N 3.36Å; L451-I525 HydrophobicContact CD2-CG1 4.31Å; L451-I525 HydrophobicContact CD2-CG2 4.2Å; L451-Y526 HydrophobicContact CD2-CD1 4.5Å; L451-Y526 HydrophobicContact CD2-CE1 3.77Å
452	L	94.9	Very high	91.5	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.016	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-43.8	173.9	179.7	62.4	0	0	0	111.5	S448 I449 I450 F455 A456 V480 F497 F507 I525	S448-L452 PolarHBondContact O-N 3.29Å; S448-L452 VanDerWaalsContact O-N 3.09Å; I449-L452 PolarHBondContact O-N 2.69Å; I450-L452 PolarHBondContact O-N 2.92Å; L452-F455 HydrophobicContact CD1-CD1 4.46Å; L452-F455 PolarHBondContact O-N 3Å; L452-A456 VanDerWaalsContact O-CB 3.23Å; L452-A456 WeakPolarHBondContact O-CB 3.28Å; L452-A456 PolarHBondContact O-N 3.2Å; L452-V480 HydrophobicContact CD2-CG1 4.27Å; L452-F497 HydrophobicContact CD1-CD1 4.02Å; L452-F497 HydrophobicContact CD1-CE1 4.42Å; L452-F497 HydrophobicContact CD1-CG 4.16Å; L452-F507 HydrophobicContact CB-CE1 4.47Å; L452-F507 HydrophobicContact CB-CZ 4.37Å; L452-F507 HydrophobicContact CD2-CD1 3.86Å; L452-F507 HydrophobicContact CD2-CE1 3.33Å; L452-F507 HydrophobicContact CD2-CZ 4.04Å; L452-F507 HydrophobicContact CG-CE1 4.47Å; L452-I525 HydrophobicContact CB-CD1 4.06Å; L452-I525 HydrophobicContact CD1-CD1 4.23Å
453	H	93.4	Very high	91.4	Very high	5 Å²	5	11.8 Å²	11.8	2%	0.023	6%	0.056	C	C	.	.	H	α-helix	trans	-62.4	-47.5	177.4	170.4	73.6	0	0	0	111.9	N280 A400 F401 F404 I449 I450 F455 A456 T457	N280-H453 PolarHBondContact ND2-CE1 3.25Å; N280-H453 PolarHBondContact ND2-ND1 2.77Å; A400-H453 PolarHBondContact O-NE2 3.26Å; F401-H453 PolarHBondContact O-CD2 3.28Å; F401-H453 PolarHBondContact O-NE2 3.45Å; F404-H453 HydrophobicContact CD2-CB 3.56Å; F404-H453 AromaticContact CD2-CD2 3.67Å; F404-H453 AromaticContact CD2-CG 3.3Å; F404-H453 AromaticContact CD2-ND1 3.69Å; F404-H453 HydrophobicContact CE2-CB 3.61Å; F404-H453 AromaticContact CE2-CG 3.92Å; F404-H453 HydrophobicContact CG-CB 4.3Å; F404-H453 AromaticContact CG-CD2 3.7Å; F404-H453 AromaticContact CG-CG 3.84Å; F404-H453 HydrophobicContact CZ-CB 4.37Å; I449-H453 PolarHBondContact O-N 3.02Å; I450-H453 WeakPolarHBondContact O-CB 3.43Å; I450-H453 PolarHBondContact O-N 3.27Å; I450-H453 VanDerWaalsContact O-N 3.12Å; H453-F455 VanDerWaalsContact C-N 3.34Å; H453-F455 PolarHBondContact O-N 3.34Å; H453-A456 PolarHBondContact O-N 3.18Å; H453-T457 PolarHBondContact CE1-OG1 2.98Å; H453-T457 VanDerWaalsContact CE1-OG1 3.24Å; H453-T457 PolarHBondContact NE2-OG1 3.42Å; H453-T457 VanDerWaalsContact O-CB 3.3Å; H453-T457 WeakPolarHBondContact O-CB 3.47Å; H453-T457 PolarHBondContact O-N 3.26Å; H453-T457 PolarHBondContact O-OG1 2.91Å
454	L	94.5	Very high	91.2	Very high	1 Å²	1	10 Å²	10	1%	0.005	5%	0.053	C	C	.	.	H	α-helix	trans	-62	-43.5	177.9	-63.7	178.6	0	0	0	111.5	I348 I349 I352 F401 L415 I450 L451 Y458	I348-L454 HydrophobicContact CG2-CB 4.1Å; I349-L454 HydrophobicContact CD1-CD1 4.32Å; I349-L454 HydrophobicContact CG1-CD1 3.78Å; I352-L454 HydrophobicContact CD1-CD2 3.91Å; F401-L454 HydrophobicContact CB-CD2 4.25Å; F401-L454 HydrophobicContact CD1-CD2 4.03Å; L415-L454 HydrophobicContact CD2-CD1 3.52Å; L415-L454 HydrophobicContact CD2-CD2 4.28Å; L415-L454 HydrophobicContact CD2-CG 4.47Å; I450-L454 HydrophobicContact CG2-CD1 3.86Å; I450-L454 HydrophobicContact CG2-CG 4.13Å; I450-L454 VanDerWaalsContact O-CG 3.29Å; I450-L454 WeakPolarHBondContact O-CG 3.35Å; I450-L454 PolarHBondContact O-N 3.36Å; L451-L454 PolarHBondContact O-N 3.26Å; L454-Y458 VanDerWaalsContact O-CB 3.28Å; L454-Y458 WeakPolarHBondContact O-CB 3.44Å; L454-Y458 PolarHBondContact O-N 2.83Å
455	F	94.8	Very high	90.7	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-62.2	-47.2	175.8	171.5	-108.9	0	0	0	112	W343 L344 I348 L451 L452 H453 T457 Y458 M459 F475 F497 I529 F533	W343-F455 HydrophobicContact CH2-CE2 4.42Å; W343-F455 HydrophobicContact CZ3-CD2 4.27Å; W343-F455 HydrophobicContact CZ3-CE2 4.25Å; L344-F455 HydrophobicContact CD2-CD2 4.2Å; I348-F455 HydrophobicContact CD1-CD2 4.38Å; L451-F455 WeakPolarHBondContact O-CB 3.45Å; L451-F455 PolarHBondContact O-N 3.36Å; L452-F455 HydrophobicContact CD1-CD1 4.46Å; L452-F455 PolarHBondContact O-N 3Å; H453-F455 VanDerWaalsContact C-N 3.34Å; H453-F455 PolarHBondContact O-N 3.34Å; F455-T457 PolarHBondContact O-N 3.37Å; F455-Y458 WeakPolarHBondContact O-CB 3.28Å; F455-Y458 PolarHBondContact O-N 3.15Å; F455-M459 HydrophobicContact CD2-CG 4.25Å; F455-M459 HydrophobicContact CE1-CG 4.21Å; F455-M459 HydrophobicContact CE2-CG 3.77Å; F455-M459 HydrophobicContact CE2-SD 4.14Å; F455-M459 HydrophobicContact CZ-CE 4.45Å; F455-M459 HydrophobicContact CZ-CG 3.75Å; F455-M459 HydrophobicContact CZ-SD 4.26Å; F455-M459 VanDerWaalsContact O-CG 3.3Å; F455-M459 WeakPolarHBondContact O-CG 3.21Å; F455-M459 PolarHBondContact O-N 3.41Å; F455-F475 HydrophobicContact CD1-CE1 4.25Å; F455-F475 HydrophobicContact CD1-CZ 4.42Å; F455-F475 AromaticContact CE1-CE1 3.89Å; F455-F475 HydrophobicContact CE1-CE1 3.89Å; F455-F475 AromaticContact CE1-CZ 3.62Å; F455-F475 HydrophobicContact CE1-CZ 3.62Å; F455-F475 HydrophobicContact CZ-CZ 4.21Å; F455-F497 AromaticContact CE1-CE2 3.95Å; F455-F497 HydrophobicContact CE1-CE2 3.95Å; F455-F497 AromaticContact CE1-CZ 3.87Å; F455-F497 HydrophobicContact CE1-CZ 3.87Å; F455-I529 HydrophobicContact CD1-CD1 4.35Å; F455-I529 HydrophobicContact CD1-CG1 4.3Å; F455-I529 HydrophobicContact CE1-CG1 4.3Å; F455-I529 HydrophobicContact CE2-CG2 4.21Å; F455-I529 HydrophobicContact CG-CD1 4.25Å; F455-I529 HydrophobicContact CZ-CG2 4.17Å; F455-F533 AromaticContact CE2-CE2 3.74Å; F455-F533 HydrophobicContact CE2-CE2 3.74Å; F455-F533 AromaticContact CE2-CZ 3.54Å; F455-F533 HydrophobicContact CE2-CZ 3.54Å; F455-F533 AromaticContact CZ-CE2 3.96Å; F455-F533 HydrophobicContact CZ-CE2 3.96Å; F455-F533 AromaticContact CZ-CZ 3.72Å; F455-F533 HydrophobicContact CZ-CZ 3.72Å
456	A	93.1	Very high	90.1	Very high	2 Å²	2	16.9 Å²	16.9	2%	0.017	9%	0.094	C	C	.	.	H	α-helix	trans	-64.1	-42.7	179.9	0	0	0	0	0	111.6	L452 H453 M459 D460 F475 S476 V480	L452-A456 VanDerWaalsContact O-CB 3.23Å; L452-A456 WeakPolarHBondContact O-CB 3.28Å; L452-A456 PolarHBondContact O-N 3.2Å; H453-A456 PolarHBondContact O-N 3.18Å; A456-M459 PolarHBondContact O-N 3.47Å; A456-D460 VanDerWaalsContact O-CG 3.27Å; A456-D460 PolarHBondContact O-N 3.42Å; A456-F475 HydrophobicContact CB-CD1 3.79Å; A456-F475 HydrophobicContact CB-CE1 4.01Å; A456-S476 WeakPolarHBondContact CB-OG 3.43Å; A456-V480 HydrophobicContact CB-CG2 4.18Å
457	T	91.6	Very high	89.3	Confident	2 Å²	2	22.5 Å²	22.5	1%	0.012	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-40.9	175.9	-55.6	0	0	0	0	111.5	A400 F401 H453 F455 M459 D460 T461	A400-T457 HydrophobicContact CB-CG2 3.73Å; F401-T457 HydrophobicContact CD1-CG2 3.56Å; F401-T457 HydrophobicContact CD2-CG2 4.04Å; F401-T457 HydrophobicContact CE1-CG2 3.65Å; F401-T457 HydrophobicContact CE2-CG2 4.1Å; F401-T457 HydrophobicContact CG-CG2 3.78Å; F401-T457 HydrophobicContact CZ-CG2 3.92Å; H453-T457 PolarHBondContact CE1-OG1 2.98Å; H453-T457 VanDerWaalsContact CE1-OG1 3.24Å; H453-T457 PolarHBondContact NE2-OG1 3.42Å; H453-T457 VanDerWaalsContact O-CB 3.3Å; H453-T457 WeakPolarHBondContact O-CB 3.47Å; H453-T457 PolarHBondContact O-N 3.26Å; H453-T457 PolarHBondContact O-OG1 2.91Å; F455-T457 PolarHBondContact O-N 3.37Å; T457-M459 VanDerWaalsContact C-N 3.34Å; T457-M459 PolarHBondContact O-N 2.91Å; T457-D460 WeakPolarHBondContact O-CB 3.29Å; T457-D460 PolarHBondContact O-N 2.95Å; T457-T461 WeakPolarHBondContact O-CG2 3.15Å; T457-T461 PolarHBondContact O-N 3.23Å
458	Y	92	Very high	88.4	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.9	-48.9	172	172.7	-85	0	0	0	110.5	L222 W343 T347 I348 L454 F455 D460 T461 R462 L553	L222-Y458 HydrophobicContact CB-CD2 4.12Å; L222-Y458 HydrophobicContact CB-CE2 3.54Å; L222-Y458 HydrophobicContact CD1-CD1 4.32Å; L222-Y458 HydrophobicContact CD1-CD2 3.16Å; L222-Y458 HydrophobicContact CD1-CE1 4.48Å; L222-Y458 HydrophobicContact CD1-CE2 3.37Å; L222-Y458 HydrophobicContact CD1-CG 3.65Å; L222-Y458 VanDerWaalsContact CD1-O 3.28Å; L222-Y458 WeakPolarHBondContact CD1-O 3.26Å; L222-Y458 HydrophobicContact CD2-CD2 3.23Å; L222-Y458 HydrophobicContact CD2-CE2 3.43Å; L222-Y458 VanDerWaalsContact CD2-CE2 3.43Å; L222-Y458 HydrophobicContact CD2-CG 4.36Å; L222-Y458 HydrophobicContact CG-CD2 3.64Å; L222-Y458 HydrophobicContact CG-CE2 3.61Å; L222-Y458 PolarHBondContact O-OH 2.91Å; W343-Y458 HydrophobicContact CH2-CD1 4.06Å; W343-Y458 AromaticContact CH2-CE1 3.64Å; W343-Y458 HydrophobicContact CH2-CE1 3.64Å; W343-Y458 AromaticContact CZ2-CE1 3.75Å; W343-Y458 HydrophobicContact CZ2-CE1 3.75Å; W343-Y458 AromaticContact CZ2-CZ 3.92Å; T347-Y458 HydrophobicContact CG2-CE2 3.71Å; I348-Y458 HydrophobicContact CB-CD2 4.46Å; I348-Y458 HydrophobicContact CD1-CD1 4.08Å; I348-Y458 HydrophobicContact CD1-CD2 3.9Å; I348-Y458 HydrophobicContact CD1-CG 3.63Å; I348-Y458 HydrophobicContact CG1-CD2 3.57Å; I348-Y458 HydrophobicContact CG1-CE2 4.09Å; I348-Y458 HydrophobicContact CG1-CG 3.88Å; L454-Y458 VanDerWaalsContact O-CB 3.28Å; L454-Y458 WeakPolarHBondContact O-CB 3.44Å; L454-Y458 PolarHBondContact O-N 2.83Å; F455-Y458 WeakPolarHBondContact O-CB 3.28Å; F455-Y458 PolarHBondContact O-N 3.15Å; Y458-D460 PolarHBondContact O-N 2.98Å; Y458-T461 PolarHBondContact O-N 3.42Å; Y458-T461 PolarHBondContact O-OG1 3.43Å; Y458-R462 HydrophobicContact CD1-CG 4.45Å; Y458-R462 HydrophobicContact CE1-CG 4.05Å; Y458-R462 WeakPolarHBondContact O-CG 3.14Å; Y458-R462 PolarHBondContact O-N 3.1Å; Y458-L553 HydrophobicContact CE1-CD2 4.09Å
459	M	90.6	Very high	87.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-62.6	-41.4	179.2	-69.3	-66	-83.4	0	0	112	F455 A456 T457 T461 R462 M463 F475 F532 F533 F543 L553	F455-M459 HydrophobicContact CD2-CG 4.25Å; F455-M459 HydrophobicContact CE1-CG 4.21Å; F455-M459 HydrophobicContact CE2-CG 3.77Å; F455-M459 HydrophobicContact CE2-SD 4.14Å; F455-M459 HydrophobicContact CZ-CE 4.45Å; F455-M459 HydrophobicContact CZ-CG 3.75Å; F455-M459 HydrophobicContact CZ-SD 4.26Å; F455-M459 VanDerWaalsContact O-CG 3.3Å; F455-M459 WeakPolarHBondContact O-CG 3.21Å; F455-M459 PolarHBondContact O-N 3.41Å; A456-M459 PolarHBondContact O-N 3.47Å; T457-M459 VanDerWaalsContact C-N 3.34Å; T457-M459 PolarHBondContact O-N 2.91Å; M459-T461 VanDerWaalsContact C-N 3.29Å; M459-T461 PolarHBondContact O-N 2.95Å; M459-R462 PolarHBondContact O-N 3.14Å; M459-M463 HydrophobicContact CB-CE 4.26Å; M459-M463 HydrophobicContact CE-CE 3.5Å; M459-M463 WeakPolarHBondContact O-CG 3.2Å; M459-M463 PolarHBondContact O-N 3.16Å; M459-M463 HydrophobicContact SD-CE 4.08Å; M459-F475 HydrophobicContact CB-CB 3.75Å; M459-F475 HydrophobicContact CB-CD1 3.77Å; M459-F475 HydrophobicContact CB-CD2 3.66Å; M459-F475 HydrophobicContact CB-CE1 4.26Å; M459-F475 HydrophobicContact CB-CE2 4.15Å; M459-F475 HydrophobicContact CB-CG 3.43Å; M459-F475 VanDerWaalsContact CB-CG 3.43Å; M459-F475 HydrophobicContact CB-CZ 4.42Å; M459-F475 HydrophobicContact CE-CD2 4.06Å; M459-F475 HydrophobicContact CE-CE2 3.81Å; M459-F475 HydrophobicContact CG-CD1 4.36Å; M459-F475 HydrophobicContact CG-CD2 4.15Å; M459-F475 HydrophobicContact CG-CE1 4.35Å; M459-F475 HydrophobicContact CG-CE2 4.13Å; M459-F475 HydrophobicContact CG-CG 4.25Å; M459-F475 HydrophobicContact CG-CZ 4.22Å; M459-F532 HydrophobicContact CE-CE1 4.1Å; M459-F532 HydrophobicContact CE-CZ 4.47Å; M459-F533 HydrophobicContact CE-CE1 4.14Å; M459-F533 HydrophobicContact CE-CZ 4.48Å; M459-F533 HydrophobicContact SD-CZ 4.41Å; M459-F543 HydrophobicContact CE-CD1 3.83Å; M459-F543 HydrophobicContact CE-CE1 3.96Å; M459-L553 HydrophobicContact CE-CD1 3.81Å; M459-L553 HydrophobicContact SD-CD1 3.66Å; M459-L553 HydrophobicContact SD-CD2 4.38Å
460	D	89.1	Confident	86.4	Confident	12 Å²	12	38.3 Å²	38.3	6%	0.064	21%	0.206	C	C	.	.	H	α-helix	trans	-53	-46.5	176.8	-75.1	-34.8	0	0	0	111.8	A456 T457 Y458 R462 M463 R473 V474 F475 S476	A456-D460 VanDerWaalsContact O-CG 3.27Å; A456-D460 PolarHBondContact O-N 3.42Å; T457-D460 WeakPolarHBondContact O-CB 3.29Å; T457-D460 PolarHBondContact O-N 2.95Å; Y458-D460 PolarHBondContact O-N 2.98Å; D460-R462 PolarHBondContact O-N 2.84Å; D460-M463 PolarHBondContact O-N 3.34Å; D460-R473 VanDerWaalsContact CG-CA 3.46Å; D460-R473 WeakPolarHBondContact OD1-CA 3.22Å; D460-R473 WeakPolarHBondContact OD2-CB 3.26Å; D460-V474 PolarHBondContact OD1-N 3.18Å; D460-F475 VanDerWaalsContact OD1-CA 3.25Å; D460-F475 WeakPolarHBondContact OD1-CA 3.4Å; D460-F475 WeakPolarHBondContact OD1-CB 3.34Å; D460-F475 PolarHBondContact OD1-N 2.82Å; D460-S476 PolarHBondContact OD1-N 2.9Å; D460-S476 VanDerWaalsContact OD2-CB 3.31Å; D460-S476 WeakPolarHBondContact OD2-CB 3.33Å; D460-S476 PolarHBondContact OD2-OG 2.74Å
461	T	85.3	Confident	85.3	Confident	23 Å²	23	39.1 Å²	39.1	14%	0.141	21%	0.212	C	C	.	.	H	α-helix	trans	-73.6	-9.5	-180	61.4	0	0	0	0	114.3	L222 V397 T457 Y458 M459	L222-T461 WeakPolarHBondContact CD1-OG1 3.39Å; V397-T461 HydrophobicContact CG1-CG2 3.85Å; T457-T461 WeakPolarHBondContact O-CG2 3.15Å; T457-T461 PolarHBondContact O-N 3.23Å; Y458-T461 PolarHBondContact O-N 3.42Å; Y458-T461 PolarHBondContact O-OG1 3.43Å; M459-T461 VanDerWaalsContact C-N 3.29Å; M459-T461 PolarHBondContact O-N 2.95Å
462	R	83.9	Confident	84.2	Confident	60 Å²	60	40.4 Å²	40.4	23%	0.226	23%	0.227	C	C	.	.	H	α-helix	trans	-100.3	-17	173.7	-57.1	-61.5	-78.1	173.1	-6.9	113.2	L222 Y458 M459 D460 V546 G552 L553	L222-R462 HydrophobicContact CD1-CG 3.8Å; Y458-R462 HydrophobicContact CD1-CG 4.45Å; Y458-R462 HydrophobicContact CE1-CG 4.05Å; Y458-R462 WeakPolarHBondContact O-CG 3.14Å; Y458-R462 PolarHBondContact O-N 3.1Å; M459-R462 PolarHBondContact O-N 3.14Å; D460-R462 PolarHBondContact O-N 2.84Å; R462-V546 WeakPolarHBondContact O-CG2 3.37Å; R462-G552 PolarHBondContact NH2-O 2.98Å; R462-L553 HydrophobicContact CB-CD2 3.75Å; R462-L553 HydrophobicContact CG-CD2 3.68Å
463	M	83	Confident	83.5	Confident	16 Å²	16	42 Å²	42	8%	0.079	23%	0.232	C	C	.	.	S	Bend	trans	-79.7	144	-179.1	-68.8	-48.5	126.9	0	0	111.4	M459 D460 V474 F475 F543 R544 V546	M459-M463 HydrophobicContact CB-CE 4.26Å; M459-M463 HydrophobicContact CE-CE 3.5Å; M459-M463 WeakPolarHBondContact O-CG 3.2Å; M459-M463 PolarHBondContact O-N 3.16Å; M459-M463 HydrophobicContact SD-CE 4.08Å; D460-M463 PolarHBondContact O-N 3.34Å; M463-V474 HydrophobicContact CB-CB 4.02Å; M463-V474 HydrophobicContact CB-CG1 4.21Å; M463-V474 HydrophobicContact CG-CB 4.46Å; M463-V474 HydrophobicContact CG-CG1 4.46Å; M463-F475 HydrophobicContact CG-CB 4.38Å; M463-F543 HydrophobicContact CE-CD1 3.43Å; M463-F543 VanDerWaalsContact CE-CD1 3.43Å; M463-F543 HydrophobicContact CE-CE1 3.48Å; M463-F543 VanDerWaalsContact CE-CE1 3.48Å; M463-F543 HydrophobicContact SD-CD1 3.62Å; M463-F543 HydrophobicContact SD-CE1 3.46Å; M463-F543 WeakPolarHBondContact SD-CE1 3.49Å; M463-R544 HydrophobicContact SD-CB 4.17Å; M463-V546 HydrophobicContact CE-CG2 4.18Å; M463-V546 HydrophobicContact SD-CG2 3.9Å
464	P	81.6	Confident	83.2	Confident	59 Å²	59	41.9 Å²	41.9	38%	0.383	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-64.8	152.9	166.4	28.9	-33.6	0	0	0	110.4	H466	P464-H466 PolarHBondContact O-N 3.41Å
465	P	78.5	Confident	83	Confident	105 Å²	105	41.8 Å²	41.8	68%	0.682	23%	0.232	S	C	*	.	P	Polyproline II helix	trans	-53.8	140.6	174.3	-25.3	33.9	0	0	0	111.8
466	H	78	Confident	82.7	Confident	54 Å²	54	42.6 Å²	42.6	25%	0.25	24%	0.237	C	C	.	.			trans	-119.6	134.8	179.3	-173.1	-87.5	0	0	0	109.8	P464 K468 C469 V474	P464-H466 PolarHBondContact O-N 3.41Å; H466-K468 PolarHBondContact ND1-N 3.06Å; H466-K468 PolarHBondContact O-N 2.83Å; H466-C469 HydrophobicContact CB-CB 4.2Å; H466-C469 PolarHBondContact O-N 3.23Å; H466-V474 HydrophobicContact CB-CB 4.4Å; H466-V474 HydrophobicContact CB-CG1 3.66Å; H466-V474 HydrophobicContact CB-CG2 3.84Å
467	P	76.5	Confident	82.4	Confident	119 Å²	119	46.3 Å²	46.3	77%	0.773	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-23.6	-172.3	23.4	-35.2	0	0	0	114.1
468	K	77.1	Confident	82.2	Confident	167 Å²	167	47.8 Å²	47.8	73%	0.726	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.2	-10.3	176.2	-58.1	-173.2	-178.7	-177.6	0	114.1	H466	H466-K468 PolarHBondContact ND1-N 3.06Å; H466-K468 PolarHBondContact O-N 2.83Å
469	C	77	Confident	82.2	Confident	8 Å²	8	47.8 Å²	47.8	5%	0.054	26%	0.262	C	S	.	.			trans	-116.2	78.4	-168.9	-61.9	0	0	0	0	110.4	H466 S471 G472 V474 Q477	H466-C469 HydrophobicContact CB-CB 4.2Å; H466-C469 PolarHBondContact O-N 3.23Å; C469-S471 PolarHBondContact O-N 3.25Å; C469-G472 PolarHBondContact O-N 3.09Å; C469-V474 HydrophobicContact CB-CB 4.48Å; C469-V474 HydrophobicContact CB-CG2 3.95Å; C469-Q477 VanDerWaalsContact CA-OE1 3.28Å; C469-Q477 VanDerWaalsContact CB-OE1 3.32Å; C469-Q477 PolarHBondContact SG-OE1 3.32Å; C469-Q477 VanDerWaalsContact SG-OE1 3.39Å
470	L	68.8	Low	82.2	Confident	162 Å²	162	48.2 Å²	48.2	85%	0.848	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-18	-176.6	-58.9	177.7	0	0	0	113.4	G472	L470-G472 VanDerWaalsContact C-N 3.3Å
471	S	71.4	Confident	82.3	Confident	19 Å²	19	48.5 Å²	48.5	13%	0.133	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-5	178.1	64.9	0	0	0	0	114	A274 C469 R473 Q477	A274-S471 VanDerWaalsContact O-O 3.08Å; C469-S471 PolarHBondContact O-N 3.25Å; S471-R473 PolarHBondContact O-N 3.04Å; S471-R473 VanDerWaalsContact O-N 3.11Å; S471-R473 PolarHBondContact OG-N 2.93Å; S471-Q477 VanDerWaalsContact OG-CD 3.24Å; S471-Q477 PolarHBondContact OG-NE2 3.49Å
472	G	72.3	Confident	82.5	Confident	32 Å²	32	48.6 Å²	48.6	33%	0.33	27%	0.265	S	S	.	.	S	Bend	trans	71.5	-7.8	-169.4	0	0	0	0	0	114.9	C469 L470 V474	C469-G472 PolarHBondContact O-N 3.09Å; L470-G472 VanDerWaalsContact C-N 3.3Å; G472-V474 VanDerWaalsContact C-N 3.27Å; G472-V474 PolarHBondContact O-N 3.44Å
473	R	82	Confident	82.6	Confident	35 Å²	35	49.1 Å²	49.1	13%	0.132	27%	0.272	C	S	.	.			trans	-85.7	62.3	178.7	-60	-164.6	-175.6	-178.2	4.8	112.4	N280 D403 D460 S471 F475 S476 Q477	N280-R473 PolarHBondContact ND2-NH1 3.36Å; D403-R473 IonicContact OD2-CZ 2.59Å; D403-R473 IonicContact OD2-NH1 2.84Å; D403-R473 IonicContact OD2-NH2 3.76Å; D403-R473 PolarHBondContact OD2-NH2 3.46Å; D460-R473 VanDerWaalsContact CG-CA 3.46Å; D460-R473 WeakPolarHBondContact OD1-CA 3.22Å; D460-R473 WeakPolarHBondContact OD2-CB 3.26Å; S471-R473 PolarHBondContact O-N 3.04Å; S471-R473 VanDerWaalsContact O-N 3.11Å; S471-R473 PolarHBondContact OG-N 2.93Å; R473-F475 PolarHBondContact O-N 2.9Å; R473-S476 PolarHBondContact O-N 3.42Å; R473-Q477 VanDerWaalsContact O-CB 3.31Å; R473-Q477 WeakPolarHBondContact O-CB 3.49Å; R473-Q477 VanDerWaalsContact O-CG 3.27Å; R473-Q477 WeakPolarHBondContact O-CG 3.33Å; R473-Q477 PolarHBondContact O-N 2.89Å
474	V	86.4	Confident	82.6	Confident	3 Å²	3	53.6 Å²	53.6	2%	0.018	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-48.9	-172.2	179.2	0	0	0	0	112.6	D460 M463 H466 C469 G472 L478	D460-V474 PolarHBondContact OD1-N 3.18Å; M463-V474 HydrophobicContact CB-CB 4.02Å; M463-V474 HydrophobicContact CB-CG1 4.21Å; M463-V474 HydrophobicContact CG-CB 4.46Å; M463-V474 HydrophobicContact CG-CG1 4.46Å; H466-V474 HydrophobicContact CB-CB 4.4Å; H466-V474 HydrophobicContact CB-CG1 3.66Å; H466-V474 HydrophobicContact CB-CG2 3.84Å; C469-V474 HydrophobicContact CB-CB 4.48Å; C469-V474 HydrophobicContact CB-CG2 3.95Å; G472-V474 VanDerWaalsContact C-N 3.27Å; G472-V474 PolarHBondContact O-N 3.44Å; V474-L478 HydrophobicContact CG1-CD1 3.85Å; V474-L478 VanDerWaalsContact O-CB 3.27Å; V474-L478 WeakPolarHBondContact O-CB 3.45Å; V474-L478 VanDerWaalsContact O-CG 3.24Å; V474-L478 WeakPolarHBondContact O-CG 3.39Å; V474-L478 PolarHBondContact O-N 3.48Å
475	F	90.5	Very high	82.8	Confident	0 Å²	0	56 Å²	56	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-68.7	-49.3	179	-174.3	-89.5	0	0	0	111.2	F455 A456 M459 D460 M463 R473 Q477 L478 N479 V480 F497 F532 F543	F455-F475 HydrophobicContact CD1-CE1 4.25Å; F455-F475 HydrophobicContact CD1-CZ 4.42Å; F455-F475 AromaticContact CE1-CE1 3.89Å; F455-F475 HydrophobicContact CE1-CE1 3.89Å; F455-F475 AromaticContact CE1-CZ 3.62Å; F455-F475 HydrophobicContact CE1-CZ 3.62Å; F455-F475 HydrophobicContact CZ-CZ 4.21Å; A456-F475 HydrophobicContact CB-CD1 3.79Å; A456-F475 HydrophobicContact CB-CE1 4.01Å; M459-F475 HydrophobicContact CB-CB 3.75Å; M459-F475 HydrophobicContact CB-CD1 3.77Å; M459-F475 HydrophobicContact CB-CD2 3.66Å; M459-F475 HydrophobicContact CB-CE1 4.26Å; M459-F475 HydrophobicContact CB-CE2 4.15Å; M459-F475 HydrophobicContact CB-CG 3.43Å; M459-F475 VanDerWaalsContact CB-CG 3.43Å; M459-F475 HydrophobicContact CB-CZ 4.42Å; M459-F475 HydrophobicContact CE-CD2 4.06Å; M459-F475 HydrophobicContact CE-CE2 3.81Å; M459-F475 HydrophobicContact CG-CD1 4.36Å; M459-F475 HydrophobicContact CG-CD2 4.15Å; M459-F475 HydrophobicContact CG-CE1 4.35Å; M459-F475 HydrophobicContact CG-CE2 4.13Å; M459-F475 HydrophobicContact CG-CG 4.25Å; M459-F475 HydrophobicContact CG-CZ 4.22Å; D460-F475 VanDerWaalsContact OD1-CA 3.25Å; D460-F475 WeakPolarHBondContact OD1-CA 3.4Å; D460-F475 WeakPolarHBondContact OD1-CB 3.34Å; D460-F475 PolarHBondContact OD1-N 2.82Å; M463-F475 HydrophobicContact CG-CB 4.38Å; R473-F475 PolarHBondContact O-N 2.9Å; F475-Q477 PolarHBondContact O-N 3.06Å; F475-L478 PolarHBondContact O-N 2.86Å; F475-N479 HydrophobicContact CD1-CB 4.32Å; F475-N479 HydrophobicContact CD2-CB 3.82Å; F475-N479 HydrophobicContact CE1-CB 4.26Å; F475-N479 HydrophobicContact CE2-CB 3.77Å; F475-N479 HydrophobicContact CG-CB 4.12Å; F475-N479 HydrophobicContact CZ-CB 3.99Å; F475-N479 WeakPolarHBondContact O-CA 3.47Å; F475-N479 VanDerWaalsContact O-CB 3.27Å; F475-N479 WeakPolarHBondContact O-CB 3.36Å; F475-N479 PolarHBondContact O-N 2.64Å; F475-V480 HydrophobicContact CD1-CG2 4.27Å; F475-V480 HydrophobicContact CE1-CG2 4.02Å; F475-F497 HydrophobicContact CE1-CD2 4.49Å; F475-F497 HydrophobicContact CE1-CE2 4.45Å; F475-F497 HydrophobicContact CZ-CD2 4.16Å; F475-F497 AromaticContact CZ-CE2 3.82Å; F475-F497 HydrophobicContact CZ-CE2 3.82Å; F475-F532 HydrophobicContact CE2-CE1 4.17Å; F475-F532 HydrophobicContact CE2-CE2 4.01Å; F475-F532 AromaticContact CE2-CZ 3.58Å; F475-F532 HydrophobicContact CE2-CZ 3.58Å; F475-F532 HydrophobicContact CZ-CE2 4.35Å; F475-F532 HydrophobicContact CZ-CZ 4.19Å; F475-F543 AromaticContact CD2-CE1 3.75Å; F475-F543 HydrophobicContact CD2-CE1 3.75Å; F475-F543 AromaticContact CD2-CZ 3.94Å; F475-F543 HydrophobicContact CD2-CZ 3.94Å; F475-F543 HydrophobicContact CE2-CE1 4.02Å; F475-F543 HydrophobicContact CE2-CZ 4.04Å
476	S	88.8	Confident	83.1	Confident	17 Å²	17	60 Å²	60	12%	0.119	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-31.8	-178.9	-64	0	0	0	0	112.9	A456 D460 R473	A456-S476 WeakPolarHBondContact CB-OG 3.43Å; D460-S476 PolarHBondContact OD1-N 2.9Å; D460-S476 VanDerWaalsContact OD2-CB 3.31Å; D460-S476 WeakPolarHBondContact OD2-CB 3.33Å; D460-S476 PolarHBondContact OD2-OG 2.74Å; R473-S476 PolarHBondContact O-N 3.42Å
477	Q	86.2	Confident	83.4	Confident	80 Å²	80	58.3 Å²	58.3	37%	0.374	31%	0.312	S	S	.	.	H	α-helix	trans	-85.5	-34.8	179.2	-71	-176.3	-17.4	0	0	114	C469 S471 R473 F475	C469-Q477 VanDerWaalsContact CA-OE1 3.28Å; C469-Q477 VanDerWaalsContact CB-OE1 3.32Å; C469-Q477 PolarHBondContact SG-OE1 3.32Å; C469-Q477 VanDerWaalsContact SG-OE1 3.39Å; S471-Q477 VanDerWaalsContact OG-CD 3.24Å; S471-Q477 PolarHBondContact OG-NE2 3.49Å; R473-Q477 VanDerWaalsContact O-CB 3.31Å; R473-Q477 WeakPolarHBondContact O-CB 3.49Å; R473-Q477 VanDerWaalsContact O-CG 3.27Å; R473-Q477 WeakPolarHBondContact O-CG 3.33Å; R473-Q477 PolarHBondContact O-N 2.89Å; F475-Q477 PolarHBondContact O-N 3.06Å
478	L	87.4	Confident	83.6	Confident	33 Å²	33	55.9 Å²	55.9	17%	0.173	29%	0.292	C	S	.	.	H	α-helix	trans	-96.8	-26.1	-174.3	-60.8	179.4	0	0	0	113.5	V474 F475 Q496	V474-L478 HydrophobicContact CG1-CD1 3.85Å; V474-L478 VanDerWaalsContact O-CB 3.27Å; V474-L478 WeakPolarHBondContact O-CB 3.45Å; V474-L478 VanDerWaalsContact O-CG 3.24Å; V474-L478 WeakPolarHBondContact O-CG 3.39Å; V474-L478 PolarHBondContact O-N 3.48Å; F475-L478 PolarHBondContact O-N 2.86Å; L478-Q496 PolarHBondContact O-NE2 3.32Å
479	N	90.8	Very high	83.9	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.7	-3.3	-168.7	-63.8	90	0	0	0	113	F475 C495 Q496 F497 R544	F475-N479 HydrophobicContact CD1-CB 4.32Å; F475-N479 HydrophobicContact CD2-CB 3.82Å; F475-N479 HydrophobicContact CE1-CB 4.26Å; F475-N479 HydrophobicContact CE2-CB 3.77Å; F475-N479 HydrophobicContact CG-CB 4.12Å; F475-N479 HydrophobicContact CZ-CB 3.99Å; F475-N479 WeakPolarHBondContact O-CA 3.47Å; F475-N479 VanDerWaalsContact O-CB 3.27Å; F475-N479 WeakPolarHBondContact O-CB 3.36Å; F475-N479 PolarHBondContact O-N 2.64Å; N479-C495 PolarHBondContact ND2-O 3.09Å; N479-Q496 CarbonylContact O-C 3.26Å; N479-Q496 WeakPolarHBondContact O-CA 3.37Å; N479-F497 PolarHBondContact O-N 3.46Å; N479-R544 PolarHBondContact OD1-NE 3.24Å; N479-R544 PolarHBondContact OD1-NH2 3.18Å
480	V	91.4	Very high	83.7	Confident	8 Å²	8	58.3 Å²	58.3	5%	0.048	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	114	174.2	-174.2	0	0	0	0	110	L452 A456 F475 R482	L452-V480 HydrophobicContact CD2-CG1 4.27Å; A456-V480 HydrophobicContact CB-CG2 4.18Å; F475-V480 HydrophobicContact CD1-CG2 4.27Å; F475-V480 HydrophobicContact CE1-CG2 4.02Å; V480-R482 HydrophobicContact CG1-CG 4.47Å
481	V	90.6	Very high	83.6	Confident	19 Å²	19	51.9 Å²	51.9	12%	0.115	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.8	177.3	-176.4	0	0	0	0	108.2	D485 P487 Q496 F497 Y498 Q499	V481-D485 HydrophobicContact CG1-CB 3.99Å; V481-D485 WeakPolarHBondContact CG1-O 3.48Å; V481-P487 HydrophobicContact CG1-CB 4.49Å; V481-Q496 HydrophobicContact CG2-CB 4.27Å; V481-F497 PolarHBondContact N-O 3.3Å; V481-Y498 HydrophobicContact CB-CD2 4.21Å; V481-Y498 HydrophobicContact CG1-CD2 4.02Å; V481-Y498 HydrophobicContact CG1-CE2 4.34Å; V481-Y498 CarbonylContact O-C 3.58Å; V481-Y498 WeakPolarHBondContact O-CA 3.38Å; V481-Q499 PolarHBondContact O-N 3.2Å
482	R	89.4	Confident	83	Confident	25 Å²	25	57.9 Å²	57.9	9%	0.094	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	140.9	-178	-57.2	178.4	179.5	82	-0.5	108.4	C282 Y285 V480 D485 Q499	C282-R482 PolarHBondContact SG-NH2 2.82Å; C282-R482 VanDerWaalsContact SG-NH2 3.44Å; Y285-R482 HydrophobicContact CD1-CB 4.03Å; Y285-R482 VanDerWaalsContact CD1-CD 3.49Å; Y285-R482 HydrophobicContact CD1-CG 4.14Å; Y285-R482 HydrophobicContact CD2-CB 4.03Å; Y285-R482 HydrophobicContact CE1-CB 4.01Å; Y285-R482 HydrophobicContact CE1-CG 4.34Å; Y285-R482 HydrophobicContact CE2-CB 4.15Å; Y285-R482 HydrophobicContact CG-CB 3.97Å; Y285-R482 HydrophobicContact CG-CG 4.36Å; V480-R482 HydrophobicContact CG1-CG 4.47Å; R482-D485 VanDerWaalsContact O-CB 3.3Å; R482-D485 WeakPolarHBondContact O-CB 3.49Å; R482-D485 PolarHBondContact O-N 3.06Å; R482-Q499 HydrophobicContact CG-CB 4.19Å
483	L	86.2	Confident	82.3	Confident	71 Å²	71	63.2 Å²	63.2	37%	0.372	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53	144.6	171.4	-167.8	68.8	0	0	0	109.3	Y285 D485 Y498 Q499 V500	Y285-L483 VanDerWaalsContact CD2-O 3.29Å; Y285-L483 WeakPolarHBondContact CD2-O 3.2Å; Y285-L483 WeakPolarHBondContact CE2-O 3.41Å; L483-D485 VanDerWaalsContact C-N 3.33Å; L483-Y498 WeakPolarHBondContact CD1-OH 3.36Å; L483-Q499 PolarHBondContact N-O 3.42Å; L483-V500 WeakPolarHBondContact CD2-O 3.38Å
484	P	83.4	Confident	81.9	Confident	110 Å²	110	63.3 Å²	63.3	71%	0.714	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	cis	-79.7	-0	3.1	35.5	-36.6	0	0	0	114.9	K486	P484-K486 PolarHBondContact O-N 3.28Å
485	D	85.2	Confident	81.9	Confident	109 Å²	109	63.1 Å²	63.1	58%	0.583	32%	0.315	S	S	*	.	S	Bend	trans	-66.8	133.9	-177.2	-62.9	-30.9	0	0	0	111.1	V481 R482 L483 Y498	V481-D485 HydrophobicContact CG1-CB 3.99Å; V481-D485 WeakPolarHBondContact CG1-O 3.48Å; R482-D485 VanDerWaalsContact O-CB 3.3Å; R482-D485 WeakPolarHBondContact O-CB 3.49Å; R482-D485 PolarHBondContact O-N 3.06Å; L483-D485 VanDerWaalsContact C-N 3.33Å; D485-Y498 WeakPolarHBondContact O-CE2 3.05Å
486	K	85.7	Confident	82	Confident	189 Å²	189	63.9 Å²	63.9	82%	0.822	32%	0.318	S	S	*	.	P	Polyproline II helix	trans	-82.8	133.8	178.1	-65.1	-176	-179.6	-177.2	0	110	P484	P484-K486 PolarHBondContact O-N 3.28Å
487	P	84.9	Confident	82.3	Confident	18 Å²	18	63.1 Å²	63.1	12%	0.117	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-66.5	151.7	176.7	27.7	-34.2	0	0	0	111.9	V481 L489 Y498 V510 I515	V481-P487 HydrophobicContact CG1-CB 4.49Å; P487-L489 HydrophobicContact CG-CD2 4.39Å; P487-L489 PolarHBondContact O-N 2.96Å; P487-Y498 HydrophobicContact CG-CD1 4.32Å; P487-Y498 HydrophobicContact CG-CD2 4.43Å; P487-Y498 HydrophobicContact CG-CE1 4.49Å; P487-Y498 HydrophobicContact CG-CG 4.3Å; P487-V510 HydrophobicContact CB-CG2 3.71Å; P487-V510 HydrophobicContact CG-CG2 3.99Å; P487-I515 HydrophobicContact CG-CD1 4.24Å
488	D	81	Confident	82.6	Confident	68 Å²	68	60.7 Å²	60.7	36%	0.364	30%	0.3	S	S	.	.			trans	-81.3	99.6	177.6	176.3	27.3	0	0	0	110.6	K490 S491 Q496	D488-K490 VanDerWaalsContact C-N 3.27Å; D488-K490 PolarHBondContact O-N 3.49Å; D488-K490 VanDerWaalsContact OD1-CB 3.31Å; D488-K490 WeakPolarHBondContact OD1-CB 3.21Å; D488-K490 PolarHBondContact OD1-N 3.35Å; D488-S491 VanDerWaalsContact OD2-CB 3.28Å; D488-S491 WeakPolarHBondContact OD2-CB 3.4Å; D488-S491 PolarHBondContact OD2-OG 3.02Å; D488-Q496 VanDerWaalsContact N-OE1 3.08Å
489	L	81.9	Confident	82.9	Confident	58 Å²	58	59.1 Å²	59.1	30%	0.304	29%	0.292	S	S	.	.			trans	-80.6	-5	176.4	-56	-179	0	0	0	113.4	I314 P487 V510 G513 I515	I314-L489 HydrophobicContact CG1-CD1 4.48Å; I314-L489 HydrophobicContact CG2-CD1 4.27Å; P487-L489 HydrophobicContact CG-CD2 4.39Å; P487-L489 PolarHBondContact O-N 2.96Å; L489-V510 HydrophobicContact CD2-CG1 3.6Å; L489-G513 VanDerWaalsContact O-CA 3.24Å; L489-G513 WeakPolarHBondContact O-CA 3.27Å; L489-I515 HydrophobicContact CD2-CD1 4.14Å; L489-I515 HydrophobicContact CD2-CG1 3.76Å
490	K	73.4	Confident	82.9	Confident	169 Å²	169	60.8 Å²	60.8	74%	0.735	30%	0.302	S	S	*	.	S	Bend	trans	-85.5	-26.3	-175.8	-60	179.8	-179.2	176.6	0	112.3	D488 K492	D488-K490 VanDerWaalsContact C-N 3.27Å; D488-K490 PolarHBondContact O-N 3.49Å; D488-K490 VanDerWaalsContact OD1-CB 3.31Å; D488-K490 WeakPolarHBondContact OD1-CB 3.21Å; D488-K490 PolarHBondContact OD1-N 3.35Å; K490-K492 PolarHBondContact O-N 3.35Å
491	S	67.4	Low	82.8	Confident	26 Å²	26	61.7 Å²	61.7	18%	0.182	31%	0.31	C	S	.	.			trans	-81.8	99.7	-177.8	48.9	0	0	0	0	112.2	D488 H493 N494	D488-S491 VanDerWaalsContact OD2-CB 3.28Å; D488-S491 WeakPolarHBondContact OD2-CB 3.4Å; D488-S491 PolarHBondContact OD2-OG 3.02Å; S491-H493 PolarHBondContact O-N 2.82Å; S491-N494 PolarHBondContact O-N 3.48Å; S491-N494 WeakPolarHBondContact OG-CB 3.46Å; S491-N494 PolarHBondContact OG-ND2 2.86Å; S491-N494 VanDerWaalsContact OG-ND2 3.13Å
492	K	58.2	Low	82.6	Confident	146 Å²	146	61.4 Å²	61.4	64%	0.635	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-11.9	178.9	-68.4	-173.8	177.3	-177.5	0	115.3	K490 N512	K490-K492 PolarHBondContact O-N 3.35Å; K492-N512 PolarHBondContact O-OD1 2.81Å; K492-N512 VanDerWaalsContact O-OD1 3.04Å
493	H	58.2	Low	82.4	Confident	143 Å²	143	63.1 Å²	63.1	66%	0.662	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.4	8.7	-173.8	-58.4	-64.4	0	0	0	114.4	S491	S491-H493 PolarHBondContact O-N 2.82Å
494	N	72.6	Confident	82.5	Confident	37 Å²	37	63.4 Å²	63.4	20%	0.198	32%	0.324	C	S	.	.			trans	-103.1	144.1	173.8	-78.3	-30.1	0	0	0	111	S491 R544	S491-N494 PolarHBondContact O-N 3.48Å; S491-N494 WeakPolarHBondContact OG-CB 3.46Å; S491-N494 PolarHBondContact OG-ND2 2.86Å; S491-N494 VanDerWaalsContact OG-ND2 3.13Å; N494-R544 PolarHBondContact OD1-NH2 3.5Å
495	C	87	Confident	82.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	124.9	168.3	-55.1	0	0	0	0	107.8	N479 V510 L511 F532 Y535 Y536	N479-C495 PolarHBondContact ND2-O 3.09Å; C495-V510 CarbonylContact C-O 3.52Å; C495-V510 WeakPolarHBondContact CA-O 3.46Å; C495-L511 HydrophobicContact CB-CD2 3.53Å; C495-L511 WeakPolarHBondContact SG-CD2 3.45Å; C495-F532 HydrophobicContact CB-CD2 3.62Å; C495-F532 HydrophobicContact CB-CE2 3.7Å; C495-Y535 WeakPolarHBondContact SG-CD1 3.24Å; C495-Y535 WeakPolarHBondContact SG-CE1 3.16Å; C495-Y536 HydrophobicContact CB-CE2 3.9Å; C495-Y536 WeakPolarHBondContact SG-CE2 3.46Å; C495-Y536 PolarHBondContact SG-OH 3.08Å
496	Q	92.3	Very high	83.2	Confident	15 Å²	15	55.8 Å²	55.8	7%	0.07	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	134.2	-177.6	-55.5	-176.6	-49	0	0	110.6	L478 N479 V481 D488 L509 V510	L478-Q496 PolarHBondContact O-NE2 3.32Å; N479-Q496 CarbonylContact O-C 3.26Å; N479-Q496 WeakPolarHBondContact O-CA 3.37Å; V481-Q496 HydrophobicContact CG2-CB 4.27Å; D488-Q496 VanDerWaalsContact N-OE1 3.08Å; Q496-L509 WeakPolarHBondContact O-CD1 3.48Å; Q496-V510 HydrophobicContact CB-CB 4.22Å; Q496-V510 PolarHBondContact N-O 3.28Å; Q496-V510 PolarHBondContact O-N 3.08Å
497	F	94.1	Very high	83.6	Confident	1 Å²	1	46.8 Å²	46.8	0%	0.004	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	124.3	162.5	-69.5	-95.5	0	0	0	107.7	L452 F455 F475 N479 V481 L509 A528 I529 F532	L452-F497 HydrophobicContact CD1-CD1 4.02Å; L452-F497 HydrophobicContact CD1-CE1 4.42Å; L452-F497 HydrophobicContact CD1-CG 4.16Å; F455-F497 AromaticContact CE1-CE2 3.95Å; F455-F497 HydrophobicContact CE1-CE2 3.95Å; F455-F497 AromaticContact CE1-CZ 3.87Å; F455-F497 HydrophobicContact CE1-CZ 3.87Å; F475-F497 HydrophobicContact CE1-CD2 4.49Å; F475-F497 HydrophobicContact CE1-CE2 4.45Å; F475-F497 HydrophobicContact CZ-CD2 4.16Å; F475-F497 AromaticContact CZ-CE2 3.82Å; F475-F497 HydrophobicContact CZ-CE2 3.82Å; N479-F497 PolarHBondContact O-N 3.46Å; V481-F497 PolarHBondContact N-O 3.3Å; F497-L509 HydrophobicContact CD1-CD1 3.95Å; F497-L509 HydrophobicContact CD2-CD1 4.16Å; F497-L509 HydrophobicContact CE1-CD1 4.04Å; F497-L509 HydrophobicContact CE2-CD1 4.2Å; F497-L509 HydrophobicContact CG-CD1 4.02Å; F497-L509 HydrophobicContact CZ-CD1 4.16Å; F497-A528 HydrophobicContact CD1-CB 3.98Å; F497-A528 HydrophobicContact CE1-CB 3.64Å; F497-I529 HydrophobicContact CE1-CG1 3.92Å; F497-I529 HydrophobicContact CZ-CG1 4.02Å; F497-F532 HydrophobicContact CD2-CD2 4.45Å; F497-F532 HydrophobicContact CE2-CB 4.04Å; F497-F532 HydrophobicContact CE2-CD1 4.45Å; F497-F532 AromaticContact CE2-CD2 3.64Å; F497-F532 HydrophobicContact CE2-CD2 3.64Å; F497-F532 HydrophobicContact CE2-CE2 4.24Å; F497-F532 AromaticContact CE2-CG 3.78Å; F497-F532 HydrophobicContact CE2-CG 3.78Å; F497-F532 HydrophobicContact CZ-CB 3.76Å; F497-F532 HydrophobicContact CZ-CD2 4.25Å; F497-F532 AromaticContact CZ-CG 3.96Å; F497-F532 HydrophobicContact CZ-CG 3.96Å
498	Y	93.4	Very high	84.1	Confident	29 Å²	29	47.3 Å²	47.3	11%	0.114	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	106	175	-178.6	-138.6	0	0	0	109.1	V481 L483 D485 P487 V500 F507 K508	V481-Y498 HydrophobicContact CB-CD2 4.21Å; V481-Y498 HydrophobicContact CG1-CD2 4.02Å; V481-Y498 HydrophobicContact CG1-CE2 4.34Å; V481-Y498 CarbonylContact O-C 3.58Å; V481-Y498 WeakPolarHBondContact O-CA 3.38Å; L483-Y498 WeakPolarHBondContact CD1-OH 3.36Å; D485-Y498 WeakPolarHBondContact O-CE2 3.05Å; P487-Y498 HydrophobicContact CG-CD1 4.32Å; P487-Y498 HydrophobicContact CG-CD2 4.43Å; P487-Y498 HydrophobicContact CG-CE1 4.49Å; P487-Y498 HydrophobicContact CG-CG 4.3Å; Y498-V500 HydrophobicContact CD1-CG2 3.74Å; Y498-V500 HydrophobicContact CE1-CG2 3.76Å; Y498-V500 HydrophobicContact CG-CG2 4.36Å; Y498-V500 PolarHBondContact O-N 2.59Å; Y498-F507 WeakPolarHBondContact O-CA 3.45Å; Y498-K508 HydrophobicContact CD1-CB 4.29Å; Y498-K508 HydrophobicContact CD1-CD 4.3Å; Y498-K508 PolarHBondContact N-O 2.73Å; Y498-K508 PolarHBondContact O-N 3.45Å
499	Q	92.8	Very high	84.7	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	108.7	178.2	-175.8	177	-4.6	0	0	109.6	Y285 V481 R482 L483 F507	Y285-Q499 HydrophobicContact CE1-CG 4.1Å; V481-Q499 PolarHBondContact O-N 3.2Å; R482-Q499 HydrophobicContact CG-CB 4.19Å; L483-Q499 PolarHBondContact N-O 3.42Å; Q499-F507 HydrophobicContact CB-CD1 3.92Å; Q499-F507 HydrophobicContact CB-CE1 4.01Å; Q499-F507 HydrophobicContact CG-CD1 3.95Å; Q499-F507 HydrophobicContact CG-CE1 3.66Å
500	V	91.5	Very high	85.3	Confident	35 Å²	35	41.3 Å²	41.3	21%	0.212	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	-35	-174.7	-177.1	0	0	0	0	111.4	L483 Y498 Q506 K508	L483-V500 WeakPolarHBondContact CD2-O 3.38Å; Y498-V500 HydrophobicContact CD1-CG2 3.74Å; Y498-V500 HydrophobicContact CE1-CG2 3.76Å; Y498-V500 HydrophobicContact CG-CG2 4.36Å; Y498-V500 PolarHBondContact O-N 2.59Å; V500-Q506 PolarHBondContact N-O 2.8Å; V500-K508 HydrophobicContact CG2-CB 4.4Å; V500-K508 HydrophobicContact CG2-CD 3.76Å; V500-K508 HydrophobicContact CG2-CG 3.76Å
501	A	89.1	Confident	86	Confident	27 Å²	27	33.4 Å²	33.4	22%	0.223	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	149	179.8	0	0	0	0	0	111.1	P504 P505 Q506	A501-P504 VanDerWaalsContact CB-O 3.24Å; A501-P504 WeakPolarHBondContact CB-O 3.44Å; A501-P505 WeakPolarHBondContact O-CA 3.29Å; A501-Q506 HydrophobicContact CB-CB 4.04Å; A501-Q506 PolarHBondContact N-O 3.15Å; A501-Q506 PolarHBondContact O-N 3.13Å
502	V	86.4	Confident	86.8	Confident	14 Å²	14	35.3 Å²	35.3	9%	0.085	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	-42.4	172.9	174.3	0	0	0	0	111.1	Y285 L286 S289 P505	Y285-V502 HydrophobicContact CD1-CG2 3.87Å; Y285-V502 HydrophobicContact CE1-CG2 3.25Å; L286-V502 HydrophobicContact CD2-CG1 3.5Å; L286-V502 VanDerWaalsContact CD2-CG1 3.5Å; L286-V502 HydrophobicContact CD2-CG2 4.31Å; S289-V502 VanDerWaalsContact OG-CG2 3.29Å; S289-V502 WeakPolarHBondContact OG-CG2 3.44Å; V502-P505 WeakPolarHBondContact O-CA 3.28Å
503	Q	85.7	Confident	88.1	Confident	60 Å²	60	29.4 Å²	29.4	28%	0.28	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-143.6	114.5	-176.3	-169.2	62.5	32.5	0	0	110.4	D430	D430-Q503 PolarHBondContact O-NE2 2.75Å; D430-Q503 PolarHBondContact O-OE1 2.84Å
504	P	87.8	Confident	89.5	Confident	77 Å²	77	26.4 Å²	26.4	50%	0.5	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	cis	-61.3	146.9	-13.3	28.8	-34.4	0	0	0	110.8	W429 A501 Q506	W429-P504 HydrophobicContact CH2-CB 3.79Å; W429-P504 HydrophobicContact CZ3-CB 3.79Å; A501-P504 VanDerWaalsContact CB-O 3.24Å; A501-P504 WeakPolarHBondContact CB-O 3.44Å; P504-Q506 PolarHBondContact O-N 2.82Å
505	P	91.3	Very high	90.4	Very high	3 Å²	3	25 Å²	25	2%	0.019	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.5	128.9	-177.7	26.8	-33.3	0	0	0	110.8	W429 S446 I449 A501 V502 F507	W429-P505 HydrophobicContact CE3-CG 4.04Å; W429-P505 HydrophobicContact CZ3-CG 4.34Å; W429-P505 WeakPolarHBondContact O-CG 3.38Å; S446-P505 WeakPolarHBondContact OG-CG 3.27Å; I449-P505 HydrophobicContact CD1-CB 3.62Å; I449-P505 HydrophobicContact CG1-CB 4.38Å; A501-P505 WeakPolarHBondContact O-CA 3.29Å; V502-P505 WeakPolarHBondContact O-CA 3.28Å; P505-F507 HydrophobicContact CB-CE2 4.26Å; P505-F507 HydrophobicContact CB-CZ 4.4Å
506	Q	93	Very high	90.8	Very high	57 Å²	57	25.6 Å²	25.6	27%	0.266	14%	0.137	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	124.8	177.8	-168.4	-179.2	16.8	0	0	110.7	V500 A501 P504 S520	V500-Q506 PolarHBondContact N-O 2.8Å; A501-Q506 HydrophobicContact CB-CB 4.04Å; A501-Q506 PolarHBondContact N-O 3.15Å; A501-Q506 PolarHBondContact O-N 3.13Å; P504-Q506 PolarHBondContact O-N 2.82Å; Q506-S520 PolarHBondContact NE2-OG 3.27Å
507	F	94.5	Very high	90.8	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	141.7	174.5	-49.8	-75.9	0	0	0	110	I449 L452 Y498 Q499 P505 N524 I525 A528	I449-F507 HydrophobicContact CD1-CE1 4.14Å; I449-F507 HydrophobicContact CD1-CZ 3.59Å; L452-F507 HydrophobicContact CB-CE1 4.47Å; L452-F507 HydrophobicContact CB-CZ 4.37Å; L452-F507 HydrophobicContact CD2-CD1 3.86Å; L452-F507 HydrophobicContact CD2-CE1 3.33Å; L452-F507 HydrophobicContact CD2-CZ 4.04Å; L452-F507 HydrophobicContact CG-CE1 4.47Å; Y498-F507 WeakPolarHBondContact O-CA 3.45Å; Q499-F507 HydrophobicContact CB-CD1 3.92Å; Q499-F507 HydrophobicContact CB-CE1 4.01Å; Q499-F507 HydrophobicContact CG-CD1 3.95Å; Q499-F507 HydrophobicContact CG-CE1 3.66Å; P505-F507 HydrophobicContact CB-CE2 4.26Å; P505-F507 HydrophobicContact CB-CZ 4.4Å; F507-N524 VanDerWaalsContact CD2-OD1 3.29Å; F507-N524 WeakPolarHBondContact CD2-OD1 3.36Å; F507-N524 PolarHBondContact N-OD1 3.4Å; F507-N524 PolarHBondContact O-ND2 3.46Å; F507-N524 PolarHBondContact O-OD1 2.76Å; F507-I525 HydrophobicContact CD2-CB 4.08Å; F507-I525 HydrophobicContact CD2-CD1 3.84Å; F507-I525 HydrophobicContact CD2-CG1 4.49Å; F507-I525 HydrophobicContact CE2-CB 4Å; F507-I525 HydrophobicContact CE2-CD1 3.79Å; F507-I525 HydrophobicContact CE2-CG1 4.26Å; F507-I525 HydrophobicContact CG-CD1 4.37Å; F507-I525 HydrophobicContact CZ-CD1 4.23Å; F507-A528 HydrophobicContact CB-CB 4.38Å
508	K	94.6	Very high	90.8	Very high	28 Å²	28	27.5 Å²	27.5	12%	0.122	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	159.9	163.7	-62.7	-175.9	179.5	-154.7	0	107.9	E316 Y498 V500 I515 Y516 N517	E316-K508 IonicContact OE1-NZ 3.51Å; E316-K508 PolarHBondContact OE1-NZ 2.72Å; E316-K508 IonicContact OE2-NZ 3.77Å; E316-K508 PolarHBondContact OE2-NZ 3.39Å; Y498-K508 HydrophobicContact CD1-CB 4.29Å; Y498-K508 HydrophobicContact CD1-CD 4.3Å; Y498-K508 PolarHBondContact N-O 2.73Å; Y498-K508 PolarHBondContact O-N 3.45Å; V500-K508 HydrophobicContact CG2-CB 4.4Å; V500-K508 HydrophobicContact CG2-CD 3.76Å; V500-K508 HydrophobicContact CG2-CG 3.76Å; K508-I515 HydrophobicContact CB-CG2 3.96Å; K508-I515 HydrophobicContact CD-CG2 3.73Å; K508-I515 HydrophobicContact CG-CG2 4.44Å; K508-Y516 WeakPolarHBondContact CA-O 3.17Å; K508-Y516 WeakPolarHBondContact CB-O 3.34Å; K508-N517 WeakPolarHBondContact CD-OD1 3.35Å; K508-N517 WeakPolarHBondContact CE-OD1 3.39Å; K508-N517 PolarHBondContact NZ-OD1 3.22Å
509	L	94.4	Very high	90.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	126.4	174.3	-160.1	79.4	0	0	0	111.2	Q496 F497 L511 Y516 L531 F532	Q496-L509 WeakPolarHBondContact O-CD1 3.48Å; F497-L509 HydrophobicContact CD1-CD1 3.95Å; F497-L509 HydrophobicContact CD2-CD1 4.16Å; F497-L509 HydrophobicContact CE1-CD1 4.04Å; F497-L509 HydrophobicContact CE2-CD1 4.2Å; F497-L509 HydrophobicContact CG-CD1 4.02Å; F497-L509 HydrophobicContact CZ-CD1 4.16Å; L509-L511 HydrophobicContact CD2-CD1 4.24Å; L509-L511 HydrophobicContact CD2-CD2 3.59Å; L509-L511 HydrophobicContact CD2-CG 3.8Å; L509-L511 HydrophobicContact CG-CD2 4.21Å; L509-L511 HydrophobicContact CG-CG 4.32Å; L509-Y516 PolarHBondContact N-O 3.5Å; L509-Y516 WeakPolarHBondContact O-CB 3.22Å; L509-Y516 PolarHBondContact O-N 3.01Å; L509-L531 HydrophobicContact CB-CD2 4.29Å; L509-L531 HydrophobicContact CD2-CB 4.1Å; L509-L531 HydrophobicContact CD2-CD2 3.26Å; L509-L531 HydrophobicContact CD2-CG 4.3Å; L509-L531 HydrophobicContact CG-CD2 4.35Å; L509-F532 HydrophobicContact CD1-CB 4.24Å; L509-F532 HydrophobicContact CD2-CB 4.04Å
510	V	92.9	Very high	90.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.006	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	119	173.6	-176.2	0	0	0	0	108.7	P487 L489 C495 Q496 R514 I515	P487-V510 HydrophobicContact CB-CG2 3.71Å; P487-V510 HydrophobicContact CG-CG2 3.99Å; L489-V510 HydrophobicContact CD2-CG1 3.6Å; C495-V510 CarbonylContact C-O 3.52Å; C495-V510 WeakPolarHBondContact CA-O 3.46Å; Q496-V510 HydrophobicContact CB-CB 4.22Å; Q496-V510 PolarHBondContact N-O 3.28Å; Q496-V510 PolarHBondContact O-N 3.08Å; V510-R514 CarbonylContact C-O 3.49Å; V510-R514 VanDerWaalsContact CA-O 3.28Å; V510-R514 WeakPolarHBondContact CA-O 3.13Å; V510-I515 HydrophobicContact CG2-CG1 4.14Å
511	L	89.5	Confident	90.6	Very high	2 Å²	2	33.2 Å²	33.2	1%	0.01	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	128.6	175.3	-63	-175.5	0	0	0	110.3	Y322 C495 L509 G513 R514 Y516 L531 Y535	Y322-L511 HydrophobicContact CD2-CD1 4.4Å; Y322-L511 HydrophobicContact CE2-CD1 3.84Å; C495-L511 HydrophobicContact CB-CD2 3.53Å; C495-L511 WeakPolarHBondContact SG-CD2 3.45Å; L509-L511 HydrophobicContact CD2-CD1 4.24Å; L509-L511 HydrophobicContact CD2-CD2 3.59Å; L509-L511 HydrophobicContact CD2-CG 3.8Å; L509-L511 HydrophobicContact CG-CD2 4.21Å; L509-L511 HydrophobicContact CG-CG 4.32Å; L511-G513 PolarHBondContact O-N 3.31Å; L511-G513 VanDerWaalsContact O-N 3.12Å; L511-R514 PolarHBondContact N-O 2.99Å; L511-R514 PolarHBondContact O-N 3.3Å; L511-Y516 HydrophobicContact CB-CD2 4.01Å; L511-Y516 HydrophobicContact CB-CE2 3.76Å; L511-Y516 HydrophobicContact CD1-CD2 4.16Å; L511-Y516 HydrophobicContact CD1-CE2 4.04Å; L511-Y516 HydrophobicContact CG-CD2 4.11Å; L511-Y516 HydrophobicContact CG-CE2 4.21Å; L511-L531 HydrophobicContact CD1-CD2 3.26Å; L511-L531 HydrophobicContact CD1-CG 4.49Å; L511-L531 HydrophobicContact CG-CD2 3.97Å; L511-Y535 HydrophobicContact CB-CD2 4.49Å; L511-Y535 HydrophobicContact CB-CE2 4.34Å; L511-Y535 HydrophobicContact CD1-CD2 3.81Å; L511-Y535 HydrophobicContact CD1-CE2 4.44Å; L511-Y535 HydrophobicContact CD1-CG 4.24Å; L511-Y535 HydrophobicContact CD2-CD1 4.38Å; L511-Y535 HydrophobicContact CD2-CD2 4.14Å; L511-Y535 HydrophobicContact CD2-CE2 4.48Å; L511-Y535 HydrophobicContact CD2-CG 4.01Å; L511-Y535 HydrophobicContact CG-CD2 4.42Å
512	N	84.3	Confident	90.8	Very high	67 Å²	67	35.5 Å²	35.5	36%	0.358	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.8	40	172.7	-167.3	29.5	0	0	0	113.1	K492 R514	K492-N512 PolarHBondContact O-OD1 2.81Å; K492-N512 VanDerWaalsContact O-OD1 3.04Å; N512-R514 VanDerWaalsContact C-N 3.3Å; N512-R514 PolarHBondContact O-N 3.44Å
513	G	83.9	Confident	91.1	Very high	21 Å²	21	39.3 Å²	39.3	22%	0.216	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	75.4	7.4	-178.7	0	0	0	0	0	116	L489 L511	L489-G513 VanDerWaalsContact O-CA 3.24Å; L489-G513 WeakPolarHBondContact O-CA 3.27Å; L511-G513 PolarHBondContact O-N 3.31Å; L511-G513 VanDerWaalsContact O-N 3.12Å
514	R	88.7	Confident	91.6	Very high	80 Å²	80	36.6 Å²	36.6	30%	0.302	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	148	173.8	-61.5	-179.3	178.4	164.2	-3.3	110.4	N315 V510 L511 N512 Y516	N315-R514 HydrophobicContact CB-CG 4.34Å; V510-R514 CarbonylContact C-O 3.49Å; V510-R514 VanDerWaalsContact CA-O 3.28Å; V510-R514 WeakPolarHBondContact CA-O 3.13Å; L511-R514 PolarHBondContact N-O 2.99Å; L511-R514 PolarHBondContact O-N 3.3Å; N512-R514 VanDerWaalsContact C-N 3.3Å; N512-R514 PolarHBondContact O-N 3.44Å; R514-Y516 HydrophobicContact CB-CE2 4.02Å
515	I	91.9	Very high	92	Very high	8 Å²	8	33 Å²	33	4%	0.041	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	122.3	176.5	-53.7	-173.5	0	0	0	108.3	I314 N315 E316 R317 P487 L489 K508 V510	I314-I515 HydrophobicContact CG2-CD1 3.57Å; I314-I515 HydrophobicContact CG2-CG1 4.16Å; N315-I515 PolarHBondContact O-N 3.16Å; N315-I515 VanDerWaalsContact O-N 3.11Å; E316-I515 CarbonylContact C-O 3.58Å; E316-I515 VanDerWaalsContact CA-O 3.25Å; E316-I515 WeakPolarHBondContact CA-O 3.24Å; E316-I515 HydrophobicContact CG-CB 4.29Å; R317-I515 PolarHBondContact N-O 2.93Å; P487-I515 HydrophobicContact CG-CD1 4.24Å; L489-I515 HydrophobicContact CD2-CD1 4.14Å; L489-I515 HydrophobicContact CD2-CG1 3.76Å; K508-I515 HydrophobicContact CB-CG2 3.96Å; K508-I515 HydrophobicContact CD-CG2 3.73Å; K508-I515 HydrophobicContact CG-CG2 4.44Å; V510-I515 HydrophobicContact CG2-CG1 4.14Å
516	Y	93.8	Very high	92.2	Very high	12 Å²	12	33.1 Å²	33.1	5%	0.047	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.8	175.4	-71.9	-91.1	0	0	0	109.9	R317 Y322 K508 L509 L511 R514 L518	R317-Y516 HydrophobicContact CB-CD1 3.97Å; R317-Y516 HydrophobicContact CB-CE1 3.89Å; R317-Y516 CarbonylContact O-C 3.55Å; R317-Y516 WeakPolarHBondContact O-CA 3.45Å; Y322-Y516 AromaticContact CD2-CE1 3.89Å; Y322-Y516 HydrophobicContact CD2-CE1 3.89Å; Y322-Y516 AromaticContact CD2-CZ 3.91Å; Y322-Y516 HydrophobicContact CG-CE1 4.17Å; K508-Y516 WeakPolarHBondContact CA-O 3.17Å; K508-Y516 WeakPolarHBondContact CB-O 3.34Å; L509-Y516 PolarHBondContact N-O 3.5Å; L509-Y516 WeakPolarHBondContact O-CB 3.22Å; L509-Y516 PolarHBondContact O-N 3.01Å; L511-Y516 HydrophobicContact CB-CD2 4.01Å; L511-Y516 HydrophobicContact CB-CE2 3.76Å; L511-Y516 HydrophobicContact CD1-CD2 4.16Å; L511-Y516 HydrophobicContact CD1-CE2 4.04Å; L511-Y516 HydrophobicContact CG-CD2 4.11Å; L511-Y516 HydrophobicContact CG-CE2 4.21Å; R514-Y516 HydrophobicContact CB-CE2 4.02Å; Y516-L518 PolarHBondContact O-N 3.35Å
517	N	93.6	Very high	92.4	Very high	49 Å²	49	31 Å²	31	26%	0.262	17%	0.168	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	108.2	174.6	-69.9	-30.1	0	0	0	108.9	E316 R317 E319 K508	E316-N517 PolarHBondContact OE2-ND2 3.06Å; E316-N517 PolarHBondContact OE2-OD1 3.02Å; R317-N517 PolarHBondContact O-N 3Å; E319-N517 PolarHBondContact N-O 3.02Å; K508-N517 WeakPolarHBondContact CD-OD1 3.35Å; K508-N517 WeakPolarHBondContact CE-OD1 3.39Å; K508-N517 PolarHBondContact NZ-OD1 3.22Å
518	L	93.6	Very high	92.4	Very high	7 Å²	7	31 Å²	31	4%	0.037	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-85.2	145.9	176	-60.4	160.9	0	0	0	109.2	E319 Y516 S520 N524 H527 A528 L531	E319-L518 HydrophobicContact CB-CD2 3.81Å; E319-L518 HydrophobicContact CG-CD2 4.44Å; E319-L518 WeakPolarHBondContact OE2-CD2 3.11Å; Y516-L518 PolarHBondContact O-N 3.35Å; L518-S520 PolarHBondContact O-N 3.22Å; L518-N524 VanDerWaalsContact CB-ND2 3.29Å; L518-N524 WeakPolarHBondContact CB-ND2 3.34Å; L518-H527 HydrophobicContact CD2-CB 3.91Å; L518-A528 HydrophobicContact CD1-CB 3.41Å; L518-A528 VanDerWaalsContact CD1-CB 3.41Å; L518-L531 HydrophobicContact CD2-CD1 4.18Å
519	I	91.6	Very high	92.5	Very high	101 Å²	101	29.7 Å²	29.7	52%	0.518	16%	0.162	S	C	.	.	P	Polyproline II helix	trans	-59	130.2	176	-65.2	165.4	0	0	0	108.6	E319 N524	E319-I519 HydrophobicContact CG-CG1 4.39Å; E319-I519 VanDerWaalsContact OE1-CB 3.26Å; E319-I519 WeakPolarHBondContact OE1-CB 3.15Å; E319-I519 WeakPolarHBondContact OE1-CD1 3.4Å; E319-I519 WeakPolarHBondContact OE1-CG1 3.32Å; E319-I519 PolarHBondContact OE1-N 3.31Å; I519-N524 WeakPolarHBondContact O-CB 3.44Å; I519-N524 PolarHBondContact O-ND2 2.74Å
520	S	90	Very high	92.6	Very high	76 Å²	76	29.7 Å²	29.7	53%	0.531	16%	0.162	S	C	.	.	S	Bend	trans	-66.9	147.3	176.1	-62.4	0	0	0	0	111.1	Q506 L518	Q506-S520 PolarHBondContact NE2-OG 3.27Å; L518-S520 PolarHBondContact O-N 3.22Å
521	G	92	Very high	92.7	Very high	7 Å²	7	29.7 Å²	29.7	7%	0.072	16%	0.162	C	C	.	.	S	Bend	trans	118	-157.9	175.9	0	0	0	0	0	113.7	K523 N524	G521-K523 VanDerWaalsContact C-N 3.26Å; G521-K523 PolarHBondContact O-N 3.28Å; G521-K523 VanDerWaalsContact O-N 3.12Å; G521-N524 WeakPolarHBondContact O-CB 3.4Å; G521-N524 PolarHBondContact O-N 3.38Å; G521-N524 VanDerWaalsContact O-N 3.07Å
522	P	92.7	Very high	92.9	Very high	76 Å²	76	29.6 Å²	29.6	49%	0.494	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.9	-163.3	23.2	-33.8	0	0	0	115.4	W429 Y526	W429-P522 HydrophobicContact CB-CB 4.26Å; W429-P522 VanDerWaalsContact CG-CA 3.43Å; W429-P522 HydrophobicContact CG-CB 3.93Å; P522-Y526 WeakPolarHBondContact O-CD2 3.41Å
523	K	93.6	Very high	93.4	Very high	93 Å²	93	26.4 Å²	26.4	40%	0.404	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-9.4	180	-63.5	-171.8	-177.4	-179.6	0	113.6	D334 G521 I525 Y526 H527	D334-K523 IonicContact OD1-NZ 3.57Å; D334-K523 PolarHBondContact OD1-NZ 3.45Å; G521-K523 VanDerWaalsContact C-N 3.26Å; G521-K523 PolarHBondContact O-N 3.28Å; G521-K523 VanDerWaalsContact O-N 3.12Å; K523-I525 PolarHBondContact O-N 2.75Å; K523-Y526 PolarHBondContact O-N 2.91Å; K523-Y526 VanDerWaalsContact O-N 3.09Å; K523-H527 PolarHBondContact O-CD2 2.71Å; K523-H527 PolarHBondContact O-N 2.83Å
524	N	95.6	Very high	93.9	Very high	3 Å²	3	26 Å²	26	2%	0.016	14%	0.137	C	C	.	.	H	α-helix	trans	-54.3	-51.4	-170.3	-176	-103	0	0	0	113	F507 L518 I519 G521 Y526 H527 A528	F507-N524 VanDerWaalsContact CD2-OD1 3.29Å; F507-N524 WeakPolarHBondContact CD2-OD1 3.36Å; F507-N524 PolarHBondContact N-OD1 3.4Å; F507-N524 PolarHBondContact O-ND2 3.46Å; F507-N524 PolarHBondContact O-OD1 2.76Å; L518-N524 VanDerWaalsContact CB-ND2 3.29Å; L518-N524 WeakPolarHBondContact CB-ND2 3.34Å; I519-N524 WeakPolarHBondContact O-CB 3.44Å; I519-N524 PolarHBondContact O-ND2 2.74Å; G521-N524 WeakPolarHBondContact O-CB 3.4Å; G521-N524 PolarHBondContact O-N 3.38Å; G521-N524 VanDerWaalsContact O-N 3.07Å; N524-Y526 PolarHBondContact O-N 3.22Å; N524-H527 PolarHBondContact O-N 3.11Å; N524-A528 WeakPolarHBondContact O-CB 3.33Å; N524-A528 PolarHBondContact O-N 3.29Å
525	I	95.8	Very high	94	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.005	12%	0.124	C	C	.	.	H	α-helix	trans	-66.2	-38.7	178.8	-175.1	57.1	0	0	0	112.6	F427 L451 L452 F507 K523 A528 I529	F427-I525 HydrophobicContact CE1-CG2 4.5Å; F427-I525 HydrophobicContact CZ-CG2 3.83Å; L451-I525 HydrophobicContact CD2-CG1 4.31Å; L451-I525 HydrophobicContact CD2-CG2 4.2Å; L452-I525 HydrophobicContact CB-CD1 4.06Å; L452-I525 HydrophobicContact CD1-CD1 4.23Å; F507-I525 HydrophobicContact CD2-CB 4.08Å; F507-I525 HydrophobicContact CD2-CD1 3.84Å; F507-I525 HydrophobicContact CD2-CG1 4.49Å; F507-I525 HydrophobicContact CE2-CB 4Å; F507-I525 HydrophobicContact CE2-CD1 3.79Å; F507-I525 HydrophobicContact CE2-CG1 4.26Å; F507-I525 HydrophobicContact CG-CD1 4.37Å; F507-I525 HydrophobicContact CZ-CD1 4.23Å; K523-I525 PolarHBondContact O-N 2.75Å; I525-A528 WeakPolarHBondContact O-CB 3.44Å; I525-A528 PolarHBondContact O-N 2.81Å; I525-I529 HydrophobicContact CD1-CD1 4.18Å; I525-I529 HydrophobicContact CD1-CG1 4.37Å; I525-I529 HydrophobicContact CG1-CD1 4.1Å; I525-I529 WeakPolarHBondContact O-CG1 3.42Å; I525-I529 PolarHBondContact O-N 3Å
526	Y	96.5	Very high	93.9	Very high	7 Å²	7	23.2 Å²	23.2	3%	0.027	13%	0.126	C	C	.	.	H	α-helix	trans	-66.8	-44.5	179.4	-61.8	-63.2	0	0	0	110.9	T337 L340 R341 L344 L424 F427 L451 P522 K523 N524 A528 I529 L530	T337-Y526 HydrophobicContact CG2-CD2 4.44Å; T337-Y526 HydrophobicContact CG2-CG 4.26Å; L340-Y526 HydrophobicContact CD2-CD1 4.14Å; L340-Y526 WeakPolarHBondContact CD2-O 3.44Å; R341-Y526 HydrophobicContact CG-CD1 3.95Å; R341-Y526 HydrophobicContact CG-CE1 3.5Å; R341-Y526 HydrophobicContact CG-CE2 4.39Å; L344-Y526 HydrophobicContact CD1-CD1 4.17Å; L344-Y526 HydrophobicContact CD1-CE1 4.05Å; L424-Y526 HydrophobicContact CD1-CE1 4.22Å; F427-Y526 AromaticContact CD1-CE2 3.87Å; F427-Y526 HydrophobicContact CD1-CE2 3.87Å; F427-Y526 AromaticContact CD1-CZ 3.96Å; F427-Y526 WeakPolarHBondContact CD1-OH 3.3Å; F427-Y526 WeakPolarHBondContact CD2-OH 3.42Å; F427-Y526 AromaticContact CE1-CE2 3.58Å; F427-Y526 HydrophobicContact CE1-CE2 3.58Å; F427-Y526 AromaticContact CE1-CZ 3.87Å; F427-Y526 WeakPolarHBondContact CG-OH 3.48Å; F427-Y526 HydrophobicContact CZ-CE2 4.14Å; L451-Y526 HydrophobicContact CD2-CD1 4.5Å; L451-Y526 HydrophobicContact CD2-CE1 3.77Å; P522-Y526 WeakPolarHBondContact O-CD2 3.41Å; K523-Y526 PolarHBondContact O-N 2.91Å; K523-Y526 VanDerWaalsContact O-N 3.09Å; N524-Y526 PolarHBondContact O-N 3.22Å; Y526-A528 VanDerWaalsContact C-N 3.33Å; Y526-A528 PolarHBondContact O-N 2.78Å; Y526-I529 PolarHBondContact O-N 2.78Å; Y526-L530 WeakPolarHBondContact O-CB 3.48Å; Y526-L530 VanDerWaalsContact O-CG 3.32Å; Y526-L530 WeakPolarHBondContact O-CG 3.04Å; Y526-L530 PolarHBondContact O-N 3.07Å
527	H	96	Very high	93.7	Very high	13 Å²	13	24 Å²	24	6%	0.06	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-38.1	175.8	-71	-160.7	0	0	0	111.4	E319 L518 K523 N524 I529 L530 L531	E319-H527 IonicContact OE1-ND1 2.72Å; E319-H527 PolarHBondContact OE1-ND1 3.21Å; E319-H527 WeakPolarHBondContact OE2-CB 3.2Å; E319-H527 IonicContact OE2-CE1 3.4Å; E319-H527 IonicContact OE2-CG 3.97Å; E319-H527 IonicContact OE2-ND1 3.25Å; E319-H527 PolarHBondContact OE2-ND1 2.77Å; L518-H527 HydrophobicContact CD2-CB 3.91Å; K523-H527 PolarHBondContact O-CD2 2.71Å; K523-H527 PolarHBondContact O-N 2.83Å; N524-H527 PolarHBondContact O-N 3.11Å; H527-I529 VanDerWaalsContact C-N 3.34Å; H527-I529 PolarHBondContact O-N 3.33Å; H527-L530 PolarHBondContact O-N 3.43Å; H527-L531 WeakPolarHBondContact O-CB 3.45Å; H527-L531 PolarHBondContact O-N 2.8Å
528	A	96.1	Very high	93.4	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-56.9	-47.6	173.4	0	0	0	0	0	111.9	F497 F507 L518 N524 I525 Y526 F532	F497-A528 HydrophobicContact CD1-CB 3.98Å; F497-A528 HydrophobicContact CE1-CB 3.64Å; F507-A528 HydrophobicContact CB-CB 4.38Å; L518-A528 HydrophobicContact CD1-CB 3.41Å; L518-A528 VanDerWaalsContact CD1-CB 3.41Å; N524-A528 WeakPolarHBondContact O-CB 3.33Å; N524-A528 PolarHBondContact O-N 3.29Å; I525-A528 WeakPolarHBondContact O-CB 3.44Å; I525-A528 PolarHBondContact O-N 2.81Å; Y526-A528 VanDerWaalsContact C-N 3.33Å; Y526-A528 PolarHBondContact O-N 2.78Å; A528-F532 WeakPolarHBondContact O-CB 3.3Å; A528-F532 PolarHBondContact O-N 3.01Å
529	I	96.5	Very high	93	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.6	-41.6	179.4	-64.1	168.2	0	0	0	111.4	L340 L344 F455 F497 I525 Y526 H527 F532 F533	L340-I529 HydrophobicContact CD1-CG2 3.74Å; L340-I529 HydrophobicContact CD2-CB 3.83Å; L340-I529 HydrophobicContact CD2-CG2 3.77Å; L340-I529 HydrophobicContact CG-CG2 4.4Å; L344-I529 HydrophobicContact CD1-CD1 4.24Å; F455-I529 HydrophobicContact CD1-CD1 4.35Å; F455-I529 HydrophobicContact CD1-CG1 4.3Å; F455-I529 HydrophobicContact CE1-CG1 4.3Å; F455-I529 HydrophobicContact CE2-CG2 4.21Å; F455-I529 HydrophobicContact CG-CD1 4.25Å; F455-I529 HydrophobicContact CZ-CG2 4.17Å; F497-I529 HydrophobicContact CE1-CG1 3.92Å; F497-I529 HydrophobicContact CZ-CG1 4.02Å; I525-I529 HydrophobicContact CD1-CD1 4.18Å; I525-I529 HydrophobicContact CD1-CG1 4.37Å; I525-I529 HydrophobicContact CG1-CD1 4.1Å; I525-I529 WeakPolarHBondContact O-CG1 3.42Å; I525-I529 PolarHBondContact O-N 3Å; Y526-I529 PolarHBondContact O-N 2.78Å; H527-I529 VanDerWaalsContact C-N 3.34Å; H527-I529 PolarHBondContact O-N 3.33Å; I529-F532 WeakPolarHBondContact O-CB 3.23Å; I529-F532 PolarHBondContact O-N 3.12Å; I529-F533 HydrophobicContact CG2-CD2 3.63Å; I529-F533 HydrophobicContact CG2-CE2 3.52Å; I529-F533 WeakPolarHBondContact O-CD2 3.25Å; I529-F533 PolarHBondContact O-N 2.74Å
530	L	96.1	Very high	92.5	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-61	-47.8	175.9	-77.1	178.5	0	0	0	111.3	W323 L333 W336 T337 L340 Y526 H527 F532 F533 H534 I558 F559	W323-L530 HydrophobicContact CH2-CB 4.14Å; L333-L530 HydrophobicContact CD1-CD1 3.81Å; W336-L530 HydrophobicContact CB-CD1 4.1Å; W336-L530 HydrophobicContact CB-CD2 3.97Å; T337-L530 WeakPolarHBondContact OG1-CD1 3.41Å; L340-L530 HydrophobicContact CB-CD2 3.94Å; L340-L530 HydrophobicContact CB-CG 4.47Å; L340-L530 HydrophobicContact CD2-CD2 3.98Å; L340-L530 HydrophobicContact CD2-CG 3.77Å; L340-L530 HydrophobicContact CG-CD2 4.45Å; Y526-L530 WeakPolarHBondContact O-CB 3.48Å; Y526-L530 VanDerWaalsContact O-CG 3.32Å; Y526-L530 WeakPolarHBondContact O-CG 3.04Å; Y526-L530 PolarHBondContact O-N 3.07Å; H527-L530 PolarHBondContact O-N 3.43Å; L530-F532 VanDerWaalsContact C-N 3.31Å; L530-F532 PolarHBondContact O-N 3.43Å; L530-F533 PolarHBondContact O-N 3.42Å; L530-H534 WeakPolarHBondContact O-CB 2.99Å; L530-H534 PolarHBondContact O-N 3.04Å; L530-I558 HydrophobicContact CD2-CG2 3.82Å; L530-F559 HydrophobicContact CD2-CE1 4.07Å; L530-F559 HydrophobicContact CD2-CZ 4.16Å
531	L	94.7	Very high	92.2	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-65.9	-37.8	-177.8	-160.3	146.7	0	0	0	110.4	E319 Y322 W323 L509 L511 L518 H527 Y535	E319-L531 HydrophobicContact CB-CD1 4.34Å; Y322-L531 HydrophobicContact CD1-CD1 3.57Å; Y322-L531 HydrophobicContact CD1-CD2 4.39Å; Y322-L531 HydrophobicContact CD1-CG 3.67Å; Y322-L531 HydrophobicContact CE1-CD1 4.1Å; Y322-L531 HydrophobicContact CE1-CD2 4.32Å; Y322-L531 HydrophobicContact CE1-CG 3.65Å; Y322-L531 HydrophobicContact CG-CD1 3.9Å; Y322-L531 HydrophobicContact CG-CG 4.19Å; W323-L531 HydrophobicContact CH2-CB 3.77Å; W323-L531 HydrophobicContact CH2-CD1 4.22Å; W323-L531 HydrophobicContact CH2-CG 4.07Å; W323-L531 HydrophobicContact CZ2-CB 3.78Å; W323-L531 HydrophobicContact CZ2-CD1 3.71Å; W323-L531 HydrophobicContact CZ2-CG 4.02Å; L509-L531 HydrophobicContact CB-CD2 4.29Å; L509-L531 HydrophobicContact CD2-CB 4.1Å; L509-L531 HydrophobicContact CD2-CD2 3.26Å; L509-L531 HydrophobicContact CD2-CG 4.3Å; L509-L531 HydrophobicContact CG-CD2 4.35Å; L511-L531 HydrophobicContact CD1-CD2 3.26Å; L511-L531 HydrophobicContact CD1-CG 4.49Å; L511-L531 HydrophobicContact CG-CD2 3.97Å; L518-L531 HydrophobicContact CD2-CD1 4.18Å; H527-L531 WeakPolarHBondContact O-CB 3.45Å; H527-L531 PolarHBondContact O-N 2.8Å; L531-Y535 WeakPolarHBondContact O-CB 3.29Å; L531-Y535 PolarHBondContact O-N 3.34Å
532	F	94.3	Very high	91.9	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-57.6	-52.9	170.1	174.9	-88.6	0	0	0	112.3	M459 F475 C495 F497 L509 A528 I529 L530 Y536 F543	M459-F532 HydrophobicContact CE-CE1 4.1Å; M459-F532 HydrophobicContact CE-CZ 4.47Å; F475-F532 HydrophobicContact CE2-CE1 4.17Å; F475-F532 HydrophobicContact CE2-CE2 4.01Å; F475-F532 AromaticContact CE2-CZ 3.58Å; F475-F532 HydrophobicContact CE2-CZ 3.58Å; F475-F532 HydrophobicContact CZ-CE2 4.35Å; F475-F532 HydrophobicContact CZ-CZ 4.19Å; C495-F532 HydrophobicContact CB-CD2 3.62Å; C495-F532 HydrophobicContact CB-CE2 3.7Å; F497-F532 HydrophobicContact CD2-CD2 4.45Å; F497-F532 HydrophobicContact CE2-CB 4.04Å; F497-F532 HydrophobicContact CE2-CD1 4.45Å; F497-F532 AromaticContact CE2-CD2 3.64Å; F497-F532 HydrophobicContact CE2-CD2 3.64Å; F497-F532 HydrophobicContact CE2-CE2 4.24Å; F497-F532 AromaticContact CE2-CG 3.78Å; F497-F532 HydrophobicContact CE2-CG 3.78Å; F497-F532 HydrophobicContact CZ-CB 3.76Å; F497-F532 HydrophobicContact CZ-CD2 4.25Å; F497-F532 AromaticContact CZ-CG 3.96Å; F497-F532 HydrophobicContact CZ-CG 3.96Å; L509-F532 HydrophobicContact CD1-CB 4.24Å; L509-F532 HydrophobicContact CD2-CB 4.04Å; A528-F532 WeakPolarHBondContact O-CB 3.3Å; A528-F532 PolarHBondContact O-N 3.01Å; I529-F532 WeakPolarHBondContact O-CB 3.23Å; I529-F532 PolarHBondContact O-N 3.12Å; L530-F532 VanDerWaalsContact C-N 3.31Å; L530-F532 PolarHBondContact O-N 3.43Å; F532-Y536 HydrophobicContact CD2-CE2 4.29Å; F532-Y536 HydrophobicContact CE1-CD2 4.26Å; F532-Y536 HydrophobicContact CE1-CE2 4.29Å; F532-Y536 AromaticContact CE2-CE2 3.79Å; F532-Y536 HydrophobicContact CE2-CE2 3.79Å; F532-Y536 HydrophobicContact CZ-CD2 4.17Å; F532-Y536 AromaticContact CZ-CE2 3.75Å; F532-Y536 HydrophobicContact CZ-CE2 3.75Å; F532-Y536 VanDerWaalsContact O-CD2 3.26Å; F532-Y536 WeakPolarHBondContact O-CD2 3.21Å; F532-F543 HydrophobicContact CE2-CE2 4.17Å; F532-F543 HydrophobicContact CE2-CZ 4.39Å; F532-F543 HydrophobicContact CZ-CD1 4.35Å; F532-F543 AromaticContact CZ-CD2 3.94Å; F532-F543 HydrophobicContact CZ-CD2 3.94Å; F532-F543 HydrophobicContact CZ-CE1 4.14Å; F532-F543 AromaticContact CZ-CE2 3.68Å; F532-F543 HydrophobicContact CZ-CE2 3.68Å; F532-F543 HydrophobicContact CZ-CG 4.25Å; F532-F543 AromaticContact CZ-CZ 3.78Å; F532-F543 HydrophobicContact CZ-CZ 3.78Å
533	F	94.2	Very high	91.6	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-70.9	-41.5	-178.3	-76.9	-51	0	0	0	112.8	W343 F455 M459 I529 L530 Y535 Y536 V537 L548 L553 V555 F559	W343-F533 HydrophobicContact CH2-CZ 4.4Å; W343-F533 HydrophobicContact CZ3-CE2 4.36Å; F455-F533 AromaticContact CE2-CE2 3.74Å; F455-F533 HydrophobicContact CE2-CE2 3.74Å; F455-F533 AromaticContact CE2-CZ 3.54Å; F455-F533 HydrophobicContact CE2-CZ 3.54Å; F455-F533 AromaticContact CZ-CE2 3.96Å; F455-F533 HydrophobicContact CZ-CE2 3.96Å; F455-F533 AromaticContact CZ-CZ 3.72Å; F455-F533 HydrophobicContact CZ-CZ 3.72Å; M459-F533 HydrophobicContact CE-CE1 4.14Å; M459-F533 HydrophobicContact CE-CZ 4.48Å; M459-F533 HydrophobicContact SD-CZ 4.41Å; I529-F533 HydrophobicContact CG2-CD2 3.63Å; I529-F533 HydrophobicContact CG2-CE2 3.52Å; I529-F533 WeakPolarHBondContact O-CD2 3.25Å; I529-F533 PolarHBondContact O-N 2.74Å; L530-F533 PolarHBondContact O-N 3.42Å; F533-Y535 PolarHBondContact O-N 3.05Å; F533-Y536 PolarHBondContact O-N 3.46Å; F533-V537 WeakPolarHBondContact O-CG2 3.4Å; F533-V537 PolarHBondContact O-N 3.2Å; F533-L548 HydrophobicContact CD1-CD2 4.12Å; F533-L548 HydrophobicContact CE1-CD2 4.23Å; F533-L553 HydrophobicContact CE1-CD1 4.05Å; F533-V555 HydrophobicContact CD1-CG2 4.05Å; F533-V555 HydrophobicContact CE1-CG1 4.47Å; F533-V555 HydrophobicContact CE1-CG2 4.07Å; F533-V555 HydrophobicContact CE2-CG1 4.2Å; F533-V555 HydrophobicContact CG-CG2 4.45Å; F533-V555 HydrophobicContact CZ-CG1 4.05Å; F533-V555 HydrophobicContact CZ-CG2 4.45Å; F533-F559 HydrophobicContact CB-CE2 3.7Å; F533-F559 HydrophobicContact CB-CZ 3.64Å
534	H	93.7	Very high	90.9	Very high	12 Å²	12	34.4 Å²	34.4	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-54.9	-43.9	179.1	-176.1	-91	0	0	0	111	Y322 W323 W336 L530 Y536 V537 T538 F559	Y322-H534 AromaticContact CE1-ND1 3.55Å; Y322-H534 AromaticContact CZ-ND1 3.69Å; Y322-H534 PolarHBondContact OH-ND1 3.4Å; Y322-H534 VanDerWaalsContact OH-ND1 3.13Å; W323-H534 HydrophobicContact CZ3-CB 4.34Å; W336-H534 AromaticContact CH2-CD2 3.87Å; W336-H534 AromaticContact CH2-NE2 3.95Å; W336-H534 AromaticContact CZ3-CD2 3.61Å; L530-H534 WeakPolarHBondContact O-CB 2.99Å; L530-H534 PolarHBondContact O-N 3.04Å; H534-Y536 VanDerWaalsContact C-N 3.27Å; H534-Y536 PolarHBondContact O-N 2.8Å; H534-V537 PolarHBondContact O-N 3.39Å; H534-T538 WeakPolarHBondContact CE1-CG2 3.47Å; H534-T538 WeakPolarHBondContact O-CG2 3.47Å; H534-T538 PolarHBondContact O-N 3.43Å; H534-T538 PolarHBondContact O-OG1 2.76Å; H534-T538 VanDerWaalsContact O-OG1 3.08Å; H534-F559 HydrophobicContact CB-CD1 4.46Å; H534-F559 HydrophobicContact CB-CE1 3.75Å; H534-F559 HydrophobicContact CB-CZ 4.07Å; H534-F559 AromaticContact CD2-CD1 3.92Å
535	Y	91.7	Very high	90.2	Very high	10 Å²	10	39.7 Å²	39.7	4%	0.039	20%	0.198	C	C	.	.	H	α-helix	trans	-57.3	-36.9	177.5	175.8	-92.9	0	0	0	113.8	Y322 C495 L511 L531 F533 T538 R539	Y322-Y535 WeakPolarHBondContact OH-CA 3.37Å; Y322-Y535 PolarHBondContact OH-N 3.44Å; C495-Y535 WeakPolarHBondContact SG-CD1 3.24Å; C495-Y535 WeakPolarHBondContact SG-CE1 3.16Å; L511-Y535 HydrophobicContact CB-CD2 4.49Å; L511-Y535 HydrophobicContact CB-CE2 4.34Å; L511-Y535 HydrophobicContact CD1-CD2 3.81Å; L511-Y535 HydrophobicContact CD1-CE2 4.44Å; L511-Y535 HydrophobicContact CD1-CG 4.24Å; L511-Y535 HydrophobicContact CD2-CD1 4.38Å; L511-Y535 HydrophobicContact CD2-CD2 4.14Å; L511-Y535 HydrophobicContact CD2-CE2 4.48Å; L511-Y535 HydrophobicContact CD2-CG 4.01Å; L511-Y535 HydrophobicContact CG-CD2 4.42Å; L531-Y535 WeakPolarHBondContact O-CB 3.29Å; L531-Y535 PolarHBondContact O-N 3.34Å; F533-Y535 PolarHBondContact O-N 3.05Å; Y535-T538 PolarHBondContact O-OG1 2.81Å; Y535-R539 VanDerWaalsContact CZ-NH1 3.31Å; Y535-R539 WeakPolarHBondContact O-CG 3.49Å; Y535-R539 PolarHBondContact OH-NH1 3.41Å; Y535-R539 PolarHBondContact OH-NH2 3.18Å; Y535-R539 VanDerWaalsContact OH-NH2 3.16Å
536	Y	90.5	Very high	89.7	Confident	21 Å²	21	40.5 Å²	40.5	8%	0.082	20%	0.203	C	C	.	.	H	α-helix	trans	-84.5	-32.4	178.7	-73.5	-71.2	0	0	0	112.5	C495 F532 F533 H534 R539 N540 E541 K542 F543	C495-Y536 HydrophobicContact CB-CE2 3.9Å; C495-Y536 WeakPolarHBondContact SG-CE2 3.46Å; C495-Y536 PolarHBondContact SG-OH 3.08Å; F532-Y536 HydrophobicContact CD2-CE2 4.29Å; F532-Y536 HydrophobicContact CE1-CD2 4.26Å; F532-Y536 HydrophobicContact CE1-CE2 4.29Å; F532-Y536 AromaticContact CE2-CE2 3.79Å; F532-Y536 HydrophobicContact CE2-CE2 3.79Å; F532-Y536 HydrophobicContact CZ-CD2 4.17Å; F532-Y536 AromaticContact CZ-CE2 3.75Å; F532-Y536 HydrophobicContact CZ-CE2 3.75Å; F532-Y536 VanDerWaalsContact O-CD2 3.26Å; F532-Y536 WeakPolarHBondContact O-CD2 3.21Å; F533-Y536 PolarHBondContact O-N 3.46Å; H534-Y536 VanDerWaalsContact C-N 3.27Å; H534-Y536 PolarHBondContact O-N 2.8Å; Y536-R539 PolarHBondContact O-N 3.01Å; Y536-N540 PolarHBondContact O-N 3.42Å; Y536-N540 VanDerWaalsContact O-N 3.16Å; Y536-E541 WeakPolarHBondContact O-CA 3.49Å; Y536-E541 PolarHBondContact O-N 2.81Å; Y536-K542 WeakPolarHBondContact CD1-O 3.36Å; Y536-F543 HydrophobicContact CD1-CB 4.37Å; Y536-F543 HydrophobicContact CD1-CD2 4.11Å; Y536-F543 HydrophobicContact CD2-CB 4.41Å; Y536-F543 AromaticContact CD2-CD2 3.87Å; Y536-F543 HydrophobicContact CD2-CD2 3.87Å; Y536-F543 HydrophobicContact CD2-CG 4.45Å; Y536-F543 AromaticContact CE1-CD2 3.65Å; Y536-F543 HydrophobicContact CE1-CD2 3.65Å; Y536-F543 HydrophobicContact CE1-CE2 4.35Å; Y536-F543 AromaticContact CE2-CD2 3.39Å; Y536-F543 HydrophobicContact CE2-CD2 3.39Å; Y536-F543 AromaticContact CE2-CE2 3.79Å; Y536-F543 HydrophobicContact CE2-CE2 3.79Å; Y536-F543 HydrophobicContact CE2-CG 4.35Å; Y536-F543 HydrophobicContact CG-CB 4.25Å; Y536-F543 HydrophobicContact CG-CD2 4.23Å; Y536-F543 AromaticContact CZ-CD2 3.27Å; Y536-F543 AromaticContact CZ-CE2 3.63Å; Y536-F543 WeakPolarHBondContact OH-CE2 3.33Å
537	V	89.9	Confident	89.4	Confident	29 Å²	29	41.2 Å²	41.2	18%	0.176	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-45	172.7	170.8	0	0	0	0	110.5	F533 H534 R539 L548 F559	F533-V537 WeakPolarHBondContact O-CG2 3.4Å; F533-V537 PolarHBondContact O-N 3.2Å; H534-V537 PolarHBondContact O-N 3.39Å; V537-R539 PolarHBondContact O-N 3.3Å; V537-L548 HydrophobicContact CG2-CB 4.48Å; V537-L548 HydrophobicContact CG2-CD1 3.59Å; V537-F559 HydrophobicContact CB-CD2 4.43Å; V537-F559 HydrophobicContact CG1-CD2 4.45Å; V537-F559 HydrophobicContact CG2-CD2 3.78Å; V537-F559 HydrophobicContact CG2-CE2 3.89Å
538	T	86.8	Confident	89.1	Confident	77 Å²	77	40.6 Å²	40.6	47%	0.472	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72	-13.5	-179.6	55.2	0	0	0	0	114.6	H534 Y535	H534-T538 WeakPolarHBondContact CE1-CG2 3.47Å; H534-T538 WeakPolarHBondContact O-CG2 3.47Å; H534-T538 PolarHBondContact O-N 3.43Å; H534-T538 PolarHBondContact O-OG1 2.76Å; H534-T538 VanDerWaalsContact O-OG1 3.08Å; Y535-T538 PolarHBondContact O-OG1 2.81Å
539	R	84.1	Confident	88.6	Confident	110 Å²	110	41.1 Å²	41.1	42%	0.415	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-70.4	-178.6	-71.7	-178.9	175.7	-151.7	1.8	113	Y535 Y536 V537	Y535-R539 VanDerWaalsContact CZ-NH1 3.31Å; Y535-R539 WeakPolarHBondContact O-CG 3.49Å; Y535-R539 PolarHBondContact OH-NH1 3.41Å; Y535-R539 PolarHBondContact OH-NH2 3.18Å; Y535-R539 VanDerWaalsContact OH-NH2 3.16Å; Y536-R539 PolarHBondContact O-N 3.01Å; V537-R539 PolarHBondContact O-N 3.3Å
540	N	82.5	Confident	88	Confident	133 Å²	133	44.8 Å²	44.8	71%	0.711	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-136.5	2.2	-167.4	-70.5	-17.1	0	0	0	113.3	Y536 K542	Y536-N540 PolarHBondContact O-N 3.42Å; Y536-N540 VanDerWaalsContact O-N 3.16Å; N540-K542 WeakPolarHBondContact O-CG 3.34Å; N540-K542 PolarHBondContact O-N 3.27Å
541	E	83.3	Confident	87.2	Confident	111 Å²	111	49.6 Å²	49.6	52%	0.519	27%	0.27	S	S	.	.	S	Bend	trans	50.3	21.6	-171.8	-58	-173.2	158.6	0	0	114.3	Y536 L548	Y536-E541 WeakPolarHBondContact O-CA 3.49Å; Y536-E541 PolarHBondContact O-N 2.81Å; E541-L548 WeakPolarHBondContact O-CB 3.47Å; E541-L548 PolarHBondContact O-N 2.85Å
542	K	85.6	Confident	86.7	Confident	128 Å²	128	49.9 Å²	49.9	56%	0.557	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.9	135.7	-176.4	-70.1	179.3	-177.1	179.1	0	110.1	Y536 N540 V546	Y536-K542 WeakPolarHBondContact CD1-O 3.36Å; N540-K542 WeakPolarHBondContact O-CG 3.34Å; N540-K542 PolarHBondContact O-N 3.27Å; K542-V546 CarbonylContact C-O 2.86Å; K542-V546 VanDerWaalsContact CA-O 3.27Å; K542-V546 WeakPolarHBondContact CA-O 3.18Å
543	F	85.8	Confident	86.4	Confident	1 Å²	1	50 Å²	50	0%	0.004	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	117	171.8	174.1	-109.7	0	0	0	109.2	M459 M463 F475 F532 Y536 S545 V546 L548	M459-F543 HydrophobicContact CE-CD1 3.83Å; M459-F543 HydrophobicContact CE-CE1 3.96Å; M463-F543 HydrophobicContact CE-CD1 3.43Å; M463-F543 VanDerWaalsContact CE-CD1 3.43Å; M463-F543 HydrophobicContact CE-CE1 3.48Å; M463-F543 VanDerWaalsContact CE-CE1 3.48Å; M463-F543 HydrophobicContact SD-CD1 3.62Å; M463-F543 HydrophobicContact SD-CE1 3.46Å; M463-F543 WeakPolarHBondContact SD-CE1 3.49Å; F475-F543 AromaticContact CD2-CE1 3.75Å; F475-F543 HydrophobicContact CD2-CE1 3.75Å; F475-F543 AromaticContact CD2-CZ 3.94Å; F475-F543 HydrophobicContact CD2-CZ 3.94Å; F475-F543 HydrophobicContact CE2-CE1 4.02Å; F475-F543 HydrophobicContact CE2-CZ 4.04Å; F532-F543 HydrophobicContact CE2-CE2 4.17Å; F532-F543 HydrophobicContact CE2-CZ 4.39Å; F532-F543 HydrophobicContact CZ-CD1 4.35Å; F532-F543 AromaticContact CZ-CD2 3.94Å; F532-F543 HydrophobicContact CZ-CD2 3.94Å; F532-F543 HydrophobicContact CZ-CE1 4.14Å; F532-F543 AromaticContact CZ-CE2 3.68Å; F532-F543 HydrophobicContact CZ-CE2 3.68Å; F532-F543 HydrophobicContact CZ-CG 4.25Å; F532-F543 AromaticContact CZ-CZ 3.78Å; F532-F543 HydrophobicContact CZ-CZ 3.78Å; Y536-F543 HydrophobicContact CD1-CB 4.37Å; Y536-F543 HydrophobicContact CD1-CD2 4.11Å; Y536-F543 HydrophobicContact CD2-CB 4.41Å; Y536-F543 AromaticContact CD2-CD2 3.87Å; Y536-F543 HydrophobicContact CD2-CD2 3.87Å; Y536-F543 HydrophobicContact CD2-CG 4.45Å; Y536-F543 AromaticContact CE1-CD2 3.65Å; Y536-F543 HydrophobicContact CE1-CD2 3.65Å; Y536-F543 HydrophobicContact CE1-CE2 4.35Å; Y536-F543 AromaticContact CE2-CD2 3.39Å; Y536-F543 HydrophobicContact CE2-CD2 3.39Å; Y536-F543 AromaticContact CE2-CE2 3.79Å; Y536-F543 HydrophobicContact CE2-CE2 3.79Å; Y536-F543 HydrophobicContact CE2-CG 4.35Å; Y536-F543 HydrophobicContact CG-CB 4.25Å; Y536-F543 HydrophobicContact CG-CD2 4.23Å; Y536-F543 AromaticContact CZ-CD2 3.27Å; Y536-F543 AromaticContact CZ-CE2 3.63Å; Y536-F543 WeakPolarHBondContact OH-CE2 3.33Å; F543-S545 VanDerWaalsContact C-N 3.26Å; F543-S545 PolarHBondContact O-N 3.06Å; F543-S545 VanDerWaalsContact O-N 3.15Å; F543-V546 PolarHBondContact N-O 3.42Å; F543-V546 WeakPolarHBondContact O-CB 3.38Å; F543-V546 PolarHBondContact O-N 3.02Å; F543-L548 HydrophobicContact CB-CD2 4.35Å
544	R	80.1	Confident	86.2	Confident	67 Å²	67	52.4 Å²	52.4	25%	0.253	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	48.4	-178.2	-61.3	-172.6	-174.7	-70.4	-5.2	113.6	M463 N479 N494 V546	M463-R544 HydrophobicContact SD-CB 4.17Å; N479-R544 PolarHBondContact OD1-NE 3.24Å; N479-R544 PolarHBondContact OD1-NH2 3.18Å; N494-R544 PolarHBondContact OD1-NH2 3.5Å; R544-V546 VanDerWaalsContact C-N 3.27Å; R544-V546 PolarHBondContact O-N 3.44Å
545	S	80.8	Confident	86.1	Confident	113 Å²	113	51.9 Å²	51.9	79%	0.79	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.9	-6.5	-177.4	-48.9	0	0	0	0	116.8	F543	F543-S545 VanDerWaalsContact C-N 3.26Å; F543-S545 PolarHBondContact O-N 3.06Å; F543-S545 VanDerWaalsContact O-N 3.15Å
546	V	85.5	Confident	86	Confident	18 Å²	18	52.5 Å²	52.5	11%	0.109	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.9	173.9	-170.5	0	0	0	0	109.6	R462 M463 K542 F543 R544 L553	R462-V546 WeakPolarHBondContact O-CG2 3.37Å; M463-V546 HydrophobicContact CE-CG2 4.18Å; M463-V546 HydrophobicContact SD-CG2 3.9Å; K542-V546 CarbonylContact C-O 2.86Å; K542-V546 VanDerWaalsContact CA-O 3.27Å; K542-V546 WeakPolarHBondContact CA-O 3.18Å; F543-V546 PolarHBondContact N-O 3.42Å; F543-V546 WeakPolarHBondContact O-CB 3.38Å; F543-V546 PolarHBondContact O-N 3.02Å; R544-V546 VanDerWaalsContact C-N 3.27Å; R544-V546 PolarHBondContact O-N 3.44Å; V546-L553 HydrophobicContact CG1-CD1 4.44Å; V546-L553 HydrophobicContact CG1-CD2 3.87Å; V546-L553 HydrophobicContact CG1-CG 3.76Å
547	S	89.1	Confident	86.1	Confident	23 Å²	23	55.9 Å²	55.9	16%	0.161	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	143.3	176.5	73.9	0	0	0	0	111.5	S551 G552 L553	S547-S551 PolarHBondContact OG-OG 3.47Å; S547-G552 CarbonylContact O-C 3.59Å; S547-G552 VanDerWaalsContact O-CA 3.32Å; S547-G552 WeakPolarHBondContact O-CA 3.26Å; S547-G552 VanDerWaalsContact OG-CA 3.26Å; S547-G552 WeakPolarHBondContact OG-CA 3.2Å; S547-G552 PolarHBondContact OG-N 3.33Å; S547-G552 VanDerWaalsContact OG-N 3.1Å; S547-L553 PolarHBondContact O-N 3.35Å
548	L	89	Confident	86.3	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-85.5	-16.4	174.3	-61.3	-173.7	0	0	0	112.4	F533 V537 E541 F543 L553 N554 V555 A556	F533-L548 HydrophobicContact CD1-CD2 4.12Å; F533-L548 HydrophobicContact CE1-CD2 4.23Å; V537-L548 HydrophobicContact CG2-CB 4.48Å; V537-L548 HydrophobicContact CG2-CD1 3.59Å; E541-L548 WeakPolarHBondContact O-CB 3.47Å; E541-L548 PolarHBondContact O-N 2.85Å; F543-L548 HydrophobicContact CB-CD2 4.35Å; L548-L553 HydrophobicContact CD2-CD1 3.8Å; L548-L553 HydrophobicContact CD2-CG 4.49Å; L548-N554 PolarHBondContact O-N 3.11Å; L548-V555 HydrophobicContact CB-CG2 3.81Å; L548-V555 HydrophobicContact CD2-CG2 3.78Å; L548-V555 HydrophobicContact CG-CG2 4.27Å; L548-V555 PolarHBondContact O-N 3.44Å; L548-A556 WeakPolarHBondContact O-CB 3.26Å; L548-A556 PolarHBondContact O-N 3.44Å
549	G	87.3	Confident	86.6	Confident	10 Å²	10	51.7 Å²	51.7	10%	0.103	28%	0.276	C	S	.	.	S	Bend	trans	-73.2	-172	176.9	0	0	0	0	0	114.4	S551 G552 N554	G549-S551 PolarHBondContact O-N 2.74Å; G549-S551 VanDerWaalsContact O-N 3.11Å; G549-G552 PolarHBondContact O-N 3.28Å; G549-G552 VanDerWaalsContact O-N 3.1Å; G549-N554 VanDerWaalsContact O-CA 3.31Å; G549-N554 WeakPolarHBondContact O-CA 3.41Å; G549-N554 PolarHBondContact O-N 3.47Å
550	P	82	Confident	86.6	Confident	78 Å²	78	49.5 Å²	49.5	51%	0.506	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-25.3	-176.2	-25.7	34.9	0	0	0	114.6	V226 G552	V226-P550 HydrophobicContact CG2-CB 4.12Å; P550-G552 VanDerWaalsContact C-N 3.29Å; P550-G552 PolarHBondContact O-N 3.49Å
551	S	79.5	Confident	86.1	Confident	101 Å²	101	50.3 Å²	50.3	71%	0.706	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-6.3	179.6	56.1	0	0	0	0	114.8	S547 G549	S547-S551 PolarHBondContact OG-OG 3.47Å; G549-S551 PolarHBondContact O-N 2.74Å; G549-S551 VanDerWaalsContact O-N 3.11Å
552	G	85.1	Confident	84.8	Confident	6 Å²	6	54.4 Å²	54.4	6%	0.062	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.6	-102.9	-171.4	0	0	0	0	0	113.3	P224 R462 S547 G549 P550	P224-G552 WeakPolarHBondContact CD-O 3.37Å; P224-G552 WeakPolarHBondContact CG-O 3.17Å; R462-G552 PolarHBondContact NH2-O 2.98Å; S547-G552 CarbonylContact O-C 3.59Å; S547-G552 VanDerWaalsContact O-CA 3.32Å; S547-G552 WeakPolarHBondContact O-CA 3.26Å; S547-G552 VanDerWaalsContact OG-CA 3.26Å; S547-G552 WeakPolarHBondContact OG-CA 3.2Å; S547-G552 PolarHBondContact OG-N 3.33Å; S547-G552 VanDerWaalsContact OG-N 3.1Å; G549-G552 PolarHBondContact O-N 3.28Å; G549-G552 VanDerWaalsContact O-N 3.1Å; P550-G552 VanDerWaalsContact C-N 3.29Å; P550-G552 PolarHBondContact O-N 3.49Å
553	L	88.2	Confident	84.7	Confident	1 Å²	1	50.8 Å²	50.8	1%	0.005	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-18.3	178.6	-62.3	-175	0	0	0	113.1	W343 Y458 M459 R462 F533 V546 S547 L548 V555	W343-L553 PolarHBondContact NE1-O 2.87Å; Y458-L553 HydrophobicContact CE1-CD2 4.09Å; M459-L553 HydrophobicContact CE-CD1 3.81Å; M459-L553 HydrophobicContact SD-CD1 3.66Å; M459-L553 HydrophobicContact SD-CD2 4.38Å; R462-L553 HydrophobicContact CB-CD2 3.75Å; R462-L553 HydrophobicContact CG-CD2 3.68Å; F533-L553 HydrophobicContact CE1-CD1 4.05Å; V546-L553 HydrophobicContact CG1-CD1 4.44Å; V546-L553 HydrophobicContact CG1-CD2 3.87Å; V546-L553 HydrophobicContact CG1-CG 3.76Å; S547-L553 PolarHBondContact O-N 3.35Å; L548-L553 HydrophobicContact CD2-CD1 3.8Å; L548-L553 HydrophobicContact CD2-CG 4.49Å; L553-V555 HydrophobicContact CB-CG1 4.14Å; L553-V555 HydrophobicContact CB-CG2 4.04Å; L553-V555 PolarHBondContact O-N 2.91Å
554	N	89.2	Confident	84.7	Confident	52 Å²	52	53.4 Å²	53.4	28%	0.278	30%	0.302	S	S	.	.			trans	48.9	55.3	-173.3	-171.5	36.1	0	0	0	112.5	P224 W343 L548 G549 W557	P224-N554 HydrophobicContact CB-CB 3.45Å; P224-N554 VanDerWaalsContact CB-CB 3.45Å; P224-N554 HydrophobicContact CG-CB 3.28Å; W343-N554 PolarHBondContact NE1-O 3.02Å; L548-N554 PolarHBondContact O-N 3.11Å; G549-N554 VanDerWaalsContact O-CA 3.31Å; G549-N554 WeakPolarHBondContact O-CA 3.41Å; G549-N554 PolarHBondContact O-N 3.47Å; N554-W557 PolarHBondContact O-NE1 3.3Å; N554-W557 VanDerWaalsContact OD1-CD1 3.32Å
555	V	91.8	Very high	84.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	31%	0.305	C	S	.	.			trans	-113	-17.2	176.1	-68.9	0	0	0	0	112.3	W343 F533 L548 L553 W557 I558	W343-V555 HydrophobicContact CD2-CG1 3.79Å; W343-V555 HydrophobicContact CE3-CG1 4.27Å; W343-V555 HydrophobicContact CG-CG1 4.37Å; W343-V555 HydrophobicContact CH2-CG1 3.88Å; W343-V555 HydrophobicContact CZ2-CG1 3.33Å; W343-V555 HydrophobicContact CZ3-CG1 4.3Å; F533-V555 HydrophobicContact CD1-CG2 4.05Å; F533-V555 HydrophobicContact CE1-CG1 4.47Å; F533-V555 HydrophobicContact CE1-CG2 4.07Å; F533-V555 HydrophobicContact CE2-CG1 4.2Å; F533-V555 HydrophobicContact CG-CG2 4.45Å; F533-V555 HydrophobicContact CZ-CG1 4.05Å; F533-V555 HydrophobicContact CZ-CG2 4.45Å; L548-V555 HydrophobicContact CB-CG2 3.81Å; L548-V555 HydrophobicContact CD2-CG2 3.78Å; L548-V555 HydrophobicContact CG-CG2 4.27Å; L548-V555 PolarHBondContact O-N 3.44Å; L553-V555 HydrophobicContact CB-CG1 4.14Å; L553-V555 HydrophobicContact CB-CG2 4.04Å; L553-V555 PolarHBondContact O-N 2.91Å; V555-W557 PolarHBondContact O-N 3.21Å; V555-W557 VanDerWaalsContact O-N 3.16Å; V555-I558 HydrophobicContact CB-CD1 4.03Å; V555-I558 HydrophobicContact CG1-CD1 4.25Å; V555-I558 WeakPolarHBondContact O-CB 3.45Å; V555-I558 VanDerWaalsContact O-CG1 3.27Å; V555-I558 WeakPolarHBondContact O-CG1 3.44Å; V555-I558 PolarHBondContact O-N 2.6Å
556	A	90.4	Very high	85.2	Confident	23 Å²	23	49.1 Å²	49.1	19%	0.19	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-56.5	-35	-177.1	0	0	0	0	0	113.1	L548 I558 F559	L548-A556 WeakPolarHBondContact O-CB 3.26Å; L548-A556 PolarHBondContact O-N 3.44Å; A556-I558 PolarHBondContact O-N 3.03Å; A556-I558 VanDerWaalsContact O-N 3.14Å; A556-F559 PolarHBondContact O-N 2.92Å; A556-F559 VanDerWaalsContact O-N 3.1Å
557	W	91.8	Very high	85.2	Confident	92 Å²	92	51 Å²	51	35%	0.348	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-62.3	-20.4	178.2	69.7	-92.2	0	0	0	113.8	N339 K342 W343 N554 V555 F559 S560	N339-W557 HydrophobicContact CB-CE3 4.45Å; N339-W557 HydrophobicContact CB-CH2 4.11Å; N339-W557 HydrophobicContact CB-CZ3 3.68Å; N339-W557 WeakPolarHBondContact O-CH2 3.26Å; K342-W557 HydrophobicContact CB-CH2 4.38Å; W343-W557 HydrophobicContact CB-CH2 4.46Å; W343-W557 HydrophobicContact CB-CZ2 3.86Å; W343-W557 AromaticContact CD1-NE1 3.99Å; W343-W557 HydrophobicContact CG-CZ2 4.38Å; N554-W557 PolarHBondContact O-NE1 3.3Å; N554-W557 VanDerWaalsContact OD1-CD1 3.32Å; V555-W557 PolarHBondContact O-N 3.21Å; V555-W557 VanDerWaalsContact O-N 3.16Å; W557-F559 PolarHBondContact O-N 3.06Å; W557-S560 WeakPolarHBondContact O-CB 3.43Å; W557-S560 PolarHBondContact O-N 3.31Å; W557-S560 PolarHBondContact O-OG 2.65Å
558	I	93.8	Very high	84.9	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-57.6	-36.7	175.7	-66.1	171.1	0	0	0	110.1	W336 N339 L340 W343 L530 V555 A556	W336-I558 HydrophobicContact CB-CG2 4.26Å; N339-I558 HydrophobicContact CB-CB 4.27Å; N339-I558 HydrophobicContact CB-CG1 4.29Å; N339-I558 HydrophobicContact CB-CG2 3.95Å; N339-I558 PolarHBondContact ND2-O 2.82Å; L340-I558 HydrophobicContact CB-CD1 4.42Å; L340-I558 HydrophobicContact CB-CG2 4.34Å; L340-I558 HydrophobicContact CD1-CD1 3.98Å; W343-I558 HydrophobicContact CB-CD1 3.93Å; W343-I558 HydrophobicContact CB-CG1 4.46Å; W343-I558 HydrophobicContact CD2-CD1 4.45Å; W343-I558 HydrophobicContact CG-CD1 4.06Å; L530-I558 HydrophobicContact CD2-CG2 3.82Å; V555-I558 HydrophobicContact CB-CD1 4.03Å; V555-I558 HydrophobicContact CG1-CD1 4.25Å; V555-I558 WeakPolarHBondContact O-CB 3.45Å; V555-I558 VanDerWaalsContact O-CG1 3.27Å; V555-I558 WeakPolarHBondContact O-CG1 3.44Å; V555-I558 PolarHBondContact O-N 2.6Å; A556-I558 PolarHBondContact O-N 3.03Å; A556-I558 VanDerWaalsContact O-N 3.14Å
559	F	93.2	Very high	84.6	Confident	19 Å²	19	56.6 Å²	56.6	8%	0.083	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-92.2	0.9	-175.7	-57.4	-76.8	0	0	0	114.1	W336 L530 F533 H534 V537 A556 W557 K561	W336-F559 AromaticContact CD2-CD1 3.78Å; W336-F559 HydrophobicContact CD2-CD1 3.78Å; W336-F559 HydrophobicContact CD2-CE1 4.39Å; W336-F559 AromaticContact CE3-CD1 3.63Å; W336-F559 HydrophobicContact CE3-CD1 3.63Å; W336-F559 AromaticContact CE3-CE1 3.96Å; W336-F559 HydrophobicContact CE3-CE1 3.96Å; W336-F559 HydrophobicContact CG-CD1 4.36Å; W336-F559 HydrophobicContact CH2-CD1 4.09Å; W336-F559 HydrophobicContact CZ2-CB 4.36Å; W336-F559 HydrophobicContact CZ2-CD1 4.25Å; W336-F559 AromaticContact CZ3-CD1 3.79Å; W336-F559 HydrophobicContact CZ3-CD1 3.79Å; W336-F559 HydrophobicContact CZ3-CE1 4.25Å; L530-F559 HydrophobicContact CD2-CE1 4.07Å; L530-F559 HydrophobicContact CD2-CZ 4.16Å; F533-F559 HydrophobicContact CB-CE2 3.7Å; F533-F559 HydrophobicContact CB-CZ 3.64Å; H534-F559 HydrophobicContact CB-CD1 4.46Å; H534-F559 HydrophobicContact CB-CE1 3.75Å; H534-F559 HydrophobicContact CB-CZ 4.07Å; H534-F559 AromaticContact CD2-CD1 3.92Å; V537-F559 HydrophobicContact CB-CD2 4.43Å; V537-F559 HydrophobicContact CG1-CD2 4.45Å; V537-F559 HydrophobicContact CG2-CD2 3.78Å; V537-F559 HydrophobicContact CG2-CE2 3.89Å; A556-F559 PolarHBondContact O-N 2.92Å; A556-F559 VanDerWaalsContact O-N 3.1Å; W557-F559 PolarHBondContact O-N 3.06Å; F559-K561 PolarHBondContact O-N 3.08Å
560	S	85.2	Confident	84.4	Confident	63 Å²	63	60.2 Å²	60.2	44%	0.441	33%	0.333	S	S	.	.			trans	-60.3	129.7	179.7	-66.9	0	0	0	0	110.9	W557 N562	W557-S560 WeakPolarHBondContact O-CB 3.43Å; W557-S560 PolarHBondContact O-N 3.31Å; W557-S560 PolarHBondContact O-OG 2.65Å; S560-N562 PolarHBondContact O-N 3.35Å
561	K	70.9	Confident	84.6	Confident	151 Å²	151	58.8 Å²	58.8	66%	0.657	32%	0.319	S	S	*	.			trans	-79.3	112.6	166.4	-65.2	-174.9	178.5	-174.9	0	107.4	F559	F559-K561 PolarHBondContact O-N 3.08Å
562	N	56.5	Low	85.1	Confident	197 Å²	197	54.9 Å²	54.9	100%	1.053	28%	0.283	S	S	*	.			trans	-50.6	0	165	-70.5	7.5	0	0	0	111.3	R335 S560	R335-N562 VanDerWaalsContact NH1-CB 3.25Å; R335-N562 VanDerWaalsContact NH1-CG 3.28Å; R335-N562 PolarHBondContact NH1-OD1 2.94Å; S560-N562 PolarHBondContact O-N 3.35Å

Retrieved 562 of 562 residues in 199.5 ms (Link to these results)

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