A0A096NQV9_PAPAN Loading...

polynucleotide adenylyltransferase

AlphaFold DB (A0A2K5W0T7), UniProt , Accession A0A096NQV9, Species PAPAN (Papio anubis, Olive baboon), Gene PAPOLG, Length 736 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	31.2	Very low	30.5	Very low	240 Å²	240	148.7 Å²	148.7	100%	1.182	82%	0.815	S	S	*	*				0	174.6	0	-66	179.9	-175.4	0	0	108.7
2	K	33.7	Very low	30.4	Very low	164 Å²	164	145.3 Å²	145.3	71%	0.713	81%	0.81	S	S	*	*			trans	-10.7	152.1	151.4	-68	174.8	155.6	-85.9	0	117.7
3	E	29.8	Very low	30.7	Very low	135 Å²	135	145.5 Å²	145.5	63%	0.631	80%	0.801	S	S	*	*			cis	-170.1	166.9	-7.1	-114.7	159.5	161	0	0	109.9
4	M	31.1	Very low	30.9	Very low	168 Å²	168	143.4 Å²	143.4	83%	0.828	80%	0.799	S	S	*	*			trans	38.1	117.1	148.7	-63.8	176.4	131.3	0	0	122
5	S	29.6	Very low	31.3	Very low	121 Å²	121	145.4 Å²	145.4	85%	0.846	80%	0.8	S	S	*	*				171.1	117	117.5	-73.9	0	0	0	0	109
6	A	29.4	Very low	32.4	Very low	87 Å²	87	146 Å²	146	72%	0.719	80%	0.796	S	S	*	*			cis	91.1	100.5	32.4	0	0	0	0	0	115
7	N	30.3	Very low	34.2	Very low	154 Å²	154	148.9 Å²	148.9	82%	0.824	80%	0.799	S	S	*	*			trans	54.8	109.4	149.9	-57.9	-6.5	0	0	0	120.6
8	T	27	Very low	36.6	Very low	141 Å²	141	146.2 Å²	146.2	87%	0.865	78%	0.78	S	S	*	*				-147.2	96	126.7	-30.1	0	0	0	0	110.9
9	V	32.5	Very low	39.5	Very low	143 Å²	143	143.4 Å²	143.4	87%	0.867	76%	0.758	S	S	*	*			trans	-118.1	130.9	160.8	178.1	0	0	0	0	106.1	D11	V9-D11 PolarHBondContact O-N 3.28Å
10	L	30.3	Very low	42.2	Very low	159 Å²	159	137.5 Å²	137.5	83%	0.832	73%	0.733	S	S	*	*			trans	-71.4	116	-172.5	-76.7	157.3	0	0	0	110.8	S12	L10-S12 VanDerWaalsContact C-N 3.29Å; L10-S12 PolarHBondContact O-N 2.94Å
11	D	30.2	Very low	44.8	Very low	124 Å²	124	133.4 Å²	133.4	66%	0.663	71%	0.711	S	S	*	*			trans	-70.8	83.3	171.9	-179.2	32.7	0	0	0	110	V9 Q13	V9-D11 PolarHBondContact O-N 3.28Å; D11-Q13 VanDerWaalsContact C-N 3.29Å; D11-Q13 PolarHBondContact O-N 2.92Å; D11-Q13 VanDerWaalsContact OD2-CG 3.24Å; D11-Q13 WeakPolarHBondContact OD2-CG 3.24Å; D11-Q13 PolarHBondContact OD2-NE2 2.87Å
12	S	30	Very low	47.9	Very low	107 Å²	107	124.8 Å²	124.8	75%	0.748	67%	0.672	S	S	*	*			trans	-72.7	86.3	172.4	60.2	0	0	0	0	109.3	L10 C14	L10-S12 VanDerWaalsContact C-N 3.29Å; L10-S12 PolarHBondContact O-N 2.94Å; S12-C14 VanDerWaalsContact C-N 3.32Å; S12-C14 PolarHBondContact O-N 3.02Å
13	Q	33.8	Very low	50.9	Low	149 Å²	149	120.9 Å²	120.9	70%	0.696	67%	0.665	S	S	*	*			trans	-61.8	86.8	-177.5	-68.2	-173	-4.1	0	0	112.5	D11 Q15	D11-Q13 VanDerWaalsContact C-N 3.29Å; D11-Q13 PolarHBondContact O-N 2.92Å; D11-Q13 VanDerWaalsContact OD2-CG 3.24Å; D11-Q13 WeakPolarHBondContact OD2-CG 3.24Å; D11-Q13 PolarHBondContact OD2-NE2 2.87Å; Q13-Q15 PolarHBondContact O-N 2.97Å
14	C	33.9	Very low	54.1	Low	115 Å²	115	116 Å²	116	78%	0.777	65%	0.645	S	S	*	*			trans	-65.1	98	161.2	-173.7	0	0	0	0	107.5	S12 Q16	S12-C14 VanDerWaalsContact C-N 3.32Å; S12-C14 PolarHBondContact O-N 3.02Å; C14-Q16 PolarHBondContact O-N 3.13Å
15	Q	37.2	Very low	57.3	Low	174 Å²	174	112.9 Å²	112.9	81%	0.813	63%	0.631	S	S	*	*			trans	-56.5	105.2	177.8	-71.1	-175.5	-9.9	0	0	109.2	Q13 K17	Q13-Q15 PolarHBondContact O-N 2.97Å; Q15-K17 PolarHBondContact O-N 2.93Å
16	Q	48.4	Very low	60.5	Low	155 Å²	155	109.4 Å²	109.4	72%	0.724	61%	0.606	S	S	*	*			trans	-62.3	106.2	178.9	-75	-170.8	-11	0	0	109.1	C14 H18	C14-Q16 PolarHBondContact O-N 3.13Å; Q16-H18 VanDerWaalsContact C-N 3.25Å; Q16-H18 PolarHBondContact O-N 3.25Å
17	K	62.6	Low	63.7	Low	196 Å²	196	109.6 Å²	109.6	85%	0.852	60%	0.595	S	S	*	*			trans	-72.1	80.3	-175.8	-167.4	175.1	-175.9	176.6	0	109.8	Q15	Q15-K17 PolarHBondContact O-N 2.93Å
18	H	78.3	Confident	66.9	Low	99 Å²	99	105.2 Å²	105.2	46%	0.458	58%	0.58	S	S	.	*			trans	-70.4	155.3	177.9	63.7	-87.7	0	0	0	111.3	Q16 T22	Q16-H18 VanDerWaalsContact C-N 3.25Å; Q16-H18 PolarHBondContact O-N 3.25Å; H18-T22 PolarHBondContact CD2-O 3.26Å
19	Y	92	Very high	70.2	Confident	94 Å²	94	102.9 Å²	102.9	37%	0.369	57%	0.568	S	S	.	*			trans	-95.7	140.9	-177.9	-63.7	-97.3	0	0	0	110.6	H211 P214 Q257	Y19-H211 WeakPolarHBondContact CE1-O 3.47Å; Y19-P214 HydrophobicContact CD2-CB 3.8Å; Y19-P214 HydrophobicContact CD2-CG 4.48Å; Y19-P214 HydrophobicContact CE2-CB 3.79Å; Y19-Q257 WeakPolarHBondContact O-CB 3.15Å
20	G	93.5	Very high	73.3	Confident	24 Å²	24	97.9 Å²	97.9	25%	0.247	54%	0.539	C	S	.	.	S	Bend	trans	101.5	-176.4	177	0	0	0	0	0	115	L286	G20-L286 WeakPolarHBondContact CA-O 3.34Å
21	I	95.4	Very high	76.5	Confident	52 Å²	52	97.5 Å²	97.5	27%	0.267	53%	0.53	S	S	.	.	S	Bend	trans	-88.7	1.2	-178.7	57.9	150.4	0	0	0	114.3	L285 K287 Q288	I21-L285 HydrophobicContact CD1-CB 4.03Å; I21-L285 HydrophobicContact CD1-CD1 4.27Å; I21-L285 HydrophobicContact CD1-CG 4.45Å; I21-L285 HydrophobicContact CG1-CB 4.39Å; I21-L285 HydrophobicContact CG2-CB 4.21Å; I21-K287 WeakPolarHBondContact CG2-O 3.37Å; I21-Q288 HydrophobicContact CG2-CG 4.13Å
22	T	96.2	Very high	79.7	Confident	59 Å²	59	99.3 Å²	99.3	36%	0.362	54%	0.535	S	S	.	.	S	Bend	trans	-145.2	158	179.6	64.8	0	0	0	0	109.7	H18 R254	H18-T22 PolarHBondContact CD2-O 3.26Å; T22-R254 PolarHBondContact OG1-NH2 3.29Å
23	S	96.7	Very high	82.8	Confident	83 Å²	83	98.1 Å²	98.1	58%	0.58	52%	0.52	S	S	*	.			trans	-50.7	151.5	162.5	-49.7	0	0	0	0	112
24	P	97.5	Very high	85.8	Confident	33 Å²	33	92.3 Å²	92.3	21%	0.214	49%	0.493	C	S	.	.			trans	-68.1	153.7	172.6	27.8	-33.3	0	0	0	111.7	L27 P260	P24-L27 HydrophobicContact CB-CD2 4.27Å; P24-L27 HydrophobicContact CG-CD2 3.58Å; P24-L27 HydrophobicContact CG-CG 4.19Å; P24-P260 HydrophobicContact CB-CG 4.14Å; P24-P260 HydrophobicContact CG-CG 4.48Å
25	I	97.8	Very high	88.8	Confident	102 Å²	102	92 Å²	92	52%	0.523	48%	0.48	S	S	.	.	S	Bend	trans	-78	-33.3	177.4	-63.8	170.9	0	0	0	110.7	L258 Y259	I25-L258 HydrophobicContact CD1-CB 4.08Å; I25-L258 HydrophobicContact CD1-CD1 4.12Å; I25-L258 HydrophobicContact CD1-CD2 4.06Å; I25-L258 HydrophobicContact CD1-CG 4.31Å; I25-L258 HydrophobicContact CG1-CB 4.26Å; I25-L258 HydrophobicContact CG1-CD2 4.03Å; I25-L258 PolarHBondContact N-O 3.24Å; I25-Y259 HydrophobicContact CB-CE1 4.03Å; I25-Y259 HydrophobicContact CB-CE2 4.4Å; I25-Y259 HydrophobicContact CD1-CE2 4.12Å; I25-Y259 HydrophobicContact CG2-CE1 3.97Å; I25-Y259 WeakPolarHBondContact CG2-OH 3.5Å
26	S	97.5	Very high	91.7	Very high	47 Å²	47	88 Å²	88	33%	0.329	46%	0.463	S	S	.	.			trans	-152.4	137.6	173.3	-177.5	0	0	0	0	112.1	A28 L258	S26-A28 WeakPolarHBondContact OG-CB 3.34Å; S26-A28 PolarHBondContact OG-N 2.97Å; S26-A28 VanDerWaalsContact OG-N 3.13Å; S26-L258 PolarHBondContact N-O 3.38Å
27	L	97.1	Very high	94.1	Very high	91 Å²	91	81.8 Å²	81.8	48%	0.476	43%	0.433	S	S	.	.			trans	-94.5	6.1	171.2	-64.2	178	0	0	0	112.7	P24 C29 P260 N261	P24-L27 HydrophobicContact CB-CD2 4.27Å; P24-L27 HydrophobicContact CG-CD2 3.58Å; P24-L27 HydrophobicContact CG-CG 4.19Å; L27-C29 PolarHBondContact O-N 2.76Å; L27-P260 HydrophobicContact CD2-CG 3.63Å; L27-N261 PolarHBondContact O-ND2 2.69Å
28	A	97.1	Very high	95.8	Very high	63 Å²	63	73.3 Å²	73.3	52%	0.521	40%	0.398	S	S	.	.	P	Polyproline II helix	trans	-62.6	126.9	-178	0	0	0	0	0	111.9	S26	S26-A28 WeakPolarHBondContact OG-CB 3.34Å; S26-A28 PolarHBondContact OG-N 2.97Å; S26-A28 VanDerWaalsContact OG-N 3.13Å
29	C	96.8	Very high	96.7	Very high	91 Å²	91	72.9 Å²	72.9	62%	0.615	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-70.5	155.9	170	-58.6	0	0	0	0	111	L27	L27-C29 PolarHBondContact O-N 2.76Å
30	P	96.9	Very high	97	Very high	38 Å²	38	72.7 Å²	72.7	25%	0.247	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-60.4	154.4	173.4	26.5	-37.8	0	0	0	112.4	D34 H35 N261 A263	P30-D34 HydrophobicContact CB-CB 3.77Å; P30-H35 VanDerWaalsContact CG-NE2 3.32Å; P30-H35 WeakPolarHBondContact CG-NE2 3.48Å; P30-N261 WeakPolarHBondContact CD-O 2.97Å; P30-A263 HydrophobicContact CB-CB 3.76Å; P30-A263 HydrophobicContact CG-CB 4.2Å
31	K	97.1	Very high	97.2	Very high	151 Å²	151	71.7 Å²	71.7	66%	0.657	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-94.5	164.6	164.7	-61.4	176.2	-177.6	-178.9	0	109.2	I33 D34 H35	K31-I33 HydrophobicContact CB-CG2 3.95Å; K31-I33 PolarHBondContact O-N 2.81Å; K31-I33 VanDerWaalsContact O-N 3.13Å; K31-D34 PolarHBondContact N-OD2 2.9Å; K31-D34 WeakPolarHBondContact O-CB 3.49Å; K31-D34 PolarHBondContact O-N 2.82Å; K31-H35 PolarHBondContact O-CD2 3.37Å; K31-H35 VanDerWaalsContact O-CD2 3.31Å; K31-H35 PolarHBondContact O-N 3.36Å
32	E	97.2	Very high	97.4	Very high	163 Å²	163	71 Å²	71	76%	0.762	38%	0.382	S	S	*	.	H	α-helix	trans	-49.9	-39.7	175.5	-173.9	171.4	-153.4	0	0	112.9	D34 H35 I36	E32-D34 VanDerWaalsContact C-N 3.34Å; E32-D34 PolarHBondContact O-N 3.32Å; E32-H35 WeakPolarHBondContact O-CB 3.32Å; E32-H35 PolarHBondContact O-N 3.33Å; E32-H35 VanDerWaalsContact O-N 3.1Å; E32-I36 PolarHBondContact O-N 3.14Å
33	I	96.6	Very high	97.4	Very high	82 Å²	82	71.4 Å²	71.4	42%	0.421	38%	0.383	S	S	.	.	H	α-helix	trans	-62.2	-33.9	175.1	-171.2	58.5	0	0	0	113.7	K31 H35 I36 Y37	K31-I33 HydrophobicContact CB-CG2 3.95Å; K31-I33 PolarHBondContact O-N 2.81Å; K31-I33 VanDerWaalsContact O-N 3.13Å; I33-H35 VanDerWaalsContact C-N 3.31Å; I33-H35 PolarHBondContact O-N 3.1Å; I33-I36 HydrophobicContact CD1-CB 4.42Å; I33-I36 HydrophobicContact CD1-CD1 4.44Å; I33-I36 PolarHBondContact O-N 3.13Å; I33-Y37 HydrophobicContact CD1-CD2 4.02Å; I33-Y37 HydrophobicContact CD1-CE2 3.72Å; I33-Y37 HydrophobicContact CG1-CD2 3.84Å; I33-Y37 HydrophobicContact CG1-CE2 3.64Å; I33-Y37 WeakPolarHBondContact O-CD2 3.43Å; I33-Y37 PolarHBondContact O-N 3.38Å
34	D	96.4	Very high	97.4	Very high	27 Å²	27	68.6 Å²	68.6	14%	0.144	37%	0.365	C	S	.	.	H	α-helix	trans	-67.2	-33.3	174.6	-65	-79.7	0	0	0	111.4	P30 K31 E32 T38 A263 S265 T266	P30-D34 HydrophobicContact CB-CB 3.77Å; K31-D34 PolarHBondContact N-OD2 2.9Å; K31-D34 WeakPolarHBondContact O-CB 3.49Å; K31-D34 PolarHBondContact O-N 2.82Å; E32-D34 VanDerWaalsContact C-N 3.34Å; E32-D34 PolarHBondContact O-N 3.32Å; D34-T38 WeakPolarHBondContact O-CB 3.04Å; D34-T38 PolarHBondContact O-N 2.72Å; D34-T38 PolarHBondContact O-OG1 2.82Å; D34-A263 HydrophobicContact CB-CB 4.17Å; D34-S265 PolarHBondContact O-OG 3.01Å; D34-T266 PolarHBondContact OD1-OG1 2.79Å
35	H	97.5	Very high	97.4	Very high	108 Å²	108	67 Å²	67	50%	0.5	36%	0.355	S	S	.	.	H	α-helix	trans	-69.2	-43.1	173	-66.2	-83.3	0	0	0	111.4	P30 K31 E32 I33 Y37 T38 Q39	P30-H35 VanDerWaalsContact CG-NE2 3.32Å; P30-H35 WeakPolarHBondContact CG-NE2 3.48Å; K31-H35 PolarHBondContact O-CD2 3.37Å; K31-H35 VanDerWaalsContact O-CD2 3.31Å; K31-H35 PolarHBondContact O-N 3.36Å; E32-H35 WeakPolarHBondContact O-CB 3.32Å; E32-H35 PolarHBondContact O-N 3.33Å; E32-H35 VanDerWaalsContact O-N 3.1Å; I33-H35 VanDerWaalsContact C-N 3.31Å; I33-H35 PolarHBondContact O-N 3.1Å; H35-Y37 VanDerWaalsContact C-N 3.35Å; H35-Y37 PolarHBondContact O-N 3.44Å; H35-T38 CarbonylContact O-C 3.49Å; H35-T38 WeakPolarHBondContact O-CA 3.44Å; H35-T38 WeakPolarHBondContact O-CB 3.37Å; H35-T38 PolarHBondContact O-N 2.81Å; H35-Q39 PolarHBondContact O-N 2.9Å
36	I	97.6	Very high	97.3	Very high	90 Å²	90	67.7 Å²	67.7	46%	0.462	35%	0.354	S	S	.	.	H	α-helix	trans	-58.4	-46	173.4	-64.8	169.2	0	0	0	110.7	E32 I33 T38 Q39 K40	E32-I36 PolarHBondContact O-N 3.14Å; I33-I36 HydrophobicContact CD1-CB 4.42Å; I33-I36 HydrophobicContact CD1-CD1 4.44Å; I33-I36 PolarHBondContact O-N 3.13Å; I36-T38 VanDerWaalsContact C-N 3.3Å; I36-T38 PolarHBondContact O-N 3.31Å; I36-Q39 PolarHBondContact O-N 2.74Å; I36-K40 PolarHBondContact O-N 3.34Å
37	Y	97.8	Very high	97.1	Very high	25 Å²	25	70.6 Å²	70.6	10%	0.098	37%	0.371	C	S	.	.	H	α-helix	trans	-65.9	-29.7	174.1	-80.8	-65.8	0	0	0	113.4	I33 H35 K40 L41 I350 L351 G353 W357	I33-Y37 HydrophobicContact CD1-CD2 4.02Å; I33-Y37 HydrophobicContact CD1-CE2 3.72Å; I33-Y37 HydrophobicContact CG1-CD2 3.84Å; I33-Y37 HydrophobicContact CG1-CE2 3.64Å; I33-Y37 WeakPolarHBondContact O-CD2 3.43Å; I33-Y37 PolarHBondContact O-N 3.38Å; H35-Y37 VanDerWaalsContact C-N 3.35Å; H35-Y37 PolarHBondContact O-N 3.44Å; Y37-K40 HydrophobicContact CD1-CD 4.42Å; Y37-L41 WeakPolarHBondContact O-CB 3.43Å; Y37-L41 PolarHBondContact O-N 3.02Å; Y37-I350 HydrophobicContact CD1-CG2 4.02Å; Y37-I350 HydrophobicContact CE1-CG2 3.97Å; Y37-I350 WeakPolarHBondContact CE1-O 3.42Å; Y37-I350 PolarHBondContact OH-O 3.35Å; Y37-L351 HydrophobicContact CD2-CD2 4.04Å; Y37-L351 HydrophobicContact CE2-CD2 4.42Å; Y37-L351 HydrophobicContact CG-CD2 4.16Å; Y37-G353 WeakPolarHBondContact OH-CA 3.35Å; Y37-G353 PolarHBondContact OH-N 3.46Å; Y37-W357 PolarHBondContact O-NE1 2.77Å
38	T	98.3	Very high	97	Very high	18 Å²	18	69.9 Å²	69.9	11%	0.11	37%	0.365	C	S	.	.	H	α-helix	trans	-69.4	-40	174.2	-64.5	0	0	0	0	111.2	D34 H35 I36 L41 I42 L221 A264 S265	D34-T38 WeakPolarHBondContact O-CB 3.04Å; D34-T38 PolarHBondContact O-N 2.72Å; D34-T38 PolarHBondContact O-OG1 2.82Å; H35-T38 CarbonylContact O-C 3.49Å; H35-T38 WeakPolarHBondContact O-CA 3.44Å; H35-T38 WeakPolarHBondContact O-CB 3.37Å; H35-T38 PolarHBondContact O-N 2.81Å; I36-T38 VanDerWaalsContact C-N 3.3Å; I36-T38 PolarHBondContact O-N 3.31Å; T38-L41 WeakPolarHBondContact O-CB 3.4Å; T38-L41 PolarHBondContact O-N 3.38Å; T38-I42 HydrophobicContact CG2-CD1 4.33Å; T38-I42 WeakPolarHBondContact O-CG1 3.39Å; T38-I42 PolarHBondContact O-N 3.1Å; T38-L221 HydrophobicContact CG2-CD2 3.67Å; T38-A264 HydrophobicContact CG2-CB 4.05Å; T38-S265 WeakPolarHBondContact OG1-CB 3.35Å; T38-S265 PolarHBondContact OG1-N 3.47Å; T38-S265 PolarHBondContact OG1-OG 2.81Å
39	Q	98.3	Very high	96.8	Very high	89 Å²	89	68.2 Å²	68.2	42%	0.416	35%	0.353	S	S	.	.	H	α-helix	trans	-64.6	-47.8	174.4	-173.6	52.8	46.8	0	0	111.1	H35 I36 L41 I42 D43	H35-Q39 PolarHBondContact O-N 2.9Å; I36-Q39 PolarHBondContact O-N 2.74Å; Q39-L41 PolarHBondContact O-N 2.88Å; Q39-L41 VanDerWaalsContact O-N 3.17Å; Q39-I42 WeakPolarHBondContact O-CB 3.22Å; Q39-I42 PolarHBondContact O-N 2.87Å; Q39-D43 VanDerWaalsContact NE2-CG 3.28Å; Q39-D43 PolarHBondContact NE2-OD1 2.94Å; Q39-D43 PolarHBondContact NE2-OD2 2.9Å; Q39-D43 PolarHBondContact O-N 3.38Å
40	K	97.9	Very high	96.7	Very high	91 Å²	91	64.1 Å²	64.1	40%	0.396	33%	0.326	S	S	.	.	H	α-helix	trans	-54.8	-34.3	172	-74.9	-171.8	160.7	-153.7	0	113.2	I36 Y37 A44 D356	I36-K40 PolarHBondContact O-N 3.34Å; Y37-K40 HydrophobicContact CD1-CD 4.42Å; K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.13Å; K40-A44 PolarHBondContact O-N 2.89Å; K40-D356 IonicContact NZ-OD1 3.31Å; K40-D356 PolarHBondContact NZ-OD1 3.07Å
41	L	98.3	Very high	96.5	Very high	2 Å²	2	65.3 Å²	65.3	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-69.5	-44.4	176.2	174.3	58.7	0	0	0	111.4	Y37 T38 Q39 D43 M45 A225 V268 W357	Y37-L41 WeakPolarHBondContact O-CB 3.43Å; Y37-L41 PolarHBondContact O-N 3.02Å; T38-L41 WeakPolarHBondContact O-CB 3.4Å; T38-L41 PolarHBondContact O-N 3.38Å; Q39-L41 PolarHBondContact O-N 2.88Å; Q39-L41 VanDerWaalsContact O-N 3.17Å; L41-D43 VanDerWaalsContact C-N 3.34Å; L41-M45 HydrophobicContact CD1-CE 4.23Å; L41-M45 HydrophobicContact CD1-CG 4.34Å; L41-M45 HydrophobicContact CD1-SD 4.29Å; L41-M45 HydrophobicContact CG-CE 3.97Å; L41-M45 WeakPolarHBondContact O-CB 3.47Å; L41-M45 VanDerWaalsContact O-CG 3.31Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 2.6Å; L41-A225 HydrophobicContact CD1-CB 4.06Å; L41-A225 HydrophobicContact CD2-CB 4.28Å; L41-V268 HydrophobicContact CD2-CG2 3.98Å; L41-W357 HydrophobicContact CB-CD2 4.07Å; L41-W357 HydrophobicContact CB-CG 4.15Å; L41-W357 HydrophobicContact CB-CZ2 4.29Å; L41-W357 HydrophobicContact CD1-CB 4.45Å; L41-W357 HydrophobicContact CD1-CD2 3.81Å; L41-W357 HydrophobicContact CD1-CE3 3.84Å; L41-W357 HydrophobicContact CD1-CG 4.1Å; L41-W357 HydrophobicContact CD1-CZ3 4.35Å; L41-W357 HydrophobicContact CD2-CH2 4.5Å; L41-W357 HydrophobicContact CD2-CZ2 4.45Å; L41-W357 HydrophobicContact CG-CD2 4.43Å
42	I	98	Very high	96.2	Very high	37 Å²	37	59.4 Å²	59.4	19%	0.19	30%	0.302	C	S	.	.	H	α-helix	trans	-57.3	-49.1	173.8	-68.7	161.7	0	0	0	110.1	T38 Q39 M45 K46 F51 L221	T38-I42 HydrophobicContact CG2-CD1 4.33Å; T38-I42 WeakPolarHBondContact O-CG1 3.39Å; T38-I42 PolarHBondContact O-N 3.1Å; Q39-I42 WeakPolarHBondContact O-CB 3.22Å; Q39-I42 PolarHBondContact O-N 2.87Å; I42-M45 WeakPolarHBondContact O-CB 3.27Å; I42-M45 PolarHBondContact O-N 2.84Å; I42-M45 VanDerWaalsContact O-N 3.08Å; I42-K46 PolarHBondContact O-N 3.03Å; I42-K46 VanDerWaalsContact O-N 3.08Å; I42-F51 HydrophobicContact CG2-CE2 4.21Å; I42-F51 HydrophobicContact CG2-CZ 4.16Å; I42-L221 HydrophobicContact CD1-CD2 3.87Å; I42-L221 HydrophobicContact CG1-CD1 3.74Å; I42-L221 HydrophobicContact CG1-CD2 3.83Å; I42-L221 HydrophobicContact CG1-CG 4.43Å
43	D	97.5	Very high	95.9	Very high	68 Å²	68	55.8 Å²	55.8	36%	0.364	29%	0.288	S	S	.	.	H	α-helix	trans	-68.4	-38.4	-176.1	-65.4	-41.8	0	0	0	112.9	Q39 L41 M45 K46 P47	Q39-D43 VanDerWaalsContact NE2-CG 3.28Å; Q39-D43 PolarHBondContact NE2-OD1 2.94Å; Q39-D43 PolarHBondContact NE2-OD2 2.9Å; Q39-D43 PolarHBondContact O-N 3.38Å; L41-D43 VanDerWaalsContact C-N 3.34Å; D43-M45 PolarHBondContact O-N 2.82Å; D43-K46 PolarHBondContact O-N 3.44Å; D43-K46 WeakPolarHBondContact OD1-CE 3.16Å; D43-K46 IonicContact OD1-NZ 3.66Å; D43-K46 PolarHBondContact OD1-NZ 3.17Å; D43-P47 WeakPolarHBondContact O-CD 3.41Å
44	A	97	Very high	95.6	Very high	25 Å²	25	59.5 Å²	59.5	21%	0.207	30%	0.303	C	S	.	.	H	α-helix	trans	-65.3	-20.4	172	0	0	0	0	0	113.5	K40 F48 W357	K40-A44 VanDerWaalsContact O-CB 3.29Å; K40-A44 WeakPolarHBondContact O-CB 3.13Å; K40-A44 PolarHBondContact O-N 2.89Å; A44-F48 WeakPolarHBondContact O-CD2 3.41Å; A44-F48 WeakPolarHBondContact O-CE2 3.44Å; A44-W357 HydrophobicContact CB-CB 3.65Å
45	M	96.9	Very high	95.4	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-90.4	-29.8	178.5	-79	-165.6	-58.3	0	0	114.2	L41 I42 D43 P47 F48 V50 F51 L221 A225 L228 L361	L41-M45 HydrophobicContact CD1-CE 4.23Å; L41-M45 HydrophobicContact CD1-CG 4.34Å; L41-M45 HydrophobicContact CD1-SD 4.29Å; L41-M45 HydrophobicContact CG-CE 3.97Å; L41-M45 WeakPolarHBondContact O-CB 3.47Å; L41-M45 VanDerWaalsContact O-CG 3.31Å; L41-M45 WeakPolarHBondContact O-CG 3.32Å; L41-M45 PolarHBondContact O-N 2.6Å; I42-M45 WeakPolarHBondContact O-CB 3.27Å; I42-M45 PolarHBondContact O-N 2.84Å; I42-M45 VanDerWaalsContact O-N 3.08Å; D43-M45 PolarHBondContact O-N 2.82Å; M45-P47 VanDerWaalsContact C-CD 3.46Å; M45-F48 PolarHBondContact O-N 3.39Å; M45-V50 HydrophobicContact CB-CG2 3.69Å; M45-V50 HydrophobicContact CG-CG2 4.29Å; M45-V50 HydrophobicContact SD-CG2 4.22Å; M45-F51 HydrophobicContact CB-CE2 4.05Å; M45-F51 HydrophobicContact CE-CE2 4.42Å; M45-F51 HydrophobicContact CE-CZ 4.04Å; M45-L221 HydrophobicContact CE-CD1 3.54Å; M45-A225 HydrophobicContact CE-CB 4.3Å; M45-A225 WeakPolarHBondContact SD-CA 3.37Å; M45-A225 HydrophobicContact SD-CB 3.65Å; M45-L228 HydrophobicContact CG-CD2 3.98Å; M45-L361 HydrophobicContact CG-CD1 4.33Å
46	K	94.8	Very high	95.1	Very high	116 Å²	116	64 Å²	64	50%	0.504	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-47.5	-46.1	-179.3	-76.5	171.8	179.6	165.4	0	114.1	I42 D43 F48 G49 F51	I42-K46 PolarHBondContact O-N 3.03Å; I42-K46 VanDerWaalsContact O-N 3.08Å; D43-K46 PolarHBondContact O-N 3.44Å; D43-K46 WeakPolarHBondContact OD1-CE 3.16Å; D43-K46 IonicContact OD1-NZ 3.66Å; D43-K46 PolarHBondContact OD1-NZ 3.17Å; K46-F48 PolarHBondContact O-N 2.81Å; K46-G49 PolarHBondContact O-N 3.38Å; K46-F51 HydrophobicContact CG-CD2 4.27Å; K46-F51 HydrophobicContact CG-CE2 4.4Å
47	P	95.1	Very high	94.8	Very high	108 Å²	108	63 Å²	63	70%	0.701	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-64.8	-9.2	-178.4	-23	35.2	0	0	0	115.6	D43 M45	D43-P47 WeakPolarHBondContact O-CD 3.41Å; M45-P47 VanDerWaalsContact C-CD 3.46Å
48	F	94.4	Very high	94.7	Very high	76 Å²	76	66.2 Å²	66.2	33%	0.333	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-99	8.9	-178	-63.4	-78.1	0	0	0	114	A44 M45 K46 V50 L228 L361	A44-F48 WeakPolarHBondContact O-CD2 3.41Å; A44-F48 WeakPolarHBondContact O-CE2 3.44Å; M45-F48 PolarHBondContact O-N 3.39Å; K46-F48 PolarHBondContact O-N 2.81Å; F48-V50 HydrophobicContact CB-CG1 4Å; F48-V50 PolarHBondContact O-N 3.25Å; F48-L228 HydrophobicContact CB-CD1 3.8Å; F48-L228 HydrophobicContact CB-CD2 3.82Å; F48-L228 HydrophobicContact CB-CG 4.49Å; F48-L228 HydrophobicContact CD1-CD1 4.29Å; F48-L228 HydrophobicContact CD2-CD2 3.75Å; F48-L228 HydrophobicContact CG-CD1 4.03Å; F48-L228 HydrophobicContact CG-CD2 3.84Å; F48-L361 HydrophobicContact CD2-CD1 4.13Å; F48-L361 HydrophobicContact CE2-CB 4.28Å; F48-L361 HydrophobicContact CE2-CD1 3.75Å; F48-L361 HydrophobicContact CZ-CB 4.3Å
49	G	93	Very high	94.5	Very high	27 Å²	27	69 Å²	69	28%	0.278	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.2	22.5	178.1	0	0	0	0	0	114	K46 F51 K109	K46-G49 PolarHBondContact O-N 3.38Å; G49-F51 VanDerWaalsContact C-N 3.26Å; G49-F51 PolarHBondContact O-N 3.44Å; G49-K109 PolarHBondContact O-N 3.13Å
50	V	93.9	Very high	94.4	Very high	6 Å²	6	65.1 Å²	65.1	4%	0.036	33%	0.331	C	S	.	.			trans	-86.6	6.4	-178.3	-51.4	0	0	0	0	113.9	M45 F48 T108 R224 L228	M45-V50 HydrophobicContact CB-CG2 3.69Å; M45-V50 HydrophobicContact CG-CG2 4.29Å; M45-V50 HydrophobicContact SD-CG2 4.22Å; F48-V50 HydrophobicContact CB-CG1 4Å; F48-V50 PolarHBondContact O-N 3.25Å; V50-T108 HydrophobicContact CB-CG2 4.2Å; V50-T108 HydrophobicContact CG1-CG2 4.18Å; V50-R224 PolarHBondContact O-NH1 3.45Å; V50-L228 HydrophobicContact CG1-CB 4.22Å; V50-L228 HydrophobicContact CG1-CD1 3.88Å; V50-L228 HydrophobicContact CG1-CD2 4Å; V50-L228 HydrophobicContact CG1-CG 4.23Å
51	F	93.9	Very high	94.3	Very high	62 Å²	62	65.3 Å²	65.3	27%	0.272	34%	0.335	S	S	.	.	S	Bend	trans	-119.6	141.7	163	-59.7	-78.4	0	0	0	106.8	I42 M45 K46 G49 K109 L221	I42-F51 HydrophobicContact CG2-CE2 4.21Å; I42-F51 HydrophobicContact CG2-CZ 4.16Å; M45-F51 HydrophobicContact CB-CE2 4.05Å; M45-F51 HydrophobicContact CE-CE2 4.42Å; M45-F51 HydrophobicContact CE-CZ 4.04Å; K46-F51 HydrophobicContact CG-CD2 4.27Å; K46-F51 HydrophobicContact CG-CE2 4.4Å; G49-F51 VanDerWaalsContact C-N 3.26Å; G49-F51 PolarHBondContact O-N 3.44Å; F51-K109 VanDerWaalsContact O-CE 3.27Å; F51-K109 WeakPolarHBondContact O-CE 3.49Å; F51-K109 WeakPolarHBondContact O-CG 3.34Å; F51-L221 HydrophobicContact CE1-CD1 4.34Å; F51-L221 HydrophobicContact CZ-CD1 4.01Å
52	E	89.7	Confident	94.2	Very high	28 Å²	28	69.4 Å²	69.4	13%	0.131	36%	0.36	C	S	.	.			trans	-103.6	146.7	178.1	-177.2	169.8	-84.6	0	0	108.2	E56 R60 H107 K109	E52-E56 HydrophobicContact CG-CB 3.47Å; E52-E56 VanDerWaalsContact CG-CB 3.47Å; E52-E56 HydrophobicContact CG-CG 4.32Å; E52-R60 IonicContact OE1-CZ 3.35Å; E52-R60 IonicContact OE1-NE 3.52Å; E52-R60 PolarHBondContact OE1-NE 3.44Å; E52-R60 IonicContact OE1-NH2 2.67Å; E52-R60 PolarHBondContact OE1-NH2 3.37Å; E52-R60 VanDerWaalsContact OE2-CD 3.27Å; E52-R60 WeakPolarHBondContact OE2-CD 3.4Å; E52-R60 IonicContact OE2-CZ 3.69Å; E52-R60 IonicContact OE2-NE 3.41Å; E52-R60 PolarHBondContact OE2-NE 2.91Å; E52-H107 VanDerWaalsContact CD-NE2 3.28Å; E52-H107 IonicContact OE1-CD2 2.94Å; E52-H107 PolarHBondContact OE1-CD2 3.18Å; E52-H107 VanDerWaalsContact OE1-CD2 3.3Å; E52-H107 IonicContact OE1-NE2 3.92Å; E52-H107 IonicContact OE2-CD2 2.65Å; E52-H107 PolarHBondContact OE2-CD2 3.01Å; E52-H107 VanDerWaalsContact OE2-CD2 3.31Å; E52-H107 IonicContact OE2-CE1 2.98Å; E52-H107 IonicContact OE2-NE2 2.7Å; E52-H107 PolarHBondContact OE2-NE2 3.3Å; E52-K109 HydrophobicContact CB-CG 4.43Å
53	D	90.1	Very high	94.1	Very high	87 Å²	87	67.6 Å²	67.6	47%	0.465	35%	0.351	S	S	.	.			trans	-79.5	158.6	-176.2	-59.3	-9.8	0	0	0	110.9	E55 E56 L57 K109	D53-E55 PolarHBondContact O-N 3.2Å; D53-E56 PolarHBondContact N-OE2 3.33Å; D53-E56 VanDerWaalsContact N-OE2 3.11Å; D53-E56 PolarHBondContact O-N 3.13Å; D53-L57 PolarHBondContact O-N 3.37Å; D53-K109 WeakPolarHBondContact OD1-CE 3.45Å; D53-K109 IonicContact OD1-NZ 2.65Å; D53-K109 PolarHBondContact OD1-NZ 3.2Å; D53-K109 IonicContact OD2-NZ 3.25Å; D53-K109 PolarHBondContact OD2-NZ 3.03Å
54	E	90.9	Very high	94.1	Very high	159 Å²	159	65.5 Å²	65.5	74%	0.743	34%	0.34	S	S	*	.	H	α-helix	trans	-63.4	-30.5	-178.7	-61.8	-169	162	0	0	112.4	L57 N58	E54-L57 PolarHBondContact O-N 2.63Å; E54-N58 VanDerWaalsContact O-CB 3.3Å; E54-N58 WeakPolarHBondContact O-CB 3.41Å; E54-N58 PolarHBondContact O-N 2.96Å; E54-N58 PolarHBondContact O-ND2 3.38Å
55	E	92.6	Very high	94.1	Very high	167 Å²	167	65.9 Å²	65.9	78%	0.78	35%	0.346	S	S	*	.	H	α-helix	trans	-65.6	-47.9	173.9	-63.1	-178.6	-179.5	0	0	112.1	D53 L57 N58 H59	D53-E55 PolarHBondContact O-N 3.2Å; E55-L57 VanDerWaalsContact C-N 3.33Å; E55-L57 PolarHBondContact O-N 3.36Å; E55-N58 PolarHBondContact O-N 3.21Å; E55-H59 WeakPolarHBondContact O-CB 3.47Å; E55-H59 PolarHBondContact O-N 3.07Å
56	E	91.3	Very high	94.1	Very high	64 Å²	64	70 Å²	70	30%	0.299	36%	0.364	S	S	.	.	H	α-helix	trans	-61	-42.1	174.9	-70	176.7	112.3	0	0	111	E52 D53 H59 R60 K109	E52-E56 HydrophobicContact CG-CB 3.47Å; E52-E56 VanDerWaalsContact CG-CB 3.47Å; E52-E56 HydrophobicContact CG-CG 4.32Å; D53-E56 PolarHBondContact N-OE2 3.33Å; D53-E56 VanDerWaalsContact N-OE2 3.11Å; D53-E56 PolarHBondContact O-N 3.13Å; E56-H59 PolarHBondContact O-N 2.84Å; E56-R60 WeakPolarHBondContact O-CG 3.41Å; E56-R60 PolarHBondContact O-N 3.36Å; E56-K109 WeakPolarHBondContact OE2-CD 3.38Å; E56-K109 WeakPolarHBondContact OE2-CE 3.39Å; E56-K109 IonicContact OE2-NZ 2.71Å; E56-K109 PolarHBondContact OE2-NZ 3.44Å
57	L	91.4	Very high	94.2	Very high	68 Å²	68	64.5 Å²	64.5	36%	0.356	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-43	178	-178.4	61.6	0	0	0	112.1	D53 E54 E55 R60 L61 Y102	D53-L57 PolarHBondContact O-N 3.37Å; E54-L57 PolarHBondContact O-N 2.63Å; E55-L57 VanDerWaalsContact C-N 3.33Å; E55-L57 PolarHBondContact O-N 3.36Å; L57-R60 PolarHBondContact O-N 2.87Å; L57-L61 WeakPolarHBondContact O-CG 3.46Å; L57-L61 PolarHBondContact O-N 2.86Å; L57-L61 VanDerWaalsContact O-N 3.14Å; L57-Y102 HydrophobicContact CD1-CE2 4.12Å
58	N	94.7	Very high	94.3	Very high	93 Å²	93	60.9 Å²	60.9	50%	0.497	32%	0.315	S	S	.	.	H	α-helix	trans	-65.2	-40.3	175.9	-76.5	-36.3	0	0	0	111.6	E54 E55 R60 L61 V62	E54-N58 VanDerWaalsContact O-CB 3.3Å; E54-N58 WeakPolarHBondContact O-CB 3.41Å; E54-N58 PolarHBondContact O-N 2.96Å; E54-N58 PolarHBondContact O-ND2 3.38Å; E55-N58 PolarHBondContact O-N 3.21Å; N58-R60 PolarHBondContact O-N 2.94Å; N58-L61 WeakPolarHBondContact O-CB 3.39Å; N58-L61 PolarHBondContact O-N 3.18Å; N58-L61 VanDerWaalsContact O-N 3.14Å; N58-V62 PolarHBondContact O-N 3.49Å
59	H	95.3	Very high	94.4	Very high	75 Å²	75	62.1 Å²	62.1	35%	0.347	33%	0.325	S	S	.	.	H	α-helix	trans	-58.7	-46	174.1	-174.1	42.9	0	0	0	111.8	E55 E56 L61 V62 V63 D161 I163	E55-H59 WeakPolarHBondContact O-CB 3.47Å; E55-H59 PolarHBondContact O-N 3.07Å; E56-H59 PolarHBondContact O-N 2.84Å; H59-L61 VanDerWaalsContact C-N 3.29Å; H59-L61 PolarHBondContact O-N 3.25Å; H59-V62 PolarHBondContact O-N 3.25Å; H59-V62 VanDerWaalsContact O-N 3.14Å; H59-V63 WeakPolarHBondContact O-CG2 3.33Å; H59-V63 PolarHBondContact O-N 3.32Å; H59-D161 PolarHBondContact NE2-O 3.04Å; H59-I163 VanDerWaalsContact CD2-CD1 3.42Å; H59-I163 WeakPolarHBondContact CD2-CD1 3.41Å
60	R	95.6	Very high	94.7	Very high	9 Å²	9	61.3 Å²	61.3	3%	0.034	31%	0.314	C	S	.	.	H	α-helix	trans	-58.9	-37.2	173.9	-68.1	-179.6	-172.8	-85	9.4	113.2	E52 E56 L57 N58 L64 Y102 A111 I113 I163	E52-R60 IonicContact OE1-CZ 3.35Å; E52-R60 IonicContact OE1-NE 3.52Å; E52-R60 PolarHBondContact OE1-NE 3.44Å; E52-R60 IonicContact OE1-NH2 2.67Å; E52-R60 PolarHBondContact OE1-NH2 3.37Å; E52-R60 VanDerWaalsContact OE2-CD 3.27Å; E52-R60 WeakPolarHBondContact OE2-CD 3.4Å; E52-R60 IonicContact OE2-CZ 3.69Å; E52-R60 IonicContact OE2-NE 3.41Å; E52-R60 PolarHBondContact OE2-NE 2.91Å; E56-R60 WeakPolarHBondContact O-CG 3.41Å; E56-R60 PolarHBondContact O-N 3.36Å; L57-R60 PolarHBondContact O-N 2.87Å; N58-R60 PolarHBondContact O-N 2.94Å; R60-L64 WeakPolarHBondContact O-CB 3.26Å; R60-L64 WeakPolarHBondContact O-CG 3.21Å; R60-L64 PolarHBondContact O-N 3.37Å; R60-Y102 HydrophobicContact CB-CE2 4.03Å; R60-Y102 VanDerWaalsContact CD-CE2 3.48Å; R60-Y102 HydrophobicContact CG-CE2 4.42Å; R60-A111 VanDerWaalsContact CZ-O 3.3Å; R60-A111 PolarHBondContact NH1-O 3.38Å; R60-A111 PolarHBondContact NH2-O 2.8Å; R60-I113 HydrophobicContact CB-CD1 4.04Å; R60-I113 HydrophobicContact CG-CD1 4.01Å; R60-I163 HydrophobicContact CB-CD1 4.28Å; R60-I163 HydrophobicContact CG-CD1 3.64Å; R60-I163 HydrophobicContact CG-CG1 4.32Å
61	L	95.2	Very high	94.8	Very high	94 Å²	94	61 Å²	61	49%	0.492	31%	0.313	S	S	.	.	H	α-helix	trans	-67.3	-39.7	176.1	-69.4	171.6	0	0	0	111.9	L57 N58 H59 G65	L57-L61 WeakPolarHBondContact O-CG 3.46Å; L57-L61 PolarHBondContact O-N 2.86Å; L57-L61 VanDerWaalsContact O-N 3.14Å; N58-L61 WeakPolarHBondContact O-CB 3.39Å; N58-L61 PolarHBondContact O-N 3.18Å; N58-L61 VanDerWaalsContact O-N 3.14Å; H59-L61 VanDerWaalsContact C-N 3.29Å; H59-L61 PolarHBondContact O-N 3.25Å; L61-G65 PolarHBondContact O-N 3.1Å
62	V	96.7	Very high	95	Very high	88 Å²	88	61 Å²	61	53%	0.533	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-47.3	175	172.3	0	0	0	0	111.2	N58 H59 L64 G65 K66	N58-V62 PolarHBondContact O-N 3.49Å; H59-V62 PolarHBondContact O-N 3.25Å; H59-V62 VanDerWaalsContact O-N 3.14Å; V62-L64 PolarHBondContact O-N 3.39Å; V62-G65 WeakPolarHBondContact O-CA 3.43Å; V62-G65 PolarHBondContact O-N 3.01Å; V62-G65 VanDerWaalsContact O-N 3.11Å; V62-K66 PolarHBondContact O-N 3.49Å
63	V	96.8	Very high	95.3	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-62.8	-40.5	178.4	173.2	0	0	0	0	111.9	H59 G65 K66 L67 F160 D161 I163 I165	H59-V63 WeakPolarHBondContact O-CG2 3.33Å; H59-V63 PolarHBondContact O-N 3.32Å; V63-G65 VanDerWaalsContact C-N 3.33Å; V63-G65 PolarHBondContact O-N 2.95Å; V63-K66 PolarHBondContact O-N 2.96Å; V63-L67 WeakPolarHBondContact O-CB 3.48Å; V63-L67 PolarHBondContact O-N 3.47Å; V63-F160 HydrophobicContact CG1-CB 3.87Å; V63-F160 HydrophobicContact CG1-CD1 3.67Å; V63-F160 HydrophobicContact CG1-CE1 4.42Å; V63-F160 HydrophobicContact CG1-CG 3.81Å; V63-D161 HydrophobicContact CG2-CB 3.9Å; V63-I163 HydrophobicContact CB-CD1 4.27Å; V63-I163 HydrophobicContact CG2-CD1 3.95Å; V63-I165 HydrophobicContact CG1-CD1 3.83Å
64	L	96.9	Very high	95.6	Very high	24 Å²	24	59.7 Å²	59.7	13%	0.126	30%	0.303	C	S	.	.	H	α-helix	trans	-64	-36.3	172.4	-79.2	168.3	0	0	0	112.8	R60 V62 N68 T98 Y102 I113	R60-L64 WeakPolarHBondContact O-CB 3.26Å; R60-L64 WeakPolarHBondContact O-CG 3.21Å; R60-L64 PolarHBondContact O-N 3.37Å; V62-L64 PolarHBondContact O-N 3.39Å; L64-N68 VanDerWaalsContact O-CB 3.26Å; L64-N68 WeakPolarHBondContact O-CB 3.45Å; L64-N68 PolarHBondContact O-N 2.85Å; L64-T98 HydrophobicContact CD1-CG2 3.77Å; L64-T98 HydrophobicContact CD2-CG2 3.67Å; L64-T98 HydrophobicContact CG-CG2 4.41Å; L64-Y102 HydrophobicContact CD1-CD1 4.39Å; L64-Y102 HydrophobicContact CD1-CE1 3.48Å; L64-Y102 VanDerWaalsContact CD1-CE1 3.48Å; L64-I113 HydrophobicContact CD1-CD1 4.33Å; L64-I113 HydrophobicContact CD2-CG2 4.2Å; L64-I113 HydrophobicContact CG-CD1 4.37Å
65	G	97	Very high	96	Very high	33 Å²	33	52.1 Å²	52.1	34%	0.34	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-50.3	172.3	0	0	0	0	0	112.3	L61 V62 V63 L67 N68 N69	L61-G65 PolarHBondContact O-N 3.1Å; V62-G65 WeakPolarHBondContact O-CA 3.43Å; V62-G65 PolarHBondContact O-N 3.01Å; V62-G65 VanDerWaalsContact O-N 3.11Å; V63-G65 VanDerWaalsContact C-N 3.33Å; V63-G65 PolarHBondContact O-N 2.95Å; G65-L67 PolarHBondContact O-N 3.27Å; G65-N68 PolarHBondContact O-N 3.41Å; G65-N69 PolarHBondContact O-N 2.87Å; G65-N69 VanDerWaalsContact O-N 3.15Å
66	K	97.1	Very high	96.1	Very high	87 Å²	87	45.6 Å²	45.6	38%	0.378	24%	0.241	S	C	.	.	H	α-helix	trans	-53.7	-54.3	173.6	-69.2	-177.7	177	-175.1	0	111.1	V62 V63 N68 N69 L70 F160 D161	V62-K66 PolarHBondContact O-N 3.49Å; V63-K66 PolarHBondContact O-N 2.96Å; K66-N68 VanDerWaalsContact C-N 3.34Å; K66-N68 PolarHBondContact O-N 3.25Å; K66-N69 WeakPolarHBondContact O-CB 3.19Å; K66-N69 PolarHBondContact O-N 3.3Å; K66-N69 VanDerWaalsContact O-N 3.13Å; K66-L70 WeakPolarHBondContact O-CG 3.43Å; K66-L70 PolarHBondContact O-N 3.01Å; K66-F160 HydrophobicContact CB-CE1 3.87Å; K66-F160 HydrophobicContact CB-CZ 3.79Å; K66-F160 HydrophobicContact CD-CE1 4.45Å; K66-F160 HydrophobicContact CD-CE2 4.07Å; K66-F160 HydrophobicContact CD-CZ 3.74Å; K66-F160 HydrophobicContact CG-CZ 4.44Å; K66-D161 IonicContact NZ-OD1 3.7Å; K66-D161 IonicContact NZ-OD2 3.19Å; K66-D161 PolarHBondContact NZ-OD2 3.43Å
67	L	97.7	Very high	96.4	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-64.6	-36.7	-175.1	-168.5	67.6	0	0	0	112.7	V63 G65 N69 L70 V71 I96 F132 L136 F158 F160 I165	V63-L67 WeakPolarHBondContact O-CB 3.48Å; V63-L67 PolarHBondContact O-N 3.47Å; G65-L67 PolarHBondContact O-N 3.27Å; L67-N69 VanDerWaalsContact C-N 3.31Å; L67-N69 PolarHBondContact O-N 3.01Å; L67-L70 HydrophobicContact CD1-CD1 4.36Å; L67-L70 PolarHBondContact O-N 2.96Å; L67-V71 PolarHBondContact O-N 3.21Å; L67-I96 HydrophobicContact CB-CD1 3.94Å; L67-I96 HydrophobicContact CD2-CD1 3.72Å; L67-I96 HydrophobicContact CG-CD1 3.48Å; L67-I96 VanDerWaalsContact CG-CD1 3.48Å; L67-I96 WeakPolarHBondContact O-CD1 3.44Å; L67-F132 HydrophobicContact CD1-CZ 4.46Å; L67-L136 HydrophobicContact CD1-CD2 3.86Å; L67-F158 HydrophobicContact CD1-CE2 4.03Å; L67-F158 HydrophobicContact CD1-CZ 3.63Å; L67-F158 HydrophobicContact CD2-CZ 3.82Å; L67-F158 HydrophobicContact CG-CZ 4.39Å; L67-F160 HydrophobicContact CB-CD1 4.36Å; L67-F160 HydrophobicContact CB-CE1 4.14Å; L67-F160 HydrophobicContact CD1-CD1 4.29Å; L67-F160 HydrophobicContact CD1-CE1 4.24Å; L67-I165 HydrophobicContact CD2-CD1 4.01Å; L67-I165 HydrophobicContact CD2-CG2 4.09Å
68	N	97.1	Very high	96.6	Very high	32 Å²	32	42.7 Å²	42.7	17%	0.171	23%	0.228	C	C	.	.	H	α-helix	trans	-66.2	-34.2	175.9	-177.2	86.4	0	0	0	112.2	L64 G65 K66 V71 K72 I96	L64-N68 VanDerWaalsContact O-CB 3.26Å; L64-N68 WeakPolarHBondContact O-CB 3.45Å; L64-N68 PolarHBondContact O-N 2.85Å; G65-N68 PolarHBondContact O-N 3.41Å; K66-N68 VanDerWaalsContact C-N 3.34Å; K66-N68 PolarHBondContact O-N 3.25Å; N68-V71 PolarHBondContact O-N 3.04Å; N68-K72 PolarHBondContact O-N 3.42Å; N68-K72 VanDerWaalsContact O-N 3.1Å; N68-I96 HydrophobicContact CB-CB 4.43Å; N68-I96 HydrophobicContact CB-CD1 4.3Å; N68-I96 HydrophobicContact CB-CG1 4.33Å; N68-I96 PolarHBondContact OD1-N 3.22Å
69	N	96.6	Very high	96.7	Very high	101 Å²	101	38.3 Å²	38.3	54%	0.54	20%	0.204	S	C	.	.	H	α-helix	trans	-68.6	-44.1	173.5	-67.2	-9.5	0	0	0	111.3	G65 K66 L67 V71 K72 E73	G65-N69 PolarHBondContact O-N 2.87Å; G65-N69 VanDerWaalsContact O-N 3.15Å; K66-N69 WeakPolarHBondContact O-CB 3.19Å; K66-N69 PolarHBondContact O-N 3.3Å; K66-N69 VanDerWaalsContact O-N 3.13Å; L67-N69 VanDerWaalsContact C-N 3.31Å; L67-N69 PolarHBondContact O-N 3.01Å; N69-V71 PolarHBondContact O-N 2.88Å; N69-K72 PolarHBondContact O-N 3.17Å; N69-K72 VanDerWaalsContact O-N 3.07Å; N69-E73 WeakPolarHBondContact O-CB 3.45Å; N69-E73 PolarHBondContact O-N 3.02Å
70	L	97.4	Very high	96.7	Very high	11 Å²	11	39.9 Å²	39.9	6%	0.058	21%	0.212	C	C	.	.	H	α-helix	trans	-57.3	-37.1	174	-66.1	175.2	0	0	0	112.6	K66 L67 W74 F132 L136 Q139 F160	K66-L70 WeakPolarHBondContact O-CG 3.43Å; K66-L70 PolarHBondContact O-N 3.01Å; L67-L70 HydrophobicContact CD1-CD1 4.36Å; L67-L70 PolarHBondContact O-N 2.96Å; L70-W74 VanDerWaalsContact O-CB 3.24Å; L70-W74 WeakPolarHBondContact O-CB 3.49Å; L70-W74 PolarHBondContact O-N 3Å; L70-F132 HydrophobicContact CB-CE2 4.32Å; L70-L136 HydrophobicContact CD1-CD2 4.48Å; L70-Q139 HydrophobicContact CD1-CG 3.97Å; L70-Q139 VanDerWaalsContact CD2-CD 3.44Å; L70-Q139 HydrophobicContact CD2-CG 3.87Å; L70-F160 HydrophobicContact CD1-CE1 4.13Å; L70-F160 HydrophobicContact CD1-CZ 4.2Å
71	V	97.6	Very high	96.6	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-41.3	174.2	163.3	0	0	0	0	112.2	L67 N68 N69 I75 I96 C117 F132	L67-V71 PolarHBondContact O-N 3.21Å; N68-V71 PolarHBondContact O-N 3.04Å; N69-V71 PolarHBondContact O-N 2.88Å; V71-I75 HydrophobicContact CG1-CD1 3.75Å; V71-I75 WeakPolarHBondContact O-CB 3.47Å; V71-I75 WeakPolarHBondContact O-CD1 3.37Å; V71-I75 VanDerWaalsContact O-CG1 3.23Å; V71-I75 WeakPolarHBondContact O-CG1 3.36Å; V71-I75 PolarHBondContact O-N 2.93Å; V71-I96 HydrophobicContact CB-CD1 4.33Å; V71-I96 HydrophobicContact CB-CG1 4.2Å; V71-I96 HydrophobicContact CG1-CG1 4.42Å; V71-I96 HydrophobicContact CG2-CD1 3.74Å; V71-I96 HydrophobicContact CG2-CG1 3.9Å; V71-C117 HydrophobicContact CG2-CB 4.5Å; V71-F132 HydrophobicContact CG2-CE1 4.19Å; V71-F132 HydrophobicContact CG2-CE2 3.99Å; V71-F132 HydrophobicContact CG2-CZ 3.53Å
72	K	96.5	Very high	96.6	Very high	60 Å²	60	42.7 Å²	42.7	26%	0.261	23%	0.231	S	C	.	.	H	α-helix	trans	-65.9	-43.6	176.1	-77.1	-173.3	173.4	-174.2	0	112	N68 N69 I75 S76 G94 D179	N68-K72 PolarHBondContact O-N 3.42Å; N68-K72 VanDerWaalsContact O-N 3.1Å; N69-K72 PolarHBondContact O-N 3.17Å; N69-K72 VanDerWaalsContact O-N 3.07Å; K72-I75 PolarHBondContact O-N 2.9Å; K72-S76 PolarHBondContact O-N 3.05Å; K72-S76 VanDerWaalsContact O-N 3.09Å; K72-G94 WeakPolarHBondContact CE-O 3.35Å; K72-G94 VanDerWaalsContact CG-O 3.28Å; K72-G94 WeakPolarHBondContact CG-O 3.37Å; K72-D179 WeakPolarHBondContact CE-OD1 3.24Å; K72-D179 IonicContact NZ-OD1 2.66Å; K72-D179 PolarHBondContact NZ-OD1 2.84Å; K72-D179 IonicContact NZ-OD2 3.37Å; K72-D179 PolarHBondContact NZ-OD2 3.4Å
73	E	96.3	Very high	96.5	Very high	85 Å²	85	45.6 Å²	45.6	40%	0.397	24%	0.243	S	C	.	.	H	α-helix	trans	-58.1	-54.8	174.7	-175.5	-168.2	123.3	0	0	111.1	N69 I75 S76 D77 K135	N69-E73 WeakPolarHBondContact O-CB 3.45Å; N69-E73 PolarHBondContact O-N 3.02Å; E73-I75 VanDerWaalsContact C-N 3.31Å; E73-I75 PolarHBondContact O-N 3.03Å; E73-S76 WeakPolarHBondContact O-CA 3.4Å; E73-S76 WeakPolarHBondContact O-CB 3.42Å; E73-S76 PolarHBondContact O-N 2.79Å; E73-D77 PolarHBondContact O-N 2.92Å; E73-K135 WeakPolarHBondContact OE1-CE 3.19Å; E73-K135 IonicContact OE1-NZ 2.81Å; E73-K135 PolarHBondContact OE1-NZ 3.33Å
74	W	97.8	Very high	96.3	Very high	3 Å²	3	48 Å²	48	1%	0.011	26%	0.256	C	S	.	.	H	α-helix	trans	-57.4	-39.4	177.6	167.8	61.5	0	0	0	113.7	L70 S76 D77 V78 V123 D127 F128 S131 F132 K135 F169	L70-W74 VanDerWaalsContact O-CB 3.24Å; L70-W74 WeakPolarHBondContact O-CB 3.49Å; L70-W74 PolarHBondContact O-N 3Å; W74-S76 VanDerWaalsContact C-N 3.27Å; W74-S76 PolarHBondContact O-N 3.21Å; W74-D77 PolarHBondContact O-N 3.06Å; W74-V78 HydrophobicContact CZ2-CG2 4.33Å; W74-V78 VanDerWaalsContact NE1-CG2 3.27Å; W74-V78 WeakPolarHBondContact O-CG2 3.46Å; W74-V78 PolarHBondContact O-N 2.73Å; W74-V123 HydrophobicContact CH2-CG1 3.27Å; W74-V123 HydrophobicContact CZ2-CG1 3.56Å; W74-V123 HydrophobicContact CZ3-CG1 3.99Å; W74-D127 HydrophobicContact CZ2-CB 3.81Å; W74-F128 HydrophobicContact CH2-CB 3.92Å; W74-F128 HydrophobicContact CH2-CD2 4.13Å; W74-F128 HydrophobicContact CZ2-CB 4.26Å; W74-F128 HydrophobicContact CZ3-CD2 4.33Å; W74-S131 PolarHBondContact NE1-OG 3.47Å; W74-F132 HydrophobicContact CB-CD2 3.6Å; W74-F132 HydrophobicContact CB-CE2 3.98Å; W74-F132 HydrophobicContact CD2-CB 3.72Å; W74-F132 AromaticContact CD2-CD2 3.5Å; W74-F132 HydrophobicContact CD2-CD2 3.5Å; W74-F132 VanDerWaalsContact CD2-CD2 3.5Å; W74-F132 HydrophobicContact CD2-CE2 4.38Å; W74-F132 AromaticContact CD2-CG 3.84Å; W74-F132 HydrophobicContact CD2-CG 3.84Å; W74-F132 HydrophobicContact CE3-CB 4.19Å; W74-F132 AromaticContact CE3-CD2 3.73Å; W74-F132 HydrophobicContact CE3-CD2 3.73Å; W74-F132 HydrophobicContact CE3-CE2 4.3Å; W74-F132 AromaticContact CE3-CG 3.98Å; W74-F132 HydrophobicContact CE3-CG 3.98Å; W74-F132 HydrophobicContact CG-CB 4.09Å; W74-F132 AromaticContact CG-CD2 3.41Å; W74-F132 HydrophobicContact CG-CD2 3.41Å; W74-F132 VanDerWaalsContact CG-CD2 3.41Å; W74-F132 HydrophobicContact CG-CE2 4.24Å; W74-F132 HydrophobicContact CG-CG 4.14Å; W74-F132 HydrophobicContact CH2-CB 4.38Å; W74-F132 HydrophobicContact CZ2-CB 3.95Å; W74-F132 HydrophobicContact CZ3-CB 4.49Å; W74-F132 HydrophobicContact CZ3-CG 4.46Å; W74-K135 HydrophobicContact CB-CD 4.18Å; W74-F169 HydrophobicContact CH2-CD2 4.37Å; W74-F169 AromaticContact CH2-CE2 3.79Å; W74-F169 HydrophobicContact CH2-CE2 3.79Å; W74-F169 HydrophobicContact CZ3-CE2 4.17Å
75	I	97.7	Very high	96.1	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-68.8	-28.1	176.6	-68.7	168	0	0	0	111	V71 K72 E73 S79 V92 G93 A119 P120 V123	V71-I75 HydrophobicContact CG1-CD1 3.75Å; V71-I75 WeakPolarHBondContact O-CB 3.47Å; V71-I75 WeakPolarHBondContact O-CD1 3.37Å; V71-I75 VanDerWaalsContact O-CG1 3.23Å; V71-I75 WeakPolarHBondContact O-CG1 3.36Å; V71-I75 PolarHBondContact O-N 2.93Å; K72-I75 PolarHBondContact O-N 2.9Å; E73-I75 VanDerWaalsContact C-N 3.31Å; E73-I75 PolarHBondContact O-N 3.03Å; I75-S79 WeakPolarHBondContact O-CB 3.46Å; I75-S79 PolarHBondContact O-N 3.4Å; I75-S79 VanDerWaalsContact O-N 3.11Å; I75-S79 PolarHBondContact O-OG 3Å; I75-V92 HydrophobicContact CG2-CB 4.47Å; I75-V92 HydrophobicContact CG2-CG1 3.85Å; I75-V92 HydrophobicContact CG2-CG2 3.72Å; I75-G93 WeakPolarHBondContact CG2-O 3.29Å; I75-A119 HydrophobicContact CD1-CB 3.81Å; I75-A119 HydrophobicContact CG1-CB 4.41Å; I75-P120 HydrophobicContact CG2-CG 4Å; I75-V123 HydrophobicContact CG1-CG2 4.32Å; I75-V123 HydrophobicContact CG2-CG2 4.11Å
76	S	96.4	Very high	95.9	Very high	30 Å²	30	53.8 Å²	53.8	21%	0.21	29%	0.289	C	S	.	.	H	α-helix	trans	-64	-53.7	167.5	-155	0	0	0	0	110.9	K72 E73 W74 V78 S79 E80 V89	K72-S76 PolarHBondContact O-N 3.05Å; K72-S76 VanDerWaalsContact O-N 3.09Å; E73-S76 WeakPolarHBondContact O-CA 3.4Å; E73-S76 WeakPolarHBondContact O-CB 3.42Å; E73-S76 PolarHBondContact O-N 2.79Å; W74-S76 VanDerWaalsContact C-N 3.27Å; W74-S76 PolarHBondContact O-N 3.21Å; S76-V78 VanDerWaalsContact C-N 3.29Å; S76-V78 PolarHBondContact O-N 2.93Å; S76-S79 CarbonylContact O-C 3.59Å; S76-S79 WeakPolarHBondContact O-CA 3.22Å; S76-S79 VanDerWaalsContact O-CB 3.28Å; S76-S79 WeakPolarHBondContact O-CB 3.42Å; S76-S79 PolarHBondContact O-N 2.99Å; S76-E80 PolarHBondContact O-N 3.5Å; S76-E80 PolarHBondContact OG-OE1 3.17Å; S76-V89 WeakPolarHBondContact OG-CG1 3.45Å
77	D	95.7	Very high	95.5	Very high	66 Å²	66	53.8 Å²	53.8	35%	0.353	30%	0.3	S	S	.	.	H	α-helix	trans	-55	-42.9	-179.9	-53.6	-22	0	0	0	112.4	E73 W74 S79 E80 S81 K135	E73-D77 PolarHBondContact O-N 2.92Å; W74-D77 PolarHBondContact O-N 3.06Å; D77-S79 VanDerWaalsContact C-N 3.3Å; D77-S79 PolarHBondContact O-N 3.46Å; D77-E80 PolarHBondContact O-N 2.94Å; D77-S81 WeakPolarHBondContact O-CB 3.27Å; D77-S81 PolarHBondContact O-N 3.21Å; D77-S81 PolarHBondContact O-OG 3.25Å; D77-K135 WeakPolarHBondContact OD2-CE 3.37Å; D77-K135 IonicContact OD2-NZ 3.23Å; D77-K135 PolarHBondContact OD2-NZ 3.02Å
78	V	96.9	Very high	95.1	Very high	6 Å²	6	56 Å²	56	4%	0.036	31%	0.313	C	S	.	.	H	α-helix	trans	-72.1	-23.7	177.5	177.2	0	0	0	0	112.1	W74 S76 S81 K82 V123 D127	W74-V78 HydrophobicContact CZ2-CG2 4.33Å; W74-V78 VanDerWaalsContact NE1-CG2 3.27Å; W74-V78 WeakPolarHBondContact O-CG2 3.46Å; W74-V78 PolarHBondContact O-N 2.73Å; S76-V78 VanDerWaalsContact C-N 3.29Å; S76-V78 PolarHBondContact O-N 2.93Å; V78-S81 WeakPolarHBondContact CA-OG 3.28Å; V78-S81 PolarHBondContact O-OG 3.16Å; V78-K82 HydrophobicContact CG1-CD 4.16Å; V78-K82 WeakPolarHBondContact O-CB 3.46Å; V78-K82 VanDerWaalsContact O-CG 3.25Å; V78-K82 WeakPolarHBondContact O-CG 3.44Å; V78-K82 PolarHBondContact O-N 3.39Å; V78-V123 HydrophobicContact CB-CG2 4.32Å; V78-V123 HydrophobicContact CG1-CB 4.35Å; V78-V123 HydrophobicContact CG1-CG1 4.31Å; V78-V123 HydrophobicContact CG1-CG2 3.85Å; V78-D127 HydrophobicContact CG1-CB 4.44Å; V78-D127 WeakPolarHBondContact CG1-OD2 3.34Å; V78-D127 HydrophobicContact CG2-CB 4.41Å
79	S	96.1	Very high	94.7	Very high	0 Å²	0	55 Å²	55	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-77.4	-41.9	173.3	-59.4	0	0	0	0	111.8	I75 S76 D77 K82 N83 L84 H122	I75-S79 WeakPolarHBondContact O-CB 3.46Å; I75-S79 PolarHBondContact O-N 3.4Å; I75-S79 VanDerWaalsContact O-N 3.11Å; I75-S79 PolarHBondContact O-OG 3Å; S76-S79 CarbonylContact O-C 3.59Å; S76-S79 WeakPolarHBondContact O-CA 3.22Å; S76-S79 VanDerWaalsContact O-CB 3.28Å; S76-S79 WeakPolarHBondContact O-CB 3.42Å; S76-S79 PolarHBondContact O-N 2.99Å; D77-S79 VanDerWaalsContact C-N 3.3Å; D77-S79 PolarHBondContact O-N 3.46Å; S79-K82 CarbonylContact O-C 3.58Å; S79-K82 PolarHBondContact O-N 3.07Å; S79-N83 PolarHBondContact O-N 3.08Å; S79-L84 WeakPolarHBondContact O-CB 3.49Å; S79-L84 PolarHBondContact O-N 3.19Å; S79-L84 VanDerWaalsContact O-N 3.07Å; S79-H122 PolarHBondContact OG-NE2 3.37Å
80	E	95.1	Very high	94.3	Very high	108 Å²	108	54.4 Å²	54.4	51%	0.505	32%	0.317	S	S	.	.	H	α-helix	trans	-69.1	-47.6	179	-69.6	172.3	-139.9	0	0	111.6	S76 D77 K82 N83 V89	S76-E80 PolarHBondContact O-N 3.5Å; S76-E80 PolarHBondContact OG-OE1 3.17Å; D77-E80 PolarHBondContact O-N 2.94Å; E80-K82 PolarHBondContact O-N 3.32Å; E80-N83 WeakPolarHBondContact O-CA 3.22Å; E80-N83 PolarHBondContact O-N 2.95Å; E80-V89 HydrophobicContact CG-CB 4.45Å; E80-V89 HydrophobicContact CG-CG1 3.69Å; E80-V89 HydrophobicContact CG-CG2 3.93Å; E80-V89 WeakPolarHBondContact OE1-CG1 3.31Å
81	S	95.1	Very high	94	Very high	82 Å²	82	58.2 Å²	58.2	57%	0.573	34%	0.341	S	S	*	.	H	α-helix	trans	-62.7	-23.4	175.4	55.1	0	0	0	0	113.7	D77 V78 N83	D77-S81 WeakPolarHBondContact O-CB 3.27Å; D77-S81 PolarHBondContact O-N 3.21Å; D77-S81 PolarHBondContact O-OG 3.25Å; V78-S81 WeakPolarHBondContact CA-OG 3.28Å; V78-S81 PolarHBondContact O-OG 3.16Å; S81-N83 VanDerWaalsContact C-N 3.3Å; S81-N83 PolarHBondContact O-ND2 3.45Å
82	K	94.8	Very high	93.8	Very high	81 Å²	81	58.4 Å²	58.4	35%	0.352	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92	14.5	171.5	-64	-177.5	-171.5	-173.8	0	113.3	V78 S79 E80 L84 H122 D127	V78-K82 HydrophobicContact CG1-CD 4.16Å; V78-K82 WeakPolarHBondContact O-CB 3.46Å; V78-K82 VanDerWaalsContact O-CG 3.25Å; V78-K82 WeakPolarHBondContact O-CG 3.44Å; V78-K82 PolarHBondContact O-N 3.39Å; S79-K82 CarbonylContact O-C 3.58Å; S79-K82 PolarHBondContact O-N 3.07Å; E80-K82 PolarHBondContact O-N 3.32Å; K82-L84 VanDerWaalsContact C-N 3.29Å; K82-L84 PolarHBondContact O-N 3.47Å; K82-H122 PolarHBondContact NZ-O 2.93Å; K82-D127 IonicContact NZ-OD1 3.73Å; K82-D127 PolarHBondContact NZ-OD1 2.91Å; K82-D127 IonicContact NZ-OD2 2.7Å; K82-D127 PolarHBondContact NZ-OD2 3.45Å
83	N	93.9	Very high	93.6	Very high	148 Å²	148	56.6 Å²	56.6	79%	0.791	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	36.1	173.1	-62	-95.7	0	0	0	113.8	S79 E80 S81	S79-N83 PolarHBondContact O-N 3.08Å; E80-N83 WeakPolarHBondContact O-CA 3.22Å; E80-N83 PolarHBondContact O-N 2.95Å; S81-N83 VanDerWaalsContact C-N 3.3Å; S81-N83 PolarHBondContact O-ND2 3.45Å
84	L	93.2	Very high	93.6	Very high	51 Å²	51	52.6 Å²	52.6	27%	0.267	32%	0.322	S	S	.	.			trans	-72	148.4	172.5	-64.2	-174.9	0	0	0	111	S79 K82 V88 V89 H122	S79-L84 WeakPolarHBondContact O-CB 3.49Å; S79-L84 PolarHBondContact O-N 3.19Å; S79-L84 VanDerWaalsContact O-N 3.07Å; K82-L84 VanDerWaalsContact C-N 3.29Å; K82-L84 PolarHBondContact O-N 3.47Å; L84-V88 HydrophobicContact CD1-CG1 4.32Å; L84-V89 HydrophobicContact CB-CG2 4.24Å; L84-H122 WeakPolarHBondContact CD1-NE2 3.47Å
85	P	93.1	Very high	93.5	Very high	69 Å²	69	54.7 Å²	54.7	45%	0.448	33%	0.331	S	S	.	.			trans	-58.6	140.8	178.6	-23.9	33.7	0	0	0	111.8	S87 V88 V89	P85-S87 PolarHBondContact O-N 3.12Å; P85-V88 HydrophobicContact CB-CG2 4.24Å; P85-V88 HydrophobicContact CG-CG2 4.25Å; P85-V88 WeakPolarHBondContact O-CA 3.5Å; P85-V88 WeakPolarHBondContact O-CB 3.15Å; P85-V88 PolarHBondContact O-N 2.88Å; P85-V89 PolarHBondContact O-N 3.4Å
86	P	90.9	Very high	93.4	Very high	110 Å²	110	55.4 Å²	55.4	71%	0.714	34%	0.335	S	S	*	.	H	α-helix	trans	-55.2	-28.7	-178.8	-30.1	36.4	0	0	0	114.9	V88 V89 A90	P86-V88 VanDerWaalsContact C-N 3.34Å; P86-V89 PolarHBondContact O-N 3.02Å; P86-A90 WeakPolarHBondContact O-CB 3.45Å; P86-A90 PolarHBondContact O-N 2.8Å
87	S	89.8	Confident	93.4	Very high	87 Å²	87	55.1 Å²	55.1	61%	0.608	33%	0.33	S	S	*	.	H	α-helix	trans	-67.2	-30.8	172.9	51.1	0	0	0	0	113.8	P85 T91	P85-S87 PolarHBondContact O-N 3.12Å; S87-T91 PolarHBondContact O-OG1 3.46Å
88	V	88.2	Confident	93.5	Very high	45 Å²	45	53.1 Å²	53.1	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-79	-42	172.7	-178.8	0	0	0	0	110	L84 P85 P86 A90 T91 V92	L84-V88 HydrophobicContact CD1-CG1 4.32Å; P85-V88 HydrophobicContact CB-CG2 4.24Å; P85-V88 HydrophobicContact CG-CG2 4.25Å; P85-V88 WeakPolarHBondContact O-CA 3.5Å; P85-V88 WeakPolarHBondContact O-CB 3.15Å; P85-V88 PolarHBondContact O-N 2.88Å; P86-V88 VanDerWaalsContact C-N 3.34Å; V88-A90 PolarHBondContact O-N 3.35Å; V88-T91 CarbonylContact O-C 3.52Å; V88-T91 PolarHBondContact O-N 2.85Å; V88-T91 VanDerWaalsContact O-N 3.09Å; V88-T91 PolarHBondContact O-OG1 3.19Å; V88-V92 WeakPolarHBondContact O-CA 3.44Å; V88-V92 WeakPolarHBondContact O-CB 3.4Å; V88-V92 PolarHBondContact O-N 3.47Å
89	V	90.2	Very high	93.5	Very high	13 Å²	13	54.1 Å²	54.1	8%	0.079	32%	0.324	C	S	.	.	H	α-helix	trans	-55.8	-51.7	174.5	179.2	0	0	0	0	110.5	S76 E80 L84 P85 P86 T91 V92	S76-V89 WeakPolarHBondContact OG-CG1 3.45Å; E80-V89 HydrophobicContact CG-CB 4.45Å; E80-V89 HydrophobicContact CG-CG1 3.69Å; E80-V89 HydrophobicContact CG-CG2 3.93Å; E80-V89 WeakPolarHBondContact OE1-CG1 3.31Å; L84-V89 HydrophobicContact CB-CG2 4.24Å; P85-V89 PolarHBondContact O-N 3.4Å; P86-V89 PolarHBondContact O-N 3.02Å; V89-T91 PolarHBondContact O-N 3.44Å; V89-V92 WeakPolarHBondContact O-CG1 3.43Å; V89-V92 PolarHBondContact O-N 3.08Å
90	A	88.2	Confident	93.4	Very high	88 Å²	88	55 Å²	55	73%	0.727	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-12.9	178.6	0	0	0	0	0	114.9	P86 V88	P86-A90 WeakPolarHBondContact O-CB 3.45Å; P86-A90 PolarHBondContact O-N 2.8Å; V88-A90 PolarHBondContact O-N 3.35Å
91	T	90.9	Very high	93.4	Very high	91 Å²	91	50.8 Å²	50.8	56%	0.558	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.5	6.6	-179.4	57.6	0	0	0	0	113.8	S87 V88 V89 G93 T176	S87-T91 PolarHBondContact O-OG1 3.46Å; V88-T91 CarbonylContact O-C 3.52Å; V88-T91 PolarHBondContact O-N 2.85Å; V88-T91 VanDerWaalsContact O-N 3.09Å; V88-T91 PolarHBondContact O-OG1 3.19Å; V89-T91 PolarHBondContact O-N 3.44Å; T91-G93 VanDerWaalsContact C-N 3.32Å; T91-G93 PolarHBondContact O-N 3.2Å; T91-T176 WeakPolarHBondContact O-CB 3.25Å; T91-T176 WeakPolarHBondContact O-CG2 3.49Å
92	V	92.9	Very high	93.5	Very high	4 Å²	4	48 Å²	48	2%	0.024	29%	0.293	C	S	.	.			trans	-64.5	-37.5	-174.6	72	0	0	0	0	112.4	I75 V88 V89 P120 T176 I177	I75-V92 HydrophobicContact CG2-CB 4.47Å; I75-V92 HydrophobicContact CG2-CG1 3.85Å; I75-V92 HydrophobicContact CG2-CG2 3.72Å; V88-V92 WeakPolarHBondContact O-CA 3.44Å; V88-V92 WeakPolarHBondContact O-CB 3.4Å; V88-V92 PolarHBondContact O-N 3.47Å; V89-V92 WeakPolarHBondContact O-CG1 3.43Å; V89-V92 PolarHBondContact O-N 3.08Å; V92-P120 HydrophobicContact CG2-CB 4.46Å; V92-P120 HydrophobicContact CG2-CG 3.7Å; V92-T176 CarbonylContact O-C 3.42Å; V92-T176 WeakPolarHBondContact O-CA 3.42Å; V92-I177 PolarHBondContact O-N 3.09Å
93	G	93.5	Very high	93.6	Very high	22 Å²	22	49.1 Å²	49.1	23%	0.227	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	64.3	-145.5	-176.6	0	0	0	0	0	112.6	I75 T91	I75-G93 WeakPolarHBondContact CG2-O 3.29Å; T91-G93 VanDerWaalsContact C-N 3.32Å; T91-G93 PolarHBondContact O-N 3.2Å
94	G	94.5	Very high	93.7	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	26%	0.259	C	S	.	.			trans	133.3	142.8	-170.6	0	0	0	0	0	108.8	K72	K72-G94 WeakPolarHBondContact CE-O 3.35Å; K72-G94 VanDerWaalsContact CG-O 3.28Å; K72-G94 WeakPolarHBondContact CG-O 3.37Å
95	K	95.4	Very high	93.8	Very high	47 Å²	47	40.8 Å²	40.8	20%	0.204	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.7	143.2	-173.1	-177.1	168.8	174.7	-172.2	0	112.9	F97 V118 I177 D179	K95-F97 HydrophobicContact CB-CD2 4.45Å; K95-F97 HydrophobicContact CB-CE2 3.9Å; K95-F97 HydrophobicContact CD-CD2 4.39Å; K95-F97 HydrophobicContact CD-CE1 4.35Å; K95-F97 HydrophobicContact CD-CE2 3.7Å; K95-F97 HydrophobicContact CD-CZ 3.68Å; K95-F97 HydrophobicContact CG-CD2 4.02Å; K95-F97 HydrophobicContact CG-CE2 3.66Å; K95-F97 HydrophobicContact CG-CZ 4.18Å; K95-V118 PolarHBondContact N-O 2.68Å; K95-V118 PolarHBondContact O-N 2.86Å; K95-I177 HydrophobicContact CB-CG2 4.1Å; K95-D179 PolarHBondContact NZ-O 2.71Å
96	I	96.8	Very high	93.9	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.082	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	136.6	167	-58.9	-175.7	0	0	0	110.4	L67 N68 V71 A115 L116	L67-I96 HydrophobicContact CB-CD1 3.94Å; L67-I96 HydrophobicContact CD2-CD1 3.72Å; L67-I96 HydrophobicContact CG-CD1 3.48Å; L67-I96 VanDerWaalsContact CG-CD1 3.48Å; L67-I96 WeakPolarHBondContact O-CD1 3.44Å; N68-I96 HydrophobicContact CB-CB 4.43Å; N68-I96 HydrophobicContact CB-CD1 4.3Å; N68-I96 HydrophobicContact CB-CG1 4.33Å; N68-I96 PolarHBondContact OD1-N 3.22Å; V71-I96 HydrophobicContact CB-CD1 4.33Å; V71-I96 HydrophobicContact CB-CG1 4.2Å; V71-I96 HydrophobicContact CG1-CG1 4.42Å; V71-I96 HydrophobicContact CG2-CD1 3.74Å; V71-I96 HydrophobicContact CG2-CG1 3.9Å; I96-A115 HydrophobicContact CG2-CB 4.11Å; I96-L116 VanDerWaalsContact CA-O 3.32Å; I96-L116 WeakPolarHBondContact CA-O 3.35Å
97	F	97.1	Very high	94.1	Very high	24 Å²	24	32.8 Å²	32.8	11%	0.105	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.7	170.5	-67	-105.7	0	0	0	108.6	K95 L116 V118 L181 L183	K95-F97 HydrophobicContact CB-CD2 4.45Å; K95-F97 HydrophobicContact CB-CE2 3.9Å; K95-F97 HydrophobicContact CD-CD2 4.39Å; K95-F97 HydrophobicContact CD-CE1 4.35Å; K95-F97 HydrophobicContact CD-CE2 3.7Å; K95-F97 HydrophobicContact CD-CZ 3.68Å; K95-F97 HydrophobicContact CG-CD2 4.02Å; K95-F97 HydrophobicContact CG-CE2 3.66Å; K95-F97 HydrophobicContact CG-CZ 4.18Å; F97-L116 HydrophobicContact CB-CB 4.44Å; F97-L116 PolarHBondContact N-O 3.01Å; F97-L116 PolarHBondContact O-N 2.95Å; F97-V118 HydrophobicContact CD2-CB 4.16Å; F97-V118 HydrophobicContact CD2-CG2 3.52Å; F97-V118 HydrophobicContact CE2-CB 4Å; F97-V118 HydrophobicContact CE2-CG2 3.72Å; F97-L181 WeakPolarHBondContact CE1-O 3.37Å; F97-L181 HydrophobicContact CE2-CD2 4.49Å; F97-L181 HydrophobicContact CZ-CB 4.23Å; F97-L181 HydrophobicContact CZ-CD2 4.29Å; F97-L181 HydrophobicContact CZ-CG 4.28Å; F97-L181 WeakPolarHBondContact CZ-O 3.49Å; F97-L183 HydrophobicContact CB-CD1 4.23Å; F97-L183 HydrophobicContact CD1-CD1 3.7Å; F97-L183 HydrophobicContact CD1-CG 4.2Å; F97-L183 HydrophobicContact CD2-CD1 3.91Å; F97-L183 HydrophobicContact CE1-CD1 3.9Å; F97-L183 HydrophobicContact CE1-CG 3.89Å; F97-L183 HydrophobicContact CE2-CD1 4.11Å; F97-L183 HydrophobicContact CE2-CD2 4.37Å; F97-L183 HydrophobicContact CE2-CG 4.37Å; F97-L183 HydrophobicContact CG-CD1 3.7Å; F97-L183 HydrophobicContact CZ-CD1 4.09Å; F97-L183 HydrophobicContact CZ-CD2 4.2Å; F97-L183 HydrophobicContact CZ-CG 3.98Å
98	T	97.1	Very high	94.2	Very high	24 Å²	24	30.3 Å²	30.3	15%	0.147	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	152.2	170.4	52.9	0	0	0	0	110.8	L64 Y102 R103 I113 D114	L64-T98 HydrophobicContact CD1-CG2 3.77Å; L64-T98 HydrophobicContact CD2-CG2 3.67Å; L64-T98 HydrophobicContact CG-CG2 4.41Å; T98-Y102 HydrophobicContact CG2-CD1 3.91Å; T98-Y102 HydrophobicContact CG2-CE1 4.06Å; T98-R103 WeakPolarHBondContact O-CG 3.44Å; T98-I113 HydrophobicContact CG2-CG2 3.87Å; T98-D114 WeakPolarHBondContact CA-O 2.94Å
99	F	96.4	Very high	94.2	Very high	26 Å²	26	31.7 Å²	31.7	11%	0.114	19%	0.185	C	C	.	.			trans	-137.5	-163.3	173.3	62.9	-85.3	0	0	0	111.6	S101 R103 D114 L116 V168 C203	F99-S101 PolarHBondContact O-N 3.3Å; F99-R103 VanDerWaalsContact C-CB 3.47Å; F99-R103 VanDerWaalsContact CA-CB 3.45Å; F99-R103 VanDerWaalsContact O-CB 3.28Å; F99-R103 WeakPolarHBondContact O-CB 3.35Å; F99-R103 PolarHBondContact O-N 3.35Å; F99-D114 HydrophobicContact CD1-CB 4.01Å; F99-D114 HydrophobicContact CD2-CB 3.65Å; F99-D114 HydrophobicContact CE1-CB 4.03Å; F99-D114 HydrophobicContact CE2-CB 3.67Å; F99-D114 WeakPolarHBondContact CE2-OD1 3.17Å; F99-D114 HydrophobicContact CG-CB 3.81Å; F99-D114 HydrophobicContact CZ-CB 3.86Å; F99-D114 PolarHBondContact N-O 3.47Å; F99-L116 HydrophobicContact CD1-CB 4.25Å; F99-L116 HydrophobicContact CE1-CB 4.21Å; F99-V168 HydrophobicContact CE1-CG2 3.68Å; F99-V168 HydrophobicContact CZ-CG2 3.85Å; F99-C203 HydrophobicContact CB-CB 4.39Å
100	G	94.9	Very high	94.1	Very high	18 Å²	18	34.5 Å²	34.5	19%	0.186	22%	0.217	C	C	.	.	H	α-helix	trans	54.7	-134.3	170.1	0	0	0	0	0	113.8	L104 D114 T206	G100-L104 WeakPolarHBondContact O-CB 3.27Å; G100-L104 VanDerWaalsContact O-CG 3.25Å; G100-L104 WeakPolarHBondContact O-CG 3.18Å; G100-L104 PolarHBondContact O-N 3.11Å; G100-D114 VanDerWaalsContact CA-OD2 3.31Å; G100-D114 WeakPolarHBondContact CA-OD2 3.32Å; G100-T206 PolarHBondContact N-OG1 2.76Å; G100-T206 VanDerWaalsContact N-OG1 3.09Å
101	S	95.1	Very high	94.3	Very high	21 Å²	21	31 Å²	31	15%	0.147	19%	0.188	C	C	.	.	H	α-helix	trans	-73.5	-35.9	-162.7	120.3	0	0	0	0	113.4	F99 V106 H107 D114	F99-S101 PolarHBondContact O-N 3.3Å; S101-V106 CarbonylContact O-C 3.57Å; S101-V106 PolarHBondContact O-N 3.02Å; S101-V106 VanDerWaalsContact O-N 3.09Å; S101-H107 PolarHBondContact O-N 3.43Å; S101-H107 VanDerWaalsContact O-N 3.09Å; S101-H107 WeakPolarHBondContact OG-CA 3.08Å; S101-H107 WeakPolarHBondContact OG-CB 3.38Å; S101-D114 PolarHBondContact N-OD2 3.46Å; S101-D114 VanDerWaalsContact N-OD2 3.13Å
102	Y	96.4	Very high	94.4	Very high	23 Å²	23	29.6 Å²	29.6	9%	0.09	18%	0.177	C	C	.	.	H	α-helix	trans	-70.7	-50.5	176.4	178.5	-100.4	0	0	0	112	L57 R60 L64 T98 L104 G105 H107 I113	L57-Y102 HydrophobicContact CD1-CE2 4.12Å; R60-Y102 HydrophobicContact CB-CE2 4.03Å; R60-Y102 VanDerWaalsContact CD-CE2 3.48Å; R60-Y102 HydrophobicContact CG-CE2 4.42Å; L64-Y102 HydrophobicContact CD1-CD1 4.39Å; L64-Y102 HydrophobicContact CD1-CE1 3.48Å; L64-Y102 VanDerWaalsContact CD1-CE1 3.48Å; T98-Y102 HydrophobicContact CG2-CD1 3.91Å; T98-Y102 HydrophobicContact CG2-CE1 4.06Å; Y102-L104 VanDerWaalsContact C-N 3.32Å; Y102-L104 PolarHBondContact O-N 3.48Å; Y102-G105 WeakPolarHBondContact O-CA 3.21Å; Y102-G105 PolarHBondContact O-N 3.45Å; Y102-H107 AromaticContact CD2-CD2 3.88Å; Y102-H107 AromaticContact CD2-CE1 3.69Å; Y102-H107 AromaticContact CD2-CG 3.96Å; Y102-H107 AromaticContact CD2-ND1 3.88Å; Y102-H107 AromaticContact CD2-NE2 3.7Å; Y102-H107 AromaticContact CE2-NE2 3.97Å; Y102-I113 HydrophobicContact CD1-CG2 4.21Å; Y102-I113 HydrophobicContact CG-CG1 4.47Å; Y102-I113 HydrophobicContact CG-CG2 4.45Å
103	R	96.6	Very high	94.6	Very high	105 Å²	105	29.4 Å²	29.4	40%	0.396	18%	0.176	S	C	.	.	H	α-helix	trans	-62.1	-35.4	179.8	175.5	64.2	175.7	-176.9	-7.7	113.3	T98 F99 G105 T206 D207	T98-R103 WeakPolarHBondContact O-CG 3.44Å; F99-R103 VanDerWaalsContact C-CB 3.47Å; F99-R103 VanDerWaalsContact CA-CB 3.45Å; F99-R103 VanDerWaalsContact O-CB 3.28Å; F99-R103 WeakPolarHBondContact O-CB 3.35Å; F99-R103 PolarHBondContact O-N 3.35Å; R103-G105 PolarHBondContact O-N 3.14Å; R103-T206 HydrophobicContact CB-CG2 3.86Å; R103-T206 HydrophobicContact CG-CG2 3.53Å; R103-D207 IonicContact CZ-OD1 2.64Å; R103-D207 VanDerWaalsContact CZ-OD1 3.27Å; R103-D207 IonicContact CZ-OD2 2.73Å; R103-D207 IonicContact NE-OD1 2.65Å; R103-D207 PolarHBondContact NE-OD1 2.66Å; R103-D207 IonicContact NE-OD2 2.77Å; R103-D207 VanDerWaalsContact NH2-CG 3.26Å; R103-D207 IonicContact NH2-OD1 2.62Å; R103-D207 PolarHBondContact NH2-OD1 2.87Å; R103-D207 IonicContact NH2-OD2 2.9Å; R103-D207 PolarHBondContact NH2-OD2 2.8Å
104	L	96.5	Very high	94.8	Very high	8 Å²	8	29.9 Å²	29.9	4%	0.042	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22.1	172.2	-73.5	177.5	0	0	0	112.5	G100 Y102 V106 T206 I209 L210 F219 R220 L223 A249	G100-L104 WeakPolarHBondContact O-CB 3.27Å; G100-L104 VanDerWaalsContact O-CG 3.25Å; G100-L104 WeakPolarHBondContact O-CG 3.18Å; G100-L104 PolarHBondContact O-N 3.11Å; Y102-L104 VanDerWaalsContact C-N 3.32Å; Y102-L104 PolarHBondContact O-N 3.48Å; L104-V106 HydrophobicContact CB-CG2 3.78Å; L104-V106 HydrophobicContact CD1-CG2 4.24Å; L104-T206 HydrophobicContact CD2-CG2 3.81Å; L104-T206 HydrophobicContact CG-CG2 3.84Å; L104-I209 HydrophobicContact CD2-CG2 4.1Å; L104-L210 HydrophobicContact CD2-CD1 4.4Å; L104-L210 HydrophobicContact CD2-CD2 3.93Å; L104-L210 HydrophobicContact CD2-CG 3.91Å; L104-F219 HydrophobicContact CD2-CE1 4.15Å; L104-F219 HydrophobicContact CD2-CZ 4.34Å; L104-R220 VanDerWaalsContact O-CG 3.31Å; L104-R220 WeakPolarHBondContact O-CG 3.4Å; L104-R220 PolarHBondContact O-NE 3.4Å; L104-L223 HydrophobicContact CD1-CD2 4.16Å; L104-A249 HydrophobicContact CD1-CB 3.81Å
105	G	95.4	Very high	95	Very high	16 Å²	16	29.9 Å²	29.9	17%	0.165	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	38.1	-172.3	0	0	0	0	0	112.4	Y102 R103 R224	Y102-G105 WeakPolarHBondContact O-CA 3.21Å; Y102-G105 PolarHBondContact O-N 3.45Å; R103-G105 PolarHBondContact O-N 3.14Å; G105-R224 VanDerWaalsContact C-NH2 3.33Å; G105-R224 PolarHBondContact O-NE 3.08Å; G105-R224 PolarHBondContact O-NH2 3.08Å
106	V	95.9	Very high	95.1	Very high	3 Å²	3	27.7 Å²	27.7	2%	0.018	16%	0.163	C	C	.	.			trans	-135.4	20.3	180	-57.5	0	0	0	0	113.3	S101 L104 R220 L223 R224 K227	S101-V106 CarbonylContact O-C 3.57Å; S101-V106 PolarHBondContact O-N 3.02Å; S101-V106 VanDerWaalsContact O-N 3.09Å; L104-V106 HydrophobicContact CB-CG2 3.78Å; L104-V106 HydrophobicContact CD1-CG2 4.24Å; V106-R220 HydrophobicContact CG1-CB 3.94Å; V106-R220 HydrophobicContact CG1-CG 3.89Å; V106-L223 HydrophobicContact CB-CD2 4.42Å; V106-L223 HydrophobicContact CB-CG 4.45Å; V106-L223 HydrophobicContact CG1-CB 4.19Å; V106-L223 HydrophobicContact CG1-CD2 4.06Å; V106-L223 HydrophobicContact CG1-CG 4.19Å; V106-L223 HydrophobicContact CG2-CD2 3.81Å; V106-L223 HydrophobicContact CG2-CG 4.17Å; V106-R224 HydrophobicContact CB-CG 4.1Å; V106-R224 HydrophobicContact CG1-CG 4.16Å; V106-K227 HydrophobicContact CB-CD 4.47Å; V106-K227 HydrophobicContact CG2-CD 4.04Å; V106-K227 PolarHBondContact O-NZ 2.9Å
107	H	93.6	Very high	95.2	Very high	8 Å²	8	26.9 Å²	26.9	4%	0.037	16%	0.16	C	C	.	.			trans	-69.6	155.2	170.1	62.5	-66.9	0	0	0	111.1	E52 S101 Y102 A111 R224	E52-H107 VanDerWaalsContact CD-NE2 3.28Å; E52-H107 IonicContact OE1-CD2 2.94Å; E52-H107 PolarHBondContact OE1-CD2 3.18Å; E52-H107 VanDerWaalsContact OE1-CD2 3.3Å; E52-H107 IonicContact OE1-NE2 3.92Å; E52-H107 IonicContact OE2-CD2 2.65Å; E52-H107 PolarHBondContact OE2-CD2 3.01Å; E52-H107 VanDerWaalsContact OE2-CD2 3.31Å; E52-H107 IonicContact OE2-CE1 2.98Å; E52-H107 IonicContact OE2-NE2 2.7Å; E52-H107 PolarHBondContact OE2-NE2 3.3Å; S101-H107 PolarHBondContact O-N 3.43Å; S101-H107 VanDerWaalsContact O-N 3.09Å; S101-H107 WeakPolarHBondContact OG-CA 3.08Å; S101-H107 WeakPolarHBondContact OG-CB 3.38Å; Y102-H107 AromaticContact CD2-CD2 3.88Å; Y102-H107 AromaticContact CD2-CE1 3.69Å; Y102-H107 AromaticContact CD2-CG 3.96Å; Y102-H107 AromaticContact CD2-ND1 3.88Å; Y102-H107 AromaticContact CD2-NE2 3.7Å; Y102-H107 AromaticContact CE2-NE2 3.97Å; H107-A111 HydrophobicContact CB-CB 4.05Å; H107-R224 PolarHBondContact O-NH1 2.96Å
108	T	92	Very high	95.2	Very high	35 Å²	35	25.8 Å²	25.8	22%	0.215	16%	0.155	C	C	.	.			trans	-107.7	168.2	177.8	57.9	0	0	0	0	109.7	V50 G110 A111	V50-T108 HydrophobicContact CB-CG2 4.2Å; V50-T108 HydrophobicContact CG1-CG2 4.18Å; T108-G110 PolarHBondContact O-N 2.68Å; T108-A111 WeakPolarHBondContact O-CB 3.48Å; T108-A111 PolarHBondContact O-N 3.2Å
109	K	88.4	Confident	95.2	Very high	73 Å²	73	24.6 Å²	24.6	32%	0.317	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	142.1	169.8	-60.2	-165.4	178.3	-130.6	0	110.7	G49 F51 E52 D53 E56 A111	G49-K109 PolarHBondContact O-N 3.13Å; F51-K109 VanDerWaalsContact O-CE 3.27Å; F51-K109 WeakPolarHBondContact O-CE 3.49Å; F51-K109 WeakPolarHBondContact O-CG 3.34Å; E52-K109 HydrophobicContact CB-CG 4.43Å; D53-K109 WeakPolarHBondContact OD1-CE 3.45Å; D53-K109 IonicContact OD1-NZ 2.65Å; D53-K109 PolarHBondContact OD1-NZ 3.2Å; D53-K109 IonicContact OD2-NZ 3.25Å; D53-K109 PolarHBondContact OD2-NZ 3.03Å; E56-K109 WeakPolarHBondContact OE2-CD 3.38Å; E56-K109 WeakPolarHBondContact OE2-CE 3.39Å; E56-K109 IonicContact OE2-NZ 2.71Å; E56-K109 PolarHBondContact OE2-NZ 3.44Å; K109-A111 PolarHBondContact O-N 3.45Å
110	G	87.6	Confident	95.2	Very high	73 Å²	73	23.4 Å²	23.4	75%	0.753	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.9	15.7	-174.9	0	0	0	0	0	115.5	T108	T108-G110 PolarHBondContact O-N 2.68Å
111	A	92.2	Very high	95.2	Very high	14 Å²	14	30.5 Å²	30.5	12%	0.116	16%	0.163	C	C	.	.			trans	-78.7	154.6	172.2	0	0	0	0	0	112.5	R60 H107 T108 K109	R60-A111 VanDerWaalsContact CZ-O 3.3Å; R60-A111 PolarHBondContact NH1-O 3.38Å; R60-A111 PolarHBondContact NH2-O 2.8Å; H107-A111 HydrophobicContact CB-CB 4.05Å; T108-A111 WeakPolarHBondContact O-CB 3.48Å; T108-A111 PolarHBondContact O-N 3.2Å; K109-A111 PolarHBondContact O-N 3.45Å
112	D	94.8	Very high	95.2	Very high	61 Å²	61	31.3 Å²	31.3	33%	0.326	17%	0.165	S	C	.	.			trans	-68.7	156.4	173.3	48	-12.1	0	0	0	113.5	E164	D112-E164 HydrophobicContact CB-CB 4.46Å
113	I	96.8	Very high	95.2	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	105.3	168.1	-55	-174.8	0	0	0	110.1	R60 L64 T98 Y102 A115 I163 E164 I165 D166	R60-I113 HydrophobicContact CB-CD1 4.04Å; R60-I113 HydrophobicContact CG-CD1 4.01Å; L64-I113 HydrophobicContact CD1-CD1 4.33Å; L64-I113 HydrophobicContact CD2-CG2 4.2Å; L64-I113 HydrophobicContact CG-CD1 4.37Å; T98-I113 HydrophobicContact CG2-CG2 3.87Å; Y102-I113 HydrophobicContact CD1-CG2 4.21Å; Y102-I113 HydrophobicContact CG-CG1 4.47Å; Y102-I113 HydrophobicContact CG-CG2 4.45Å; I113-A115 PolarHBondContact O-N 3.33Å; I113-I163 HydrophobicContact CD1-CG2 3.68Å; I113-I163 HydrophobicContact CG1-CG2 3.89Å; I113-E164 PolarHBondContact N-O 3.31Å; I113-I165 HydrophobicContact CB-CG1 4.5Å; I113-D166 PolarHBondContact O-N 2.76Å
114	D	97.5	Very high	95.2	Very high	33 Å²	33	29 Å²	29	18%	0.176	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.6	112.2	162.7	-66.5	-79.3	0	0	0	110.5	T98 F99 G100 S101	T98-D114 WeakPolarHBondContact CA-O 2.94Å; F99-D114 HydrophobicContact CD1-CB 4.01Å; F99-D114 HydrophobicContact CD2-CB 3.65Å; F99-D114 HydrophobicContact CE1-CB 4.03Å; F99-D114 HydrophobicContact CE2-CB 3.67Å; F99-D114 WeakPolarHBondContact CE2-OD1 3.17Å; F99-D114 HydrophobicContact CG-CB 3.81Å; F99-D114 HydrophobicContact CZ-CB 3.86Å; F99-D114 PolarHBondContact N-O 3.47Å; G100-D114 VanDerWaalsContact CA-OD2 3.31Å; G100-D114 WeakPolarHBondContact CA-OD2 3.32Å; S101-D114 PolarHBondContact N-OD2 3.46Å; S101-D114 VanDerWaalsContact N-OD2 3.13Å
115	A	97.9	Very high	95.1	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	141	-176.6	0	0	0	0	0	113.2	I96 I113 I165 D166 L167 V168	I96-A115 HydrophobicContact CG2-CB 4.11Å; I113-A115 PolarHBondContact O-N 3.33Å; A115-I165 HydrophobicContact CB-CG2 4.09Å; A115-D166 PolarHBondContact N-O 2.85Å; A115-D166 VanDerWaalsContact O-O 3.09Å; A115-L167 HydrophobicContact CB-CD1 3.66Å; A115-L167 CarbonylContact O-C 3.56Å; A115-L167 WeakPolarHBondContact O-CA 3.43Å; A115-V168 VanDerWaalsContact O-CG2 3.32Å; A115-V168 WeakPolarHBondContact O-CG2 3.45Å; A115-V168 PolarHBondContact O-N 2.92Å
116	L	98.1	Very high	95.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.8	177.4	174.3	68.4	0	0	0	110.4	I96 F97 F99 V118 V168 A170 L183 L200 C203	I96-L116 VanDerWaalsContact CA-O 3.32Å; I96-L116 WeakPolarHBondContact CA-O 3.35Å; F97-L116 HydrophobicContact CB-CB 4.44Å; F97-L116 PolarHBondContact N-O 3.01Å; F97-L116 PolarHBondContact O-N 2.95Å; F99-L116 HydrophobicContact CD1-CB 4.25Å; F99-L116 HydrophobicContact CE1-CB 4.21Å; L116-V118 HydrophobicContact CD2-CG2 3.69Å; L116-V118 HydrophobicContact CG-CG2 3.78Å; L116-V168 WeakPolarHBondContact CA-O 3.35Å; L116-V168 HydrophobicContact CB-CG2 4.21Å; L116-V168 HydrophobicContact CD1-CG2 3.77Å; L116-A170 HydrophobicContact CD1-CB 3.85Å; L116-L183 HydrophobicContact CD2-CD1 3.97Å; L116-L200 HydrophobicContact CD2-CD2 4.02Å; L116-C203 HydrophobicContact CD2-CB 4.28Å; L116-C203 VanDerWaalsContact CD2-SG 3.51Å
117	C	98.1	Very high	95.3	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	119	164.9	177.2	0	0	0	0	110	V71 F128 L167 V168 F169 A170	V71-C117 HydrophobicContact CG2-CB 4.5Å; C117-F128 HydrophobicContact CB-CE2 4.16Å; C117-L167 HydrophobicContact CB-CD1 4.11Å; C117-L167 HydrophobicContact CB-CG 4.4Å; C117-V168 PolarHBondContact N-O 3.03Å; C117-F169 HydrophobicContact CB-CD2 4.25Å; C117-A170 PolarHBondContact O-N 2.77Å
118	V	97.4	Very high	95.5	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	119.6	175.4	-179.8	0	0	0	0	110.1	K95 F97 L116 A170 L172 I177 L181 L183	K95-V118 PolarHBondContact N-O 2.68Å; K95-V118 PolarHBondContact O-N 2.86Å; F97-V118 HydrophobicContact CD2-CB 4.16Å; F97-V118 HydrophobicContact CD2-CG2 3.52Å; F97-V118 HydrophobicContact CE2-CB 4Å; F97-V118 HydrophobicContact CE2-CG2 3.72Å; L116-V118 HydrophobicContact CD2-CG2 3.69Å; L116-V118 HydrophobicContact CG-CG2 3.78Å; V118-A170 WeakPolarHBondContact CA-O 3.04Å; V118-L172 HydrophobicContact CG1-CD1 3.55Å; V118-L172 HydrophobicContact CG1-CG 3.9Å; V118-I177 HydrophobicContact CG1-CD1 4.13Å; V118-I177 HydrophobicContact CG1-CG2 4.38Å; V118-L181 HydrophobicContact CG1-CD2 4Å; V118-L183 HydrophobicContact CG2-CD1 4.23Å; V118-L183 HydrophobicContact CG2-CD2 4.36Å
119	A	97.1	Very high	95.7	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	154.9	-173.7	0	0	0	0	0	112.7	I75 V123 F169 A170 R171 L172	I75-A119 HydrophobicContact CD1-CB 3.81Å; I75-A119 HydrophobicContact CG1-CB 4.41Å; A119-V123 HydrophobicContact CB-CB 3.89Å; A119-V123 HydrophobicContact CB-CG1 3.9Å; A119-V123 HydrophobicContact CB-CG2 4.44Å; A119-F169 HydrophobicContact CB-CE2 3.53Å; A119-F169 HydrophobicContact CB-CZ 3.93Å; A119-A170 PolarHBondContact N-O 3.32Å; A119-R171 WeakPolarHBondContact O-CA 3.18Å; A119-L172 PolarHBondContact O-N 3.06Å
120	P	95.9	Very high	96.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.178	C	C	.	.			trans	-74.2	170.2	179.3	34.2	-40	0	0	0	113	I75 V92 H122 V123 I174 Q175 I177	I75-P120 HydrophobicContact CG2-CG 4Å; V92-P120 HydrophobicContact CG2-CB 4.46Å; V92-P120 HydrophobicContact CG2-CG 3.7Å; P120-H122 VanDerWaalsContact C-N 3.27Å; P120-H122 WeakPolarHBondContact CG-CE1 3.45Å; P120-H122 PolarHBondContact O-N 3.24Å; P120-H122 VanDerWaalsContact O-N 3.08Å; P120-V123 HydrophobicContact CG-CG2 3.93Å; P120-V123 PolarHBondContact O-N 2.99Å; P120-I174 WeakPolarHBondContact CA-O 3.43Å; P120-I174 WeakPolarHBondContact CB-O 3.29Å; P120-Q175 VanDerWaalsContact CB-O 3.24Å; P120-Q175 WeakPolarHBondContact CB-O 3.15Å; P120-I177 HydrophobicContact CB-CD1 4.46Å; P120-I177 HydrophobicContact CB-CG1 4.2Å
121	R	95.2	Very high	96.5	Very high	167 Å²	167	32.3 Å²	32.3	63%	0.63	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-27.1	-168.3	-176.4	175.1	170.3	-175.8	-4.2	115.5	R171 L172 I174	R121-R171 VanDerWaalsContact O-CD 3.27Å; R121-R171 WeakPolarHBondContact O-CD 3.31Å; R121-R171 PolarHBondContact O-NH1 3.46Å; R121-L172 VanDerWaalsContact CA-O 3.28Å; R121-L172 WeakPolarHBondContact CA-O 3.41Å; R121-L172 WeakPolarHBondContact CB-O 3.42Å; R121-L172 PolarHBondContact N-O 3.41Å; R121-I174 WeakPolarHBondContact CB-O 3.32Å; R121-I174 PolarHBondContact N-O 3.36Å
122	H	95.2	Very high	96.8	Very high	39 Å²	39	31.7 Å²	31.7	18%	0.181	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-13.9	-180	56.1	-77.9	0	0	0	114.5	S79 K82 L84 P120	S79-H122 PolarHBondContact OG-NE2 3.37Å; K82-H122 PolarHBondContact NZ-O 2.93Å; L84-H122 WeakPolarHBondContact CD1-NE2 3.47Å; P120-H122 VanDerWaalsContact C-N 3.27Å; P120-H122 WeakPolarHBondContact CG-CE1 3.45Å; P120-H122 PolarHBondContact O-N 3.24Å; P120-H122 VanDerWaalsContact O-N 3.08Å
123	V	97.1	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	15%	0.147	C	C	.	.	S	Bend	trans	-90	116.6	177.8	-178.4	0	0	0	0	109.1	W74 I75 V78 A119 P120 D127 F169 R171	W74-V123 HydrophobicContact CH2-CG1 3.27Å; W74-V123 HydrophobicContact CZ2-CG1 3.56Å; W74-V123 HydrophobicContact CZ3-CG1 3.99Å; I75-V123 HydrophobicContact CG1-CG2 4.32Å; I75-V123 HydrophobicContact CG2-CG2 4.11Å; V78-V123 HydrophobicContact CB-CG2 4.32Å; V78-V123 HydrophobicContact CG1-CB 4.35Å; V78-V123 HydrophobicContact CG1-CG1 4.31Å; V78-V123 HydrophobicContact CG1-CG2 3.85Å; A119-V123 HydrophobicContact CB-CB 3.89Å; A119-V123 HydrophobicContact CB-CG1 3.9Å; A119-V123 HydrophobicContact CB-CG2 4.44Å; P120-V123 HydrophobicContact CG-CG2 3.93Å; P120-V123 PolarHBondContact O-N 2.99Å; V123-D127 HydrophobicContact CG1-CB 4.43Å; V123-F169 HydrophobicContact CG1-CE2 4.22Å; V123-F169 HydrophobicContact CG1-CZ 4.12Å; V123-R171 WeakPolarHBondContact O-CD 3.42Å; V123-R171 WeakPolarHBondContact O-CG 3.25Å
124	E	95.9	Very high	96.9	Very high	80 Å²	80	34.4 Å²	34.4	37%	0.374	16%	0.164	S	C	.	.			trans	-96.7	166.9	-170.9	-54.9	-133.7	116.9	0	0	112.7	S126 D127 F128 R171	E124-S126 VanDerWaalsContact C-N 3.29Å; E124-S126 WeakPolarHBondContact CB-OG 3.19Å; E124-S126 PolarHBondContact O-N 3.34Å; E124-D127 PolarHBondContact N-OD2 3.22Å; E124-D127 WeakPolarHBondContact O-CB 3.4Å; E124-D127 PolarHBondContact O-N 3.25Å; E124-F128 PolarHBondContact O-N 3.48Å; E124-R171 IonicContact OE1-CZ 3.65Å; E124-R171 IonicContact OE1-NH1 3.71Å; E124-R171 PolarHBondContact OE1-NH1 2.65Å; E124-R171 IonicContact OE1-NH2 2.69Å; E124-R171 PolarHBondContact OE1-NH2 3.27Å
125	R	95.9	Very high	96.9	Very high	18 Å²	18	34.7 Å²	34.7	7%	0.068	16%	0.164	C	C	.	.	H	α-helix	trans	-69.4	-29.9	178	-175.4	173.9	-64.5	-74.2	-5.1	112.2	F128 F129 F169 C196	R125-F128 PolarHBondContact O-N 3.27Å; R125-F129 HydrophobicContact CG-CD2 3.85Å; R125-F129 HydrophobicContact CG-CE2 3.76Å; R125-F129 WeakPolarHBondContact O-CD2 3.28Å; R125-F129 PolarHBondContact O-N 3.04Å; R125-F129 VanDerWaalsContact O-N 3.14Å; R125-F169 HydrophobicContact CB-CD1 4.19Å; R125-F169 HydrophobicContact CB-CE1 4.19Å; R125-F169 HydrophobicContact CG-CD1 4.33Å; R125-F169 PolarHBondContact NH1-O 2.88Å; R125-F169 PolarHBondContact NH2-O 3.12Å; R125-C196 PolarHBondContact NH2-SG 3.24Å
126	S	96.5	Very high	96.8	Very high	44 Å²	44	34.8 Å²	34.8	31%	0.308	16%	0.164	S	C	.	.	H	α-helix	trans	-59.3	-49.6	168	37	0	0	0	0	111.4	E124 F128 F129 Q130	E124-S126 VanDerWaalsContact C-N 3.29Å; E124-S126 WeakPolarHBondContact CB-OG 3.19Å; E124-S126 PolarHBondContact O-N 3.34Å; S126-F128 PolarHBondContact O-N 3Å; S126-F129 PolarHBondContact O-N 3.43Å; S126-F129 VanDerWaalsContact O-N 3.14Å; S126-Q130 VanDerWaalsContact O-CB 3.28Å; S126-Q130 WeakPolarHBondContact O-CB 3.42Å; S126-Q130 WeakPolarHBondContact O-CG 3.25Å; S126-Q130 PolarHBondContact O-N 2.88Å
127	D	97.3	Very high	96.7	Very high	22 Å²	22	40.4 Å²	40.4	12%	0.118	19%	0.189	C	C	.	.	H	α-helix	trans	-55.7	-40.1	178.1	-52.8	-27.4	0	0	0	111.2	W74 V78 K82 V123 E124 Q130 S131 F132	W74-D127 HydrophobicContact CZ2-CB 3.81Å; V78-D127 HydrophobicContact CG1-CB 4.44Å; V78-D127 WeakPolarHBondContact CG1-OD2 3.34Å; V78-D127 HydrophobicContact CG2-CB 4.41Å; K82-D127 IonicContact NZ-OD1 3.73Å; K82-D127 PolarHBondContact NZ-OD1 2.91Å; K82-D127 IonicContact NZ-OD2 2.7Å; K82-D127 PolarHBondContact NZ-OD2 3.45Å; V123-D127 HydrophobicContact CG1-CB 4.43Å; E124-D127 PolarHBondContact N-OD2 3.22Å; E124-D127 WeakPolarHBondContact O-CB 3.4Å; E124-D127 PolarHBondContact O-N 3.25Å; D127-Q130 PolarHBondContact O-N 3.48Å; D127-S131 WeakPolarHBondContact O-CA 3.33Å; D127-S131 PolarHBondContact O-N 3.12Å; D127-S131 PolarHBondContact O-OG 3.03Å; D127-F132 PolarHBondContact O-N 3.37Å
128	F	97.9	Very high	96.5	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	22%	0.22	C	C	.	.	I	π-helix	trans	-65.6	-45.8	177.3	178	-103.6	0	0	0	112.8	W74 C117 E124 R125 S126 Q130 F132 F133 I156 L167 F169	W74-F128 HydrophobicContact CH2-CB 3.92Å; W74-F128 HydrophobicContact CH2-CD2 4.13Å; W74-F128 HydrophobicContact CZ2-CB 4.26Å; W74-F128 HydrophobicContact CZ3-CD2 4.33Å; C117-F128 HydrophobicContact CB-CE2 4.16Å; E124-F128 PolarHBondContact O-N 3.48Å; R125-F128 PolarHBondContact O-N 3.27Å; S126-F128 PolarHBondContact O-N 3Å; F128-Q130 VanDerWaalsContact C-N 3.3Å; F128-Q130 PolarHBondContact O-N 3.14Å; F128-F132 HydrophobicContact CD2-CB 4.34Å; F128-F132 AromaticContact CD2-CD1 3.88Å; F128-F132 HydrophobicContact CD2-CD1 3.88Å; F128-F132 HydrophobicContact CD2-CG 4.42Å; F128-F132 AromaticContact CE2-CD1 3.76Å; F128-F132 HydrophobicContact CE2-CD1 3.76Å; F128-F132 HydrophobicContact CE2-CE1 4.25Å; F128-F132 WeakPolarHBondContact O-CB 3.28Å; F128-F133 PolarHBondContact O-N 3.46Å; F128-I156 HydrophobicContact CD1-CD1 3.89Å; F128-I156 HydrophobicContact CD1-CG1 4.34Å; F128-I156 HydrophobicContact CD2-CD1 4.47Å; F128-I156 HydrophobicContact CE1-CB 4.42Å; F128-I156 HydrophobicContact CE1-CD1 3.48Å; F128-I156 VanDerWaalsContact CE1-CD1 3.48Å; F128-I156 HydrophobicContact CE1-CG1 3.61Å; F128-I156 HydrophobicContact CE2-CD1 4.1Å; F128-I156 HydrophobicContact CG-CD1 4.38Å; F128-I156 HydrophobicContact CZ-CB 4.31Å; F128-I156 HydrophobicContact CZ-CD1 3.59Å; F128-I156 HydrophobicContact CZ-CG1 3.9Å; F128-L167 HydrophobicContact CE2-CD2 3.92Å; F128-L167 HydrophobicContact CE2-CG 4.19Å; F128-L167 HydrophobicContact CZ-CD2 4.13Å; F128-L167 HydrophobicContact CZ-CG 4.04Å; F128-F169 HydrophobicContact CB-CB 4.35Å; F128-F169 HydrophobicContact CB-CD1 4.27Å; F128-F169 HydrophobicContact CB-CD2 3.84Å; F128-F169 HydrophobicContact CB-CE2 4.14Å; F128-F169 HydrophobicContact CB-CG 3.9Å; F128-F169 HydrophobicContact CB-CZ 4.49Å; F128-F169 HydrophobicContact CD1-CB 3.51Å; F128-F169 HydrophobicContact CD1-CD2 4.45Å; F128-F169 HydrophobicContact CD1-CG 4.02Å; F128-F169 HydrophobicContact CD2-CB 3.89Å; F128-F169 AromaticContact CD2-CD2 3.58Å; F128-F169 HydrophobicContact CD2-CD2 3.58Å; F128-F169 HydrophobicContact CD2-CE2 4.4Å; F128-F169 AromaticContact CD2-CG 3.98Å; F128-F169 HydrophobicContact CD2-CG 3.98Å; F128-F169 HydrophobicContact CE1-CB 3.6Å; F128-F169 HydrophobicContact CE2-CB 3.99Å; F128-F169 HydrophobicContact CE2-CD2 4.23Å; F128-F169 HydrophobicContact CG-CB 3.65Å; F128-F169 HydrophobicContact CG-CD1 4.47Å; F128-F169 AromaticContact CG-CD2 3.71Å; F128-F169 HydrophobicContact CG-CD2 3.71Å; F128-F169 HydrophobicContact CG-CE2 4.47Å; F128-F169 AromaticContact CG-CG 3.7Å; F128-F169 HydrophobicContact CG-CG 3.7Å; F128-F169 HydrophobicContact CZ-CB 3.85Å
129	F	97.2	Very high	96.3	Very high	22 Å²	22	50.2 Å²	50.2	10%	0.096	23%	0.234	C	C	.	.	I	π-helix	trans	-80.1	-7.7	178.4	-73.2	-61.7	0	0	0	114.6	R125 S126 F133 A147 E149 P154 I156	R125-F129 HydrophobicContact CG-CD2 3.85Å; R125-F129 HydrophobicContact CG-CE2 3.76Å; R125-F129 WeakPolarHBondContact O-CD2 3.28Å; R125-F129 PolarHBondContact O-N 3.04Å; R125-F129 VanDerWaalsContact O-N 3.14Å; S126-F129 PolarHBondContact O-N 3.43Å; S126-F129 VanDerWaalsContact O-N 3.14Å; F129-F133 WeakPolarHBondContact O-CB 3.34Å; F129-A147 HydrophobicContact CD1-CB 3.87Å; F129-A147 HydrophobicContact CE1-CB 4.18Å; F129-E149 HydrophobicContact CD2-CB 4.08Å; F129-E149 HydrophobicContact CD2-CG 3.9Å; F129-E149 HydrophobicContact CE2-CB 3.9Å; F129-E149 HydrophobicContact CE2-CG 3.7Å; F129-E149 HydrophobicContact CG-CB 4.47Å; F129-E149 HydrophobicContact CZ-CB 4.14Å; F129-E149 HydrophobicContact CZ-CG 4.38Å; F129-P154 HydrophobicContact CE2-CB 3.65Å; F129-P154 HydrophobicContact CZ-CB 3.52Å; F129-I156 HydrophobicContact CD1-CD1 4.03Å; F129-I156 HydrophobicContact CD1-CG1 3.72Å; F129-I156 HydrophobicContact CE1-CD1 4.29Å; F129-I156 HydrophobicContact CE1-CG1 3.56Å
130	Q	96.1	Very high	96.2	Very high	129 Å²	129	57.4 Å²	57.4	60%	0.603	27%	0.273	S	S	*	.	I	π-helix	trans	-113.7	-79.4	179.1	-63.9	173.5	-8	0	0	111	S126 D127 F128 F132 F133 E134	S126-Q130 VanDerWaalsContact O-CB 3.28Å; S126-Q130 WeakPolarHBondContact O-CB 3.42Å; S126-Q130 WeakPolarHBondContact O-CG 3.25Å; S126-Q130 PolarHBondContact O-N 2.88Å; D127-Q130 PolarHBondContact O-N 3.48Å; F128-Q130 VanDerWaalsContact C-N 3.3Å; F128-Q130 PolarHBondContact O-N 3.14Å; Q130-F132 PolarHBondContact O-N 3.37Å; Q130-F133 PolarHBondContact O-N 2.7Å; Q130-E134 PolarHBondContact O-N 2.87Å
131	S	97.3	Very high	96.1	Very high	50 Å²	50	58.7 Å²	58.7	35%	0.35	29%	0.286	S	S	.	.	I	π-helix	trans	-66.2	-36.8	-174.5	61.7	0	0	0	0	114.1	W74 D127 K135	W74-S131 PolarHBondContact NE1-OG 3.47Å; D127-S131 WeakPolarHBondContact O-CA 3.33Å; D127-S131 PolarHBondContact O-N 3.12Å; D127-S131 PolarHBondContact O-OG 3.03Å; S131-K135 PolarHBondContact O-N 2.87Å
132	F	97.9	Very high	96.1	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.263	C	S	.	.	I	π-helix	trans	-74.9	-40.6	174.7	-165.5	-118.9	0	0	0	112	L67 L70 V71 W74 D127 F128 Q130 E134 K135 L136 L167	L67-F132 HydrophobicContact CD1-CZ 4.46Å; L70-F132 HydrophobicContact CB-CE2 4.32Å; V71-F132 HydrophobicContact CG2-CE1 4.19Å; V71-F132 HydrophobicContact CG2-CE2 3.99Å; V71-F132 HydrophobicContact CG2-CZ 3.53Å; W74-F132 HydrophobicContact CB-CD2 3.6Å; W74-F132 HydrophobicContact CB-CE2 3.98Å; W74-F132 HydrophobicContact CD2-CB 3.72Å; W74-F132 AromaticContact CD2-CD2 3.5Å; W74-F132 HydrophobicContact CD2-CD2 3.5Å; W74-F132 VanDerWaalsContact CD2-CD2 3.5Å; W74-F132 HydrophobicContact CD2-CE2 4.38Å; W74-F132 AromaticContact CD2-CG 3.84Å; W74-F132 HydrophobicContact CD2-CG 3.84Å; W74-F132 HydrophobicContact CE3-CB 4.19Å; W74-F132 AromaticContact CE3-CD2 3.73Å; W74-F132 HydrophobicContact CE3-CD2 3.73Å; W74-F132 HydrophobicContact CE3-CE2 4.3Å; W74-F132 AromaticContact CE3-CG 3.98Å; W74-F132 HydrophobicContact CE3-CG 3.98Å; W74-F132 HydrophobicContact CG-CB 4.09Å; W74-F132 AromaticContact CG-CD2 3.41Å; W74-F132 HydrophobicContact CG-CD2 3.41Å; W74-F132 VanDerWaalsContact CG-CD2 3.41Å; W74-F132 HydrophobicContact CG-CE2 4.24Å; W74-F132 HydrophobicContact CG-CG 4.14Å; W74-F132 HydrophobicContact CH2-CB 4.38Å; W74-F132 HydrophobicContact CZ2-CB 3.95Å; W74-F132 HydrophobicContact CZ3-CB 4.49Å; W74-F132 HydrophobicContact CZ3-CG 4.46Å; D127-F132 PolarHBondContact O-N 3.37Å; F128-F132 HydrophobicContact CD2-CB 4.34Å; F128-F132 AromaticContact CD2-CD1 3.88Å; F128-F132 HydrophobicContact CD2-CD1 3.88Å; F128-F132 HydrophobicContact CD2-CG 4.42Å; F128-F132 AromaticContact CE2-CD1 3.76Å; F128-F132 HydrophobicContact CE2-CD1 3.76Å; F128-F132 HydrophobicContact CE2-CE1 4.25Å; F128-F132 WeakPolarHBondContact O-CB 3.28Å; Q130-F132 PolarHBondContact O-N 3.37Å; F132-E134 PolarHBondContact O-N 3.44Å; F132-K135 PolarHBondContact O-N 2.88Å; F132-K135 VanDerWaalsContact O-N 3.11Å; F132-L136 HydrophobicContact CD1-CD1 3.81Å; F132-L136 HydrophobicContact CD1-CG 4.07Å; F132-L136 HydrophobicContact CE1-CD1 3.63Å; F132-L136 HydrophobicContact CE1-CD2 3.84Å; F132-L136 HydrophobicContact CE1-CG 3.8Å; F132-L136 HydrophobicContact CE2-CD2 4.4Å; F132-L136 HydrophobicContact CZ-CD1 4.37Å; F132-L136 HydrophobicContact CZ-CD2 3.74Å; F132-L136 HydrophobicContact CZ-CG 4.06Å; F132-L136 WeakPolarHBondContact O-CG 3.46Å; F132-L136 PolarHBondContact O-N 2.91Å; F132-L167 HydrophobicContact CD1-CD2 4.37Å; F132-L167 HydrophobicContact CE1-CD2 3.56Å; F132-L167 HydrophobicContact CZ-CD2 4.42Å
133	F	96.8	Very high	96.1	Very high	41 Å²	41	58.1 Å²	58.1	18%	0.18	28%	0.284	C	S	.	.	H	α-helix	trans	-57.6	-46.7	175.4	-174.2	-91.1	0	0	0	111.8	F128 F129 Q130 L136 K137 L145 A147 I156	F128-F133 PolarHBondContact O-N 3.46Å; F129-F133 WeakPolarHBondContact O-CB 3.34Å; Q130-F133 PolarHBondContact O-N 2.7Å; F133-L136 PolarHBondContact O-N 3.03Å; F133-K137 WeakPolarHBondContact O-CB 3.39Å; F133-K137 PolarHBondContact O-N 3.32Å; F133-L145 HydrophobicContact CD2-CD1 4.01Å; F133-L145 HydrophobicContact CD2-CD2 4.42Å; F133-L145 HydrophobicContact CD2-CG 4.19Å; F133-L145 HydrophobicContact CE1-CD2 4.41Å; F133-L145 HydrophobicContact CE2-CD1 3.71Å; F133-L145 HydrophobicContact CE2-CD2 4.1Å; F133-L145 HydrophobicContact CE2-CG 3.56Å; F133-L145 HydrophobicContact CZ-CD1 4.44Å; F133-L145 HydrophobicContact CZ-CD2 4.09Å; F133-L145 HydrophobicContact CZ-CG 3.78Å; F133-A147 HydrophobicContact CD2-CB 3.98Å; F133-A147 HydrophobicContact CE2-CB 3.82Å; F133-I156 HydrophobicContact CB-CD1 4.28Å; F133-I156 HydrophobicContact CD2-CD1 4.12Å; F133-I156 HydrophobicContact CD2-CG1 4.36Å; F133-I156 HydrophobicContact CD2-CG2 4.08Å; F133-I156 HydrophobicContact CE2-CG2 4.37Å
134	E	96.9	Very high	95.8	Very high	77 Å²	77	63.7 Å²	63.7	36%	0.36	31%	0.314	S	S	.	.	H	α-helix	trans	-68.6	-31.5	174.4	-71.2	-66.5	130	0	0	112.5	Q130 F132 K137 H138	Q130-E134 PolarHBondContact O-N 2.87Å; F132-E134 PolarHBondContact O-N 3.44Å; E134-K137 PolarHBondContact O-N 3.47Å; E134-K137 VanDerWaalsContact OE1-CD 3.26Å; E134-K137 WeakPolarHBondContact OE1-CD 3.42Å; E134-K137 IonicContact OE1-NZ 3.93Å; E134-K137 PolarHBondContact OE1-NZ 3.19Å; E134-K137 WeakPolarHBondContact OE2-CD 3.41Å; E134-K137 IonicContact OE2-NZ 2.77Å; E134-K137 PolarHBondContact OE2-NZ 3.46Å; E134-H138 PolarHBondContact O-N 2.79Å; E134-H138 PolarHBondContact O-ND1 2.86Å; E134-H138 IonicContact OE2-CE1 3.86Å
135	K	96.8	Very high	95.7	Very high	40 Å²	40	61.8 Å²	61.8	17%	0.174	31%	0.306	C	S	.	.	H	α-helix	trans	-63.2	-48.1	170.6	-170.3	-175.7	-71.9	-78.1	0	111.2	E73 W74 D77 S131 F132 K137 H138 Q139	E73-K135 WeakPolarHBondContact OE1-CE 3.19Å; E73-K135 IonicContact OE1-NZ 2.81Å; E73-K135 PolarHBondContact OE1-NZ 3.33Å; W74-K135 HydrophobicContact CB-CD 4.18Å; D77-K135 WeakPolarHBondContact OD2-CE 3.37Å; D77-K135 IonicContact OD2-NZ 3.23Å; D77-K135 PolarHBondContact OD2-NZ 3.02Å; S131-K135 PolarHBondContact O-N 2.87Å; F132-K135 PolarHBondContact O-N 2.88Å; F132-K135 VanDerWaalsContact O-N 3.11Å; K135-K137 VanDerWaalsContact C-N 3.28Å; K135-K137 PolarHBondContact O-N 2.89Å; K135-H138 PolarHBondContact O-N 3.36Å; K135-H138 VanDerWaalsContact O-N 3.16Å; K135-Q139 WeakPolarHBondContact O-CG 3.36Å
136	L	96.8	Very high	95.6	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.005	33%	0.325	C	S	.	.	H	α-helix	trans	-58.3	-39.1	177.8	-68.2	173.6	0	0	0	112.3	L67 L70 F132 F133 H138 Q139 I142 L145 I156 F158	L67-L136 HydrophobicContact CD1-CD2 3.86Å; L70-L136 HydrophobicContact CD1-CD2 4.48Å; F132-L136 HydrophobicContact CD1-CD1 3.81Å; F132-L136 HydrophobicContact CD1-CG 4.07Å; F132-L136 HydrophobicContact CE1-CD1 3.63Å; F132-L136 HydrophobicContact CE1-CD2 3.84Å; F132-L136 HydrophobicContact CE1-CG 3.8Å; F132-L136 HydrophobicContact CE2-CD2 4.4Å; F132-L136 HydrophobicContact CZ-CD1 4.37Å; F132-L136 HydrophobicContact CZ-CD2 3.74Å; F132-L136 HydrophobicContact CZ-CG 4.06Å; F132-L136 WeakPolarHBondContact O-CG 3.46Å; F132-L136 PolarHBondContact O-N 2.91Å; F133-L136 PolarHBondContact O-N 3.03Å; L136-H138 PolarHBondContact O-N 3.33Å; L136-Q139 PolarHBondContact O-N 2.86Å; L136-Q139 VanDerWaalsContact O-N 3.15Å; L136-I142 HydrophobicContact CB-CD1 3.99Å; L136-I142 HydrophobicContact CD2-CD1 3.53Å; L136-I142 HydrophobicContact CG-CD1 4.35Å; L136-L145 HydrophobicContact CB-CD1 4.33Å; L136-L145 HydrophobicContact CB-CD2 4.01Å; L136-L145 HydrophobicContact CD1-CD1 4.15Å; L136-I156 HydrophobicContact CD1-CG2 4.15Å; L136-F158 HydrophobicContact CD1-CD1 4.48Å; L136-F158 HydrophobicContact CD1-CE1 4.24Å; L136-F158 HydrophobicContact CD2-CE2 4.49Å; L136-F158 HydrophobicContact CD2-CZ 4.38Å
137	K	94.4	Very high	95.3	Very high	118 Å²	118	67.1 Å²	67.1	51%	0.513	33%	0.33	S	S	.	.	H	α-helix	trans	-63.4	-22	179.2	-178.2	-176.5	166.9	-160.9	0	114.3	F133 E134 K135 L145	F133-K137 WeakPolarHBondContact O-CB 3.39Å; F133-K137 PolarHBondContact O-N 3.32Å; E134-K137 PolarHBondContact O-N 3.47Å; E134-K137 VanDerWaalsContact OE1-CD 3.26Å; E134-K137 WeakPolarHBondContact OE1-CD 3.42Å; E134-K137 IonicContact OE1-NZ 3.93Å; E134-K137 PolarHBondContact OE1-NZ 3.19Å; E134-K137 WeakPolarHBondContact OE2-CD 3.41Å; E134-K137 IonicContact OE2-NZ 2.77Å; E134-K137 PolarHBondContact OE2-NZ 3.46Å; K135-K137 VanDerWaalsContact C-N 3.28Å; K135-K137 PolarHBondContact O-N 2.89Å; K137-L145 HydrophobicContact CB-CD2 3.74Å
138	H	94.3	Very high	94.9	Very high	142 Å²	142	68.9 Å²	68.9	66%	0.657	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104	10.7	177.3	-63.3	90.8	0	0	0	113.1	E134 K135 L136	E134-H138 PolarHBondContact O-N 2.79Å; E134-H138 PolarHBondContact O-ND1 2.86Å; E134-H138 IonicContact OE2-CE1 3.86Å; K135-H138 PolarHBondContact O-N 3.36Å; K135-H138 VanDerWaalsContact O-N 3.16Å; L136-H138 PolarHBondContact O-N 3.33Å
139	Q	94.8	Very high	94.6	Very high	64 Å²	64	72.6 Å²	72.6	30%	0.299	36%	0.359	S	S	.	.	S	Bend	trans	-98.2	130	179.7	-76.1	-69.9	-27.2	0	0	112.2	L70 K135 L136 I142	L70-Q139 HydrophobicContact CD1-CG 3.97Å; L70-Q139 VanDerWaalsContact CD2-CD 3.44Å; L70-Q139 HydrophobicContact CD2-CG 3.87Å; K135-Q139 WeakPolarHBondContact O-CG 3.36Å; L136-Q139 PolarHBondContact O-N 2.86Å; L136-Q139 VanDerWaalsContact O-N 3.15Å; Q139-I142 HydrophobicContact CB-CD1 4.01Å; Q139-I142 HydrophobicContact CB-CG1 4.3Å; Q139-I142 PolarHBondContact O-N 3.07Å
140	D	94.3	Very high	94	Very high	151 Å²	151	79.6 Å²	79.6	81%	0.807	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	139	176.3	-75.4	-43.9	0	0	0	111.5	I142 F160	D140-I142 VanDerWaalsContact C-N 3.32Å; D140-F160 WeakPolarHBondContact O-CE2 3.22Å
141	G	93.1	Very high	93.6	Very high	28 Å²	28	75 Å²	75	29%	0.289	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.5	-10	-177.8	0	0	0	0	0	115	F160 D161	G141-F160 WeakPolarHBondContact O-CA 3.43Å; G141-D161 WeakPolarHBondContact CA-OD1 3.18Å; G141-D161 PolarHBondContact O-N 3.31Å
142	I	95.9	Very high	93	Very high	27 Å²	27	79.5 Å²	79.5	14%	0.138	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	134	175.1	-65.1	-168.9	0	0	0	111.6	L136 Q139 D140 L145 F158 E159 F160	L136-I142 HydrophobicContact CB-CD1 3.99Å; L136-I142 HydrophobicContact CD2-CD1 3.53Å; L136-I142 HydrophobicContact CG-CD1 4.35Å; Q139-I142 HydrophobicContact CB-CD1 4.01Å; Q139-I142 HydrophobicContact CB-CG1 4.3Å; Q139-I142 PolarHBondContact O-N 3.07Å; D140-I142 VanDerWaalsContact C-N 3.32Å; I142-L145 HydrophobicContact CG2-CB 4.29Å; I142-F158 HydrophobicContact CD1-CD2 4.04Å; I142-F158 HydrophobicContact CD1-CE2 3.98Å; I142-F158 HydrophobicContact CG1-CD2 4.27Å; I142-F158 HydrophobicContact CG2-CB 4.26Å; I142-F158 HydrophobicContact CG2-CD2 4.05Å; I142-F158 HydrophobicContact CG2-CG 4.5Å; I142-E159 CarbonylContact C-O 3.48Å; I142-E159 WeakPolarHBondContact CA-O 3.34Å; I142-F160 HydrophobicContact CD1-CD1 4.36Å; I142-F160 HydrophobicContact CD1-CD2 4.48Å; I142-F160 HydrophobicContact CD1-CE1 4.45Å; I142-F160 HydrophobicContact CD1-CG 4.37Å; I142-F160 HydrophobicContact CG1-CB 4.3Å; I142-F160 HydrophobicContact CG1-CD1 4.32Å; I142-F160 HydrophobicContact CG1-CD2 3.65Å; I142-F160 HydrophobicContact CG1-CE2 3.94Å; I142-F160 HydrophobicContact CG1-CG 3.85Å; I142-F160 HydrophobicContact CG1-CZ 4.39Å
143	R	94.2	Very high	92.8	Very high	167 Å²	167	81.5 Å²	81.5	63%	0.63	41%	0.407	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140	166.3	-179.2	-62	-178.9	178.1	-136.2	-4.8	110.4	L145 E159	R143-L145 PolarHBondContact O-N 2.71Å; R143-E159 HydrophobicContact CB-CB 4.14Å; R143-E159 HydrophobicContact CB-CG 4.46Å; R143-E159 PolarHBondContact N-O 3.2Å; R143-E159 PolarHBondContact O-N 3.35Å
144	N	92.2	Very high	92.7	Very high	117 Å²	117	79.6 Å²	79.6	63%	0.626	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	53.9	28.8	170	-63.8	-42.4	0	0	0	114.8	R146 E159	N144-R146 PolarHBondContact O-N 2.78Å; N144-E159 HydrophobicContact CB-CB 4.39Å; N144-E159 PolarHBondContact ND2-OE2 2.9Å
145	L	94.1	Very high	92.6	Very high	40 Å²	40	76.4 Å²	76.4	21%	0.209	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	120.1	-173.3	175.3	63.9	0	0	0	111.9	F133 L136 K137 I142 R143 I156 K157 F158	F133-L145 HydrophobicContact CD2-CD1 4.01Å; F133-L145 HydrophobicContact CD2-CD2 4.42Å; F133-L145 HydrophobicContact CD2-CG 4.19Å; F133-L145 HydrophobicContact CE1-CD2 4.41Å; F133-L145 HydrophobicContact CE2-CD1 3.71Å; F133-L145 HydrophobicContact CE2-CD2 4.1Å; F133-L145 HydrophobicContact CE2-CG 3.56Å; F133-L145 HydrophobicContact CZ-CD1 4.44Å; F133-L145 HydrophobicContact CZ-CD2 4.09Å; F133-L145 HydrophobicContact CZ-CG 3.78Å; L136-L145 HydrophobicContact CB-CD1 4.33Å; L136-L145 HydrophobicContact CB-CD2 4.01Å; L136-L145 HydrophobicContact CD1-CD1 4.15Å; K137-L145 HydrophobicContact CB-CD2 3.74Å; I142-L145 HydrophobicContact CG2-CB 4.29Å; R143-L145 PolarHBondContact O-N 2.71Å; L145-I156 HydrophobicContact CD1-CG2 3.47Å; L145-I156 VanDerWaalsContact CD1-CG2 3.47Å; L145-K157 WeakPolarHBondContact CA-O 3.41Å; L145-F158 HydrophobicContact CB-CB 4.19Å; L145-F158 HydrophobicContact CD1-CB 3.81Å; L145-F158 HydrophobicContact CD1-CD1 4.37Å; L145-F158 HydrophobicContact CD1-CG 4.28Å
146	R	92.3	Very high	92.7	Very high	125 Å²	125	74.5 Å²	74.5	47%	0.472	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.4	139.7	-179.8	58.4	-174.3	166.1	168.8	-5.7	111.7	N144 K157	N144-R146 PolarHBondContact O-N 2.78Å; R146-K157 HydrophobicContact CG-CB 3.87Å; R146-K157 PolarHBondContact N-O 3.04Å; R146-K157 PolarHBondContact O-N 2.87Å
147	A	91.4	Very high	92.7	Very high	48 Å²	48	77.1 Å²	77.1	40%	0.397	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	143.6	174.9	0	0	0	0	0	111	F129 F133 I156	F129-A147 HydrophobicContact CD1-CB 3.87Å; F129-A147 HydrophobicContact CE1-CB 4.18Å; F133-A147 HydrophobicContact CD2-CB 3.98Å; F133-A147 HydrophobicContact CE2-CB 3.82Å; A147-I156 HydrophobicContact CB-CG1 4.41Å
148	V	89.3	Confident	92.8	Very high	60 Å²	60	71.9 Å²	71.9	36%	0.364	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	84.1	173.3	-165.7	0	0	0	0	108.7	A151 V155	V148-A151 HydrophobicContact CB-CB 4.43Å; V148-A151 HydrophobicContact CG1-CB 3.85Å; V148-V155 HydrophobicContact CB-CG1 4.11Å; V148-V155 HydrophobicContact CG2-CG1 4.49Å; V148-V155 PolarHBondContact N-O 3Å; V148-V155 PolarHBondContact O-N 3.13Å
149	E	91.1	Very high	93	Very high	78 Å²	78	67.3 Å²	67.3	36%	0.364	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-39.8	-177.4	-177.7	164.3	-166.6	0	0	112.8	F129 A151 P154 R195	F129-E149 HydrophobicContact CD2-CB 4.08Å; F129-E149 HydrophobicContact CD2-CG 3.9Å; F129-E149 HydrophobicContact CE2-CB 3.9Å; F129-E149 HydrophobicContact CE2-CG 3.7Å; F129-E149 HydrophobicContact CG-CB 4.47Å; F129-E149 HydrophobicContact CZ-CB 4.14Å; F129-E149 HydrophobicContact CZ-CG 4.38Å; E149-A151 PolarHBondContact O-N 2.96Å; E149-A151 VanDerWaalsContact O-N 3.1Å; E149-P154 WeakPolarHBondContact O-CB 3.39Å; E149-P154 WeakPolarHBondContact O-CG 3.45Å; E149-R195 IonicContact OE1-NH1 3Å; E149-R195 PolarHBondContact OE1-NH1 3.24Å
150	D	84.9	Confident	93.1	Very high	169 Å²	169	64.4 Å²	64.4	90%	0.904	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	3.2	-177.5	-67	-60.2	0	0	0	114.8
151	A	86.2	Confident	93.1	Very high	33 Å²	33	59.5 Å²	59.5	27%	0.273	30%	0.304	S	S	.	.	S	Bend	trans	-66.6	154.1	175.7	0	0	0	0	0	112.4	V148 E149 V153	V148-A151 HydrophobicContact CB-CB 4.43Å; V148-A151 HydrophobicContact CG1-CB 3.85Å; E149-A151 PolarHBondContact O-N 2.96Å; E149-A151 VanDerWaalsContact O-N 3.1Å; A151-V153 VanDerWaalsContact CB-O 3.23Å; A151-V153 WeakPolarHBondContact CB-O 3.04Å; A151-V153 CarbonylContact O-C 3.59Å; A151-V153 PolarHBondContact O-N 2.84Å; A151-V153 VanDerWaalsContact O-N 3.13Å
152	F	86	Confident	93.2	Very high	144 Å²	144	60.9 Å²	60.9	63%	0.632	32%	0.318	S	S	*	.	S	Bend	trans	-54.5	-34.9	177.1	178.7	-95.5	0	0	0	112.6	R198	F152-R198 HydrophobicContact CE1-CG 4.22Å; F152-R198 HydrophobicContact CZ-CG 4.41Å; F152-R198 WeakPolarHBondContact O-CD 3.48Å; F152-R198 PolarHBondContact O-NH1 2.84Å
153	V	92.3	Very high	93.1	Very high	42 Å²	42	60.2 Å²	60.2	26%	0.255	31%	0.314	S	S	.	.	S	Bend	trans	-118.5	115.1	159.1	-168.1	0	0	0	0	107	A151 V155 V168 R198 S199	A151-V153 VanDerWaalsContact CB-O 3.23Å; A151-V153 WeakPolarHBondContact CB-O 3.04Å; A151-V153 CarbonylContact O-C 3.59Å; A151-V153 PolarHBondContact O-N 2.84Å; A151-V153 VanDerWaalsContact O-N 3.13Å; V153-V155 PolarHBondContact O-N 2.97Å; V153-V168 HydrophobicContact CG1-CB 4.07Å; V153-V168 HydrophobicContact CG1-CG1 3.65Å; V153-R198 HydrophobicContact CG2-CB 4.05Å; V153-S199 WeakPolarHBondContact CG1-OG 3.49Å
154	P	94.6	Very high	93.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.309	C	S	.	.			trans	-65	131.4	179	-21.1	31.9	0	0	0	111.7	F129 E149 R195	F129-P154 HydrophobicContact CE2-CB 3.65Å; F129-P154 HydrophobicContact CZ-CB 3.52Å; E149-P154 WeakPolarHBondContact O-CB 3.39Å; E149-P154 WeakPolarHBondContact O-CG 3.45Å; P154-R195 HydrophobicContact CG-CB 4.17Å; P154-R195 HydrophobicContact CG-CG 4.23Å
155	V	96.6	Very high	93.6	Very high	11 Å²	11	52 Å²	52	7%	0.067	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	144.9	-169.6	63.7	0	0	0	0	112.3	V148 V153 K157 D166 V168	V148-V155 HydrophobicContact CB-CG1 4.11Å; V148-V155 HydrophobicContact CG2-CG1 4.49Å; V148-V155 PolarHBondContact N-O 3Å; V148-V155 PolarHBondContact O-N 3.13Å; V153-V155 PolarHBondContact O-N 2.97Å; V155-K157 HydrophobicContact CG1-CG 4.21Å; V155-K157 HydrophobicContact CG2-CG 4.09Å; V155-D166 HydrophobicContact CG2-CB 4.23Å; V155-V168 HydrophobicContact CB-CG1 3.85Å; V155-V168 HydrophobicContact CG2-CG1 3.88Å
156	I	97.5	Very high	93.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	126.7	160.5	-61.2	173.5	0	0	0	107	F128 F129 F133 L136 L145 A147 F158 L167	F128-I156 HydrophobicContact CD1-CD1 3.89Å; F128-I156 HydrophobicContact CD1-CG1 4.34Å; F128-I156 HydrophobicContact CD2-CD1 4.47Å; F128-I156 HydrophobicContact CE1-CB 4.42Å; F128-I156 HydrophobicContact CE1-CD1 3.48Å; F128-I156 VanDerWaalsContact CE1-CD1 3.48Å; F128-I156 HydrophobicContact CE1-CG1 3.61Å; F128-I156 HydrophobicContact CE2-CD1 4.1Å; F128-I156 HydrophobicContact CG-CD1 4.38Å; F128-I156 HydrophobicContact CZ-CB 4.31Å; F128-I156 HydrophobicContact CZ-CD1 3.59Å; F128-I156 HydrophobicContact CZ-CG1 3.9Å; F129-I156 HydrophobicContact CD1-CD1 4.03Å; F129-I156 HydrophobicContact CD1-CG1 3.72Å; F129-I156 HydrophobicContact CE1-CD1 4.29Å; F129-I156 HydrophobicContact CE1-CG1 3.56Å; F133-I156 HydrophobicContact CB-CD1 4.28Å; F133-I156 HydrophobicContact CD2-CD1 4.12Å; F133-I156 HydrophobicContact CD2-CG1 4.36Å; F133-I156 HydrophobicContact CD2-CG2 4.08Å; F133-I156 HydrophobicContact CE2-CG2 4.37Å; L136-I156 HydrophobicContact CD1-CG2 4.15Å; L145-I156 HydrophobicContact CD1-CG2 3.47Å; L145-I156 VanDerWaalsContact CD1-CG2 3.47Å; A147-I156 HydrophobicContact CB-CG1 4.41Å; I156-F158 HydrophobicContact CG2-CD1 4.07Å; I156-L167 PolarHBondContact N-O 2.94Å; I156-L167 PolarHBondContact O-N 2.98Å
157	K	96.8	Very high	94	Very high	56 Å²	56	45.7 Å²	45.7	24%	0.243	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.4	177.6	-57	179.5	151.4	-81.9	0	109	L145 R146 V155 I165 D166	L145-K157 WeakPolarHBondContact CA-O 3.41Å; R146-K157 HydrophobicContact CG-CB 3.87Å; R146-K157 PolarHBondContact N-O 3.04Å; R146-K157 PolarHBondContact O-N 2.87Å; V155-K157 HydrophobicContact CG1-CG 4.21Å; V155-K157 HydrophobicContact CG2-CG 4.09Å; K157-I165 WeakPolarHBondContact CA-O 3.21Å; K157-D166 WeakPolarHBondContact CE-OD2 3.23Å; K157-D166 WeakPolarHBondContact CG-OD1 3.18Å; K157-D166 IonicContact NZ-OD1 3.24Å; K157-D166 PolarHBondContact NZ-OD1 2.83Å; K157-D166 IonicContact NZ-OD2 2.66Å; K157-D166 PolarHBondContact NZ-OD2 2.7Å
158	F	96.9	Very high	94.3	Very high	7 Å²	7	43.9 Å²	43.9	3%	0.031	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-158.5	166.4	178.1	58.9	-75.4	0	0	0	110.7	L67 L136 I142 L145 I156 F160 I165 L167	L67-F158 HydrophobicContact CD1-CE2 4.03Å; L67-F158 HydrophobicContact CD1-CZ 3.63Å; L67-F158 HydrophobicContact CD2-CZ 3.82Å; L67-F158 HydrophobicContact CG-CZ 4.39Å; L136-F158 HydrophobicContact CD1-CD1 4.48Å; L136-F158 HydrophobicContact CD1-CE1 4.24Å; L136-F158 HydrophobicContact CD2-CE2 4.49Å; L136-F158 HydrophobicContact CD2-CZ 4.38Å; I142-F158 HydrophobicContact CD1-CD2 4.04Å; I142-F158 HydrophobicContact CD1-CE2 3.98Å; I142-F158 HydrophobicContact CG1-CD2 4.27Å; I142-F158 HydrophobicContact CG2-CB 4.26Å; I142-F158 HydrophobicContact CG2-CD2 4.05Å; I142-F158 HydrophobicContact CG2-CG 4.5Å; L145-F158 HydrophobicContact CB-CB 4.19Å; L145-F158 HydrophobicContact CD1-CB 3.81Å; L145-F158 HydrophobicContact CD1-CD1 4.37Å; L145-F158 HydrophobicContact CD1-CG 4.28Å; I156-F158 HydrophobicContact CG2-CD1 4.07Å; F158-F160 HydrophobicContact CD2-CB 4.06Å; F158-F160 HydrophobicContact CE2-CB 3.9Å; F158-F160 HydrophobicContact CE2-CD1 4.1Å; F158-F160 HydrophobicContact CE2-CG 4.34Å; F158-I165 HydrophobicContact CD1-CB 4.5Å; F158-I165 HydrophobicContact CE1-CB 4.11Å; F158-I165 HydrophobicContact CE1-CG2 4.01Å; F158-I165 HydrophobicContact CE2-CB 4.24Å; F158-I165 HydrophobicContact CE2-CD1 4Å; F158-I165 HydrophobicContact CZ-CB 3.96Å; F158-I165 HydrophobicContact CZ-CD1 4.16Å; F158-I165 HydrophobicContact CZ-CG2 3.89Å; F158-I165 PolarHBondContact N-O 2.89Å; F158-I165 VanDerWaalsContact N-O 3.16Å; F158-I165 PolarHBondContact O-N 2.86Å; F158-L167 HydrophobicContact CE1-CB 3.91Å; F158-L167 HydrophobicContact CE1-CD2 4.29Å
159	E	97.4	Very high	94.7	Very high	46 Å²	46	41 Å²	41	22%	0.215	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	135.8	167.7	177.7	-163.3	142.9	0	0	107.8	I142 R143 N144 I163	I142-E159 CarbonylContact C-O 3.48Å; I142-E159 WeakPolarHBondContact CA-O 3.34Å; R143-E159 HydrophobicContact CB-CB 4.14Å; R143-E159 HydrophobicContact CB-CG 4.46Å; R143-E159 PolarHBondContact N-O 3.2Å; R143-E159 PolarHBondContact O-N 3.35Å; N144-E159 HydrophobicContact CB-CB 4.39Å; N144-E159 PolarHBondContact ND2-OE2 2.9Å; E159-I163 CarbonylContact C-O 3.54Å; E159-I163 VanDerWaalsContact CA-O 3.31Å; E159-I163 WeakPolarHBondContact CA-O 3.24Å
160	F	97.1	Very high	95	Very high	3 Å²	3	37.3 Å²	37.3	1%	0.013	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	117.7	175.7	-165.5	-179.1	0	0	0	108.9	V63 K66 L67 L70 D140 G141 I142 F158 G162 I163 I165	V63-F160 HydrophobicContact CG1-CB 3.87Å; V63-F160 HydrophobicContact CG1-CD1 3.67Å; V63-F160 HydrophobicContact CG1-CE1 4.42Å; V63-F160 HydrophobicContact CG1-CG 3.81Å; K66-F160 HydrophobicContact CB-CE1 3.87Å; K66-F160 HydrophobicContact CB-CZ 3.79Å; K66-F160 HydrophobicContact CD-CE1 4.45Å; K66-F160 HydrophobicContact CD-CE2 4.07Å; K66-F160 HydrophobicContact CD-CZ 3.74Å; K66-F160 HydrophobicContact CG-CZ 4.44Å; L67-F160 HydrophobicContact CB-CD1 4.36Å; L67-F160 HydrophobicContact CB-CE1 4.14Å; L67-F160 HydrophobicContact CD1-CD1 4.29Å; L67-F160 HydrophobicContact CD1-CE1 4.24Å; L70-F160 HydrophobicContact CD1-CE1 4.13Å; L70-F160 HydrophobicContact CD1-CZ 4.2Å; D140-F160 WeakPolarHBondContact O-CE2 3.22Å; G141-F160 WeakPolarHBondContact O-CA 3.43Å; I142-F160 HydrophobicContact CD1-CD1 4.36Å; I142-F160 HydrophobicContact CD1-CD2 4.48Å; I142-F160 HydrophobicContact CD1-CE1 4.45Å; I142-F160 HydrophobicContact CD1-CG 4.37Å; I142-F160 HydrophobicContact CG1-CB 4.3Å; I142-F160 HydrophobicContact CG1-CD1 4.32Å; I142-F160 HydrophobicContact CG1-CD2 3.65Å; I142-F160 HydrophobicContact CG1-CE2 3.94Å; I142-F160 HydrophobicContact CG1-CG 3.85Å; I142-F160 HydrophobicContact CG1-CZ 4.39Å; F158-F160 HydrophobicContact CD2-CB 4.06Å; F158-F160 HydrophobicContact CE2-CB 3.9Å; F158-F160 HydrophobicContact CE2-CD1 4.1Å; F158-F160 HydrophobicContact CE2-CG 4.34Å; F160-G162 PolarHBondContact O-N 2.93Å; F160-I163 PolarHBondContact N-O 3.06Å; F160-I163 PolarHBondContact O-N 3.26Å; F160-I165 HydrophobicContact CB-CD1 3.94Å; F160-I165 HydrophobicContact CD1-CD1 4.36Å
161	D	95.6	Very high	95.5	Very high	49 Å²	49	33.2 Å²	33.2	26%	0.262	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.9	39	-173.6	-57.2	-32.6	0	0	0	113.5	H59 V63 K66 G141	H59-D161 PolarHBondContact NE2-O 3.04Å; V63-D161 HydrophobicContact CG2-CB 3.9Å; K66-D161 IonicContact NZ-OD1 3.7Å; K66-D161 IonicContact NZ-OD2 3.19Å; K66-D161 PolarHBondContact NZ-OD2 3.43Å; G141-D161 WeakPolarHBondContact CA-OD1 3.18Å; G141-D161 PolarHBondContact O-N 3.31Å
162	G	94.1	Very high	95.9	Very high	56 Å²	56	31.8 Å²	31.8	58%	0.577	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.4	4.2	-179.2	0	0	0	0	0	116	F160	F160-G162 PolarHBondContact O-N 2.93Å
163	I	95.4	Very high	96.3	Very high	13 Å²	13	27.4 Å²	27.4	7%	0.067	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	125.2	177.1	-68.2	157.4	0	0	0	110.4	H59 R60 V63 I113 E159 F160 I165	H59-I163 VanDerWaalsContact CD2-CD1 3.42Å; H59-I163 WeakPolarHBondContact CD2-CD1 3.41Å; R60-I163 HydrophobicContact CB-CD1 4.28Å; R60-I163 HydrophobicContact CG-CD1 3.64Å; R60-I163 HydrophobicContact CG-CG1 4.32Å; V63-I163 HydrophobicContact CB-CD1 4.27Å; V63-I163 HydrophobicContact CG2-CD1 3.95Å; I113-I163 HydrophobicContact CD1-CG2 3.68Å; I113-I163 HydrophobicContact CG1-CG2 3.89Å; E159-I163 CarbonylContact C-O 3.54Å; E159-I163 VanDerWaalsContact CA-O 3.31Å; E159-I163 WeakPolarHBondContact CA-O 3.24Å; F160-I163 PolarHBondContact N-O 3.06Å; F160-I163 PolarHBondContact O-N 3.26Å; I163-I165 HydrophobicContact CG2-CG1 4.25Å
164	E	97.3	Very high	96.2	Very high	111 Å²	111	27.7 Å²	27.7	52%	0.519	15%	0.154	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	132.5	171	-65	-165.9	132.5	0	0	111.9	D112 I113	D112-E164 HydrophobicContact CB-CB 4.46Å; I113-E164 PolarHBondContact N-O 3.31Å
165	I	97.8	Very high	96.1	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.7	-179.1	-55.6	-176.5	0	0	0	110	V63 L67 I113 A115 K157 F158 F160 I163 L167	V63-I165 HydrophobicContact CG1-CD1 3.83Å; L67-I165 HydrophobicContact CD2-CD1 4.01Å; L67-I165 HydrophobicContact CD2-CG2 4.09Å; I113-I165 HydrophobicContact CB-CG1 4.5Å; A115-I165 HydrophobicContact CB-CG2 4.09Å; K157-I165 WeakPolarHBondContact CA-O 3.21Å; F158-I165 HydrophobicContact CD1-CB 4.5Å; F158-I165 HydrophobicContact CE1-CB 4.11Å; F158-I165 HydrophobicContact CE1-CG2 4.01Å; F158-I165 HydrophobicContact CE2-CB 4.24Å; F158-I165 HydrophobicContact CE2-CD1 4Å; F158-I165 HydrophobicContact CZ-CB 3.96Å; F158-I165 HydrophobicContact CZ-CD1 4.16Å; F158-I165 HydrophobicContact CZ-CG2 3.89Å; F158-I165 PolarHBondContact N-O 2.89Å; F158-I165 VanDerWaalsContact N-O 3.16Å; F158-I165 PolarHBondContact O-N 2.86Å; F160-I165 HydrophobicContact CB-CD1 3.94Å; F160-I165 HydrophobicContact CD1-CD1 4.36Å; I163-I165 HydrophobicContact CG2-CG1 4.25Å; I165-L167 HydrophobicContact CG2-CB 4.38Å
166	D	97.8	Very high	95.9	Very high	34 Å²	34	37.6 Å²	37.6	18%	0.182	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	95.1	171.3	-98.9	36.9	0	0	0	108.9	I113 A115 V155 K157	I113-D166 PolarHBondContact O-N 2.76Å; A115-D166 PolarHBondContact N-O 2.85Å; A115-D166 VanDerWaalsContact O-O 3.09Å; V155-D166 HydrophobicContact CG2-CB 4.23Å; K157-D166 WeakPolarHBondContact CE-OD2 3.23Å; K157-D166 WeakPolarHBondContact CG-OD1 3.18Å; K157-D166 IonicContact NZ-OD1 3.24Å; K157-D166 PolarHBondContact NZ-OD1 2.83Å; K157-D166 IonicContact NZ-OD2 2.66Å; K157-D166 PolarHBondContact NZ-OD2 2.7Å
167	L	98.2	Very high	95.7	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	108	-176.7	-170.9	67.4	0	0	0	111.5	A115 C117 F128 F132 I156 F158 I165	A115-L167 HydrophobicContact CB-CD1 3.66Å; A115-L167 CarbonylContact O-C 3.56Å; A115-L167 WeakPolarHBondContact O-CA 3.43Å; C117-L167 HydrophobicContact CB-CD1 4.11Å; C117-L167 HydrophobicContact CB-CG 4.4Å; F128-L167 HydrophobicContact CE2-CD2 3.92Å; F128-L167 HydrophobicContact CE2-CG 4.19Å; F128-L167 HydrophobicContact CZ-CD2 4.13Å; F128-L167 HydrophobicContact CZ-CG 4.04Å; F132-L167 HydrophobicContact CD1-CD2 4.37Å; F132-L167 HydrophobicContact CE1-CD2 3.56Å; F132-L167 HydrophobicContact CZ-CD2 4.42Å; I156-L167 PolarHBondContact N-O 2.94Å; I156-L167 PolarHBondContact O-N 2.98Å; F158-L167 HydrophobicContact CE1-CB 3.91Å; F158-L167 HydrophobicContact CE1-CD2 4.29Å; I165-L167 HydrophobicContact CG2-CB 4.38Å
168	V	97.9	Very high	95.4	Very high	9 Å²	9	38.5 Å²	38.5	6%	0.055	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	158.1	171.4	-64.9	0	0	0	0	111.1	F99 A115 L116 C117 V153 V155	F99-V168 HydrophobicContact CE1-CG2 3.68Å; F99-V168 HydrophobicContact CZ-CG2 3.85Å; A115-V168 VanDerWaalsContact O-CG2 3.32Å; A115-V168 WeakPolarHBondContact O-CG2 3.45Å; A115-V168 PolarHBondContact O-N 2.92Å; L116-V168 WeakPolarHBondContact CA-O 3.35Å; L116-V168 HydrophobicContact CB-CG2 4.21Å; L116-V168 HydrophobicContact CD1-CG2 3.77Å; C117-V168 PolarHBondContact N-O 3.03Å; V153-V168 HydrophobicContact CG1-CB 4.07Å; V153-V168 HydrophobicContact CG1-CG1 3.65Å; V155-V168 HydrophobicContact CB-CG1 3.85Å; V155-V168 HydrophobicContact CG2-CG1 3.88Å
169	F	98	Very high	95	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	136.7	-176.3	176.3	-99.3	0	0	0	113.3	W74 C117 A119 V123 R125 F128 R171 S199	W74-F169 HydrophobicContact CH2-CD2 4.37Å; W74-F169 AromaticContact CH2-CE2 3.79Å; W74-F169 HydrophobicContact CH2-CE2 3.79Å; W74-F169 HydrophobicContact CZ3-CE2 4.17Å; C117-F169 HydrophobicContact CB-CD2 4.25Å; A119-F169 HydrophobicContact CB-CE2 3.53Å; A119-F169 HydrophobicContact CB-CZ 3.93Å; V123-F169 HydrophobicContact CG1-CE2 4.22Å; V123-F169 HydrophobicContact CG1-CZ 4.12Å; R125-F169 HydrophobicContact CB-CD1 4.19Å; R125-F169 HydrophobicContact CB-CE1 4.19Å; R125-F169 HydrophobicContact CG-CD1 4.33Å; R125-F169 PolarHBondContact NH1-O 2.88Å; R125-F169 PolarHBondContact NH2-O 3.12Å; F128-F169 HydrophobicContact CB-CB 4.35Å; F128-F169 HydrophobicContact CB-CD1 4.27Å; F128-F169 HydrophobicContact CB-CD2 3.84Å; F128-F169 HydrophobicContact CB-CE2 4.14Å; F128-F169 HydrophobicContact CB-CG 3.9Å; F128-F169 HydrophobicContact CB-CZ 4.49Å; F128-F169 HydrophobicContact CD1-CB 3.51Å; F128-F169 HydrophobicContact CD1-CD2 4.45Å; F128-F169 HydrophobicContact CD1-CG 4.02Å; F128-F169 HydrophobicContact CD2-CB 3.89Å; F128-F169 AromaticContact CD2-CD2 3.58Å; F128-F169 HydrophobicContact CD2-CD2 3.58Å; F128-F169 HydrophobicContact CD2-CE2 4.4Å; F128-F169 AromaticContact CD2-CG 3.98Å; F128-F169 HydrophobicContact CD2-CG 3.98Å; F128-F169 HydrophobicContact CE1-CB 3.6Å; F128-F169 HydrophobicContact CE2-CB 3.99Å; F128-F169 HydrophobicContact CE2-CD2 4.23Å; F128-F169 HydrophobicContact CG-CB 3.65Å; F128-F169 HydrophobicContact CG-CD1 4.47Å; F128-F169 AromaticContact CG-CD2 3.71Å; F128-F169 HydrophobicContact CG-CD2 3.71Å; F128-F169 HydrophobicContact CG-CE2 4.47Å; F128-F169 AromaticContact CG-CG 3.7Å; F128-F169 HydrophobicContact CG-CG 3.7Å; F128-F169 HydrophobicContact CZ-CB 3.85Å; F169-R171 HydrophobicContact CE1-CB 3.98Å; F169-R171 HydrophobicContact CZ-CB 4.13Å; F169-S199 WeakPolarHBondContact O-CB 3.25Å; F169-S199 PolarHBondContact O-OG 3.32Å
170	A	97.2	Very high	94.6	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.1	166.8	0	0	0	0	0	112.5	L116 C117 V118 A119 C196 L200	L116-A170 HydrophobicContact CD1-CB 3.85Å; C117-A170 PolarHBondContact O-N 2.77Å; V118-A170 WeakPolarHBondContact CA-O 3.04Å; A119-A170 PolarHBondContact N-O 3.32Å; A170-C196 HydrophobicContact CB-CB 4.35Å; A170-L200 HydrophobicContact CB-CD1 4.17Å; A170-L200 HydrophobicContact CB-CD2 4.03Å; A170-L200 HydrophobicContact CB-CG 3.69Å
171	R	95.6	Very high	94.2	Very high	83 Å²	83	48 Å²	48	31%	0.313	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.1	167	179.2	172.1	93.4	168.7	-25.4	110	A119 R121 V123 E124 F169 L192	A119-R171 WeakPolarHBondContact O-CA 3.18Å; R121-R171 VanDerWaalsContact O-CD 3.27Å; R121-R171 WeakPolarHBondContact O-CD 3.31Å; R121-R171 PolarHBondContact O-NH1 3.46Å; V123-R171 WeakPolarHBondContact O-CD 3.42Å; V123-R171 WeakPolarHBondContact O-CG 3.25Å; E124-R171 IonicContact OE1-CZ 3.65Å; E124-R171 IonicContact OE1-NH1 3.71Å; E124-R171 PolarHBondContact OE1-NH1 2.65Å; E124-R171 IonicContact OE1-NH2 2.69Å; E124-R171 PolarHBondContact OE1-NH2 3.27Å; F169-R171 HydrophobicContact CE1-CB 3.98Å; F169-R171 HydrophobicContact CZ-CB 4.13Å; R171-L192 WeakPolarHBondContact O-CD2 3.4Å
172	L	94.8	Very high	93.9	Very high	3 Å²	3	48.7 Å²	48.7	2%	0.016	27%	0.274	C	S	.	.			trans	-98.3	155.2	173.7	-65.9	-177	0	0	0	112.1	V118 A119 R121 I174 I177 L181 L183 R188 L192 L200	V118-L172 HydrophobicContact CG1-CD1 3.55Å; V118-L172 HydrophobicContact CG1-CG 3.9Å; A119-L172 PolarHBondContact O-N 3.06Å; R121-L172 VanDerWaalsContact CA-O 3.28Å; R121-L172 WeakPolarHBondContact CA-O 3.41Å; R121-L172 WeakPolarHBondContact CB-O 3.42Å; R121-L172 PolarHBondContact N-O 3.41Å; L172-I174 HydrophobicContact CB-CD1 4.27Å; L172-I174 HydrophobicContact CB-CG1 3.9Å; L172-I174 HydrophobicContact CD1-CD1 4.15Å; L172-I174 PolarHBondContact O-N 3.17Å; L172-I177 HydrophobicContact CB-CD1 4.44Å; L172-I177 HydrophobicContact CD1-CD1 4.28Å; L172-L181 HydrophobicContact CD1-CD2 3.69Å; L172-L183 HydrophobicContact CD1-CD2 4.27Å; L172-R188 HydrophobicContact CD2-CB 4.45Å; L172-L192 HydrophobicContact CD2-CD1 4.01Å; L172-L200 HydrophobicContact CD2-CD1 3.77Å; L172-L200 HydrophobicContact CD2-CD2 4.11Å
173	A	92.5	Very high	93.8	Very high	53 Å²	53	46.5 Å²	46.5	44%	0.438	25%	0.248	S	C	.	.	S	Bend	trans	-78.6	32.6	-178.8	0	0	0	0	0	114.3	L192	A173-L192 HydrophobicContact CB-CD2 4.24Å
174	I	91.7	Very high	93.4	Very high	47 Å²	47	49.8 Å²	49.8	24%	0.241	26%	0.26	C	S	.	.	S	Bend	trans	-126.9	154.6	-176.3	58.9	-176.3	0	0	0	111.3	P120 R121 L172 T176 I177	P120-I174 WeakPolarHBondContact CA-O 3.43Å; P120-I174 WeakPolarHBondContact CB-O 3.29Å; R121-I174 WeakPolarHBondContact CB-O 3.32Å; R121-I174 PolarHBondContact N-O 3.36Å; L172-I174 HydrophobicContact CB-CD1 4.27Å; L172-I174 HydrophobicContact CB-CG1 3.9Å; L172-I174 HydrophobicContact CD1-CD1 4.15Å; L172-I174 PolarHBondContact O-N 3.17Å; I174-T176 WeakPolarHBondContact CD1-O 3.49Å; I174-I177 HydrophobicContact CD1-CD1 3.78Å; I174-I177 HydrophobicContact CG1-CD1 3.84Å
175	Q	91.1	Very high	92.8	Very high	158 Å²	158	47.5 Å²	47.5	74%	0.738	25%	0.251	S	S	*	.	S	Bend	trans	-77.8	-31.9	-175.2	-72.2	176.7	-24.4	0	0	113.7	P120	P120-Q175 VanDerWaalsContact CB-O 3.24Å; P120-Q175 WeakPolarHBondContact CB-O 3.15Å
176	T	92.9	Very high	92.3	Very high	62 Å²	62	49.3 Å²	49.3	38%	0.38	26%	0.261	S	S	.	.			trans	-134	152.1	-178.2	62.1	0	0	0	0	110.9	T91 V92 I174	T91-T176 WeakPolarHBondContact O-CB 3.25Å; T91-T176 WeakPolarHBondContact O-CG2 3.49Å; V92-T176 CarbonylContact O-C 3.42Å; V92-T176 WeakPolarHBondContact O-CA 3.42Å; I174-T176 WeakPolarHBondContact CD1-O 3.49Å
177	I	94.4	Very high	91.8	Very high	5 Å²	5	50.1 Å²	50.1	3%	0.026	27%	0.269	C	S	.	.	B	Isolated β-bridge	trans	-113.6	104.4	-179.7	-56.7	-58.1	0	0	0	109.1	V92 K95 V118 P120 L172 I174 L181	V92-I177 PolarHBondContact O-N 3.09Å; K95-I177 HydrophobicContact CB-CG2 4.1Å; V118-I177 HydrophobicContact CG1-CD1 4.13Å; V118-I177 HydrophobicContact CG1-CG2 4.38Å; P120-I177 HydrophobicContact CB-CD1 4.46Å; P120-I177 HydrophobicContact CB-CG1 4.2Å; L172-I177 HydrophobicContact CB-CD1 4.44Å; L172-I177 HydrophobicContact CD1-CD1 4.28Å; I174-I177 HydrophobicContact CD1-CD1 3.78Å; I174-I177 HydrophobicContact CG1-CD1 3.84Å; I177-L181 HydrophobicContact CG2-CD2 4.06Å
178	S	90.8	Very high	91.2	Very high	70 Å²	70	54 Å²	54	49%	0.49	28%	0.284	S	S	.	.			trans	-71.4	142.3	175.8	-178.2	0	0	0	0	111.9	N180 L181	S178-N180 PolarHBondContact O-N 3.4Å; S178-N180 VanDerWaalsContact O-N 3.14Å; S178-N180 PolarHBondContact OG-N 3.19Å; S178-L181 WeakPolarHBondContact O-CB 3.32Å; S178-L181 PolarHBondContact O-N 2.94Å
179	D	87.4	Confident	90.8	Very high	81 Å²	81	53.8 Å²	53.8	43%	0.433	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-22.4	171.8	-75.6	-55.1	0	0	0	113.2	K72 K95	K72-D179 WeakPolarHBondContact CE-OD1 3.24Å; K72-D179 IonicContact NZ-OD1 2.66Å; K72-D179 PolarHBondContact NZ-OD1 2.84Å; K72-D179 IonicContact NZ-OD2 3.37Å; K72-D179 PolarHBondContact NZ-OD2 3.4Å; K95-D179 PolarHBondContact NZ-O 2.71Å
180	N	88.8	Confident	90.3	Very high	156 Å²	156	60 Å²	60	83%	0.834	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	13.7	176.6	-69	-30.1	0	0	0	114.1	S178 D182	S178-N180 PolarHBondContact O-N 3.4Å; S178-N180 VanDerWaalsContact O-N 3.14Å; S178-N180 PolarHBondContact OG-N 3.19Å; N180-D182 PolarHBondContact O-N 2.66Å
181	L	89.8	Confident	89.7	Confident	17 Å²	17	66.2 Å²	66.2	9%	0.089	35%	0.349	C	S	.	.			trans	-62.9	124.2	179.4	174.6	65.7	0	0	0	112.5	F97 V118 L172 I177 S178 L183	F97-L181 WeakPolarHBondContact CE1-O 3.37Å; F97-L181 HydrophobicContact CE2-CD2 4.49Å; F97-L181 HydrophobicContact CZ-CB 4.23Å; F97-L181 HydrophobicContact CZ-CD2 4.29Å; F97-L181 HydrophobicContact CZ-CG 4.28Å; F97-L181 WeakPolarHBondContact CZ-O 3.49Å; V118-L181 HydrophobicContact CG1-CD2 4Å; L172-L181 HydrophobicContact CD1-CD2 3.69Å; I177-L181 HydrophobicContact CG2-CD2 4.06Å; S178-L181 WeakPolarHBondContact O-CB 3.32Å; S178-L181 PolarHBondContact O-N 2.94Å; L181-L183 HydrophobicContact CD2-CD2 3.8Å; L181-L183 HydrophobicContact CG-CD2 4Å
182	D	88.9	Confident	89.4	Confident	65 Å²	65	63.6 Å²	63.6	35%	0.348	34%	0.341	S	S	.	.			trans	-93.3	134.8	164.8	-167.8	-21.4	0	0	0	110	N180 R184	N180-D182 PolarHBondContact O-N 2.66Å; D182-R184 WeakPolarHBondContact OD1-CB 3.06Å; D182-R184 WeakPolarHBondContact OD1-CG 3.26Å; D182-R184 PolarHBondContact OD1-N 3.14Å; D182-R184 IonicContact OD1-NE 3.86Å; D182-R184 PolarHBondContact OD1-NE 2.88Å; D182-R184 VanDerWaalsContact OD1-NE 3.16Å; D182-R184 IonicContact OD2-CZ 2.78Å; D182-R184 VanDerWaalsContact OD2-CZ 3.25Å; D182-R184 IonicContact OD2-NE 3.24Å; D182-R184 PolarHBondContact OD2-NE 3.41Å; D182-R184 IonicContact OD2-NH2 3.9Å; D182-R184 PolarHBondContact OD2-NH2 2.79Å
183	L	91.6	Very high	89.2	Confident	9 Å²	9	66.7 Å²	66.7	5%	0.047	36%	0.358	C	S	.	.	S	Bend	trans	-95.7	-8.9	-178.7	-60.1	179.3	0	0	0	113.4	F97 L116 V118 L172 L181 D185 L200 C203 R204	F97-L183 HydrophobicContact CB-CD1 4.23Å; F97-L183 HydrophobicContact CD1-CD1 3.7Å; F97-L183 HydrophobicContact CD1-CG 4.2Å; F97-L183 HydrophobicContact CD2-CD1 3.91Å; F97-L183 HydrophobicContact CE1-CD1 3.9Å; F97-L183 HydrophobicContact CE1-CG 3.89Å; F97-L183 HydrophobicContact CE2-CD1 4.11Å; F97-L183 HydrophobicContact CE2-CD2 4.37Å; F97-L183 HydrophobicContact CE2-CG 4.37Å; F97-L183 HydrophobicContact CG-CD1 3.7Å; F97-L183 HydrophobicContact CZ-CD1 4.09Å; F97-L183 HydrophobicContact CZ-CD2 4.2Å; F97-L183 HydrophobicContact CZ-CG 3.98Å; L116-L183 HydrophobicContact CD2-CD1 3.97Å; V118-L183 HydrophobicContact CG2-CD1 4.23Å; V118-L183 HydrophobicContact CG2-CD2 4.36Å; L172-L183 HydrophobicContact CD1-CD2 4.27Å; L181-L183 HydrophobicContact CD2-CD2 3.8Å; L181-L183 HydrophobicContact CG-CD2 4Å; L183-D185 VanDerWaalsContact C-N 3.33Å; L183-L200 HydrophobicContact CD1-CD2 4.26Å; L183-L200 HydrophobicContact CD2-CD2 4.04Å; L183-C203 HydrophobicContact CD1-CB 3.9Å; L183-R204 HydrophobicContact CB-CG 4.3Å; L183-R204 WeakPolarHBondContact O-CD 3.1Å; L183-R204 VanDerWaalsContact O-CG 3.23Å; L183-R204 WeakPolarHBondContact O-CG 3.45Å; L183-R204 PolarHBondContact O-NH1 2.96Å
184	R	86.5	Confident	89	Confident	82 Å²	82	67.5 Å²	67.5	31%	0.309	35%	0.354	S	S	.	.			trans	-71.9	-24.8	-177.7	-64.4	176.9	-64	167.2	-1.6	113.7	D182 D186 R204 E208 H211	D182-R184 WeakPolarHBondContact OD1-CB 3.06Å; D182-R184 WeakPolarHBondContact OD1-CG 3.26Å; D182-R184 PolarHBondContact OD1-N 3.14Å; D182-R184 IonicContact OD1-NE 3.86Å; D182-R184 PolarHBondContact OD1-NE 2.88Å; D182-R184 VanDerWaalsContact OD1-NE 3.16Å; D182-R184 IonicContact OD2-CZ 2.78Å; D182-R184 VanDerWaalsContact OD2-CZ 3.25Å; D182-R184 IonicContact OD2-NE 3.24Å; D182-R184 PolarHBondContact OD2-NE 3.41Å; D182-R184 IonicContact OD2-NH2 3.9Å; D182-R184 PolarHBondContact OD2-NH2 2.79Å; R184-D186 PolarHBondContact O-N 3.33Å; R184-D186 VanDerWaalsContact O-N 3.15Å; R184-R204 PolarHBondContact O-NH1 3.06Å; R184-E208 WeakPolarHBondContact CD-OE1 3.27Å; R184-H211 PolarHBondContact NH1-CD2 2.84Å; R184-H211 PolarHBondContact NH1-CE1 3.03Å; R184-H211 VanDerWaalsContact NH1-CE1 3.25Å; R184-H211 PolarHBondContact NH1-ND1 3.23Å; R184-H211 PolarHBondContact NH1-NE2 3.01Å
185	D	86.3	Confident	89	Confident	63 Å²	63	69.4 Å²	69.4	34%	0.337	36%	0.358	S	S	.	.			trans	-58.3	113.3	175.1	166.6	24.5	0	0	0	111.5	L183 S187 R188 R204	L183-D185 VanDerWaalsContact C-N 3.33Å; D185-S187 PolarHBondContact O-N 2.98Å; D185-S187 WeakPolarHBondContact OD1-CB 3.5Å; D185-S187 PolarHBondContact OD1-N 2.9Å; D185-S187 PolarHBondContact OD1-OG 2.69Å; D185-S187 PolarHBondContact OD2-OG 3.25Å; D185-R188 HydrophobicContact CB-CG 4.04Å; D185-R188 VanDerWaalsContact O-CB 3.31Å; D185-R188 WeakPolarHBondContact O-CB 3.48Å; D185-R188 VanDerWaalsContact O-CG 3.29Å; D185-R188 WeakPolarHBondContact O-CG 3.38Å; D185-R188 PolarHBondContact O-N 3.37Å; D185-R188 VanDerWaalsContact O-N 3.08Å; D185-R188 IonicContact OD2-CZ 3.31Å; D185-R188 IonicContact OD2-NE 2.84Å; D185-R188 PolarHBondContact OD2-NE 3.07Å; D185-R188 IonicContact OD2-NH2 2.69Å; D185-R204 PolarHBondContact O-NH1 3.42Å
186	D	86.6	Confident	89.1	Confident	38 Å²	38	62.2 Å²	62.2	20%	0.203	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-57.5	-26.2	177.2	-96.1	32.9	0	0	0	113.5	R184 R188 L189 R204 S292 Y319	R184-D186 PolarHBondContact O-N 3.33Å; R184-D186 VanDerWaalsContact O-N 3.15Å; D186-R188 PolarHBondContact O-N 2.76Å; D186-R188 VanDerWaalsContact O-N 3.12Å; D186-L189 PolarHBondContact O-N 2.84Å; D186-R204 IonicContact OD1-CZ 3.73Å; D186-R204 IonicContact OD1-NH1 3.06Å; D186-R204 IonicContact OD1-NH2 3.36Å; D186-R204 PolarHBondContact OD1-NH2 2.77Å; D186-S292 WeakPolarHBondContact OD2-CB 3.36Å; D186-S292 PolarHBondContact OD2-OG 3.43Å; D186-Y319 WeakPolarHBondContact OD2-CB 3.47Å; D186-Y319 WeakPolarHBondContact OD2-CD1 3.44Å
187	S	86.3	Confident	89.1	Confident	51 Å²	51	59.5 Å²	59.5	36%	0.357	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-59.3	-26.8	176.7	92.6	0	0	0	0	112.1	D185 L189 R190	D185-S187 PolarHBondContact O-N 2.98Å; D185-S187 WeakPolarHBondContact OD1-CB 3.5Å; D185-S187 PolarHBondContact OD1-N 2.9Å; D185-S187 PolarHBondContact OD1-OG 2.69Å; D185-S187 PolarHBondContact OD2-OG 3.25Å; S187-L189 PolarHBondContact O-N 3.25Å; S187-R190 VanDerWaalsContact O-CB 3.31Å; S187-R190 WeakPolarHBondContact O-CB 3.37Å; S187-R190 WeakPolarHBondContact O-CG 3.43Å; S187-R190 PolarHBondContact O-N 3.37Å
188	R	86.8	Confident	89	Confident	82 Å²	82	63.2 Å²	63.2	31%	0.309	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-68.5	-19	178.1	-53	-56.5	169.1	154.8	3.6	113.6	L172 D185 D186 R190 L192	L172-R188 HydrophobicContact CD2-CB 4.45Å; D185-R188 HydrophobicContact CB-CG 4.04Å; D185-R188 VanDerWaalsContact O-CB 3.31Å; D185-R188 WeakPolarHBondContact O-CB 3.48Å; D185-R188 VanDerWaalsContact O-CG 3.29Å; D185-R188 WeakPolarHBondContact O-CG 3.38Å; D185-R188 PolarHBondContact O-N 3.37Å; D185-R188 VanDerWaalsContact O-N 3.08Å; D185-R188 IonicContact OD2-CZ 3.31Å; D185-R188 IonicContact OD2-NE 2.84Å; D185-R188 PolarHBondContact OD2-NE 3.07Å; D185-R188 IonicContact OD2-NH2 2.69Å; D186-R188 PolarHBondContact O-N 2.76Å; D186-R188 VanDerWaalsContact O-N 3.12Å; R188-R190 VanDerWaalsContact C-N 3.34Å; R188-L192 VanDerWaalsContact O-CD1 3.27Å; R188-L192 WeakPolarHBondContact O-CD1 3.22Å
189	L	89.4	Confident	89.2	Confident	4 Å²	4	60 Å²	60	2%	0.021	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-84	-6.7	176.5	-58.2	-173.9	0	0	0	113.4	D186 S187 S191 L192 I197 L200 L294 L296 Y319	D186-L189 PolarHBondContact O-N 2.84Å; S187-L189 PolarHBondContact O-N 3.25Å; L189-S191 PolarHBondContact O-N 3.26Å; L189-L192 HydrophobicContact CD2-CD1 4.48Å; L189-L192 PolarHBondContact O-N 3.03Å; L189-I197 HydrophobicContact CD2-CG1 4.42Å; L189-I197 HydrophobicContact CD2-CG2 4.46Å; L189-L200 HydrophobicContact CD2-CB 4.31Å; L189-L200 HydrophobicContact CD2-CD1 3.81Å; L189-L294 HydrophobicContact CB-CD1 3.82Å; L189-L296 HydrophobicContact CD1-CD1 4.32Å; L189-Y319 HydrophobicContact CD1-CD1 4.1Å
190	R	86.8	Confident	89.5	Confident	132 Å²	132	56.2 Å²	56.2	50%	0.498	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61	128.5	-179.3	-74.1	173.8	176.7	-165.9	-1.1	111.7	S187 R188 L192 L294	S187-R190 VanDerWaalsContact O-CB 3.31Å; S187-R190 WeakPolarHBondContact O-CB 3.37Å; S187-R190 WeakPolarHBondContact O-CG 3.43Å; S187-R190 PolarHBondContact O-N 3.37Å; R188-R190 VanDerWaalsContact C-N 3.34Å; R190-L192 PolarHBondContact O-N 3.01Å; R190-L294 HydrophobicContact CG-CD1 4.46Å; R190-L294 HydrophobicContact CG-CD2 3.53Å
191	S	85.2	Confident	89.7	Confident	130 Å²	130	50 Å²	50	91%	0.909	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	26.6	175.6	-53.5	0	0	0	0	115.2	L189	L189-S191 PolarHBondContact O-N 3.26Å
192	L	89.9	Confident	89.9	Confident	27 Å²	27	50.1 Å²	50.1	14%	0.141	25%	0.251	C	S	.	.			trans	-87	150.9	174.3	-61.9	-163.4	0	0	0	112.7	R171 L172 A173 R188 L189 R190 C196 I197 L200	R171-L192 WeakPolarHBondContact O-CD2 3.4Å; L172-L192 HydrophobicContact CD2-CD1 4.01Å; A173-L192 HydrophobicContact CB-CD2 4.24Å; R188-L192 VanDerWaalsContact O-CD1 3.27Å; R188-L192 WeakPolarHBondContact O-CD1 3.22Å; L189-L192 HydrophobicContact CD2-CD1 4.48Å; L189-L192 PolarHBondContact O-N 3.03Å; R190-L192 PolarHBondContact O-N 3.01Å; L192-C196 HydrophobicContact CB-CB 4.34Å; L192-C196 HydrophobicContact CD1-CB 4.27Å; L192-I197 HydrophobicContact CB-CD1 4.21Å; L192-I197 HydrophobicContact CB-CG1 3.81Å; L192-L200 HydrophobicContact CD1-CD1 3.39Å
193	D	89.3	Confident	90.2	Very high	68 Å²	68	47.2 Å²	47.2	36%	0.364	24%	0.236	S	C	.	.			trans	-62.5	144.1	165.6	176.3	31.5	0	0	0	110.6	R195 C196 I197	D193-R195 PolarHBondContact O-N 3.43Å; D193-R195 VanDerWaalsContact O-N 3.13Å; D193-R195 WeakPolarHBondContact OD2-CB 3.2Å; D193-R195 IonicContact OD2-CZ 2.68Å; D193-R195 IonicContact OD2-NE 3.71Å; D193-R195 PolarHBondContact OD2-NE 3.32Å; D193-R195 IonicContact OD2-NH2 2.71Å; D193-R195 PolarHBondContact OD2-NH2 2.94Å; D193-C196 WeakPolarHBondContact O-CA 3.21Å; D193-C196 WeakPolarHBondContact O-CB 3.46Å; D193-C196 PolarHBondContact O-N 3.32Å; D193-I197 PolarHBondContact O-N 2.99Å; D193-I197 VanDerWaalsContact O-N 3.1Å
194	I	89	Confident	90.4	Very high	70 Å²	70	47 Å²	47	36%	0.359	24%	0.235	S	C	.	.	H	α-helix	trans	-57.5	-31.1	-179	-171.3	59.2	0	0	0	112.2	I197 R198	I194-I197 PolarHBondContact O-N 2.96Å; I194-R198 VanDerWaalsContact O-CG 3.28Å; I194-R198 WeakPolarHBondContact O-CG 3.42Å; I194-R198 PolarHBondContact O-N 2.83Å
195	R	92.2	Very high	90.8	Very high	88 Å²	88	43.5 Å²	43.5	33%	0.332	22%	0.222	S	C	.	.	H	α-helix	trans	-67	-39.3	174.6	-60.1	176.5	-67.6	172.2	-2.5	111.8	E149 P154 D193 R198 S199	E149-R195 IonicContact OE1-NH1 3Å; E149-R195 PolarHBondContact OE1-NH1 3.24Å; P154-R195 HydrophobicContact CG-CB 4.17Å; P154-R195 HydrophobicContact CG-CG 4.23Å; D193-R195 PolarHBondContact O-N 3.43Å; D193-R195 VanDerWaalsContact O-N 3.13Å; D193-R195 WeakPolarHBondContact OD2-CB 3.2Å; D193-R195 IonicContact OD2-CZ 2.68Å; D193-R195 IonicContact OD2-NE 3.71Å; D193-R195 PolarHBondContact OD2-NE 3.32Å; D193-R195 IonicContact OD2-NH2 2.71Å; D193-R195 PolarHBondContact OD2-NH2 2.94Å; R195-R198 PolarHBondContact O-N 2.88Å; R195-S199 PolarHBondContact O-N 3.44Å; R195-S199 VanDerWaalsContact O-N 3.08Å; R195-S199 PolarHBondContact O-OG 3.09Å; R195-S199 VanDerWaalsContact O-OG 3.07Å
196	C	93.6	Very high	91.3	Very high	7 Å²	7	40.8 Å²	40.8	5%	0.047	21%	0.208	C	C	.	.	H	α-helix	trans	-66.3	-41.3	174.4	-66.3	0	0	0	0	111.9	R125 A170 L192 D193 R198 S199 L200	R125-C196 PolarHBondContact NH2-SG 3.24Å; A170-C196 HydrophobicContact CB-CB 4.35Å; L192-C196 HydrophobicContact CB-CB 4.34Å; L192-C196 HydrophobicContact CD1-CB 4.27Å; D193-C196 WeakPolarHBondContact O-CA 3.21Å; D193-C196 WeakPolarHBondContact O-CB 3.46Å; D193-C196 PolarHBondContact O-N 3.32Å; C196-R198 PolarHBondContact O-N 3.06Å; C196-S199 PolarHBondContact O-N 2.94Å; C196-L200 WeakPolarHBondContact O-CD1 3.44Å; C196-L200 WeakPolarHBondContact O-CG 3.41Å; C196-L200 PolarHBondContact O-N 3.17Å
197	I	92.3	Very high	91.8	Very high	5 Å²	5	40.1 Å²	40.1	3%	0.026	21%	0.205	C	C	.	.	H	α-helix	trans	-60.6	-45.3	176.8	-63.1	169.6	0	0	0	110.4	L189 L192 D193 I194 S199 L200 N201 L296 P320	L189-I197 HydrophobicContact CD2-CG1 4.42Å; L189-I197 HydrophobicContact CD2-CG2 4.46Å; L192-I197 HydrophobicContact CB-CD1 4.21Å; L192-I197 HydrophobicContact CB-CG1 3.81Å; D193-I197 PolarHBondContact O-N 2.99Å; D193-I197 VanDerWaalsContact O-N 3.1Å; I194-I197 PolarHBondContact O-N 2.96Å; I197-S199 PolarHBondContact O-N 3.45Å; I197-L200 PolarHBondContact O-N 3.08Å; I197-N201 PolarHBondContact O-N 3.15Å; I197-N201 PolarHBondContact O-OD1 2.98Å; I197-L296 HydrophobicContact CD1-CD1 3.89Å; I197-L296 HydrophobicContact CD1-CD2 3.73Å; I197-L296 HydrophobicContact CD1-CG 4.5Å; I197-L296 HydrophobicContact CG2-CD1 4.1Å; I197-P320 HydrophobicContact CG2-CG 4.24Å
198	R	91.8	Very high	92.2	Very high	83 Å²	83	38.8 Å²	38.8	31%	0.313	19%	0.193	S	C	.	.	H	α-helix	trans	-61.9	-42.1	176.1	-68.9	172.2	-172.4	169.4	3.3	112.7	F152 V153 I194 R195 C196 N201	F152-R198 HydrophobicContact CE1-CG 4.22Å; F152-R198 HydrophobicContact CZ-CG 4.41Å; F152-R198 WeakPolarHBondContact O-CD 3.48Å; F152-R198 PolarHBondContact O-NH1 2.84Å; V153-R198 HydrophobicContact CG2-CB 4.05Å; I194-R198 VanDerWaalsContact O-CG 3.28Å; I194-R198 WeakPolarHBondContact O-CG 3.42Å; I194-R198 PolarHBondContact O-N 2.83Å; R195-R198 PolarHBondContact O-N 2.88Å; C196-R198 PolarHBondContact O-N 3.06Å; R198-N201 PolarHBondContact O-N 2.86Å
199	S	94.7	Very high	92.7	Very high	2 Å²	2	34.9 Å²	34.9	1%	0.014	18%	0.178	C	C	.	.	H	α-helix	trans	-61.7	-44	174.3	-57.2	0	0	0	0	112.3	V153 F169 R195 C196 I197 N201 G202	V153-S199 WeakPolarHBondContact CG1-OG 3.49Å; F169-S199 WeakPolarHBondContact O-CB 3.25Å; F169-S199 PolarHBondContact O-OG 3.32Å; R195-S199 PolarHBondContact O-N 3.44Å; R195-S199 VanDerWaalsContact O-N 3.08Å; R195-S199 PolarHBondContact O-OG 3.09Å; R195-S199 VanDerWaalsContact O-OG 3.07Å; C196-S199 PolarHBondContact O-N 2.94Å; I197-S199 PolarHBondContact O-N 3.45Å; S199-N201 VanDerWaalsContact C-N 3.31Å; S199-N201 PolarHBondContact O-N 3.04Å; S199-G202 PolarHBondContact O-N 3.38Å
200	L	95.2	Very high	93.1	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-65	-33.2	178.8	-74.4	160	0	0	0	112.8	L116 A170 L172 L183 L189 L192 C196 I197 G202 C203 R204	L116-L200 HydrophobicContact CD2-CD2 4.02Å; A170-L200 HydrophobicContact CB-CD1 4.17Å; A170-L200 HydrophobicContact CB-CD2 4.03Å; A170-L200 HydrophobicContact CB-CG 3.69Å; L172-L200 HydrophobicContact CD2-CD1 3.77Å; L172-L200 HydrophobicContact CD2-CD2 4.11Å; L183-L200 HydrophobicContact CD1-CD2 4.26Å; L183-L200 HydrophobicContact CD2-CD2 4.04Å; L189-L200 HydrophobicContact CD2-CB 4.31Å; L189-L200 HydrophobicContact CD2-CD1 3.81Å; L192-L200 HydrophobicContact CD1-CD1 3.39Å; C196-L200 WeakPolarHBondContact O-CD1 3.44Å; C196-L200 WeakPolarHBondContact O-CG 3.41Å; C196-L200 PolarHBondContact O-N 3.17Å; I197-L200 PolarHBondContact O-N 3.08Å; L200-G202 PolarHBondContact O-N 3.33Å; L200-C203 PolarHBondContact O-N 3.16Å; L200-R204 WeakPolarHBondContact O-CG 3.49Å; L200-R204 PolarHBondContact O-N 3.03Å
201	N	92.6	Very high	93.5	Very high	26 Å²	26	33 Å²	33	14%	0.139	18%	0.175	C	C	.	.	H	α-helix	trans	-61.7	-27.4	-179.1	-85.2	10.6	0	0	0	113.3	I197 R198 S199 V205	I197-N201 PolarHBondContact O-N 3.15Å; I197-N201 PolarHBondContact O-OD1 2.98Å; R198-N201 PolarHBondContact O-N 2.86Å; S199-N201 VanDerWaalsContact C-N 3.31Å; S199-N201 PolarHBondContact O-N 3.04Å; N201-V205 VanDerWaalsContact O-CB 3.26Å; N201-V205 WeakPolarHBondContact O-CB 3.19Å; N201-V205 VanDerWaalsContact O-CG2 3.24Å; N201-V205 WeakPolarHBondContact O-CG2 3.46Å; N201-V205 PolarHBondContact O-N 2.96Å
202	G	92.6	Very high	94.1	Very high	19 Å²	19	28 Å²	28	20%	0.196	14%	0.138	C	C	.	.	H	α-helix	trans	-57.3	-56.1	173.7	0	0	0	0	0	112.2	S199 L200 T206	S199-G202 PolarHBondContact O-N 3.38Å; L200-G202 PolarHBondContact O-N 3.33Å; G202-T206 WeakPolarHBondContact O-CB 3.42Å; G202-T206 PolarHBondContact O-N 3.17Å; G202-T206 PolarHBondContact O-OG1 3.29Å
203	C	95.5	Very high	94.5	Very high	4 Å²	4	27 Å²	27	3%	0.027	13%	0.132	C	C	.	.	H	α-helix	trans	-63.9	-48.5	175.5	-63	0	0	0	0	112.2	F99 L116 L183 L200 V205 T206 D207	F99-C203 HydrophobicContact CB-CB 4.39Å; L116-C203 HydrophobicContact CD2-CB 4.28Å; L116-C203 VanDerWaalsContact CD2-SG 3.51Å; L183-C203 HydrophobicContact CD1-CB 3.9Å; L200-C203 PolarHBondContact O-N 3.16Å; C203-V205 PolarHBondContact O-N 2.91Å; C203-T206 PolarHBondContact O-N 2.87Å; C203-T206 VanDerWaalsContact O-N 3.16Å; C203-D207 PolarHBondContact O-N 3.45Å
204	R	95.7	Very high	94.8	Very high	4 Å²	4	25.7 Å²	25.7	2%	0.015	13%	0.128	C	C	.	.	H	α-helix	trans	-57.8	-47.6	-176.9	-72.1	165.2	57.1	80.2	2.2	112.1	L183 R184 D185 D186 L200 E208 A318 Y319	L183-R204 HydrophobicContact CB-CG 4.3Å; L183-R204 WeakPolarHBondContact O-CD 3.1Å; L183-R204 VanDerWaalsContact O-CG 3.23Å; L183-R204 WeakPolarHBondContact O-CG 3.45Å; L183-R204 PolarHBondContact O-NH1 2.96Å; R184-R204 PolarHBondContact O-NH1 3.06Å; D185-R204 PolarHBondContact O-NH1 3.42Å; D186-R204 IonicContact OD1-CZ 3.73Å; D186-R204 IonicContact OD1-NH1 3.06Å; D186-R204 IonicContact OD1-NH2 3.36Å; D186-R204 PolarHBondContact OD1-NH2 2.77Å; L200-R204 WeakPolarHBondContact O-CG 3.49Å; L200-R204 PolarHBondContact O-N 3.03Å; R204-E208 VanDerWaalsContact O-CB 3.32Å; R204-E208 WeakPolarHBondContact O-CB 3.37Å; R204-E208 VanDerWaalsContact O-CG 3.25Å; R204-E208 WeakPolarHBondContact O-CG 3.37Å; R204-E208 PolarHBondContact O-N 3.47Å; R204-A318 HydrophobicContact CB-CB 3.76Å; R204-Y319 PolarHBondContact NE-O 2.81Å; R204-Y319 PolarHBondContact NH2-O 3.14Å
205	V	96	Very high	95.2	Very high	8 Å²	8	25.4 Å²	25.4	5%	0.048	13%	0.127	C	C	.	.	H	α-helix	trans	-65.4	-40.3	177.4	170.4	0	0	0	0	111.6	N201 C203 I209 V246 T316 A318	N201-V205 VanDerWaalsContact O-CB 3.26Å; N201-V205 WeakPolarHBondContact O-CB 3.19Å; N201-V205 VanDerWaalsContact O-CG2 3.24Å; N201-V205 WeakPolarHBondContact O-CG2 3.46Å; N201-V205 PolarHBondContact O-N 2.96Å; C203-V205 PolarHBondContact O-N 2.91Å; V205-I209 HydrophobicContact CG1-CD1 3.85Å; V205-I209 WeakPolarHBondContact O-CD1 3.46Å; V205-I209 VanDerWaalsContact O-CG1 3.26Å; V205-I209 WeakPolarHBondContact O-CG1 3.16Å; V205-I209 PolarHBondContact O-N 3.2Å; V205-V246 HydrophobicContact CG1-CG2 3.71Å; V205-T316 HydrophobicContact CG1-CG2 4.32Å; V205-T316 HydrophobicContact CG2-CG2 4.07Å; V205-A318 HydrophobicContact CG2-CB 3.91Å
206	T	96.8	Very high	95.5	Very high	6 Å²	6	25.9 Å²	25.9	4%	0.037	13%	0.132	C	C	.	.	H	α-helix	trans	-64.8	-47.2	-178.9	-57.9	0	0	0	0	111.9	G100 R103 L104 G202 C203 I209 L210	G100-T206 PolarHBondContact N-OG1 2.76Å; G100-T206 VanDerWaalsContact N-OG1 3.09Å; R103-T206 HydrophobicContact CB-CG2 3.86Å; R103-T206 HydrophobicContact CG-CG2 3.53Å; L104-T206 HydrophobicContact CD2-CG2 3.81Å; L104-T206 HydrophobicContact CG-CG2 3.84Å; G202-T206 WeakPolarHBondContact O-CB 3.42Å; G202-T206 PolarHBondContact O-N 3.17Å; G202-T206 PolarHBondContact O-OG1 3.29Å; C203-T206 PolarHBondContact O-N 2.87Å; C203-T206 VanDerWaalsContact O-N 3.16Å; T206-I209 PolarHBondContact O-N 3.27Å; T206-L210 PolarHBondContact O-N 2.9Å
207	D	95.5	Very high	95.7	Very high	25 Å²	25	32.4 Å²	32.4	13%	0.134	16%	0.162	C	C	.	.	H	α-helix	trans	-73.1	-33.5	179.1	-82.9	-0.8	0	0	0	112.2	R103 C203 L210 H211	R103-D207 IonicContact CZ-OD1 2.64Å; R103-D207 VanDerWaalsContact CZ-OD1 3.27Å; R103-D207 IonicContact CZ-OD2 2.73Å; R103-D207 IonicContact NE-OD1 2.65Å; R103-D207 PolarHBondContact NE-OD1 2.66Å; R103-D207 IonicContact NE-OD2 2.77Å; R103-D207 VanDerWaalsContact NH2-CG 3.26Å; R103-D207 IonicContact NH2-OD1 2.62Å; R103-D207 PolarHBondContact NH2-OD1 2.87Å; R103-D207 IonicContact NH2-OD2 2.9Å; R103-D207 PolarHBondContact NH2-OD2 2.8Å; C203-D207 PolarHBondContact O-N 3.45Å; D207-L210 PolarHBondContact O-N 2.7Å; D207-H211 PolarHBondContact O-N 3.4Å; D207-H211 VanDerWaalsContact O-N 3.07Å; D207-H211 PolarHBondContact O-ND1 3.29Å
208	E	95.8	Very high	96	Very high	22 Å²	22	33.5 Å²	33.5	10%	0.103	17%	0.169	C	C	.	.	H	α-helix	trans	-61	-44	170.7	-78.6	-68.5	94.6	0	0	111.8	R184 R204 L210 H211 L212 K287 P317 A318	R184-E208 WeakPolarHBondContact CD-OE1 3.27Å; R204-E208 VanDerWaalsContact O-CB 3.32Å; R204-E208 WeakPolarHBondContact O-CB 3.37Å; R204-E208 VanDerWaalsContact O-CG 3.25Å; R204-E208 WeakPolarHBondContact O-CG 3.37Å; R204-E208 PolarHBondContact O-N 3.47Å; E208-L210 VanDerWaalsContact C-N 3.27Å; E208-L210 PolarHBondContact O-N 3.45Å; E208-H211 CarbonylContact O-C 3.52Å; E208-H211 PolarHBondContact O-N 3.24Å; E208-L212 HydrophobicContact CB-CD1 4.37Å; E208-L212 WeakPolarHBondContact O-CB 3.39Å; E208-L212 WeakPolarHBondContact O-CG 3.27Å; E208-L212 PolarHBondContact O-N 2.91Å; E208-K287 VanDerWaalsContact OE2-CE 3.23Å; E208-K287 WeakPolarHBondContact OE2-CE 3.41Å; E208-K287 IonicContact OE2-NZ 2.71Å; E208-K287 PolarHBondContact OE2-NZ 3.19Å; E208-P317 HydrophobicContact CB-CB 4.1Å; E208-P317 HydrophobicContact CB-CG 3.71Å; E208-A318 HydrophobicContact CG-CB 4.11Å
209	I	97.8	Very high	96.3	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	15%	0.154	C	C	.	.	H	α-helix	trans	-56.9	-42.9	175.1	-71.3	164.3	0	0	0	110.8	L104 V205 T206 H211 L212 F219 V246 A249 M250 A253 L286 P317	L104-I209 HydrophobicContact CD2-CG2 4.1Å; V205-I209 HydrophobicContact CG1-CD1 3.85Å; V205-I209 WeakPolarHBondContact O-CD1 3.46Å; V205-I209 VanDerWaalsContact O-CG1 3.26Å; V205-I209 WeakPolarHBondContact O-CG1 3.16Å; V205-I209 PolarHBondContact O-N 3.2Å; T206-I209 PolarHBondContact O-N 3.27Å; I209-H211 VanDerWaalsContact C-N 3.27Å; I209-H211 PolarHBondContact O-N 2.75Å; I209-L212 PolarHBondContact O-N 3.26Å; I209-F219 HydrophobicContact CG2-CE1 4.3Å; I209-F219 HydrophobicContact CG2-CE2 4.15Å; I209-F219 HydrophobicContact CG2-CZ 3.61Å; I209-V246 HydrophobicContact CD1-CG2 4.14Å; I209-A249 HydrophobicContact CD1-CB 4.34Å; I209-M250 HydrophobicContact CD1-CG 3.6Å; I209-M250 HydrophobicContact CD1-SD 4.43Å; I209-M250 HydrophobicContact CG1-CG 4.06Å; I209-A253 HydrophobicContact CG2-CB 4.2Å; I209-L286 HydrophobicContact CG1-CD1 3.97Å; I209-P317 HydrophobicContact CG1-CG 4.28Å
210	L	97	Very high	96.5	Very high	12 Å²	12	33.3 Å²	33.3	6%	0.063	17%	0.167	C	C	.	.	H	α-helix	trans	-69.4	-20	177.7	-67.7	173.1	0	0	0	114	L104 T206 D207 E208 K216 F219	L104-L210 HydrophobicContact CD2-CD1 4.4Å; L104-L210 HydrophobicContact CD2-CD2 3.93Å; L104-L210 HydrophobicContact CD2-CG 3.91Å; T206-L210 PolarHBondContact O-N 2.9Å; D207-L210 PolarHBondContact O-N 2.7Å; E208-L210 VanDerWaalsContact C-N 3.27Å; E208-L210 PolarHBondContact O-N 3.45Å; L210-K216 WeakPolarHBondContact O-CE 3.46Å; L210-F219 HydrophobicContact CD2-CE1 4.23Å
211	H	95.9	Very high	96.7	Very high	85 Å²	85	34.6 Å²	34.6	39%	0.394	17%	0.174	S	C	.	.	H	α-helix	trans	-93.1	-14.7	173.1	-72.3	90.9	0	0	0	113.5	Y19 R184 D207 E208 I209	Y19-H211 WeakPolarHBondContact CE1-O 3.47Å; R184-H211 PolarHBondContact NH1-CD2 2.84Å; R184-H211 PolarHBondContact NH1-CE1 3.03Å; R184-H211 VanDerWaalsContact NH1-CE1 3.25Å; R184-H211 PolarHBondContact NH1-ND1 3.23Å; R184-H211 PolarHBondContact NH1-NE2 3.01Å; D207-H211 PolarHBondContact O-N 3.4Å; D207-H211 VanDerWaalsContact O-N 3.07Å; D207-H211 PolarHBondContact O-ND1 3.29Å; E208-H211 CarbonylContact O-C 3.52Å; E208-H211 PolarHBondContact O-N 3.24Å; I209-H211 VanDerWaalsContact C-N 3.27Å; I209-H211 PolarHBondContact O-N 2.75Å
212	L	97.1	Very high	97	Very high	24 Å²	24	33.3 Å²	33.3	13%	0.126	17%	0.167	C	C	.	.	S	Bend	trans	-100.6	8.9	-177.2	-68.5	170.6	0	0	0	113.9	E208 I209 Q257 L286 K287 P317	E208-L212 HydrophobicContact CB-CD1 4.37Å; E208-L212 WeakPolarHBondContact O-CB 3.39Å; E208-L212 WeakPolarHBondContact O-CG 3.27Å; E208-L212 PolarHBondContact O-N 2.91Å; I209-L212 PolarHBondContact O-N 3.26Å; L212-Q257 WeakPolarHBondContact O-CG 3.39Å; L212-Q257 PolarHBondContact O-NE2 3.45Å; L212-L286 HydrophobicContact CD1-CB 3.92Å; L212-K287 HydrophobicContact CD1-CB 4.14Å; L212-K287 HydrophobicContact CD1-CD 4.25Å; L212-K287 HydrophobicContact CD1-CG 4.1Å; L212-K287 HydrophobicContact CD2-CB 3.96Å; L212-P317 HydrophobicContact CD1-CB 3.52Å; L212-P317 HydrophobicContact CD1-CG 4.08Å
213	V	97.8	Very high	97.2	Very high	5 Å²	5	32.4 Å²	32.4	3%	0.03	16%	0.158	C	C	.	.			trans	-114.3	140	173.8	-65	0	0	0	0	112.1	K216 F219 A253 C256	V213-K216 HydrophobicContact CG2-CG 4.19Å; V213-F219 HydrophobicContact CB-CB 4.38Å; V213-F219 HydrophobicContact CB-CG 4.44Å; V213-F219 HydrophobicContact CG1-CB 4.44Å; V213-F219 HydrophobicContact CG1-CD2 3.79Å; V213-F219 HydrophobicContact CG1-CE2 4.25Å; V213-F219 HydrophobicContact CG1-CG 4.09Å; V213-F219 HydrophobicContact CG2-CB 4.24Å; V213-F219 HydrophobicContact CG2-CD1 4.36Å; V213-F219 HydrophobicContact CG2-CG 4.18Å; V213-A253 HydrophobicContact CG1-CB 3.52Å; V213-C256 HydrophobicContact CG1-CB 4.33Å
214	P	96.9	Very high	97.4	Very high	41 Å²	41	33.8 Å²	33.8	27%	0.266	16%	0.162	S	C	.	.	S	Bend	trans	-73.3	-37.5	-177.4	25.5	-31.9	0	0	0	113.6	Y19 C256 P260	Y19-P214 HydrophobicContact CD2-CB 3.8Å; Y19-P214 HydrophobicContact CD2-CG 4.48Å; Y19-P214 HydrophobicContact CE2-CB 3.79Å; P214-C256 HydrophobicContact CG-CB 4.47Å; P214-C256 WeakPolarHBondContact CG-O 3.38Å; P214-P260 HydrophobicContact CB-CB 3.81Å; P214-P260 HydrophobicContact CG-CB 3.62Å
215	N	97.5	Very high	97.5	Very high	65 Å²	65	33.8 Å²	33.8	35%	0.348	16%	0.163	S	C	.	.			trans	-128.4	120.2	172.8	-173.4	-44.2	0	0	0	110.1	E217 T218 F219	N215-E217 PolarHBondContact OD1-N 3Å; N215-T218 PolarHBondContact ND2-OG1 3.27Å; N215-T218 PolarHBondContact OD1-N 3.42Å; N215-T218 VanDerWaalsContact OD1-N 3.08Å; N215-T218 PolarHBondContact OD1-OG1 3.3Å; N215-F219 WeakPolarHBondContact O-CB 3.23Å; N215-F219 PolarHBondContact O-N 2.84Å
216	K	97.9	Very high	97.7	Very high	98 Å²	98	33.4 Å²	33.4	43%	0.426	16%	0.161	S	C	.	.	H	α-helix	trans	-73.3	-32.3	-177.1	-69.1	172.5	176.1	171.9	0	113.2	L210 V213 R220	L210-K216 WeakPolarHBondContact O-CE 3.46Å; V213-K216 HydrophobicContact CG2-CG 4.19Å; K216-R220 WeakPolarHBondContact O-CB 3.45Å; K216-R220 WeakPolarHBondContact O-CD 3.35Å; K216-R220 WeakPolarHBondContact O-CG 3.33Å; K216-R220 PolarHBondContact O-N 3.24Å
217	E	97.7	Very high	97.7	Very high	144 Å²	144	34 Å²	34	67%	0.673	16%	0.163	S	C	*	.	H	α-helix	trans	-77.2	-46.6	-177.1	-65.4	172.6	-179.6	0	0	110.8	N215 F219 R220 L221	N215-E217 PolarHBondContact OD1-N 3Å; E217-F219 VanDerWaalsContact C-N 3.33Å; E217-F219 PolarHBondContact O-N 3.25Å; E217-R220 WeakPolarHBondContact O-CB 3.36Å; E217-R220 PolarHBondContact O-N 3.19Å; E217-L221 PolarHBondContact O-N 3.37Å
218	T	97.9	Very high	97.8	Very high	28 Å²	28	33.5 Å²	33.5	17%	0.172	16%	0.161	C	C	.	.	H	α-helix	trans	-63.9	-41.3	175.3	-27.4	0	0	0	0	111.1	N215 R220 L221 T222 A264 L267	N215-T218 PolarHBondContact ND2-OG1 3.27Å; N215-T218 PolarHBondContact OD1-N 3.42Å; N215-T218 VanDerWaalsContact OD1-N 3.08Å; N215-T218 PolarHBondContact OD1-OG1 3.3Å; T218-R220 PolarHBondContact O-N 3.02Å; T218-L221 PolarHBondContact O-N 2.79Å; T218-T222 WeakPolarHBondContact O-CB 3.43Å; T218-T222 PolarHBondContact O-N 2.69Å; T218-T222 PolarHBondContact O-OG1 3.39Å; T218-A264 HydrophobicContact CG2-CB 3.8Å; T218-A264 VanDerWaalsContact CG2-N 3.3Å; T218-L267 HydrophobicContact CG2-CD1 3.7Å
219	F	98.7	Very high	97.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-54.2	-49.7	170.5	163.4	-101.6	0	0	0	112.3	L104 I209 L210 V213 N215 E217 L221 L223 A249 V252 A253	L104-F219 HydrophobicContact CD2-CE1 4.15Å; L104-F219 HydrophobicContact CD2-CZ 4.34Å; I209-F219 HydrophobicContact CG2-CE1 4.3Å; I209-F219 HydrophobicContact CG2-CE2 4.15Å; I209-F219 HydrophobicContact CG2-CZ 3.61Å; L210-F219 HydrophobicContact CD2-CE1 4.23Å; V213-F219 HydrophobicContact CB-CB 4.38Å; V213-F219 HydrophobicContact CB-CG 4.44Å; V213-F219 HydrophobicContact CG1-CB 4.44Å; V213-F219 HydrophobicContact CG1-CD2 3.79Å; V213-F219 HydrophobicContact CG1-CE2 4.25Å; V213-F219 HydrophobicContact CG1-CG 4.09Å; V213-F219 HydrophobicContact CG2-CB 4.24Å; V213-F219 HydrophobicContact CG2-CD1 4.36Å; V213-F219 HydrophobicContact CG2-CG 4.18Å; N215-F219 WeakPolarHBondContact O-CB 3.23Å; N215-F219 PolarHBondContact O-N 2.84Å; E217-F219 VanDerWaalsContact C-N 3.33Å; E217-F219 PolarHBondContact O-N 3.25Å; F219-L221 PolarHBondContact O-N 3.35Å; F219-L223 HydrophobicContact CE1-CD2 4.09Å; F219-L223 HydrophobicContact CE2-CD2 4.05Å; F219-L223 HydrophobicContact CZ-CD2 3.55Å; F219-L223 WeakPolarHBondContact O-CB 3.42Å; F219-L223 PolarHBondContact O-N 3.11Å; F219-A249 HydrophobicContact CZ-CB 4.42Å; F219-V252 HydrophobicContact CD2-CG1 3.9Å; F219-V252 HydrophobicContact CE2-CB 4.37Å; F219-V252 HydrophobicContact CE2-CG1 4.18Å; F219-A253 HydrophobicContact CD2-CB 4.32Å; F219-A253 HydrophobicContact CE2-CB 3.88Å
220	R	98.6	Very high	97.9	Very high	81 Å²	81	32.6 Å²	32.6	31%	0.306	16%	0.156	S	C	.	.	H	α-helix	trans	-58.9	-45.7	177.6	-79	163	177.1	161.3	-5	112	L104 V106 K216 E217 T218 L223 R224	L104-R220 VanDerWaalsContact O-CG 3.31Å; L104-R220 WeakPolarHBondContact O-CG 3.4Å; L104-R220 PolarHBondContact O-NE 3.4Å; V106-R220 HydrophobicContact CG1-CB 3.94Å; V106-R220 HydrophobicContact CG1-CG 3.89Å; K216-R220 WeakPolarHBondContact O-CB 3.45Å; K216-R220 WeakPolarHBondContact O-CD 3.35Å; K216-R220 WeakPolarHBondContact O-CG 3.33Å; K216-R220 PolarHBondContact O-N 3.24Å; E217-R220 WeakPolarHBondContact O-CB 3.36Å; E217-R220 PolarHBondContact O-N 3.19Å; T218-R220 PolarHBondContact O-N 3.02Å; R220-L223 PolarHBondContact O-N 3.32Å; R220-R224 WeakPolarHBondContact O-CG 3.47Å; R220-R224 PolarHBondContact O-N 3.44Å
221	L	98.5	Very high	97.9	Very high	28 Å²	28	37.4 Å²	37.4	15%	0.147	18%	0.177	C	C	.	.	H	α-helix	trans	-67.2	-45.8	-177.7	-176.8	56.9	0	0	0	112.1	T38 I42 M45 F51 E217 T218 F219 L223 R224 A225 A264	T38-L221 HydrophobicContact CG2-CD2 3.67Å; I42-L221 HydrophobicContact CD1-CD2 3.87Å; I42-L221 HydrophobicContact CG1-CD1 3.74Å; I42-L221 HydrophobicContact CG1-CD2 3.83Å; I42-L221 HydrophobicContact CG1-CG 4.43Å; M45-L221 HydrophobicContact CE-CD1 3.54Å; F51-L221 HydrophobicContact CE1-CD1 4.34Å; F51-L221 HydrophobicContact CZ-CD1 4.01Å; E217-L221 PolarHBondContact O-N 3.37Å; T218-L221 PolarHBondContact O-N 2.79Å; F219-L221 PolarHBondContact O-N 3.35Å; L221-L223 VanDerWaalsContact C-N 3.31Å; L221-L223 PolarHBondContact O-N 3.04Å; L221-R224 PolarHBondContact O-N 3.44Å; L221-A225 PolarHBondContact O-N 3.31Å; L221-A225 VanDerWaalsContact O-N 3.13Å; L221-A264 HydrophobicContact CB-CB 4.01Å; L221-A264 HydrophobicContact CD2-CB 3.61Å; L221-A264 HydrophobicContact CG-CB 3.73Å
222	T	98.8	Very high	97.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-61.5	-38.7	172.8	-61.6	0	0	0	0	111.5	T218 A225 V226 V252 A264 L267 V268	T218-T222 WeakPolarHBondContact O-CB 3.43Å; T218-T222 PolarHBondContact O-N 2.69Å; T218-T222 PolarHBondContact O-OG1 3.39Å; T222-A225 PolarHBondContact O-N 2.93Å; T222-V226 HydrophobicContact CG2-CG2 4.41Å; T222-V226 WeakPolarHBondContact O-CG2 3.45Å; T222-V226 PolarHBondContact O-N 2.82Å; T222-V252 HydrophobicContact CG2-CG1 3.61Å; T222-V252 HydrophobicContact CG2-CG2 4.42Å; T222-A264 WeakPolarHBondContact OG1-CA 3.28Å; T222-A264 PolarHBondContact OG1-O 3.34Å; T222-L267 HydrophobicContact CG2-CB 3.95Å; T222-L267 WeakPolarHBondContact OG1-CB 3.4Å; T222-V268 HydrophobicContact CG2-CG2 3.86Å
223	L	98.8	Very high	97.7	Very high	0 Å²	0	38 Å²	38	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-34.4	178.7	-178	56.7	0	0	0	112.9	L104 V106 F219 R220 L221 A225 K227 W248 A249 V252	L104-L223 HydrophobicContact CD1-CD2 4.16Å; V106-L223 HydrophobicContact CB-CD2 4.42Å; V106-L223 HydrophobicContact CB-CG 4.45Å; V106-L223 HydrophobicContact CG1-CB 4.19Å; V106-L223 HydrophobicContact CG1-CD2 4.06Å; V106-L223 HydrophobicContact CG1-CG 4.19Å; V106-L223 HydrophobicContact CG2-CD2 3.81Å; V106-L223 HydrophobicContact CG2-CG 4.17Å; F219-L223 HydrophobicContact CE1-CD2 4.09Å; F219-L223 HydrophobicContact CE2-CD2 4.05Å; F219-L223 HydrophobicContact CZ-CD2 3.55Å; F219-L223 WeakPolarHBondContact O-CB 3.42Å; F219-L223 PolarHBondContact O-N 3.11Å; R220-L223 PolarHBondContact O-N 3.32Å; L221-L223 VanDerWaalsContact C-N 3.31Å; L221-L223 PolarHBondContact O-N 3.04Å; L223-A225 VanDerWaalsContact C-N 3.35Å; L223-K227 HydrophobicContact CD1-CD 4.18Å; L223-K227 HydrophobicContact CD1-CG 3.91Å; L223-K227 HydrophobicContact CG-CD 4.1Å; L223-K227 HydrophobicContact CG-CG 4.31Å; L223-K227 VanDerWaalsContact O-CB 3.28Å; L223-K227 WeakPolarHBondContact O-CB 3.17Å; L223-K227 VanDerWaalsContact O-CG 3.25Å; L223-K227 WeakPolarHBondContact O-CG 3.36Å; L223-K227 PolarHBondContact O-N 3.5Å; L223-W248 HydrophobicContact CD1-CB 4.29Å; L223-A249 HydrophobicContact CD1-CB 4.3Å; L223-A249 HydrophobicContact CD2-CB 3.65Å; L223-V252 HydrophobicContact CB-CB 4.44Å; L223-V252 HydrophobicContact CB-CG1 4.12Å; L223-V252 HydrophobicContact CB-CG2 4.48Å; L223-V252 HydrophobicContact CD1-CB 4.28Å; L223-V252 HydrophobicContact CD1-CG2 3.95Å
224	R	98.5	Very high	97.6	Very high	32 Å²	32	38.4 Å²	38.4	12%	0.121	18%	0.179	C	C	.	.	H	α-helix	trans	-59.4	-46.3	169	-74.5	177.3	-174.4	-80	1.2	110.5	V50 G105 V106 H107 R220 L221 L228	V50-R224 PolarHBondContact O-NH1 3.45Å; G105-R224 VanDerWaalsContact C-NH2 3.33Å; G105-R224 PolarHBondContact O-NE 3.08Å; G105-R224 PolarHBondContact O-NH2 3.08Å; V106-R224 HydrophobicContact CB-CG 4.1Å; V106-R224 HydrophobicContact CG1-CG 4.16Å; H107-R224 PolarHBondContact O-NH1 2.96Å; R220-R224 WeakPolarHBondContact O-CG 3.47Å; R220-R224 PolarHBondContact O-N 3.44Å; L221-R224 PolarHBondContact O-N 3.44Å; R224-L228 WeakPolarHBondContact O-CB 3.29Å; R224-L228 PolarHBondContact O-N 3.23Å
225	A	98.6	Very high	97.6	Very high	4 Å²	4	36.5 Å²	36.5	3%	0.033	17%	0.167	C	C	.	.	H	α-helix	trans	-61.7	-48.7	176.5	0	0	0	0	0	113.1	L41 M45 L221 T222 L223 L228 W229 V268	L41-A225 HydrophobicContact CD1-CB 4.06Å; L41-A225 HydrophobicContact CD2-CB 4.28Å; M45-A225 HydrophobicContact CE-CB 4.3Å; M45-A225 WeakPolarHBondContact SD-CA 3.37Å; M45-A225 HydrophobicContact SD-CB 3.65Å; L221-A225 PolarHBondContact O-N 3.31Å; L221-A225 VanDerWaalsContact O-N 3.13Å; T222-A225 PolarHBondContact O-N 2.93Å; L223-A225 VanDerWaalsContact C-N 3.35Å; A225-L228 PolarHBondContact O-N 3.33Å; A225-W229 WeakPolarHBondContact O-CB 3.36Å; A225-W229 PolarHBondContact O-N 3.34Å; A225-V268 HydrophobicContact CB-CG2 3.84Å
226	V	98.7	Very high	97.6	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	16%	0.161	C	C	.	.	H	α-helix	trans	-67	-39.2	179.7	169.4	0	0	0	0	112	T222 W229 A230 W248 V252 F271	T222-V226 HydrophobicContact CG2-CG2 4.41Å; T222-V226 WeakPolarHBondContact O-CG2 3.45Å; T222-V226 PolarHBondContact O-N 2.82Å; V226-W229 HydrophobicContact CG1-CE3 4.42Å; V226-A230 VanDerWaalsContact O-CB 3.28Å; V226-A230 WeakPolarHBondContact O-CB 3.49Å; V226-A230 PolarHBondContact O-N 3.31Å; V226-W248 HydrophobicContact CG1-CD2 4.34Å; V226-W248 HydrophobicContact CG1-CE3 3.79Å; V226-W248 HydrophobicContact CG1-CZ3 4.43Å; V226-V252 HydrophobicContact CB-CG2 3.85Å; V226-V252 HydrophobicContact CG1-CG2 3.93Å; V226-V252 HydrophobicContact CG2-CG2 3.84Å; V226-F271 HydrophobicContact CB-CZ 4.46Å; V226-F271 HydrophobicContact CG1-CE1 3.88Å; V226-F271 HydrophobicContact CG1-CE2 3.89Å; V226-F271 HydrophobicContact CG1-CZ 3.45Å; V226-F271 VanDerWaalsContact CG1-CZ 3.45Å; V226-F271 HydrophobicContact CG2-CD1 3.96Å; V226-F271 HydrophobicContact CG2-CD2 4.18Å; V226-F271 HydrophobicContact CG2-CE1 4Å; V226-F271 HydrophobicContact CG2-CE2 4.19Å; V226-F271 HydrophobicContact CG2-CG 4.07Å; V226-F271 HydrophobicContact CG2-CZ 4.12Å
227	K	97.9	Very high	97.5	Very high	18 Å²	18	32.5 Å²	32.5	8%	0.078	15%	0.148	C	C	.	.	H	α-helix	trans	-62.6	-43.9	173.7	-76.6	176.7	66.1	-177	0	111.6	V106 L223 K231 Y236	V106-K227 HydrophobicContact CB-CD 4.47Å; V106-K227 HydrophobicContact CG2-CD 4.04Å; V106-K227 PolarHBondContact O-NZ 2.9Å; L223-K227 HydrophobicContact CD1-CD 4.18Å; L223-K227 HydrophobicContact CD1-CG 3.91Å; L223-K227 HydrophobicContact CG-CD 4.1Å; L223-K227 HydrophobicContact CG-CG 4.31Å; L223-K227 VanDerWaalsContact O-CB 3.28Å; L223-K227 WeakPolarHBondContact O-CB 3.17Å; L223-K227 VanDerWaalsContact O-CG 3.25Å; L223-K227 WeakPolarHBondContact O-CG 3.36Å; L223-K227 PolarHBondContact O-N 3.5Å; K227-K231 WeakPolarHBondContact O-CG 3.33Å; K227-K231 PolarHBondContact O-N 3.37Å; K227-Y236 HydrophobicContact CG-CE2 4.23Å
228	L	97.6	Very high	97.3	Very high	15 Å²	15	28.3 Å²	28.3	8%	0.079	13%	0.13	C	C	.	.	H	α-helix	trans	-64.2	-49.7	177.4	-179.3	61.1	0	0	0	110.8	M45 F48 V50 R224 A225 A230 K231 R232 L361	M45-L228 HydrophobicContact CG-CD2 3.98Å; F48-L228 HydrophobicContact CB-CD1 3.8Å; F48-L228 HydrophobicContact CB-CD2 3.82Å; F48-L228 HydrophobicContact CB-CG 4.49Å; F48-L228 HydrophobicContact CD1-CD1 4.29Å; F48-L228 HydrophobicContact CD2-CD2 3.75Å; F48-L228 HydrophobicContact CG-CD1 4.03Å; F48-L228 HydrophobicContact CG-CD2 3.84Å; V50-L228 HydrophobicContact CG1-CB 4.22Å; V50-L228 HydrophobicContact CG1-CD1 3.88Å; V50-L228 HydrophobicContact CG1-CD2 4Å; V50-L228 HydrophobicContact CG1-CG 4.23Å; R224-L228 WeakPolarHBondContact O-CB 3.29Å; R224-L228 PolarHBondContact O-N 3.23Å; A225-L228 PolarHBondContact O-N 3.33Å; L228-A230 PolarHBondContact O-N 2.88Å; L228-K231 PolarHBondContact O-N 2.61Å; L228-R232 HydrophobicContact CD1-CG 3.93Å; L228-R232 HydrophobicContact CG-CG 4.23Å; L228-R232 WeakPolarHBondContact O-CB 3.4Å; L228-R232 WeakPolarHBondContact O-CG 3.47Å; L228-R232 PolarHBondContact O-N 3.41Å; L228-L361 HydrophobicContact CD2-CD1 3.78Å; L228-L361 HydrophobicContact CD2-CD2 3.88Å; L228-L361 HydrophobicContact CD2-CG 4.4Å; L228-L361 HydrophobicContact CG-CD2 4.01Å
229	W	98.3	Very high	97	Very high	4 Å²	4	30.7 Å²	30.7	2%	0.015	14%	0.14	C	C	.	.	H	α-helix	trans	-52.9	-53.7	174.1	168.3	81.5	0	0	0	111.4	A225 V226 K231 R232 R233 I235 W248 F271 F272 E339 F340 L361	A225-W229 WeakPolarHBondContact O-CB 3.36Å; A225-W229 PolarHBondContact O-N 3.34Å; V226-W229 HydrophobicContact CG1-CE3 4.42Å; W229-K231 PolarHBondContact O-N 3.07Å; W229-R232 CarbonylContact O-C 3.5Å; W229-R232 PolarHBondContact O-N 3.16Å; W229-R232 VanDerWaalsContact O-N 3.07Å; W229-R233 HydrophobicContact CD2-CG 4.33Å; W229-R233 HydrophobicContact CG-CG 4.23Å; W229-R233 HydrophobicContact CZ2-CG 4.4Å; W229-R233 WeakPolarHBondContact O-CB 3.19Å; W229-R233 WeakPolarHBondContact O-CG 3.19Å; W229-R233 PolarHBondContact O-N 3.04Å; W229-I235 HydrophobicContact CH2-CD1 3.44Å; W229-I235 VanDerWaalsContact CH2-CD1 3.44Å; W229-I235 HydrophobicContact CZ2-CD1 4.02Å; W229-I235 HydrophobicContact CZ3-CD1 3.76Å; W229-W248 HydrophobicContact CH2-CH2 4.4Å; W229-W248 AromaticContact CZ3-CH2 3.74Å; W229-W248 HydrophobicContact CZ3-CH2 3.74Å; W229-W248 HydrophobicContact CZ3-CZ2 4.5Å; W229-W248 AromaticContact CZ3-CZ3 3.9Å; W229-W248 HydrophobicContact CZ3-CZ3 3.9Å; W229-F271 HydrophobicContact CZ3-CE1 4.25Å; W229-F272 AromaticContact CD2-CE1 3.8Å; W229-F272 HydrophobicContact CD2-CE1 3.8Å; W229-F272 AromaticContact CD2-CZ 3.77Å; W229-F272 HydrophobicContact CD2-CZ 3.77Å; W229-F272 AromaticContact CE2-CE1 3.51Å; W229-F272 AromaticContact CE2-CZ 3.7Å; W229-F272 AromaticContact CE3-CE1 3.99Å; W229-F272 HydrophobicContact CE3-CE1 3.99Å; W229-F272 HydrophobicContact CE3-CZ 4.25Å; W229-F272 HydrophobicContact CG-CZ 4.07Å; W229-F272 AromaticContact CH2-CE1 3.72Å; W229-F272 HydrophobicContact CH2-CE1 3.72Å; W229-F272 HydrophobicContact CZ2-CD1 4.38Å; W229-F272 AromaticContact CZ2-CE1 3.49Å; W229-F272 HydrophobicContact CZ2-CE1 3.49Å; W229-F272 VanDerWaalsContact CZ2-CE1 3.49Å; W229-F272 HydrophobicContact CZ2-CZ 4.17Å; W229-F272 AromaticContact CZ3-CE1 3.95Å; W229-F272 HydrophobicContact CZ3-CE1 3.95Å; W229-F272 AromaticContact NE1-CZ 3.84Å; W229-E339 HydrophobicContact CZ2-CB 4.12Å; W229-F340 AromaticContact CH2-CD1 3.53Å; W229-F340 HydrophobicContact CH2-CD1 3.53Å; W229-F340 AromaticContact CH2-CE1 3.63Å; W229-F340 HydrophobicContact CH2-CE1 3.63Å; W229-F340 HydrophobicContact CZ2-CD1 4.37Å; W229-F340 HydrophobicContact CZ3-CD1 4.2Å; W229-F340 AromaticContact CZ3-CE1 3.9Å; W229-F340 HydrophobicContact CZ3-CE1 3.9Å; W229-L361 HydrophobicContact CB-CD2 4.49Å
230	A	98	Very high	96.9	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.9	-39.6	-178.2	0	0	0	0	0	113.2	V226 L228 G234 I235 Y236 W248	V226-A230 VanDerWaalsContact O-CB 3.28Å; V226-A230 WeakPolarHBondContact O-CB 3.49Å; V226-A230 PolarHBondContact O-N 3.31Å; L228-A230 PolarHBondContact O-N 2.88Å; A230-G234 PolarHBondContact O-N 3.26Å; A230-I235 HydrophobicContact CB-CG1 4.11Å; A230-I235 WeakPolarHBondContact O-CG1 3.48Å; A230-I235 PolarHBondContact O-N 3.36Å; A230-Y236 HydrophobicContact CB-CD2 4.1Å; A230-W248 HydrophobicContact CB-CD2 4.15Å; A230-W248 VanDerWaalsContact CB-CE2 3.48Å; A230-W248 HydrophobicContact CB-CH2 4.25Å; A230-W248 HydrophobicContact CB-CZ2 3.54Å
231	K	95.7	Very high	96.7	Very high	113 Å²	113	26.9 Å²	26.9	49%	0.491	13%	0.126	S	C	.	.	H	α-helix	trans	-62.3	-49.6	171	-78.3	-172.5	173	-169.8	0	111.1	K227 L228 W229 R233 G234 Y236	K227-K231 WeakPolarHBondContact O-CG 3.33Å; K227-K231 PolarHBondContact O-N 3.37Å; L228-K231 PolarHBondContact O-N 2.61Å; W229-K231 PolarHBondContact O-N 3.07Å; K231-R233 VanDerWaalsContact C-N 3.31Å; K231-R233 PolarHBondContact O-N 2.83Å; K231-G234 PolarHBondContact O-N 2.73Å; K231-G234 VanDerWaalsContact O-N 3.16Å; K231-Y236 HydrophobicContact CG-CD1 4.05Å; K231-Y236 HydrophobicContact CG-CD2 4.16Å; K231-Y236 HydrophobicContact CG-CG 3.81Å
232	R	94.8	Very high	96.7	Very high	89 Å²	89	25.6 Å²	25.6	34%	0.336	12%	0.119	S	C	.	.	H	α-helix	trans	-65	-30.8	-178.6	-67.4	-71.7	-71.4	-166	-12.3	113.2	L228 W229 L361 P363 P364	L228-R232 HydrophobicContact CD1-CG 3.93Å; L228-R232 HydrophobicContact CG-CG 4.23Å; L228-R232 WeakPolarHBondContact O-CB 3.4Å; L228-R232 WeakPolarHBondContact O-CG 3.47Å; L228-R232 PolarHBondContact O-N 3.41Å; W229-R232 CarbonylContact O-C 3.5Å; W229-R232 PolarHBondContact O-N 3.16Å; W229-R232 VanDerWaalsContact O-N 3.07Å; R232-L361 PolarHBondContact NE-O 2.84Å; R232-L361 PolarHBondContact NH2-O 3.37Å; R232-P363 WeakPolarHBondContact O-CA 3.4Å; R232-P364 WeakPolarHBondContact O-CD 3.5Å
233	R	95.3	Very high	96.7	Very high	31 Å²	31	25.6 Å²	25.6	12%	0.117	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.4	175.8	-59.4	-50	-65.6	-159.4	-15.4	114.6	W229 K231 I235 E339 E362	W229-R233 HydrophobicContact CD2-CG 4.33Å; W229-R233 HydrophobicContact CG-CG 4.23Å; W229-R233 HydrophobicContact CZ2-CG 4.4Å; W229-R233 WeakPolarHBondContact O-CB 3.19Å; W229-R233 WeakPolarHBondContact O-CG 3.19Å; W229-R233 PolarHBondContact O-N 3.04Å; K231-R233 VanDerWaalsContact C-N 3.31Å; K231-R233 PolarHBondContact O-N 2.83Å; R233-I235 HydrophobicContact CB-CD1 4.32Å; R233-I235 HydrophobicContact CB-CG1 4.18Å; R233-E339 IonicContact CZ-OE2 3.97Å; R233-E339 IonicContact NE-OE2 3.21Å; R233-E339 PolarHBondContact NE-OE2 2.86Å; R233-E339 IonicContact NH2-OE1 2.74Å; R233-E339 IonicContact NH2-OE2 2.92Å; R233-E339 PolarHBondContact NH2-OE2 3.13Å; R233-E362 PolarHBondContact NH1-O 2.91Å
234	G	95	Very high	96.5	Very high	15 Å²	15	26.1 Å²	26.1	16%	0.155	13%	0.125	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	31.7	177.6	0	0	0	0	0	113.8	A230 K231 P417	A230-G234 PolarHBondContact O-N 3.26Å; K231-G234 PolarHBondContact O-N 2.73Å; K231-G234 VanDerWaalsContact O-N 3.16Å; G234-P417 WeakPolarHBondContact O-CD 3.43Å; G234-P417 WeakPolarHBondContact O-CG 3.43Å
235	I	97.3	Very high	96.4	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.132	C	C	.	.			trans	-126.1	29.3	-177.3	60.5	175.2	0	0	0	112.3	W229 A230 R233 F242 W248 V335 M336 E339	W229-I235 HydrophobicContact CH2-CD1 3.44Å; W229-I235 VanDerWaalsContact CH2-CD1 3.44Å; W229-I235 HydrophobicContact CZ2-CD1 4.02Å; W229-I235 HydrophobicContact CZ3-CD1 3.76Å; A230-I235 HydrophobicContact CB-CG1 4.11Å; A230-I235 WeakPolarHBondContact O-CG1 3.48Å; A230-I235 PolarHBondContact O-N 3.36Å; R233-I235 HydrophobicContact CB-CD1 4.32Å; R233-I235 HydrophobicContact CB-CG1 4.18Å; I235-F242 HydrophobicContact CB-CD1 3.93Å; I235-F242 HydrophobicContact CB-CE1 4.21Å; I235-F242 HydrophobicContact CB-CG 4.37Å; I235-F242 HydrophobicContact CG2-CD1 4.02Å; I235-F242 HydrophobicContact CG2-CE1 3.76Å; I235-F242 HydrophobicContact CG2-CZ 4.29Å; I235-F242 WeakPolarHBondContact O-CB 3.08Å; I235-W248 HydrophobicContact CD1-CH2 4.07Å; I235-W248 HydrophobicContact CD1-CZ2 4.18Å; I235-W248 HydrophobicContact CG1-CZ2 4.13Å; I235-W248 WeakPolarHBondContact O-CZ2 3.24Å; I235-V335 HydrophobicContact CG2-CG1 3.83Å; I235-M336 HydrophobicContact CB-CG 4.16Å; I235-M336 HydrophobicContact CD1-CG 4.4Å; I235-M336 HydrophobicContact CG2-CG 4.25Å; I235-E339 HydrophobicContact CD1-CB 4.12Å; I235-E339 HydrophobicContact CG2-CG 4.4Å
236	Y	96.8	Very high	96.3	Very high	59 Å²	59	28.6 Å²	28.6	23%	0.231	15%	0.148	C	C	.	.	B	Isolated β-bridge	trans	-119	86.6	179.3	-168.2	-79.2	0	0	0	110.1	K227 A230 K231 G245 W248	K227-Y236 HydrophobicContact CG-CE2 4.23Å; A230-Y236 HydrophobicContact CB-CD2 4.1Å; K231-Y236 HydrophobicContact CG-CD1 4.05Å; K231-Y236 HydrophobicContact CG-CD2 4.16Å; K231-Y236 HydrophobicContact CG-CG 3.81Å; Y236-G245 VanDerWaalsContact OH-CA 3.29Å; Y236-G245 WeakPolarHBondContact OH-CA 3.34Å; Y236-W248 AromaticContact CD2-CD1 3.4Å; Y236-W248 VanDerWaalsContact CD2-CD1 3.4Å; Y236-W248 AromaticContact CD2-NE1 3.4Å; Y236-W248 AromaticContact CE2-CD1 3.49Å; Y236-W248 VanDerWaalsContact CE2-CD1 3.49Å; Y236-W248 HydrophobicContact CE2-CG 4.5Å
237	S	95.9	Very high	96.3	Very high	20 Å²	20	28.6 Å²	28.6	14%	0.14	15%	0.148	C	C	.	.			trans	-171	110.8	167.5	176.7	0	0	0	0	111	M239 L240 G241 F242 L243	S237-M239 VanDerWaalsContact C-N 3.27Å; S237-M239 PolarHBondContact O-N 2.84Å; S237-M239 PolarHBondContact OG-N 3.13Å; S237-L240 PolarHBondContact O-N 3.29Å; S237-L240 PolarHBondContact OG-N 3.16Å; S237-G241 PolarHBondContact O-N 2.93Å; S237-F242 CarbonylContact O-C 3.58Å; S237-F242 WeakPolarHBondContact O-CA 3.34Å; S237-F242 WeakPolarHBondContact O-CB 3.43Å; S237-F242 PolarHBondContact O-N 3.41Å; S237-L243 PolarHBondContact N-O 2.92Å
238	N	94.3	Very high	96.3	Very high	57 Å²	57	27.7 Å²	27.7	31%	0.305	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-33.8	173.3	178.7	39.2	0	0	0	112.3	L240 G241 F242 N327	N238-L240 PolarHBondContact O-N 3.13Å; N238-G241 PolarHBondContact O-N 3.16Å; N238-F242 WeakPolarHBondContact CA-O 3.43Å; N238-N327 WeakPolarHBondContact O-CB 3.11Å; N238-N327 PolarHBondContact O-ND2 3.14Å; N238-N327 PolarHBondContact OD1-ND2 3.31Å
239	M	91.5	Very high	96.4	Very high	77 Å²	77	27 Å²	27	38%	0.379	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-35.3	-177.7	-169.8	178.6	-64.6	0	0	112.3	S237 E394 S395 R398	S237-M239 VanDerWaalsContact C-N 3.27Å; S237-M239 PolarHBondContact O-N 2.84Å; S237-M239 PolarHBondContact OG-N 3.13Å; M239-E394 HydrophobicContact SD-CB 4Å; M239-E394 HydrophobicContact SD-CG 3.83Å; M239-S395 VanDerWaalsContact SD-CA 3.51Å; M239-S395 PolarHBondContact SD-N 3Å; M239-R398 WeakPolarHBondContact O-CD 3.26Å; M239-R398 PolarHBondContact O-NH1 2.84Å
240	L	95	Very high	96.4	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.7	7	-178.3	-60.9	176	0	0	0	113.8	S237 N238 E394 I397 V415 P417	S237-L240 PolarHBondContact O-N 3.29Å; S237-L240 PolarHBondContact OG-N 3.16Å; N238-L240 PolarHBondContact O-N 3.13Å; L240-E394 HydrophobicContact CD1-CG 4.49Å; L240-E394 HydrophobicContact CD2-CG 3.89Å; L240-E394 HydrophobicContact CG-CG 4.33Å; L240-I397 HydrophobicContact CD2-CB 3.75Å; L240-I397 HydrophobicContact CD2-CD1 4.19Å; L240-I397 HydrophobicContact CD2-CG1 4.35Å; L240-I397 HydrophobicContact CD2-CG2 4.31Å; L240-V415 HydrophobicContact CB-CG1 4.06Å; L240-V415 HydrophobicContact CD1-CG2 4.27Å; L240-V415 HydrophobicContact CD2-CG2 4.43Å; L240-P417 HydrophobicContact CD1-CB 3.95Å; L240-P417 HydrophobicContact CD1-CG 4.42Å
241	G	95.8	Very high	96.4	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.01	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.9	11.2	177.6	0	0	0	0	0	115.8	S237 N238 N327 V328 T332	S237-G241 PolarHBondContact O-N 2.93Å; N238-G241 PolarHBondContact O-N 3.16Å; G241-N327 WeakPolarHBondContact CA-O 3.28Å; G241-V328 WeakPolarHBondContact O-CA 3.44Å; G241-V328 WeakPolarHBondContact O-CG2 3.43Å; G241-T332 WeakPolarHBondContact O-CB 3.42Å; G241-T332 PolarHBondContact O-OG1 3.2Å; G241-T332 VanDerWaalsContact O-OG1 3.1Å
242	F	97.9	Very high	96.6	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	-94.1	-172.3	167	-66.8	-68.9	0	0	0	111.3	I235 S237 N238 T332 V335 M336 H414 V415 P417	I235-F242 HydrophobicContact CB-CD1 3.93Å; I235-F242 HydrophobicContact CB-CE1 4.21Å; I235-F242 HydrophobicContact CB-CG 4.37Å; I235-F242 HydrophobicContact CG2-CD1 4.02Å; I235-F242 HydrophobicContact CG2-CE1 3.76Å; I235-F242 HydrophobicContact CG2-CZ 4.29Å; I235-F242 WeakPolarHBondContact O-CB 3.08Å; S237-F242 CarbonylContact O-C 3.58Å; S237-F242 WeakPolarHBondContact O-CA 3.34Å; S237-F242 WeakPolarHBondContact O-CB 3.43Å; S237-F242 PolarHBondContact O-N 3.41Å; N238-F242 WeakPolarHBondContact CA-O 3.43Å; F242-T332 HydrophobicContact CD1-CG2 4.09Å; F242-T332 HydrophobicContact CD2-CG2 4.39Å; F242-T332 HydrophobicContact CE1-CG2 3.86Å; F242-T332 HydrophobicContact CE2-CG2 4.18Å; F242-T332 HydrophobicContact CG-CG2 4.36Å; F242-T332 HydrophobicContact CZ-CG2 3.92Å; F242-V335 HydrophobicContact CE1-CB 4.16Å; F242-V335 HydrophobicContact CE1-CG1 3.97Å; F242-V335 HydrophobicContact CZ-CG1 4.32Å; F242-M336 HydrophobicContact CB-SD 4.36Å; F242-M336 HydrophobicContact CD1-CE 4.14Å; F242-M336 HydrophobicContact CD1-CG 3.78Å; F242-M336 HydrophobicContact CD1-SD 3.76Å; F242-M336 HydrophobicContact CE1-CG 4.16Å; F242-H414 AromaticContact CZ-CD2 3.66Å; F242-H414 AromaticContact CZ-NE2 3.72Å; F242-V415 HydrophobicContact CE2-CG1 4.14Å; F242-P417 HydrophobicContact CD2-CG 3.94Å; F242-P417 HydrophobicContact CE2-CG 3.96Å
243	L	98.3	Very high	96.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	10%	0.101	C	C	.	.	B	Isolated β-bridge	trans	-81.1	137.4	176.5	-92.8	69.4	0	0	0	112.1	S237 W248 L251 M312 I314 T325 V328 M336	S237-L243 PolarHBondContact N-O 2.92Å; L243-W248 HydrophobicContact CB-CD2 3.88Å; L243-W248 HydrophobicContact CB-CG 4.2Å; L243-W248 HydrophobicContact CB-CH2 4.31Å; L243-W248 HydrophobicContact CB-CZ2 3.62Å; L243-W248 VanDerWaalsContact CB-NE1 3.32Å; L243-W248 HydrophobicContact CD2-CD2 3.76Å; L243-W248 HydrophobicContact CD2-CE3 3.67Å; L243-W248 HydrophobicContact CD2-CG 4.37Å; L243-W248 HydrophobicContact CD2-CH2 4.01Å; L243-W248 HydrophobicContact CD2-CZ2 4.11Å; L243-W248 HydrophobicContact CD2-CZ3 3.77Å; L243-W248 HydrophobicContact CG-CZ2 4.39Å; L243-W248 PolarHBondContact O-NE1 2.85Å; L243-W248 VanDerWaalsContact O-NE1 3.15Å; L243-L251 HydrophobicContact CD2-CD1 3.52Å; L243-L251 HydrophobicContact CD2-CG 4.08Å; L243-M312 HydrophobicContact CD1-CE 3.86Å; L243-M312 HydrophobicContact CD1-SD 3.95Å; L243-I314 HydrophobicContact CD1-CD1 4.3Å; L243-I314 HydrophobicContact CD2-CD1 3.66Å; L243-I314 HydrophobicContact CG-CD1 4.1Å; L243-T325 HydrophobicContact CD1-CG2 3.63Å; L243-T325 HydrophobicContact CG-CG2 3.68Å; L243-V328 HydrophobicContact CD1-CG2 4.46Å; L243-M336 HydrophobicContact CD1-CE 3.81Å; L243-M336 HydrophobicContact CD1-SD 3.5Å; L243-M336 WeakPolarHBondContact CD1-SD 3.47Å
244	G	95.6	Very high	96.9	Very high	12 Å²	12	16.1 Å²	16.1	12%	0.124	10%	0.097	C	C	.	.			trans	-89	174.8	166.1	0	0	0	0	0	113	V246 S247 W248	G244-V246 PolarHBondContact O-N 2.76Å; G244-S247 WeakPolarHBondContact O-CB 3.45Å; G244-S247 PolarHBondContact O-N 2.87Å; G244-S247 VanDerWaalsContact O-N 3.09Å; G244-W248 VanDerWaalsContact O-CD1 3.22Å; G244-W248 PolarHBondContact O-N 3.22Å; G244-W248 VanDerWaalsContact O-N 3.08Å
245	G	95.6	Very high	97.1	Very high	26 Å²	26	15.4 Å²	15.4	27%	0.268	9%	0.089	S	C	.	.	H	α-helix	trans	-56.5	-41.6	-173.2	0	0	0	0	0	115	Y236 W248 A249	Y236-G245 VanDerWaalsContact OH-CA 3.29Å; Y236-G245 WeakPolarHBondContact OH-CA 3.34Å; G245-W248 PolarHBondContact O-N 3.48Å; G245-A249 WeakPolarHBondContact O-CB 3.26Å; G245-A249 PolarHBondContact O-N 2.72Å
246	V	96.9	Very high	97.2	Very high	61 Å²	61	15.6 Å²	15.6	37%	0.37	9%	0.09	S	C	.	.	H	α-helix	trans	-67	-37.6	177.2	70.3	0	0	0	0	112.2	V205 I209 G244 A249 M250	V205-V246 HydrophobicContact CG1-CG2 3.71Å; I209-V246 HydrophobicContact CD1-CG2 4.14Å; G244-V246 PolarHBondContact O-N 2.76Å; V246-A249 WeakPolarHBondContact O-CB 3.44Å; V246-A249 PolarHBondContact O-N 3.09Å; V246-M250 HydrophobicContact CG2-CE 4.3Å; V246-M250 WeakPolarHBondContact O-CG 3.34Å; V246-M250 PolarHBondContact O-N 2.94Å
247	S	98.5	Very high	97.3	Very high	1 Å²	1	13 Å²	13	1%	0.007	8%	0.08	C	C	.	.	H	α-helix	trans	-65.6	-42.7	177.3	-46.3	0	0	0	0	110.9	G244 M250 L251 S324	G244-S247 WeakPolarHBondContact O-CB 3.45Å; G244-S247 PolarHBondContact O-N 2.87Å; G244-S247 VanDerWaalsContact O-N 3.09Å; S247-M250 PolarHBondContact O-N 2.77Å; S247-L251 PolarHBondContact O-N 3.29Å; S247-S324 WeakPolarHBondContact CB-OG 3.34Å; S247-S324 PolarHBondContact OG-O 3.1Å; S247-S324 VanDerWaalsContact OG-O 3.09Å; S247-S324 PolarHBondContact OG-OG 2.93Å
248	W	98.8	Very high	97.4	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.7	-40.9	172	-69.8	117.8	0	0	0	112.5	L223 V226 W229 A230 I235 Y236 L243 G244 G245 M250 L251 V252 F271 F340	L223-W248 HydrophobicContact CD1-CB 4.29Å; V226-W248 HydrophobicContact CG1-CD2 4.34Å; V226-W248 HydrophobicContact CG1-CE3 3.79Å; V226-W248 HydrophobicContact CG1-CZ3 4.43Å; W229-W248 HydrophobicContact CH2-CH2 4.4Å; W229-W248 AromaticContact CZ3-CH2 3.74Å; W229-W248 HydrophobicContact CZ3-CH2 3.74Å; W229-W248 HydrophobicContact CZ3-CZ2 4.5Å; W229-W248 AromaticContact CZ3-CZ3 3.9Å; W229-W248 HydrophobicContact CZ3-CZ3 3.9Å; A230-W248 HydrophobicContact CB-CD2 4.15Å; A230-W248 VanDerWaalsContact CB-CE2 3.48Å; A230-W248 HydrophobicContact CB-CH2 4.25Å; A230-W248 HydrophobicContact CB-CZ2 3.54Å; I235-W248 HydrophobicContact CD1-CH2 4.07Å; I235-W248 HydrophobicContact CD1-CZ2 4.18Å; I235-W248 HydrophobicContact CG1-CZ2 4.13Å; I235-W248 WeakPolarHBondContact O-CZ2 3.24Å; Y236-W248 AromaticContact CD2-CD1 3.4Å; Y236-W248 VanDerWaalsContact CD2-CD1 3.4Å; Y236-W248 AromaticContact CD2-NE1 3.4Å; Y236-W248 AromaticContact CE2-CD1 3.49Å; Y236-W248 VanDerWaalsContact CE2-CD1 3.49Å; Y236-W248 HydrophobicContact CE2-CG 4.5Å; L243-W248 HydrophobicContact CB-CD2 3.88Å; L243-W248 HydrophobicContact CB-CG 4.2Å; L243-W248 HydrophobicContact CB-CH2 4.31Å; L243-W248 HydrophobicContact CB-CZ2 3.62Å; L243-W248 VanDerWaalsContact CB-NE1 3.32Å; L243-W248 HydrophobicContact CD2-CD2 3.76Å; L243-W248 HydrophobicContact CD2-CE3 3.67Å; L243-W248 HydrophobicContact CD2-CG 4.37Å; L243-W248 HydrophobicContact CD2-CH2 4.01Å; L243-W248 HydrophobicContact CD2-CZ2 4.11Å; L243-W248 HydrophobicContact CD2-CZ3 3.77Å; L243-W248 HydrophobicContact CG-CZ2 4.39Å; L243-W248 PolarHBondContact O-NE1 2.85Å; L243-W248 VanDerWaalsContact O-NE1 3.15Å; G244-W248 VanDerWaalsContact O-CD1 3.22Å; G244-W248 PolarHBondContact O-N 3.22Å; G244-W248 VanDerWaalsContact O-N 3.08Å; G245-W248 PolarHBondContact O-N 3.48Å; W248-M250 VanDerWaalsContact C-N 3.32Å; W248-M250 PolarHBondContact O-N 3.09Å; W248-L251 HydrophobicContact CE3-CD1 4.06Å; W248-L251 HydrophobicContact CZ3-CD1 3.93Å; W248-L251 PolarHBondContact O-N 3.45Å; W248-V252 WeakPolarHBondContact O-CG2 3.38Å; W248-V252 PolarHBondContact O-N 2.8Å; W248-F271 AromaticContact CE3-CZ 3.9Å; W248-F271 HydrophobicContact CE3-CZ 3.9Å; W248-F271 HydrophobicContact CZ3-CE1 4.45Å; W248-F271 AromaticContact CZ3-CZ 3.8Å; W248-F271 HydrophobicContact CZ3-CZ 3.8Å; W248-F340 AromaticContact CH2-CE1 3.96Å; W248-F340 HydrophobicContact CH2-CE1 3.96Å; W248-F340 HydrophobicContact CH2-CZ 4.01Å; W248-F340 AromaticContact CZ3-CE1 3.73Å; W248-F340 HydrophobicContact CZ3-CE1 3.73Å; W248-F340 AromaticContact CZ3-CZ 3.85Å; W248-F340 HydrophobicContact CZ3-CZ 3.85Å
249	A	98.7	Very high	97.6	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-59.9	-41.7	175	0	0	0	0	0	112.1	L104 I209 F219 L223 G245 V246 V252 A253	L104-A249 HydrophobicContact CD1-CB 3.81Å; I209-A249 HydrophobicContact CD1-CB 4.34Å; F219-A249 HydrophobicContact CZ-CB 4.42Å; L223-A249 HydrophobicContact CD1-CB 4.3Å; L223-A249 HydrophobicContact CD2-CB 3.65Å; G245-A249 WeakPolarHBondContact O-CB 3.26Å; G245-A249 PolarHBondContact O-N 2.72Å; V246-A249 WeakPolarHBondContact O-CB 3.44Å; V246-A249 PolarHBondContact O-N 3.09Å; A249-V252 PolarHBondContact O-N 2.81Å; A249-A253 VanDerWaalsContact O-CB 3.27Å; A249-A253 WeakPolarHBondContact O-CB 3.4Å; A249-A253 PolarHBondContact O-N 2.93Å
250	M	98.8	Very high	97.9	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-70.8	-37.6	178.3	-66.9	-171.4	-68.8	0	0	113.2	I209 V246 S247 W248 A253 R254 L286 I314 T316 S324	I209-M250 HydrophobicContact CD1-CG 3.6Å; I209-M250 HydrophobicContact CD1-SD 4.43Å; I209-M250 HydrophobicContact CG1-CG 4.06Å; V246-M250 HydrophobicContact CG2-CE 4.3Å; V246-M250 WeakPolarHBondContact O-CG 3.34Å; V246-M250 PolarHBondContact O-N 2.94Å; S247-M250 PolarHBondContact O-N 2.77Å; W248-M250 VanDerWaalsContact C-N 3.32Å; W248-M250 PolarHBondContact O-N 3.09Å; M250-A253 PolarHBondContact O-N 3.29Å; M250-R254 PolarHBondContact O-N 2.86Å; M250-L286 HydrophobicContact CB-CD1 4.04Å; M250-L286 HydrophobicContact CG-CD1 3.81Å; M250-L286 HydrophobicContact SD-CD1 4.48Å; M250-I314 HydrophobicContact CB-CG2 3.83Å; M250-I314 HydrophobicContact CE-CG2 3.86Å; M250-T316 HydrophobicContact CE-CG2 4.07Å; M250-T316 HydrophobicContact SD-CG2 4.36Å; M250-S324 WeakPolarHBondContact CE-OG 3.35Å
251	L	98.9	Very high	98	Very high	0 Å²	0	12 Å²	12	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-60.8	-47.7	171.9	-68.2	-166.2	0	0	0	111.6	L243 S247 W248 R254 T255 F271 F275 W280 V284 I314 F340	L243-L251 HydrophobicContact CD2-CD1 3.52Å; L243-L251 HydrophobicContact CD2-CG 4.08Å; S247-L251 PolarHBondContact O-N 3.29Å; W248-L251 HydrophobicContact CE3-CD1 4.06Å; W248-L251 HydrophobicContact CZ3-CD1 3.93Å; W248-L251 PolarHBondContact O-N 3.45Å; L251-R254 PolarHBondContact O-N 2.9Å; L251-T255 PolarHBondContact O-N 3.27Å; L251-T255 VanDerWaalsContact O-N 3.08Å; L251-T255 PolarHBondContact O-OG1 3.42Å; L251-F271 HydrophobicContact CB-CE2 3.6Å; L251-F271 HydrophobicContact CB-CZ 4.27Å; L251-F271 HydrophobicContact CD1-CE2 4.39Å; L251-F271 HydrophobicContact CD1-CZ 4.27Å; L251-F275 HydrophobicContact CB-CD2 4.29Å; L251-F275 HydrophobicContact CB-CE2 3.72Å; L251-F275 HydrophobicContact CB-CZ 3.96Å; L251-F275 HydrophobicContact CD1-CD2 4.33Å; L251-F275 HydrophobicContact CD1-CG 4.44Å; L251-F275 HydrophobicContact CD2-CD1 4.15Å; L251-F275 HydrophobicContact CD2-CE1 3.72Å; L251-F275 HydrophobicContact CD2-CE2 4.25Å; L251-F275 HydrophobicContact CD2-CZ 3.78Å; L251-F275 HydrophobicContact CG-CE2 4.37Å; L251-F275 HydrophobicContact CG-CZ 4.37Å; L251-F275 WeakPolarHBondContact O-CE2 3.12Å; L251-F275 WeakPolarHBondContact O-CZ 3.47Å; L251-W280 HydrophobicContact CD2-CH2 4.49Å; L251-V284 HydrophobicContact CD2-CB 4.28Å; L251-V284 HydrophobicContact CD2-CG1 4.08Å; L251-V284 HydrophobicContact CD2-CG2 3.86Å; L251-I314 HydrophobicContact CD1-CD1 4.15Å; L251-I314 HydrophobicContact CD2-CD1 3.53Å; L251-I314 HydrophobicContact CD2-CG1 3.97Å; L251-I314 HydrophobicContact CD2-CG2 4.3Å; L251-I314 HydrophobicContact CG-CD1 3.8Å; L251-F340 HydrophobicContact CD1-CZ 4.18Å
252	V	98.9	Very high	98.1	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-64.6	-42.9	178.6	174.8	0	0	0	0	111.5	F219 T222 L223 V226 W248 A249 R254 T255 C256 F271	F219-V252 HydrophobicContact CD2-CG1 3.9Å; F219-V252 HydrophobicContact CE2-CB 4.37Å; F219-V252 HydrophobicContact CE2-CG1 4.18Å; T222-V252 HydrophobicContact CG2-CG1 3.61Å; T222-V252 HydrophobicContact CG2-CG2 4.42Å; L223-V252 HydrophobicContact CB-CB 4.44Å; L223-V252 HydrophobicContact CB-CG1 4.12Å; L223-V252 HydrophobicContact CB-CG2 4.48Å; L223-V252 HydrophobicContact CD1-CB 4.28Å; L223-V252 HydrophobicContact CD1-CG2 3.95Å; V226-V252 HydrophobicContact CB-CG2 3.85Å; V226-V252 HydrophobicContact CG1-CG2 3.93Å; V226-V252 HydrophobicContact CG2-CG2 3.84Å; W248-V252 WeakPolarHBondContact O-CG2 3.38Å; W248-V252 PolarHBondContact O-N 2.8Å; A249-V252 PolarHBondContact O-N 2.81Å; V252-R254 VanDerWaalsContact C-N 3.27Å; V252-R254 PolarHBondContact O-N 2.93Å; V252-T255 WeakPolarHBondContact O-CB 3.47Å; V252-T255 PolarHBondContact O-N 3.05Å; V252-T255 VanDerWaalsContact O-N 3.07Å; V252-C256 PolarHBondContact O-N 3.18Å; V252-C256 PolarHBondContact O-SG 3.2Å; V252-C256 VanDerWaalsContact O-SG 3.32Å; V252-F271 HydrophobicContact CG2-CD2 3.82Å; V252-F271 HydrophobicContact CG2-CE2 3.67Å
253	A	98.8	Very high	98.1	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-57.2	-41.6	174.9	0	0	0	0	0	111.6	I209 V213 F219 A249 M250 T255 C256 Q257 L286	I209-A253 HydrophobicContact CG2-CB 4.2Å; V213-A253 HydrophobicContact CG1-CB 3.52Å; F219-A253 HydrophobicContact CD2-CB 4.32Å; F219-A253 HydrophobicContact CE2-CB 3.88Å; A249-A253 VanDerWaalsContact O-CB 3.27Å; A249-A253 WeakPolarHBondContact O-CB 3.4Å; A249-A253 PolarHBondContact O-N 2.93Å; M250-A253 PolarHBondContact O-N 3.29Å; A253-T255 VanDerWaalsContact C-N 3.35Å; A253-T255 PolarHBondContact O-N 3.32Å; A253-C256 WeakPolarHBondContact O-CB 3.31Å; A253-C256 PolarHBondContact O-N 2.88Å; A253-Q257 WeakPolarHBondContact O-CG 3.36Å; A253-Q257 PolarHBondContact O-N 3.09Å; A253-L286 HydrophobicContact CB-CD1 3.98Å; A253-L286 HydrophobicContact CB-CD2 3.8Å
254	R	98.8	Very high	98.1	Very high	8 Å²	8	12.9 Å²	12.9	3%	0.03	8%	0.082	C	C	.	.	H	α-helix	trans	-65.2	-36.5	175.9	-172.6	60.7	178.2	138.8	7.5	112.2	T22 M250 L251 V252 Q257 L258 F275 V284 L285 L286	T22-R254 PolarHBondContact OG1-NH2 3.29Å; M250-R254 PolarHBondContact O-N 2.86Å; L251-R254 PolarHBondContact O-N 2.9Å; V252-R254 VanDerWaalsContact C-N 3.27Å; V252-R254 PolarHBondContact O-N 2.93Å; R254-Q257 VanDerWaalsContact CD-OE1 3.25Å; R254-Q257 PolarHBondContact O-N 3.09Å; R254-L258 HydrophobicContact CG-CD1 4.38Å; R254-L258 VanDerWaalsContact O-CG 3.32Å; R254-L258 WeakPolarHBondContact O-CG 3.17Å; R254-L258 PolarHBondContact O-N 2.74Å; R254-F275 HydrophobicContact CB-CZ 4.37Å; R254-V284 HydrophobicContact CB-CG1 3.96Å; R254-V284 HydrophobicContact CG-CG1 4.04Å; R254-L285 WeakPolarHBondContact CD-O 3.29Å; R254-L286 HydrophobicContact CB-CD2 3.82Å
255	T	98.8	Very high	98.3	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62.8	-43.9	171.3	-50.9	0	0	0	0	111.6	L251 V252 A253 Q257 L258 Y259 L267 K270 F271 F275	L251-T255 PolarHBondContact O-N 3.27Å; L251-T255 VanDerWaalsContact O-N 3.08Å; L251-T255 PolarHBondContact O-OG1 3.42Å; V252-T255 WeakPolarHBondContact O-CB 3.47Å; V252-T255 PolarHBondContact O-N 3.05Å; V252-T255 VanDerWaalsContact O-N 3.07Å; A253-T255 VanDerWaalsContact C-N 3.35Å; A253-T255 PolarHBondContact O-N 3.32Å; T255-Q257 VanDerWaalsContact C-N 3.31Å; T255-Q257 PolarHBondContact O-N 3.13Å; T255-L258 PolarHBondContact O-N 3.04Å; T255-L258 VanDerWaalsContact O-N 3.13Å; T255-Y259 HydrophobicContact CG2-CD2 4.3Å; T255-Y259 PolarHBondContact O-N 2.91Å; T255-L267 HydrophobicContact CG2-CD2 4.03Å; T255-K270 HydrophobicContact CG2-CB 3.84Å; T255-F271 HydrophobicContact CG2-CB 4.17Å; T255-F275 WeakPolarHBondContact OG1-CE2 3.46Å
256	C	98.7	Very high	98.4	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.02	7%	0.07	C	C	.	.	H	α-helix	trans	-60.5	-38.5	176.5	-62.2	0	0	0	0	112.4	V213 P214 V252 A253 L258 Y259 P260	V213-C256 HydrophobicContact CG1-CB 4.33Å; P214-C256 HydrophobicContact CG-CB 4.47Å; P214-C256 WeakPolarHBondContact CG-O 3.38Å; V252-C256 PolarHBondContact O-N 3.18Å; V252-C256 PolarHBondContact O-SG 3.2Å; V252-C256 VanDerWaalsContact O-SG 3.32Å; A253-C256 WeakPolarHBondContact O-CB 3.31Å; A253-C256 PolarHBondContact O-N 2.88Å; C256-L258 VanDerWaalsContact C-N 3.32Å; C256-L258 PolarHBondContact O-N 3.26Å; C256-Y259 CarbonylContact O-C 3.55Å; C256-Y259 PolarHBondContact O-N 2.82Å; C256-P260 VanDerWaalsContact O-CA 3.28Å; C256-P260 WeakPolarHBondContact O-CA 3.43Å
257	Q	98.6	Very high	98.5	Very high	4 Å²	4	9.4 Å²	9.4	2%	0.019	5%	0.053	C	C	.	.	H	α-helix	trans	-61.1	-38.3	174	-70.3	-178.6	-11.8	0	0	113.1	Y19 L212 A253 R254 T255 Y259 L286	Y19-Q257 WeakPolarHBondContact O-CB 3.15Å; L212-Q257 WeakPolarHBondContact O-CG 3.39Å; L212-Q257 PolarHBondContact O-NE2 3.45Å; A253-Q257 WeakPolarHBondContact O-CG 3.36Å; A253-Q257 PolarHBondContact O-N 3.09Å; R254-Q257 VanDerWaalsContact CD-OE1 3.25Å; R254-Q257 PolarHBondContact O-N 3.09Å; T255-Q257 VanDerWaalsContact C-N 3.31Å; T255-Q257 PolarHBondContact O-N 3.13Å; Q257-Y259 VanDerWaalsContact C-N 3.34Å; Q257-L286 PolarHBondContact NE2-O 2.86Å
258	L	98.6	Very high	98.5	Very high	9 Å²	9	9.5 Å²	9.5	5%	0.047	5%	0.054	C	C	.	.	H	α-helix	trans	-78.5	-18.2	-177.5	-65	167.9	0	0	0	113.2	I25 S26 R254 T255 C256 V274	I25-L258 HydrophobicContact CD1-CB 4.08Å; I25-L258 HydrophobicContact CD1-CD1 4.12Å; I25-L258 HydrophobicContact CD1-CD2 4.06Å; I25-L258 HydrophobicContact CD1-CG 4.31Å; I25-L258 HydrophobicContact CG1-CB 4.26Å; I25-L258 HydrophobicContact CG1-CD2 4.03Å; I25-L258 PolarHBondContact N-O 3.24Å; S26-L258 PolarHBondContact N-O 3.38Å; R254-L258 HydrophobicContact CG-CD1 4.38Å; R254-L258 VanDerWaalsContact O-CG 3.32Å; R254-L258 WeakPolarHBondContact O-CG 3.17Å; R254-L258 PolarHBondContact O-N 2.74Å; T255-L258 PolarHBondContact O-N 3.04Å; T255-L258 VanDerWaalsContact O-N 3.13Å; C256-L258 VanDerWaalsContact C-N 3.32Å; C256-L258 PolarHBondContact O-N 3.26Å; L258-V274 HydrophobicContact CD1-CG1 4.3Å; L258-V274 HydrophobicContact CD1-CG2 4.2Å
259	Y	98.4	Very high	98.5	Very high	23 Å²	23	10.1 Å²	10.1	9%	0.09	6%	0.056	C	C	.	.	S	Bend	trans	-140.3	63.5	-177.2	-61.6	-85.7	0	0	0	110.8	I25 T255 C256 Q257 N261 A262 K270 V274	I25-Y259 HydrophobicContact CB-CE1 4.03Å; I25-Y259 HydrophobicContact CB-CE2 4.4Å; I25-Y259 HydrophobicContact CD1-CE2 4.12Å; I25-Y259 HydrophobicContact CG2-CE1 3.97Å; I25-Y259 WeakPolarHBondContact CG2-OH 3.5Å; T255-Y259 HydrophobicContact CG2-CD2 4.3Å; T255-Y259 PolarHBondContact O-N 2.91Å; C256-Y259 CarbonylContact O-C 3.55Å; C256-Y259 PolarHBondContact O-N 2.82Å; Q257-Y259 VanDerWaalsContact C-N 3.34Å; Y259-N261 VanDerWaalsContact C-N 3.27Å; Y259-N261 PolarHBondContact O-N 2.96Å; Y259-N261 VanDerWaalsContact O-N 3.13Å; Y259-A262 PolarHBondContact O-N 3.3Å; Y259-K270 HydrophobicContact CD1-CD 4.45Å; Y259-K270 HydrophobicContact CD1-CG 3.96Å; Y259-K270 HydrophobicContact CD2-CB 3.72Å; Y259-K270 HydrophobicContact CD2-CG 3.85Å; Y259-K270 HydrophobicContact CE1-CD 3.86Å; Y259-K270 HydrophobicContact CE1-CG 3.83Å; Y259-K270 HydrophobicContact CE2-CB 3.6Å; Y259-K270 HydrophobicContact CE2-CD 4.16Å; Y259-K270 HydrophobicContact CE2-CG 3.74Å; Y259-K270 HydrophobicContact CG-CB 4.3Å; Y259-K270 HydrophobicContact CG-CG 3.96Å; Y259-V274 HydrophobicContact CE2-CG2 4.23Å
260	P	97.8	Very high	98.5	Very high	27 Å²	27	12.3 Å²	12.3	18%	0.175	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-26.5	-162.4	24	-36.3	0	0	0	115.5	P24 L27 P214 C256	P24-P260 HydrophobicContact CB-CG 4.14Å; P24-P260 HydrophobicContact CG-CG 4.48Å; L27-P260 HydrophobicContact CD2-CG 3.63Å; P214-P260 HydrophobicContact CB-CB 3.81Å; P214-P260 HydrophobicContact CG-CB 3.62Å; C256-P260 VanDerWaalsContact O-CA 3.28Å; C256-P260 WeakPolarHBondContact O-CA 3.43Å
261	N	97.5	Very high	98.5	Very high	77 Å²	77	12.3 Å²	12.3	41%	0.412	7%	0.066	S	C	.	.	T	Hydrogen-bonded Turn	trans	-99.5	-4.4	-175.5	-62.1	-16.2	0	0	0	113.3	L27 P30 Y259	L27-N261 PolarHBondContact O-ND2 2.69Å; P30-N261 WeakPolarHBondContact CD-O 2.97Å; Y259-N261 VanDerWaalsContact C-N 3.27Å; Y259-N261 PolarHBondContact O-N 2.96Å; Y259-N261 VanDerWaalsContact O-N 3.13Å
262	A	98.1	Very high	98.5	Very high	9 Å²	9	12.3 Å²	12.3	7%	0.074	7%	0.066	C	C	.	.			trans	-79.9	150	-168	0	0	0	0	0	113.7	Y259 T266 L267	Y259-A262 PolarHBondContact O-N 3.3Å; A262-T266 HydrophobicContact CB-CG2 4.3Å; A262-L267 HydrophobicContact CB-CD2 4.23Å; A262-L267 HydrophobicContact CB-CG 4.18Å
263	A	98.3	Very high	98.5	Very high	9 Å²	9	14.3 Å²	14.3	7%	0.074	8%	0.077	C	C	.	.			trans	-74.5	165.4	176.3	0	0	0	0	0	112.8	P30 D34 S265 T266 L267	P30-A263 HydrophobicContact CB-CB 3.76Å; P30-A263 HydrophobicContact CG-CB 4.2Å; D34-A263 HydrophobicContact CB-CB 4.17Å; A263-S265 PolarHBondContact O-N 3.31Å; A263-T266 WeakPolarHBondContact O-CB 3.35Å; A263-T266 PolarHBondContact O-N 3.44Å; A263-L267 WeakPolarHBondContact O-CG 3.45Å; A263-L267 PolarHBondContact O-N 3.28Å
264	A	98.4	Very high	98.5	Very high	1 Å²	1	15.2 Å²	15.2	1%	0.008	8%	0.082	C	C	.	.	H	α-helix	trans	-65.7	-35.3	-171.9	0	0	0	0	0	113.3	T38 T218 L221 T222 L267 V268	T38-A264 HydrophobicContact CG2-CB 4.05Å; T218-A264 HydrophobicContact CG2-CB 3.8Å; T218-A264 VanDerWaalsContact CG2-N 3.3Å; L221-A264 HydrophobicContact CB-CB 4.01Å; L221-A264 HydrophobicContact CD2-CB 3.61Å; L221-A264 HydrophobicContact CG-CB 3.73Å; T222-A264 WeakPolarHBondContact OG1-CA 3.28Å; T222-A264 PolarHBondContact OG1-O 3.34Å; A264-L267 PolarHBondContact O-N 2.92Å; A264-V268 WeakPolarHBondContact O-CG2 3.42Å; A264-V268 PolarHBondContact O-N 3.47Å
265	S	98.1	Very high	98.5	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-56.5	-52.4	170.9	53.2	0	0	0	0	111.7	D34 T38 A263 L267 V268 H269	D34-S265 PolarHBondContact O-OG 3.01Å; T38-S265 WeakPolarHBondContact OG1-CB 3.35Å; T38-S265 PolarHBondContact OG1-N 3.47Å; T38-S265 PolarHBondContact OG1-OG 2.81Å; A263-S265 PolarHBondContact O-N 3.31Å; S265-L267 VanDerWaalsContact C-N 3.34Å; S265-L267 PolarHBondContact O-N 3.02Å; S265-V268 PolarHBondContact O-N 2.74Å; S265-H269 PolarHBondContact O-N 3.22Å
266	T	98.5	Very high	98.5	Very high	22 Å²	22	15.7 Å²	15.7	14%	0.135	9%	0.086	C	C	.	.	H	α-helix	trans	-60.4	-43.3	176.9	-31.9	0	0	0	0	110.7	D34 A262 A263 V268 H269 K270	D34-T266 PolarHBondContact OD1-OG1 2.79Å; A262-T266 HydrophobicContact CB-CG2 4.3Å; A263-T266 WeakPolarHBondContact O-CB 3.35Å; A263-T266 PolarHBondContact O-N 3.44Å; T266-V268 PolarHBondContact O-N 2.85Å; T266-H269 WeakPolarHBondContact O-CB 3.37Å; T266-H269 PolarHBondContact O-N 3.4Å; T266-K270 WeakPolarHBondContact O-CG 3.27Å; T266-K270 PolarHBondContact O-N 3.21Å
267	L	98.8	Very high	98.5	Very high	4 Å²	4	22.6 Å²	22.6	2%	0.021	12%	0.116	C	C	.	.	H	α-helix	trans	-65.8	-35.4	178.7	-74.2	172.9	0	0	0	113.2	T218 T222 T255 A262 A263 A264 S265 K270 F271	T218-L267 HydrophobicContact CG2-CD1 3.7Å; T222-L267 HydrophobicContact CG2-CB 3.95Å; T222-L267 WeakPolarHBondContact OG1-CB 3.4Å; T255-L267 HydrophobicContact CG2-CD2 4.03Å; A262-L267 HydrophobicContact CB-CD2 4.23Å; A262-L267 HydrophobicContact CB-CG 4.18Å; A263-L267 WeakPolarHBondContact O-CG 3.45Å; A263-L267 PolarHBondContact O-N 3.28Å; A264-L267 PolarHBondContact O-N 2.92Å; S265-L267 VanDerWaalsContact C-N 3.34Å; S265-L267 PolarHBondContact O-N 3.02Å; L267-K270 PolarHBondContact O-N 3.03Å; L267-F271 VanDerWaalsContact O-CB 3.27Å; L267-F271 WeakPolarHBondContact O-CB 3.39Å; L267-F271 PolarHBondContact O-N 2.9Å
268	V	98.8	Very high	98.4	Very high	2 Å²	2	25.1 Å²	25.1	1%	0.012	13%	0.125	C	C	.	.	H	α-helix	trans	-64.9	-39.9	173.1	173.3	0	0	0	0	111	L41 T222 A225 A264 S265 T266 F272 T347 W357 L360	L41-V268 HydrophobicContact CD2-CG2 3.98Å; T222-V268 HydrophobicContact CG2-CG2 3.86Å; A225-V268 HydrophobicContact CB-CG2 3.84Å; A264-V268 WeakPolarHBondContact O-CG2 3.42Å; A264-V268 PolarHBondContact O-N 3.47Å; S265-V268 PolarHBondContact O-N 2.74Å; T266-V268 PolarHBondContact O-N 2.85Å; V268-F272 HydrophobicContact CG1-CD2 4.39Å; V268-F272 HydrophobicContact CG1-CE2 3.73Å; V268-F272 WeakPolarHBondContact O-CD2 3.3Å; V268-F272 PolarHBondContact O-N 3.49Å; V268-T347 HydrophobicContact CG1-CG2 4.22Å; V268-W357 HydrophobicContact CB-CH2 4.22Å; V268-W357 HydrophobicContact CB-CZ3 4.22Å; V268-W357 HydrophobicContact CG1-CH2 4.24Å; V268-W357 HydrophobicContact CG1-CZ3 3.76Å; V268-L360 HydrophobicContact CG1-CD2 3.93Å
269	H	98.8	Very high	98.4	Very high	13 Å²	13	31.7 Å²	31.7	6%	0.06	16%	0.156	C	C	.	.	H	α-helix	trans	-61.9	-49.9	170.8	176.6	-93.1	0	0	0	112	S265 T266 F271 F272 L273 T347 D348 L351	S265-H269 PolarHBondContact O-N 3.22Å; T266-H269 WeakPolarHBondContact O-CB 3.37Å; T266-H269 PolarHBondContact O-N 3.4Å; H269-F271 VanDerWaalsContact C-N 3.27Å; H269-F271 PolarHBondContact O-N 3.34Å; H269-F272 PolarHBondContact O-N 3.07Å; H269-L273 PolarHBondContact O-N 2.96Å; H269-T347 PolarHBondContact CD2-OG1 3.15Å; H269-D348 IonicContact CD2-OD1 3.56Å; H269-D348 IonicContact CE1-OD1 3.69Å; H269-D348 IonicContact NE2-OD1 2.72Å; H269-D348 PolarHBondContact NE2-OD1 2.98Å; H269-L351 HydrophobicContact CB-CD1 3.69Å
270	K	98.8	Very high	98.4	Very high	47 Å²	47	32.2 Å²	32.2	20%	0.204	16%	0.158	C	C	.	.	H	α-helix	trans	-64.3	-31.2	-178.8	-65.2	-43.3	177.2	-152.8	0	113.1	T255 Y259 T266 L267 L273 V274	T255-K270 HydrophobicContact CG2-CB 3.84Å; Y259-K270 HydrophobicContact CD1-CD 4.45Å; Y259-K270 HydrophobicContact CD1-CG 3.96Å; Y259-K270 HydrophobicContact CD2-CB 3.72Å; Y259-K270 HydrophobicContact CD2-CG 3.85Å; Y259-K270 HydrophobicContact CE1-CD 3.86Å; Y259-K270 HydrophobicContact CE1-CG 3.83Å; Y259-K270 HydrophobicContact CE2-CB 3.6Å; Y259-K270 HydrophobicContact CE2-CD 4.16Å; Y259-K270 HydrophobicContact CE2-CG 3.74Å; Y259-K270 HydrophobicContact CG-CB 4.3Å; Y259-K270 HydrophobicContact CG-CG 3.96Å; T266-K270 WeakPolarHBondContact O-CG 3.27Å; T266-K270 PolarHBondContact O-N 3.21Å; L267-K270 PolarHBondContact O-N 3.03Å; K270-L273 HydrophobicContact CD-CD2 3.92Å; K270-L273 PolarHBondContact O-N 3Å; K270-V274 WeakPolarHBondContact O-CB 3.16Å; K270-V274 VanDerWaalsContact O-CG2 3.27Å; K270-V274 WeakPolarHBondContact O-CG2 3.35Å; K270-V274 PolarHBondContact O-N 3.46Å
271	F	98.9	Very high	98.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-58.1	-51.4	173.2	174.2	-88.7	0	0	0	111	V226 W229 W248 L251 V252 T255 L267 H269 V274 F275 F340	V226-F271 HydrophobicContact CB-CZ 4.46Å; V226-F271 HydrophobicContact CG1-CE1 3.88Å; V226-F271 HydrophobicContact CG1-CE2 3.89Å; V226-F271 HydrophobicContact CG1-CZ 3.45Å; V226-F271 VanDerWaalsContact CG1-CZ 3.45Å; V226-F271 HydrophobicContact CG2-CD1 3.96Å; V226-F271 HydrophobicContact CG2-CD2 4.18Å; V226-F271 HydrophobicContact CG2-CE1 4Å; V226-F271 HydrophobicContact CG2-CE2 4.19Å; V226-F271 HydrophobicContact CG2-CG 4.07Å; V226-F271 HydrophobicContact CG2-CZ 4.12Å; W229-F271 HydrophobicContact CZ3-CE1 4.25Å; W248-F271 AromaticContact CE3-CZ 3.9Å; W248-F271 HydrophobicContact CE3-CZ 3.9Å; W248-F271 HydrophobicContact CZ3-CE1 4.45Å; W248-F271 AromaticContact CZ3-CZ 3.8Å; W248-F271 HydrophobicContact CZ3-CZ 3.8Å; L251-F271 HydrophobicContact CB-CE2 3.6Å; L251-F271 HydrophobicContact CB-CZ 4.27Å; L251-F271 HydrophobicContact CD1-CE2 4.39Å; L251-F271 HydrophobicContact CD1-CZ 4.27Å; V252-F271 HydrophobicContact CG2-CD2 3.82Å; V252-F271 HydrophobicContact CG2-CE2 3.67Å; T255-F271 HydrophobicContact CG2-CB 4.17Å; L267-F271 VanDerWaalsContact O-CB 3.27Å; L267-F271 WeakPolarHBondContact O-CB 3.39Å; L267-F271 PolarHBondContact O-N 2.9Å; H269-F271 VanDerWaalsContact C-N 3.27Å; H269-F271 PolarHBondContact O-N 3.34Å; F271-V274 PolarHBondContact O-N 3.22Å; F271-F275 AromaticContact CD2-CD2 3.77Å; F271-F275 HydrophobicContact CD2-CD2 3.77Å; F271-F275 AromaticContact CD2-CE2 3.71Å; F271-F275 HydrophobicContact CD2-CE2 3.71Å; F271-F275 AromaticContact CE2-CD2 3.81Å; F271-F275 HydrophobicContact CE2-CD2 3.81Å; F271-F275 AromaticContact CE2-CE2 3.85Å; F271-F275 HydrophobicContact CE2-CE2 3.85Å; F271-F275 HydrophobicContact CG-CD2 4.13Å; F271-F275 HydrophobicContact CG-CE2 4.43Å; F271-F275 HydrophobicContact CZ-CD2 4.17Å; F271-F275 WeakPolarHBondContact O-CD2 3.34Å; F271-F275 PolarHBondContact O-N 2.74Å; F271-F340 HydrophobicContact CE1-CD1 4.27Å; F271-F340 AromaticContact CE1-CE1 3.87Å; F271-F340 HydrophobicContact CE1-CE1 3.87Å; F271-F340 HydrophobicContact CZ-CE1 4.16Å
272	F	98.9	Very high	98.4	Very high	1 Å²	1	34.8 Å²	34.8	0%	0.004	17%	0.174	C	C	.	.	H	α-helix	trans	-67.7	-39.4	176.6	-60.7	-55.7	0	0	0	112.4	W229 V268 H269 V274 F275 S276 F340 G343 L344 T347 L360	W229-F272 AromaticContact CD2-CE1 3.8Å; W229-F272 HydrophobicContact CD2-CE1 3.8Å; W229-F272 AromaticContact CD2-CZ 3.77Å; W229-F272 HydrophobicContact CD2-CZ 3.77Å; W229-F272 AromaticContact CE2-CE1 3.51Å; W229-F272 AromaticContact CE2-CZ 3.7Å; W229-F272 AromaticContact CE3-CE1 3.99Å; W229-F272 HydrophobicContact CE3-CE1 3.99Å; W229-F272 HydrophobicContact CE3-CZ 4.25Å; W229-F272 HydrophobicContact CG-CZ 4.07Å; W229-F272 AromaticContact CH2-CE1 3.72Å; W229-F272 HydrophobicContact CH2-CE1 3.72Å; W229-F272 HydrophobicContact CZ2-CD1 4.38Å; W229-F272 AromaticContact CZ2-CE1 3.49Å; W229-F272 HydrophobicContact CZ2-CE1 3.49Å; W229-F272 VanDerWaalsContact CZ2-CE1 3.49Å; W229-F272 HydrophobicContact CZ2-CZ 4.17Å; W229-F272 AromaticContact CZ3-CE1 3.95Å; W229-F272 HydrophobicContact CZ3-CE1 3.95Å; W229-F272 AromaticContact NE1-CZ 3.84Å; V268-F272 HydrophobicContact CG1-CD2 4.39Å; V268-F272 HydrophobicContact CG1-CE2 3.73Å; V268-F272 WeakPolarHBondContact O-CD2 3.3Å; V268-F272 PolarHBondContact O-N 3.49Å; H269-F272 PolarHBondContact O-N 3.07Å; F272-V274 VanDerWaalsContact C-N 3.3Å; F272-V274 PolarHBondContact O-N 3.28Å; F272-F275 PolarHBondContact O-N 2.65Å; F272-S276 WeakPolarHBondContact O-CB 3.29Å; F272-S276 PolarHBondContact O-N 3.11Å; F272-S276 PolarHBondContact O-OG 2.98Å; F272-F340 HydrophobicContact CD1-CD1 4.14Å; F272-F340 HydrophobicContact CE1-CD1 4.44Å; F272-G343 VanDerWaalsContact CD2-C 3.49Å; F272-L344 HydrophobicContact CB-CB 3.8Å; F272-T347 HydrophobicContact CD2-CG2 3.69Å; F272-T347 HydrophobicContact CE2-CG2 3.76Å; F272-L360 HydrophobicContact CE2-CD1 3.82Å; F272-L360 HydrophobicContact CE2-CD2 3.98Å; F272-L360 HydrophobicContact CZ-CD1 3.97Å; F272-L360 HydrophobicContact CZ-CD2 4.4Å
273	L	98.7	Very high	98.4	Very high	42 Å²	42	36.2 Å²	36.2	22%	0.22	18%	0.183	C	C	.	.	H	α-helix	trans	-59.7	-39	177.2	-179	61.2	0	0	0	112.7	H269 K270 K277 L344	H269-L273 PolarHBondContact O-N 2.96Å; K270-L273 HydrophobicContact CD-CD2 3.92Å; K270-L273 PolarHBondContact O-N 3Å; L273-K277 HydrophobicContact CD1-CD 4.24Å; L273-L344 HydrophobicContact CB-CD1 3.97Å; L273-L344 HydrophobicContact CD1-CD1 4.23Å; L273-L344 HydrophobicContact CD1-CD2 4.11Å
274	V	98.6	Very high	98.5	Very high	18 Å²	18	35.9 Å²	35.9	11%	0.109	18%	0.179	C	C	.	.	H	α-helix	trans	-73.5	-55.2	177.1	171.3	0	0	0	0	110.5	L258 Y259 K270 F271 F272 K277 W278	L258-V274 HydrophobicContact CD1-CG1 4.3Å; L258-V274 HydrophobicContact CD1-CG2 4.2Å; Y259-V274 HydrophobicContact CE2-CG2 4.23Å; K270-V274 WeakPolarHBondContact O-CB 3.16Å; K270-V274 VanDerWaalsContact O-CG2 3.27Å; K270-V274 WeakPolarHBondContact O-CG2 3.35Å; K270-V274 PolarHBondContact O-N 3.46Å; F271-V274 PolarHBondContact O-N 3.22Å; F272-V274 VanDerWaalsContact C-N 3.3Å; F272-V274 PolarHBondContact O-N 3.28Å; V274-K277 CarbonylContact O-C 3.5Å; V274-K277 PolarHBondContact O-N 2.84Å; V274-W278 HydrophobicContact CG1-CE3 3.77Å; V274-W278 HydrophobicContact CG1-CZ3 4.16Å; V274-W278 PolarHBondContact O-N 3.35Å
275	F	98.7	Very high	98.5	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-82.4	-16	-169.2	-60.6	-58.6	0	0	0	115.5	L251 R254 T255 F271 F272 K277 W278 W280 V284 F340	L251-F275 HydrophobicContact CB-CD2 4.29Å; L251-F275 HydrophobicContact CB-CE2 3.72Å; L251-F275 HydrophobicContact CB-CZ 3.96Å; L251-F275 HydrophobicContact CD1-CD2 4.33Å; L251-F275 HydrophobicContact CD1-CG 4.44Å; L251-F275 HydrophobicContact CD2-CD1 4.15Å; L251-F275 HydrophobicContact CD2-CE1 3.72Å; L251-F275 HydrophobicContact CD2-CE2 4.25Å; L251-F275 HydrophobicContact CD2-CZ 3.78Å; L251-F275 HydrophobicContact CG-CE2 4.37Å; L251-F275 HydrophobicContact CG-CZ 4.37Å; L251-F275 WeakPolarHBondContact O-CE2 3.12Å; L251-F275 WeakPolarHBondContact O-CZ 3.47Å; R254-F275 HydrophobicContact CB-CZ 4.37Å; T255-F275 WeakPolarHBondContact OG1-CE2 3.46Å; F271-F275 AromaticContact CD2-CD2 3.77Å; F271-F275 HydrophobicContact CD2-CD2 3.77Å; F271-F275 AromaticContact CD2-CE2 3.71Å; F271-F275 HydrophobicContact CD2-CE2 3.71Å; F271-F275 AromaticContact CE2-CD2 3.81Å; F271-F275 HydrophobicContact CE2-CD2 3.81Å; F271-F275 AromaticContact CE2-CE2 3.85Å; F271-F275 HydrophobicContact CE2-CE2 3.85Å; F271-F275 HydrophobicContact CG-CD2 4.13Å; F271-F275 HydrophobicContact CG-CE2 4.43Å; F271-F275 HydrophobicContact CZ-CD2 4.17Å; F271-F275 WeakPolarHBondContact O-CD2 3.34Å; F271-F275 PolarHBondContact O-N 2.74Å; F272-F275 PolarHBondContact O-N 2.65Å; F275-K277 VanDerWaalsContact C-N 3.28Å; F275-W278 HydrophobicContact CD1-CB 4.24Å; F275-W278 HydrophobicContact CD1-CD2 4.32Å; F275-W278 HydrophobicContact CD1-CE3 4.17Å; F275-W278 HydrophobicContact CD1-CG 4.37Å; F275-W278 HydrophobicContact CE1-CD2 4.32Å; F275-W278 AromaticContact CE1-CE3 3.93Å; F275-W278 HydrophobicContact CE1-CE3 3.93Å; F275-W278 HydrophobicContact CE1-CZ3 4.34Å; F275-W280 HydrophobicContact CD1-CZ2 4.22Å; F275-V284 HydrophobicContact CE1-CG2 3.98Å; F275-F340 HydrophobicContact CB-CD1 4.46Å; F275-F340 HydrophobicContact CB-CD2 3.96Å; F275-F340 HydrophobicContact CB-CE1 4.41Å; F275-F340 HydrophobicContact CB-CE2 3.92Å; F275-F340 HydrophobicContact CB-CG 4.27Å; F275-F340 HydrophobicContact CB-CZ 4.16Å; F275-F340 WeakPolarHBondContact O-CD2 3.12Å
276	S	98.3	Very high	98.5	Very high	18 Å²	18	37.1 Å²	37.1	13%	0.126	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.8	166	63.7	0	0	0	0	113.6	F272	F272-S276 WeakPolarHBondContact O-CB 3.29Å; F272-S276 PolarHBondContact O-N 3.11Å; F272-S276 PolarHBondContact O-OG 2.98Å
277	K	98.3	Very high	98.3	Very high	148 Å²	148	38.1 Å²	38.1	64%	0.643	19%	0.188	S	C	*	.	S	Bend	trans	-113.7	4.3	-179.7	-61.9	-173.7	178.6	-175.2	0	113.5	L273 V274 F275	L273-K277 HydrophobicContact CD1-CD 4.24Å; V274-K277 CarbonylContact O-C 3.5Å; V274-K277 PolarHBondContact O-N 2.84Å; F275-K277 VanDerWaalsContact C-N 3.28Å
278	W	98.5	Very high	98	Very high	57 Å²	57	43.7 Å²	43.7	22%	0.216	21%	0.214	C	C	.	.			trans	-74	127.9	-177.6	-170.4	-79.7	0	0	0	111	V274 F275 W280 N282 V284	V274-W278 HydrophobicContact CG1-CE3 3.77Å; V274-W278 HydrophobicContact CG1-CZ3 4.16Å; V274-W278 PolarHBondContact O-N 3.35Å; F275-W278 HydrophobicContact CD1-CB 4.24Å; F275-W278 HydrophobicContact CD1-CD2 4.32Å; F275-W278 HydrophobicContact CD1-CE3 4.17Å; F275-W278 HydrophobicContact CD1-CG 4.37Å; F275-W278 HydrophobicContact CE1-CD2 4.32Å; F275-W278 AromaticContact CE1-CE3 3.93Å; F275-W278 HydrophobicContact CE1-CE3 3.93Å; F275-W278 HydrophobicContact CE1-CZ3 4.34Å; W278-W280 VanDerWaalsContact C-N 3.31Å; W278-W280 HydrophobicContact CB-CZ2 4.19Å; W278-W280 AromaticContact CD1-CD2 3.45Å; W278-W280 VanDerWaalsContact CD1-CD2 3.45Å; W278-W280 AromaticContact CD1-CE2 3.5Å; W278-W280 VanDerWaalsContact CD1-CE2 3.5Å; W278-W280 AromaticContact CD1-CE3 3.55Å; W278-W280 AromaticContact CD1-CH2 3.85Å; W278-W280 AromaticContact CD1-CZ2 3.71Å; W278-W280 AromaticContact CD1-CZ3 3.76Å; W278-W280 HydrophobicContact CG-CD2 4.36Å; W278-W280 AromaticContact CG-CE2 3.99Å; W278-W280 HydrophobicContact CG-CH2 4.35Å; W278-W280 AromaticContact CG-CZ2 3.99Å; W278-W280 HydrophobicContact CG-CZ2 3.99Å; W278-W280 AromaticContact NE1-CE3 3.78Å; W278-W280 AromaticContact NE1-CZ3 3.73Å; W278-W280 PolarHBondContact O-N 3.03Å; W278-N282 PolarHBondContact NE1-O 3.13Å; W278-V284 HydrophobicContact CD2-CG2 4.32Å; W278-V284 HydrophobicContact CH2-CG2 4.12Å; W278-V284 HydrophobicContact CZ2-CB 4.45Å; W278-V284 HydrophobicContact CZ2-CG2 3.65Å
279	E	98.1	Very high	97.5	Very high	148 Å²	148	47 Å²	47	69%	0.692	24%	0.235	S	C	*	.			trans	-79.6	74.7	-175.9	-64	-175.2	148.8	0	0	111.5	N282	E279-N282 WeakPolarHBondContact O-CB 3.35Å; E279-N282 VanDerWaalsContact O-CG 3.28Å; E279-N282 PolarHBondContact O-N 3.32Å; E279-N282 PolarHBondContact O-ND2 3.08Å
280	W	98.1	Very high	96.7	Very high	34 Å²	34	51.6 Å²	51.6	13%	0.129	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	131.8	174.4	-57.1	106.6	0	0	0	110.8	L251 F275 W278 V284 M312 I314	L251-W280 HydrophobicContact CD2-CH2 4.49Å; F275-W280 HydrophobicContact CD1-CZ2 4.22Å; W278-W280 VanDerWaalsContact C-N 3.31Å; W278-W280 HydrophobicContact CB-CZ2 4.19Å; W278-W280 AromaticContact CD1-CD2 3.45Å; W278-W280 VanDerWaalsContact CD1-CD2 3.45Å; W278-W280 AromaticContact CD1-CE2 3.5Å; W278-W280 VanDerWaalsContact CD1-CE2 3.5Å; W278-W280 AromaticContact CD1-CE3 3.55Å; W278-W280 AromaticContact CD1-CH2 3.85Å; W278-W280 AromaticContact CD1-CZ2 3.71Å; W278-W280 AromaticContact CD1-CZ3 3.76Å; W278-W280 HydrophobicContact CG-CD2 4.36Å; W278-W280 AromaticContact CG-CE2 3.99Å; W278-W280 HydrophobicContact CG-CH2 4.35Å; W278-W280 AromaticContact CG-CZ2 3.99Å; W278-W280 HydrophobicContact CG-CZ2 3.99Å; W278-W280 AromaticContact NE1-CE3 3.78Å; W278-W280 AromaticContact NE1-CZ3 3.73Å; W278-W280 PolarHBondContact O-N 3.03Å; W280-V284 HydrophobicContact CH2-CG2 3.67Å; W280-V284 HydrophobicContact CZ3-CG2 3.99Å; W280-M312 HydrophobicContact CD2-CB 4.37Å; W280-M312 HydrophobicContact CD2-CG 3.69Å; W280-M312 HydrophobicContact CE3-CB 4.1Å; W280-M312 HydrophobicContact CE3-CG 3.56Å; W280-M312 HydrophobicContact CG-CG 4.49Å; W280-M312 HydrophobicContact CH2-CE 3.92Å; W280-M312 HydrophobicContact CH2-CG 3.72Å; W280-M312 HydrophobicContact CZ2-CE 3.56Å; W280-M312 HydrophobicContact CZ2-CG 3.87Å; W280-M312 HydrophobicContact CZ3-CB 4.39Å; W280-M312 HydrophobicContact CZ3-CG 3.57Å; W280-I314 HydrophobicContact CH2-CG1 4.38Å
281	P	97.8	Very high	95.6	Very high	70 Å²	70	58.5 Å²	58.5	46%	0.455	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	cis	-100.5	25.9	22.3	39.6	-37.4	0	0	0	115.9	H310 P313	P281-H310 WeakPolarHBondContact CB-O 3.31Å; P281-P313 WeakPolarHBondContact O-CD 3.23Å; P281-P313 WeakPolarHBondContact O-CG 3.4Å
282	N	98.1	Very high	94.7	Very high	87 Å²	87	59.9 Å²	59.9	47%	0.465	30%	0.3	S	S	.	.	S	Bend	trans	-56.2	133.2	174.6	-71.5	-30.5	0	0	0	111	W278 E279	W278-N282 PolarHBondContact NE1-O 3.13Å; E279-N282 WeakPolarHBondContact O-CB 3.35Å; E279-N282 VanDerWaalsContact O-CG 3.28Å; E279-N282 PolarHBondContact O-N 3.32Å; E279-N282 PolarHBondContact O-ND2 3.08Å
283	P	98.1	Very high	93.9	Very high	40 Å²	40	65.8 Å²	65.8	26%	0.26	33%	0.331	S	S	.	.			trans	-79.5	139.8	-170.4	30.8	-36.2	0	0	0	113.6	L285 W299 P313 I315	P283-L285 HydrophobicContact CB-CD2 4.06Å; P283-L285 HydrophobicContact CB-CG 4.43Å; P283-L285 HydrophobicContact CG-CD2 4.37Å; P283-L285 HydrophobicContact CG-CG 4.4Å; P283-L285 PolarHBondContact O-N 3.12Å; P283-W299 HydrophobicContact CB-CH2 3.55Å; P283-W299 HydrophobicContact CB-CZ3 3.79Å; P283-W299 HydrophobicContact CG-CH2 3.77Å; P283-W299 HydrophobicContact CG-CZ3 4.01Å; P283-P313 WeakPolarHBondContact CA-O 3.43Å; P283-P313 HydrophobicContact CB-CB 4.37Å; P283-P313 HydrophobicContact CB-CG 4.13Å; P283-I315 HydrophobicContact CB-CG1 4.07Å
284	V	98.7	Very high	93.1	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.006	33%	0.33	C	S	.	.	B	Isolated β-bridge	trans	-81.1	110.5	168.3	177.4	0	0	0	0	109.2	L251 R254 F275 W278 W280 P313 I314 I315	L251-V284 HydrophobicContact CD2-CB 4.28Å; L251-V284 HydrophobicContact CD2-CG1 4.08Å; L251-V284 HydrophobicContact CD2-CG2 3.86Å; R254-V284 HydrophobicContact CB-CG1 3.96Å; R254-V284 HydrophobicContact CG-CG1 4.04Å; F275-V284 HydrophobicContact CE1-CG2 3.98Å; W278-V284 HydrophobicContact CD2-CG2 4.32Å; W278-V284 HydrophobicContact CH2-CG2 4.12Å; W278-V284 HydrophobicContact CZ2-CB 4.45Å; W278-V284 HydrophobicContact CZ2-CG2 3.65Å; W280-V284 HydrophobicContact CH2-CG2 3.67Å; W280-V284 HydrophobicContact CZ3-CG2 3.99Å; V284-P313 PolarHBondContact N-O 3.03Å; V284-I314 HydrophobicContact CB-CG1 4.36Å; V284-I314 HydrophobicContact CB-CG2 4.19Å; V284-I314 HydrophobicContact CG1-CG2 4.34Å; V284-I315 PolarHBondContact O-N 2.69Å
285	L	98.3	Very high	92.4	Very high	25 Å²	25	72.3 Å²	72.3	13%	0.131	37%	0.366	C	S	.	.			trans	-112.1	138.3	176.9	-51.8	-175.3	0	0	0	110.8	I21 R254 P283 I315	I21-L285 HydrophobicContact CD1-CB 4.03Å; I21-L285 HydrophobicContact CD1-CD1 4.27Å; I21-L285 HydrophobicContact CD1-CG 4.45Å; I21-L285 HydrophobicContact CG1-CB 4.39Å; I21-L285 HydrophobicContact CG2-CB 4.21Å; R254-L285 WeakPolarHBondContact CD-O 3.29Å; P283-L285 HydrophobicContact CB-CD2 4.06Å; P283-L285 HydrophobicContact CB-CG 4.43Å; P283-L285 HydrophobicContact CG-CD2 4.37Å; P283-L285 HydrophobicContact CG-CG 4.4Å; P283-L285 PolarHBondContact O-N 3.12Å; L285-I315 HydrophobicContact CD2-CB 3.58Å; L285-I315 HydrophobicContact CD2-CG1 3.5Å; L285-I315 HydrophobicContact CD2-CG2 4.16Å
286	L	98	Very high	91.8	Very high	2 Å²	2	74 Å²	74	1%	0.01	37%	0.374	C	S	.	.	S	Bend	trans	-98.5	-22.6	176.4	-68.9	-178.4	0	0	0	114.5	G20 I209 L212 M250 A253 R254 Q257 P317	G20-L286 WeakPolarHBondContact CA-O 3.34Å; I209-L286 HydrophobicContact CG1-CD1 3.97Å; L212-L286 HydrophobicContact CD1-CB 3.92Å; M250-L286 HydrophobicContact CB-CD1 4.04Å; M250-L286 HydrophobicContact CG-CD1 3.81Å; M250-L286 HydrophobicContact SD-CD1 4.48Å; A253-L286 HydrophobicContact CB-CD1 3.98Å; A253-L286 HydrophobicContact CB-CD2 3.8Å; R254-L286 HydrophobicContact CB-CD2 3.82Å; Q257-L286 PolarHBondContact NE2-O 2.86Å; L286-P317 HydrophobicContact CB-CB 4.36Å; L286-P317 HydrophobicContact CD1-CG 4.32Å
287	K	95.4	Very high	91.3	Very high	43 Å²	43	77.3 Å²	77.3	19%	0.187	40%	0.396	C	S	.	.	S	Bend	trans	-146.2	170	169	66.1	169.9	-175.1	179.6	0	109.1	I21 E208 L212 E290 P317	I21-K287 WeakPolarHBondContact CG2-O 3.37Å; E208-K287 VanDerWaalsContact OE2-CE 3.23Å; E208-K287 WeakPolarHBondContact OE2-CE 3.41Å; E208-K287 IonicContact OE2-NZ 2.71Å; E208-K287 PolarHBondContact OE2-NZ 3.19Å; L212-K287 HydrophobicContact CD1-CB 4.14Å; L212-K287 HydrophobicContact CD1-CD 4.25Å; L212-K287 HydrophobicContact CD1-CG 4.1Å; L212-K287 HydrophobicContact CD2-CB 3.96Å; K287-E290 WeakPolarHBondContact CE-OE1 3.35Å; K287-E290 IonicContact NZ-OE1 2.74Å; K287-E290 PolarHBondContact NZ-OE1 3.15Å; K287-P317 WeakPolarHBondContact CE-O 3.46Å; K287-P317 HydrophobicContact CG-CB 4.19Å
288	Q	93.2	Very high	91.1	Very high	121 Å²	121	72.6 Å²	72.6	57%	0.565	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-65.3	137.6	170.4	-65.3	-63.7	-1.3	0	0	109.2	I21 E290	I21-Q288 HydrophobicContact CG2-CG 4.13Å; Q288-E290 PolarHBondContact O-N 3.03Å
289	P	87.9	Confident	90.9	Very high	71 Å²	71	71.2 Å²	71.2	46%	0.461	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-61.5	125.7	170.9	-21.2	33.5	0	0	0	110.2
290	E	81.8	Confident	90.7	Very high	110 Å²	110	65.4 Å²	65.4	51%	0.514	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-87.3	128.6	174.1	-70.9	163.4	-120.2	0	0	109	K287 Q288	K287-E290 WeakPolarHBondContact CE-OE1 3.35Å; K287-E290 IonicContact NZ-OE1 2.74Å; K287-E290 PolarHBondContact NZ-OE1 3.15Å; Q288-E290 PolarHBondContact O-N 3.03Å
291	E	75.9	Confident	90.5	Very high	192 Å²	192	65.6 Å²	65.6	90%	0.897	35%	0.353	S	S	*	.	P	Polyproline II helix	trans	-75.3	122.8	175	-68.2	-172.4	178.2	0	0	110
292	S	80.1	Confident	90.3	Very high	29 Å²	29	70.9 Å²	70.9	20%	0.203	36%	0.364	C	S	.	.			trans	-130.7	131.9	-174	-175	0	0	0	0	110.2	D186 L294 Y319	D186-S292 WeakPolarHBondContact OD2-CB 3.36Å; D186-S292 PolarHBondContact OD2-OG 3.43Å; S292-L294 PolarHBondContact O-N 2.75Å; S292-Y319 PolarHBondContact O-OH 3.3Å
293	N	81.2	Confident	90	Very high	125 Å²	125	72.2 Å²	72.2	67%	0.668	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	26.4	-164.7	62.6	-3.3	0	0	0	114.8
294	L	81.7	Confident	89.7	Confident	37 Å²	37	73 Å²	73	19%	0.194	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.3	-0.4	-174.3	-55.3	-177.4	0	0	0	113.8	L189 R190 S292 L296 Y319	L189-L294 HydrophobicContact CB-CD1 3.82Å; R190-L294 HydrophobicContact CG-CD1 4.46Å; R190-L294 HydrophobicContact CG-CD2 3.53Å; S292-L294 PolarHBondContact O-N 2.75Å; L294-L296 HydrophobicContact CB-CD1 4.39Å; L294-L296 HydrophobicContact CB-CG 4.03Å; L294-L296 PolarHBondContact O-N 3.04Å; L294-Y319 HydrophobicContact CB-CE1 4.02Å; L294-Y319 HydrophobicContact CD1-CE1 4.03Å; L294-Y319 HydrophobicContact CG-CE1 4.34Å
295	N	83.9	Confident	89.5	Confident	160 Å²	160	76.5 Å²	76.5	86%	0.856	40%	0.4	S	S	*	.			trans	51.5	26.9	178	-65.1	-17.7	0	0	0	114.7
296	L	87.5	Confident	89.3	Confident	35 Å²	35	78.9 Å²	78.9	18%	0.183	42%	0.418	C	S	.	.			trans	-75.1	153.4	174.4	-56.2	-177.6	0	0	0	110.4	L189 I197 L294 V298 Y319 P320	L189-L296 HydrophobicContact CD1-CD1 4.32Å; I197-L296 HydrophobicContact CD1-CD1 3.89Å; I197-L296 HydrophobicContact CD1-CD2 3.73Å; I197-L296 HydrophobicContact CD1-CG 4.5Å; I197-L296 HydrophobicContact CG2-CD1 4.1Å; L294-L296 HydrophobicContact CB-CD1 4.39Å; L294-L296 HydrophobicContact CB-CG 4.03Å; L294-L296 PolarHBondContact O-N 3.04Å; L296-V298 PolarHBondContact O-N 2.97Å; L296-V298 VanDerWaalsContact O-N 3.13Å; L296-Y319 HydrophobicContact CB-CE1 4.28Å; L296-Y319 HydrophobicContact CD1-CD1 4.48Å; L296-Y319 HydrophobicContact CD1-CE1 3.69Å; L296-Y319 HydrophobicContact CG-CE1 4.14Å; L296-Y319 PolarHBondContact N-OH 2.71Å; L296-P320 HydrophobicContact CB-CB 3.85Å; L296-P320 HydrophobicContact CB-CG 4.03Å; L296-P320 HydrophobicContact CD1-CB 4.31Å; L296-P320 HydrophobicContact CD1-CG 3.85Å
297	P	87.4	Confident	89.2	Confident	88 Å²	88	79.6 Å²	79.6	57%	0.571	42%	0.422	S	S	*	.			trans	-61.8	116.3	175.2	-21.5	33.4	0	0	0	111.2	P320 Q322	P297-P320 WeakPolarHBondContact O-CB 3.41Å; P297-Q322 PolarHBondContact O-NE2 2.74Å
298	V	92.4	Very high	89.2	Confident	49 Å²	49	84.6 Å²	84.6	30%	0.297	44%	0.44	S	S	.	.			trans	-110.5	142.6	173.6	175.9	0	0	0	0	108.7	L296 D300 Y319 P320 Q321	L296-V298 PolarHBondContact O-N 2.97Å; L296-V298 VanDerWaalsContact O-N 3.13Å; V298-D300 PolarHBondContact O-N 3.49Å; V298-Y319 HydrophobicContact CG2-CD2 4.01Å; V298-Y319 HydrophobicContact CG2-CE2 3.47Å; V298-Y319 VanDerWaalsContact CG2-CE2 3.47Å; V298-P320 HydrophobicContact CG2-CB 4.05Å; V298-Q321 CarbonylContact C-O 3.59Å; V298-Q321 WeakPolarHBondContact CA-O 3.45Å; V298-Q321 HydrophobicContact CG1-CB 4.27Å
299	W	94.4	Very high	89.3	Confident	28 Å²	28	87.6 Å²	87.6	11%	0.106	45%	0.447	C	S	.	.			trans	-70	114.2	171	179.7	81.8	0	0	0	109.8	P283 P301 D307 H310 P313 I315 Q321 N323	P283-W299 HydrophobicContact CB-CH2 3.55Å; P283-W299 HydrophobicContact CB-CZ3 3.79Å; P283-W299 HydrophobicContact CG-CH2 3.77Å; P283-W299 HydrophobicContact CG-CZ3 4.01Å; W299-P301 VanDerWaalsContact CH2-CD 3.49Å; W299-P301 HydrophobicContact CH2-CG 3.67Å; W299-P301 HydrophobicContact CZ2-CB 4.36Å; W299-P301 HydrophobicContact CZ2-CG 3.74Å; W299-P301 HydrophobicContact CZ3-CG 4.34Å; W299-D307 WeakPolarHBondContact CA-OD2 3.32Å; W299-H310 AromaticContact CD1-CE1 3.79Å; W299-H310 AromaticContact CD1-ND1 3.45Å; W299-H310 AromaticContact NE1-CE1 3.81Å; W299-H310 AromaticContact NE1-ND1 3.04Å; W299-H310 PolarHBondContact NE1-ND1 3.34Å; W299-P313 HydrophobicContact CH2-CB 4.4Å; W299-P313 HydrophobicContact CZ2-CB 3.89Å; W299-P313 HydrophobicContact CZ2-CG 4.15Å; W299-I315 HydrophobicContact CB-CD1 4.46Å; W299-I315 HydrophobicContact CD2-CD1 3.35Å; W299-I315 HydrophobicContact CD2-CG1 4.15Å; W299-I315 HydrophobicContact CE3-CD1 3.36Å; W299-I315 HydrophobicContact CE3-CG1 3.61Å; W299-I315 HydrophobicContact CE3-CG2 4.36Å; W299-I315 HydrophobicContact CG-CD1 3.83Å; W299-I315 HydrophobicContact CH2-CD1 4.27Å; W299-I315 HydrophobicContact CZ2-CD1 4.27Å; W299-I315 HydrophobicContact CZ3-CD1 3.84Å; W299-I315 HydrophobicContact CZ3-CG1 3.81Å; W299-Q321 PolarHBondContact N-O 2.89Å; W299-N323 HydrophobicContact CG-CB 4.19Å
300	D	94	Very high	89.7	Confident	26 Å²	26	85.8 Å²	85.8	14%	0.139	43%	0.433	C	S	.	.			trans	-153.6	105.3	172.4	-179.5	0.4	0	0	0	110.9	V298 R302 V303 N304 D307	V298-D300 PolarHBondContact O-N 3.49Å; D300-R302 VanDerWaalsContact CG-NE 3.35Å; D300-R302 PolarHBondContact O-N 2.88Å; D300-R302 VanDerWaalsContact O-N 3.12Å; D300-R302 WeakPolarHBondContact OD1-CB 3.44Å; D300-R302 VanDerWaalsContact OD1-CG 3.22Å; D300-R302 WeakPolarHBondContact OD1-CG 3.26Å; D300-R302 IonicContact OD1-CZ 2.9Å; D300-R302 PolarHBondContact OD1-N 3.43Å; D300-R302 IonicContact OD1-NE 3.18Å; D300-R302 PolarHBondContact OD1-NE 2.96Å; D300-R302 IonicContact OD1-NH2 2.7Å; D300-R302 IonicContact OD2-CZ 2.84Å; D300-R302 VanDerWaalsContact OD2-CZ 3.24Å; D300-R302 IonicContact OD2-NE 2.85Å; D300-R302 PolarHBondContact OD2-NE 2.83Å; D300-R302 IonicContact OD2-NH2 2.68Å; D300-R302 PolarHBondContact OD2-NH2 2.92Å; D300-V303 HydrophobicContact CB-CG2 3.88Å; D300-V303 PolarHBondContact O-N 2.86Å; D300-N304 WeakPolarHBondContact O-CB 3.4Å; D300-N304 PolarHBondContact O-N 3.17Å; D300-D307 PolarHBondContact N-OD2 2.7Å
301	P	94.5	Very high	90.5	Very high	38 Å²	38	82.8 Å²	82.8	25%	0.247	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-10.9	-178.3	30.3	-35.7	0	0	0	113.3	W299 D307 R308	W299-P301 VanDerWaalsContact CH2-CD 3.49Å; W299-P301 HydrophobicContact CH2-CG 3.67Å; W299-P301 HydrophobicContact CZ2-CB 4.36Å; W299-P301 HydrophobicContact CZ2-CG 3.74Å; W299-P301 HydrophobicContact CZ3-CG 4.34Å; P301-D307 HydrophobicContact CB-CB 4.13Å; P301-R308 HydrophobicContact CB-CG 3.87Å; P301-R308 VanDerWaalsContact O-CG 3.24Å; P301-R308 WeakPolarHBondContact O-CG 3.08Å; P301-R308 PolarHBondContact O-NE 3.42Å
302	R	93.2	Very high	91.6	Very high	182 Å²	182	73.7 Å²	73.7	69%	0.687	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-51.9	173.1	-56.7	172.2	-62.4	172.7	7.9	109.7	D300 R308	D300-R302 VanDerWaalsContact CG-NE 3.35Å; D300-R302 PolarHBondContact O-N 2.88Å; D300-R302 VanDerWaalsContact O-N 3.12Å; D300-R302 WeakPolarHBondContact OD1-CB 3.44Å; D300-R302 VanDerWaalsContact OD1-CG 3.22Å; D300-R302 WeakPolarHBondContact OD1-CG 3.26Å; D300-R302 IonicContact OD1-CZ 2.9Å; D300-R302 PolarHBondContact OD1-N 3.43Å; D300-R302 IonicContact OD1-NE 3.18Å; D300-R302 PolarHBondContact OD1-NE 2.96Å; D300-R302 IonicContact OD1-NH2 2.7Å; D300-R302 IonicContact OD2-CZ 2.84Å; D300-R302 VanDerWaalsContact OD2-CZ 3.24Å; D300-R302 IonicContact OD2-NE 2.85Å; D300-R302 PolarHBondContact OD2-NE 2.83Å; D300-R302 IonicContact OD2-NH2 2.68Å; D300-R302 PolarHBondContact OD2-NH2 2.92Å; R302-R308 PolarHBondContact O-NH2 3.4Å
303	V	92.4	Very high	92.5	Very high	114 Å²	114	72.4 Å²	72.4	69%	0.691	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-30.7	-174.7	-59.1	0	0	0	0	113.9	D300 P305	D300-V303 HydrophobicContact CB-CG2 3.88Å; D300-V303 PolarHBondContact O-N 2.86Å; V303-P305 WeakPolarHBondContact O-CD 3.4Å
304	N	92.8	Very high	93.3	Very high	57 Å²	57	66.4 Å²	66.4	31%	0.305	34%	0.337	S	S	.	.			trans	-103.4	112	-179.2	-179.8	6.7	0	0	0	111.2	D300 S306 D307	D300-N304 WeakPolarHBondContact O-CB 3.4Å; D300-N304 PolarHBondContact O-N 3.17Å; N304-S306 VanDerWaalsContact C-N 3.25Å; N304-S306 PolarHBondContact O-N 2.94Å; N304-S306 WeakPolarHBondContact OD1-CB 3.3Å; N304-S306 PolarHBondContact OD1-N 2.8Å; N304-D307 HydrophobicContact CB-CB 4.19Å; N304-D307 WeakPolarHBondContact CB-OD2 3.48Å; N304-D307 PolarHBondContact ND2-OD1 3Å; N304-D307 PolarHBondContact ND2-OD2 3.24Å; N304-D307 PolarHBondContact O-N 3.25Å
305	P	94.6	Very high	94.1	Very high	75 Å²	75	65 Å²	65	49%	0.487	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-61.2	-29.6	176.9	-24.7	35.6	0	0	0	114.1	V303 D307 R308 Y309	V303-P305 WeakPolarHBondContact O-CD 3.4Å; P305-D307 VanDerWaalsContact C-N 3.29Å; P305-D307 PolarHBondContact O-N 3.4Å; P305-R308 WeakPolarHBondContact O-CB 3.47Å; P305-R308 PolarHBondContact O-N 3.42Å; P305-Y309 WeakPolarHBondContact O-CD2 3.32Å; P305-Y309 WeakPolarHBondContact O-CE2 3.41Å
306	S	93.4	Very high	94.7	Very high	74 Å²	74	58.1 Å²	58.1	52%	0.517	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	-64.1	-36.7	178.7	-172.5	0	0	0	0	111.9	N304 R308 Y309	N304-S306 VanDerWaalsContact C-N 3.25Å; N304-S306 PolarHBondContact O-N 2.94Å; N304-S306 WeakPolarHBondContact OD1-CB 3.3Å; N304-S306 PolarHBondContact OD1-N 2.8Å; S306-R308 PolarHBondContact O-N 3.42Å; S306-Y309 PolarHBondContact O-N 2.92Å
307	D	94.6	Very high	95.1	Very high	17 Å²	17	56.8 Å²	56.8	9%	0.091	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-69.8	-18.6	-175.9	-76.5	-24.2	0	0	0	113.1	W299 D300 P301 N304 P305 Y309 H310	W299-D307 WeakPolarHBondContact CA-OD2 3.32Å; D300-D307 PolarHBondContact N-OD2 2.7Å; P301-D307 HydrophobicContact CB-CB 4.13Å; N304-D307 HydrophobicContact CB-CB 4.19Å; N304-D307 WeakPolarHBondContact CB-OD2 3.48Å; N304-D307 PolarHBondContact ND2-OD1 3Å; N304-D307 PolarHBondContact ND2-OD2 3.24Å; N304-D307 PolarHBondContact O-N 3.25Å; P305-D307 VanDerWaalsContact C-N 3.29Å; P305-D307 PolarHBondContact O-N 3.4Å; D307-Y309 VanDerWaalsContact C-N 3.25Å; D307-Y309 PolarHBondContact O-N 3.04Å; D307-H310 PolarHBondContact O-N 3.35Å; D307-H310 IonicContact OD1-CE1 3.78Å; D307-H310 PolarHBondContact OD1-CE1 3.31Å; D307-H310 IonicContact OD1-ND1 2.89Å
308	R	95.6	Very high	95.4	Very high	148 Å²	148	52.7 Å²	52.7	56%	0.558	26%	0.26	S	S	*	.	G	3₁₀ helix	trans	-69.2	-20.5	177.7	-58	177.5	-176.6	173.1	1.1	113.3	P301 R302 P305 S306	P301-R308 HydrophobicContact CB-CG 3.87Å; P301-R308 VanDerWaalsContact O-CG 3.24Å; P301-R308 WeakPolarHBondContact O-CG 3.08Å; P301-R308 PolarHBondContact O-NE 3.42Å; R302-R308 PolarHBondContact O-NH2 3.4Å; P305-R308 WeakPolarHBondContact O-CB 3.47Å; P305-R308 PolarHBondContact O-N 3.42Å; S306-R308 PolarHBondContact O-N 3.42Å
309	Y	95.8	Very high	95.4	Very high	184 Å²	184	50.8 Å²	50.8	72%	0.722	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-90.4	-2.1	-178.9	-63.3	-82.6	0	0	0	113.5	P305 S306 D307 L311	P305-Y309 WeakPolarHBondContact O-CD2 3.32Å; P305-Y309 WeakPolarHBondContact O-CE2 3.41Å; S306-Y309 PolarHBondContact O-N 2.92Å; D307-Y309 VanDerWaalsContact C-N 3.25Å; D307-Y309 PolarHBondContact O-N 3.04Å; Y309-L311 PolarHBondContact O-N 2.89Å
310	H	97.3	Very high	95.3	Very high	33 Å²	33	49.8 Å²	49.8	15%	0.153	25%	0.245	C	C	.	.			trans	-69.9	116.8	178.6	-68.2	158.4	0	0	0	111.6	P281 W299 D307 P313 N323	P281-H310 WeakPolarHBondContact CB-O 3.31Å; W299-H310 AromaticContact CD1-CE1 3.79Å; W299-H310 AromaticContact CD1-ND1 3.45Å; W299-H310 AromaticContact NE1-CE1 3.81Å; W299-H310 AromaticContact NE1-ND1 3.04Å; W299-H310 PolarHBondContact NE1-ND1 3.34Å; D307-H310 PolarHBondContact O-N 3.35Å; D307-H310 IonicContact OD1-CE1 3.78Å; D307-H310 PolarHBondContact OD1-CE1 3.31Å; D307-H310 IonicContact OD1-ND1 2.89Å; H310-P313 HydrophobicContact CB-CB 4.24Å; H310-N323 WeakPolarHBondContact CB-ND2 3.42Å; H310-N323 PolarHBondContact ND1-ND2 2.83Å; H310-N323 VanDerWaalsContact ND1-ND2 3.11Å
311	L	97.9	Very high	95.3	Very high	48 Å²	48	48.9 Å²	48.9	25%	0.251	24%	0.239	S	C	.	.	S	Bend	trans	-80.5	-20.7	-167.6	-60.3	178.2	0	0	0	115	Y309 S329 R333	Y309-L311 PolarHBondContact O-N 2.89Å; L311-S329 VanDerWaalsContact CD1-C 3.49Å; L311-R333 WeakPolarHBondContact O-CD 3.12Å; L311-R333 PolarHBondContact O-NH1 2.95Å
312	M	98.4	Very high	95.3	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-151.2	65.9	-178.2	-170.8	-174.5	176.1	0	0	110.7	L243 W280 T325 V328 R333 M336 F340	L243-M312 HydrophobicContact CD1-CE 3.86Å; L243-M312 HydrophobicContact CD1-SD 3.95Å; W280-M312 HydrophobicContact CD2-CB 4.37Å; W280-M312 HydrophobicContact CD2-CG 3.69Å; W280-M312 HydrophobicContact CE3-CB 4.1Å; W280-M312 HydrophobicContact CE3-CG 3.56Å; W280-M312 HydrophobicContact CG-CG 4.49Å; W280-M312 HydrophobicContact CH2-CE 3.92Å; W280-M312 HydrophobicContact CH2-CG 3.72Å; W280-M312 HydrophobicContact CZ2-CE 3.56Å; W280-M312 HydrophobicContact CZ2-CG 3.87Å; W280-M312 HydrophobicContact CZ3-CB 4.39Å; W280-M312 HydrophobicContact CZ3-CG 3.57Å; M312-T325 WeakPolarHBondContact O-CB 3.34Å; M312-T325 PolarHBondContact O-OG1 3.22Å; M312-V328 HydrophobicContact CB-CB 4.31Å; M312-V328 HydrophobicContact CB-CG1 3.88Å; M312-V328 HydrophobicContact SD-CG1 4.31Å; M312-R333 HydrophobicContact CB-CG 4.38Å; M312-M336 HydrophobicContact SD-CE 3.64Å; M312-M336 HydrophobicContact SD-SD 4.46Å; M312-F340 HydrophobicContact CE-CE2 3.85Å; M312-F340 HydrophobicContact CE-CZ 4.17Å
313	P	98.4	Very high	95.4	Very high	2 Å²	2	42.8 Å²	42.8	1%	0.013	22%	0.216	C	C	.	.			trans	-75.4	129.2	-170.2	25.3	-27.6	0	0	0	113.3	P281 P283 V284 W299 H310 I315 N323	P281-P313 WeakPolarHBondContact O-CD 3.23Å; P281-P313 WeakPolarHBondContact O-CG 3.4Å; P283-P313 WeakPolarHBondContact CA-O 3.43Å; P283-P313 HydrophobicContact CB-CB 4.37Å; P283-P313 HydrophobicContact CB-CG 4.13Å; V284-P313 PolarHBondContact N-O 3.03Å; W299-P313 HydrophobicContact CH2-CB 4.4Å; W299-P313 HydrophobicContact CZ2-CB 3.89Å; W299-P313 HydrophobicContact CZ2-CG 4.15Å; H310-P313 HydrophobicContact CB-CB 4.24Å; P313-I315 HydrophobicContact CB-CD1 4.02Å; P313-N323 WeakPolarHBondContact CA-OD1 3.43Å
314	I	98.7	Very high	95.7	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.188	C	C	.	.	B	Isolated β-bridge	trans	-128.8	117.6	176	-53.7	172	0	0	0	106.8	L243 M250 L251 W280 V284 N323 S324 T325	L243-I314 HydrophobicContact CD1-CD1 4.3Å; L243-I314 HydrophobicContact CD2-CD1 3.66Å; L243-I314 HydrophobicContact CG-CD1 4.1Å; M250-I314 HydrophobicContact CB-CG2 3.83Å; M250-I314 HydrophobicContact CE-CG2 3.86Å; L251-I314 HydrophobicContact CD1-CD1 4.15Å; L251-I314 HydrophobicContact CD2-CD1 3.53Å; L251-I314 HydrophobicContact CD2-CG1 3.97Å; L251-I314 HydrophobicContact CD2-CG2 4.3Å; L251-I314 HydrophobicContact CG-CD1 3.8Å; W280-I314 HydrophobicContact CH2-CG1 4.38Å; V284-I314 HydrophobicContact CB-CG1 4.36Å; V284-I314 HydrophobicContact CB-CG2 4.19Å; V284-I314 HydrophobicContact CG1-CG2 4.34Å; I314-N323 PolarHBondContact N-OD1 3.31Å; I314-N323 VanDerWaalsContact N-OD1 3.14Å; I314-N323 PolarHBondContact O-OD1 2.78Å; I314-S324 PolarHBondContact O-N 3.2Å; I314-S324 PolarHBondContact O-OG 3.07Å; I314-T325 HydrophobicContact CD1-CG2 3.8Å; I314-T325 HydrophobicContact CG1-CG2 4.33Å; I314-T325 PolarHBondContact N-OG1 3.09Å
315	I	98	Very high	95.9	Very high	7 Å²	7	35.5 Å²	35.5	4%	0.036	17%	0.174	C	C	.	.	B	Isolated β-bridge	trans	-106.9	130.3	-160.6	-50	-53.2	0	0	0	111.3	P283 V284 L285 W299 P313 Q321 Q322 N323	P283-I315 HydrophobicContact CB-CG1 4.07Å; V284-I315 PolarHBondContact O-N 2.69Å; L285-I315 HydrophobicContact CD2-CB 3.58Å; L285-I315 HydrophobicContact CD2-CG1 3.5Å; L285-I315 HydrophobicContact CD2-CG2 4.16Å; W299-I315 HydrophobicContact CB-CD1 4.46Å; W299-I315 HydrophobicContact CD2-CD1 3.35Å; W299-I315 HydrophobicContact CD2-CG1 4.15Å; W299-I315 HydrophobicContact CE3-CD1 3.36Å; W299-I315 HydrophobicContact CE3-CG1 3.61Å; W299-I315 HydrophobicContact CE3-CG2 4.36Å; W299-I315 HydrophobicContact CG-CD1 3.83Å; W299-I315 HydrophobicContact CH2-CD1 4.27Å; W299-I315 HydrophobicContact CZ2-CD1 4.27Å; W299-I315 HydrophobicContact CZ3-CD1 3.84Å; W299-I315 HydrophobicContact CZ3-CG1 3.81Å; P313-I315 HydrophobicContact CB-CD1 4.02Å; I315-Q321 HydrophobicContact CG2-CB 3.83Å; I315-Q322 WeakPolarHBondContact CA-O 3.44Å; I315-N323 HydrophobicContact CD1-CB 3.85Å
316	T	96.8	Very high	95.8	Very high	16 Å²	16	38.2 Å²	38.2	10%	0.098	18%	0.176	C	C	.	.			trans	-65.5	130.6	178.3	60.7	0	0	0	0	111.4	V205 M250 A318 Q321 Q322	V205-T316 HydrophobicContact CG1-CG2 4.32Å; V205-T316 HydrophobicContact CG2-CG2 4.07Å; M250-T316 HydrophobicContact CE-CG2 4.07Å; M250-T316 HydrophobicContact SD-CG2 4.36Å; T316-A318 PolarHBondContact O-N 2.85Å; T316-Q321 WeakPolarHBondContact O-CB 3.47Å; T316-Q321 VanDerWaalsContact O-CG 3.29Å; T316-Q321 WeakPolarHBondContact O-CG 3.33Å; T316-Q322 PolarHBondContact N-O 3.03Å; T316-Q322 PolarHBondContact OG1-N 3.42Å; T316-Q322 PolarHBondContact OG1-O 3.03Å
317	P	95.6	Very high	96	Very high	6 Å²	6	35.5 Å²	35.5	4%	0.039	16%	0.156	C	C	.	.	S	Bend	trans	-67.9	-37	-174.9	23.8	-34.3	0	0	0	114.1	E208 I209 L212 L286 K287	E208-P317 HydrophobicContact CB-CB 4.1Å; E208-P317 HydrophobicContact CB-CG 3.71Å; I209-P317 HydrophobicContact CG1-CG 4.28Å; L212-P317 HydrophobicContact CD1-CB 3.52Å; L212-P317 HydrophobicContact CD1-CG 4.08Å; L286-P317 HydrophobicContact CB-CB 4.36Å; L286-P317 HydrophobicContact CD1-CG 4.32Å; K287-P317 WeakPolarHBondContact CE-O 3.46Å; K287-P317 HydrophobicContact CG-CB 4.19Å
318	A	94.3	Very high	96.1	Very high	3 Å²	3	35.2 Å²	35.2	3%	0.025	15%	0.154	C	C	.	.	S	Bend	trans	-70.6	141.4	-179.7	0	0	0	0	0	111.7	R204 V205 E208 T316 P320 Q321	R204-A318 HydrophobicContact CB-CB 3.76Å; V205-A318 HydrophobicContact CG2-CB 3.91Å; E208-A318 HydrophobicContact CG-CB 4.11Å; T316-A318 PolarHBondContact O-N 2.85Å; A318-P320 CarbonylContact O-C 3.6Å; A318-P320 VanDerWaalsContact O-C 3.31Å; A318-Q321 PolarHBondContact O-N 2.94Å
319	Y	92.2	Very high	96.2	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.035	14%	0.135	C	C	.	.	S	Bend	trans	-69.8	144.8	169.7	179.1	-91.3	0	0	0	110.9	D186 L189 R204 S292 L294 L296 V298	D186-Y319 WeakPolarHBondContact OD2-CB 3.47Å; D186-Y319 WeakPolarHBondContact OD2-CD1 3.44Å; L189-Y319 HydrophobicContact CD1-CD1 4.1Å; R204-Y319 PolarHBondContact NE-O 2.81Å; R204-Y319 PolarHBondContact NH2-O 3.14Å; S292-Y319 PolarHBondContact O-OH 3.3Å; L294-Y319 HydrophobicContact CB-CE1 4.02Å; L294-Y319 HydrophobicContact CD1-CE1 4.03Å; L294-Y319 HydrophobicContact CG-CE1 4.34Å; L296-Y319 HydrophobicContact CB-CE1 4.28Å; L296-Y319 HydrophobicContact CD1-CD1 4.48Å; L296-Y319 HydrophobicContact CD1-CE1 3.69Å; L296-Y319 HydrophobicContact CG-CE1 4.14Å; L296-Y319 PolarHBondContact N-OH 2.71Å; V298-Y319 HydrophobicContact CG2-CD2 4.01Å; V298-Y319 HydrophobicContact CG2-CE2 3.47Å; V298-Y319 VanDerWaalsContact CG2-CE2 3.47Å
320	P	92.9	Very high	96.3	Very high	7 Å²	7	23.8 Å²	23.8	5%	0.045	12%	0.121	C	C	.	.	S	Bend	cis	-70.9	128.7	-13	30	-34.6	0	0	0	111.1	I197 L296 P297 V298 A318	I197-P320 HydrophobicContact CG2-CG 4.24Å; L296-P320 HydrophobicContact CB-CB 3.85Å; L296-P320 HydrophobicContact CB-CG 4.03Å; L296-P320 HydrophobicContact CD1-CB 4.31Å; L296-P320 HydrophobicContact CD1-CG 3.85Å; P297-P320 WeakPolarHBondContact O-CB 3.41Å; V298-P320 HydrophobicContact CG2-CB 4.05Å; A318-P320 CarbonylContact O-C 3.6Å; A318-P320 VanDerWaalsContact O-C 3.31Å
321	Q	93.9	Very high	96.3	Very high	6 Å²	6	22.3 Å²	22.3	3%	0.028	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-71.1	135.1	-176	-58.7	83	-6.1	0	0	110.1	V298 W299 I315 T316 A318	V298-Q321 CarbonylContact C-O 3.59Å; V298-Q321 WeakPolarHBondContact CA-O 3.45Å; V298-Q321 HydrophobicContact CG1-CB 4.27Å; W299-Q321 PolarHBondContact N-O 2.89Å; I315-Q321 HydrophobicContact CG2-CB 3.83Å; T316-Q321 WeakPolarHBondContact O-CB 3.47Å; T316-Q321 VanDerWaalsContact O-CG 3.29Å; T316-Q321 WeakPolarHBondContact O-CG 3.33Å; A318-Q321 PolarHBondContact O-N 2.94Å
322	Q	94.2	Very high	96.3	Very high	82 Å²	82	20.1 Å²	20.1	38%	0.383	10%	0.103	S	C	.	.			trans	-136.6	151.8	-175.9	-68.6	-70.2	-91.7	0	0	110.8	P297 I315 T316 S324	P297-Q322 PolarHBondContact O-NE2 2.74Å; I315-Q322 WeakPolarHBondContact CA-O 3.44Å; T316-Q322 PolarHBondContact N-O 3.03Å; T316-Q322 PolarHBondContact OG1-N 3.42Å; T316-Q322 PolarHBondContact OG1-O 3.03Å; Q322-S324 PolarHBondContact O-N 2.86Å
323	N	96.6	Very high	96.2	Very high	10 Å²	10	23.1 Å²	23.1	5%	0.053	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-75.3	115.2	171.4	178.5	18.8	0	0	0	110.4	W299 H310 P313 I314 I315 T325 Y326	W299-N323 HydrophobicContact CG-CB 4.19Å; H310-N323 WeakPolarHBondContact CB-ND2 3.42Å; H310-N323 PolarHBondContact ND1-ND2 2.83Å; H310-N323 VanDerWaalsContact ND1-ND2 3.11Å; P313-N323 WeakPolarHBondContact CA-OD1 3.43Å; I314-N323 PolarHBondContact N-OD1 3.31Å; I314-N323 VanDerWaalsContact N-OD1 3.14Å; I314-N323 PolarHBondContact O-OD1 2.78Å; I315-N323 HydrophobicContact CD1-CB 3.85Å; N323-T325 PolarHBondContact O-N 3.48Å; N323-T325 PolarHBondContact OD1-N 2.92Å; N323-T325 PolarHBondContact OD1-OG1 3.42Å; N323-Y326 WeakPolarHBondContact ND2-CA 3.46Å; N323-Y326 PolarHBondContact ND2-N 2.86Å; N323-Y326 WeakPolarHBondContact O-CD1 3.31Å
324	S	96.7	Very high	96.2	Very high	16 Å²	16	26.4 Å²	26.4	11%	0.112	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	3.4	178.5	77.7	0	0	0	0	114.2	S247 M250 I314 Q322	S247-S324 WeakPolarHBondContact CB-OG 3.34Å; S247-S324 PolarHBondContact OG-O 3.1Å; S247-S324 VanDerWaalsContact OG-O 3.09Å; S247-S324 PolarHBondContact OG-OG 2.93Å; M250-S324 WeakPolarHBondContact CE-OG 3.35Å; I314-S324 PolarHBondContact O-N 3.2Å; I314-S324 PolarHBondContact O-OG 3.07Å; Q322-S324 PolarHBondContact O-N 2.86Å
325	T	97	Very high	96.2	Very high	2 Å²	2	26.6 Å²	26.6	1%	0.012	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.8	29.8	-178	37.4	0	0	0	0	112.9	L243 M312 I314 N323 N327 V328	L243-T325 HydrophobicContact CD1-CG2 3.63Å; L243-T325 HydrophobicContact CG-CG2 3.68Å; M312-T325 WeakPolarHBondContact O-CB 3.34Å; M312-T325 PolarHBondContact O-OG1 3.22Å; I314-T325 HydrophobicContact CD1-CG2 3.8Å; I314-T325 HydrophobicContact CG1-CG2 4.33Å; I314-T325 PolarHBondContact N-OG1 3.09Å; N323-T325 PolarHBondContact O-N 3.48Å; N323-T325 PolarHBondContact OD1-N 2.92Å; N323-T325 PolarHBondContact OD1-OG1 3.42Å; T325-N327 PolarHBondContact O-N 2.8Å; T325-N327 VanDerWaalsContact O-N 3.16Å; T325-V328 HydrophobicContact CG2-CG2 4.03Å; T325-V328 WeakPolarHBondContact O-CB 3.21Å; T325-V328 WeakPolarHBondContact O-CG2 3.27Å; T325-V328 PolarHBondContact O-N 2.86Å; T325-V328 VanDerWaalsContact O-N 3.07Å
326	Y	93.9	Very high	96.2	Very high	132 Å²	132	26.3 Å²	26.3	52%	0.518	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	-19.9	177.1	71.6	-90.6	0	0	0	114	N323 V328	N323-Y326 WeakPolarHBondContact ND2-CA 3.46Å; N323-Y326 PolarHBondContact ND2-N 2.86Å; N323-Y326 WeakPolarHBondContact O-CD1 3.31Å; Y326-V328 VanDerWaalsContact C-N 3.31Å
327	N	96.2	Very high	96.3	Very high	18 Å²	18	27 Å²	27	10%	0.096	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.4	-6.4	175.1	-65.4	-60.9	0	0	0	114	N238 G241 T325 S329 R398	N238-N327 WeakPolarHBondContact O-CB 3.11Å; N238-N327 PolarHBondContact O-ND2 3.14Å; N238-N327 PolarHBondContact OD1-ND2 3.31Å; G241-N327 WeakPolarHBondContact CA-O 3.28Å; T325-N327 PolarHBondContact O-N 2.8Å; T325-N327 VanDerWaalsContact O-N 3.16Å; N327-S329 PolarHBondContact O-N 3.14Å; N327-R398 PolarHBondContact OD1-NE 3.3Å
328	V	98	Very high	96.4	Very high	10 Å²	10	30.5 Å²	30.5	6%	0.061	15%	0.154	C	C	.	.			trans	-70.7	120	-175.8	177.4	0	0	0	0	111.3	G241 L243 M312 T325 Y326 R333 M336	G241-V328 WeakPolarHBondContact O-CA 3.44Å; G241-V328 WeakPolarHBondContact O-CG2 3.43Å; L243-V328 HydrophobicContact CD1-CG2 4.46Å; M312-V328 HydrophobicContact CB-CB 4.31Å; M312-V328 HydrophobicContact CB-CG1 3.88Å; M312-V328 HydrophobicContact SD-CG1 4.31Å; T325-V328 HydrophobicContact CG2-CG2 4.03Å; T325-V328 WeakPolarHBondContact O-CB 3.21Å; T325-V328 WeakPolarHBondContact O-CG2 3.27Å; T325-V328 PolarHBondContact O-N 2.86Å; T325-V328 VanDerWaalsContact O-N 3.07Å; Y326-V328 VanDerWaalsContact C-N 3.31Å; V328-R333 HydrophobicContact CG1-CB 3.8Å; V328-M336 HydrophobicContact CG1-CE 3.86Å; V328-M336 HydrophobicContact CG2-CE 4.02Å
329	S	97.3	Very high	96.6	Very high	23 Å²	23	30.4 Å²	30.4	16%	0.161	15%	0.153	C	C	.	.			trans	-92.9	177.7	178.4	83.2	0	0	0	0	112.7	L311 N327 S331 T332 R333 E405	L311-S329 VanDerWaalsContact CD1-C 3.49Å; N327-S329 PolarHBondContact O-N 3.14Å; S329-S331 PolarHBondContact OG-N 3.01Å; S329-T332 WeakPolarHBondContact CA-OG1 3.11Å; S329-T332 PolarHBondContact N-OG1 3.02Å; S329-T332 PolarHBondContact O-OG1 3.47Å; S329-T332 PolarHBondContact OG-N 3.05Å; S329-T332 PolarHBondContact OG-OG1 3.37Å; S329-R333 VanDerWaalsContact O-CB 3.29Å; S329-R333 WeakPolarHBondContact O-CB 3.5Å; S329-R333 PolarHBondContact O-N 3.39Å; S329-E405 WeakPolarHBondContact CB-OE1 3.21Å; S329-E405 PolarHBondContact OG-OE1 2.92Å
330	T	97.1	Very high	96.9	Very high	69 Å²	69	30 Å²	30	42%	0.423	15%	0.152	S	C	.	.	H	α-helix	trans	-65.7	-42	178.3	-45.2	0	0	0	0	111	T334 E405	T330-T334 VanDerWaalsContact O-CB 3.32Å; T330-T334 WeakPolarHBondContact O-CB 3.19Å; T330-T334 PolarHBondContact O-N 3.49Å; T330-T334 PolarHBondContact O-OG1 3.48Å; T330-E405 WeakPolarHBondContact CA-OE2 3.5Å; T330-E405 WeakPolarHBondContact CB-OE2 3.06Å; T330-E405 PolarHBondContact N-OE1 3.22Å; T330-E405 PolarHBondContact N-OE2 3.32Å; T330-E405 PolarHBondContact OG1-OE2 3.29Å; T330-E405 VanDerWaalsContact OG1-OE2 3.06Å
331	S	97.5	Very high	97.1	Very high	3 Å²	3	34.7 Å²	34.7	2%	0.021	17%	0.172	C	C	.	.	H	α-helix	trans	-67.8	-48.7	179.2	-54.8	0	0	0	0	111.8	S329 T334 V335 E405 A413	S329-S331 PolarHBondContact OG-N 3.01Å; S331-T334 PolarHBondContact O-N 3.29Å; S331-T334 VanDerWaalsContact O-N 3.14Å; S331-V335 WeakPolarHBondContact O-CG2 3.47Å; S331-V335 PolarHBondContact O-N 3.01Å; S331-E405 WeakPolarHBondContact CA-OE1 3.49Å; S331-E405 WeakPolarHBondContact CB-OE1 3.44Å; S331-E405 PolarHBondContact N-OE1 3.49Å; S331-E405 WeakPolarHBondContact OG-CG 3.41Å; S331-E405 PolarHBondContact OG-OE1 2.95Å; S331-A413 WeakPolarHBondContact CB-O 3.34Å; S331-A413 PolarHBondContact OG-N 3.43Å
332	T	97.8	Very high	97.3	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.006	19%	0.185	C	C	.	.	H	α-helix	trans	-65.4	-41	-177.6	46.4	0	0	0	0	111.6	G241 F242 S329 T334 V335 M336	G241-T332 WeakPolarHBondContact O-CB 3.42Å; G241-T332 PolarHBondContact O-OG1 3.2Å; G241-T332 VanDerWaalsContact O-OG1 3.1Å; F242-T332 HydrophobicContact CD1-CG2 4.09Å; F242-T332 HydrophobicContact CD2-CG2 4.39Å; F242-T332 HydrophobicContact CE1-CG2 3.86Å; F242-T332 HydrophobicContact CE2-CG2 4.18Å; F242-T332 HydrophobicContact CG-CG2 4.36Å; F242-T332 HydrophobicContact CZ-CG2 3.92Å; S329-T332 WeakPolarHBondContact CA-OG1 3.11Å; S329-T332 PolarHBondContact N-OG1 3.02Å; S329-T332 PolarHBondContact O-OG1 3.47Å; S329-T332 PolarHBondContact OG-N 3.05Å; S329-T332 PolarHBondContact OG-OG1 3.37Å; T332-T334 PolarHBondContact O-N 3.49Å; T332-V335 PolarHBondContact O-N 3.31Å; T332-M336 WeakPolarHBondContact O-CE 3.49Å; T332-M336 WeakPolarHBondContact O-CG 3.46Å; T332-M336 PolarHBondContact O-N 3.19Å
333	R	98	Very high	97.5	Very high	63 Å²	63	33.7 Å²	33.7	24%	0.238	17%	0.168	C	C	.	.	H	α-helix	trans	-57.4	-47.5	168.9	-173	-176	69.8	174.7	1.9	112	L311 M312 V328 S329 V335 M336 V337	L311-R333 WeakPolarHBondContact O-CD 3.12Å; L311-R333 PolarHBondContact O-NH1 2.95Å; M312-R333 HydrophobicContact CB-CG 4.38Å; V328-R333 HydrophobicContact CG1-CB 3.8Å; S329-R333 VanDerWaalsContact O-CB 3.29Å; S329-R333 WeakPolarHBondContact O-CB 3.5Å; S329-R333 PolarHBondContact O-N 3.39Å; R333-V335 VanDerWaalsContact C-N 3.34Å; R333-V335 PolarHBondContact O-N 3.32Å; R333-M336 PolarHBondContact O-N 2.85Å; R333-V337 HydrophobicContact CG-CG2 4.31Å; R333-V337 WeakPolarHBondContact O-CG2 3.48Å; R333-V337 PolarHBondContact O-N 3.38Å
334	T	97.8	Very high	97.6	Very high	71 Å²	71	34.3 Å²	34.3	44%	0.436	17%	0.171	S	C	.	.	H	α-helix	trans	-63.1	-40.6	-177.7	-59.2	0	0	0	0	111.7	T330 S331 T332 E338 L412	T330-T334 VanDerWaalsContact O-CB 3.32Å; T330-T334 WeakPolarHBondContact O-CB 3.19Å; T330-T334 PolarHBondContact O-N 3.49Å; T330-T334 PolarHBondContact O-OG1 3.48Å; S331-T334 PolarHBondContact O-N 3.29Å; S331-T334 VanDerWaalsContact O-N 3.14Å; T332-T334 PolarHBondContact O-N 3.49Å; T334-E338 WeakPolarHBondContact O-CB 3.35Å; T334-E338 PolarHBondContact O-N 3.31Å; T334-L412 HydrophobicContact CG2-CD1 3.98Å
335	V	97.8	Very high	97.7	Very high	5 Å²	5	35.9 Å²	35.9	3%	0.03	19%	0.185	C	C	.	.	H	α-helix	trans	-60.6	-50.7	171.8	171.5	0	0	0	0	110.8	I235 F242 S331 T332 R333 V337 E338 E339 L412 H414	I235-V335 HydrophobicContact CG2-CG1 3.83Å; F242-V335 HydrophobicContact CE1-CB 4.16Å; F242-V335 HydrophobicContact CE1-CG1 3.97Å; F242-V335 HydrophobicContact CZ-CG1 4.32Å; S331-V335 WeakPolarHBondContact O-CG2 3.47Å; S331-V335 PolarHBondContact O-N 3.01Å; T332-V335 PolarHBondContact O-N 3.31Å; R333-V335 VanDerWaalsContact C-N 3.34Å; R333-V335 PolarHBondContact O-N 3.32Å; V335-V337 PolarHBondContact O-N 3.32Å; V335-E338 PolarHBondContact O-N 2.85Å; V335-E339 HydrophobicContact CG1-CG 4.21Å; V335-E339 WeakPolarHBondContact O-CG 3.3Å; V335-E339 PolarHBondContact O-N 2.73Å; V335-L412 HydrophobicContact CG2-CD1 4.39Å; V335-L412 HydrophobicContact CG2-CD2 3.97Å; V335-H414 HydrophobicContact CG2-CB 4.04Å
336	M	98.5	Very high	97.8	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-64.6	-39.5	-176.9	-69.6	-176.1	-71.4	0	0	113.1	I235 F242 L243 M312 V328 T332 R333 E338 E339 F340	I235-M336 HydrophobicContact CB-CG 4.16Å; I235-M336 HydrophobicContact CD1-CG 4.4Å; I235-M336 HydrophobicContact CG2-CG 4.25Å; F242-M336 HydrophobicContact CB-SD 4.36Å; F242-M336 HydrophobicContact CD1-CE 4.14Å; F242-M336 HydrophobicContact CD1-CG 3.78Å; F242-M336 HydrophobicContact CD1-SD 3.76Å; F242-M336 HydrophobicContact CE1-CG 4.16Å; L243-M336 HydrophobicContact CD1-CE 3.81Å; L243-M336 HydrophobicContact CD1-SD 3.5Å; L243-M336 WeakPolarHBondContact CD1-SD 3.47Å; M312-M336 HydrophobicContact SD-CE 3.64Å; M312-M336 HydrophobicContact SD-SD 4.46Å; V328-M336 HydrophobicContact CG1-CE 3.86Å; V328-M336 HydrophobicContact CG2-CE 4.02Å; T332-M336 WeakPolarHBondContact O-CE 3.49Å; T332-M336 WeakPolarHBondContact O-CG 3.46Å; T332-M336 PolarHBondContact O-N 3.19Å; R333-M336 PolarHBondContact O-N 2.85Å; M336-E338 VanDerWaalsContact C-N 3.31Å; M336-E338 PolarHBondContact O-N 3.06Å; M336-E339 PolarHBondContact O-N 3.37Å; M336-F340 HydrophobicContact CB-CE2 4.37Å; M336-F340 WeakPolarHBondContact O-CD2 3.32Å; M336-F340 VanDerWaalsContact O-CG 3.22Å; M336-F340 WeakPolarHBondContact O-CG 3.32Å; M336-F340 PolarHBondContact O-N 3.22Å
337	V	98.5	Very high	98	Very high	32 Å²	32	30.5 Å²	30.5	19%	0.194	17%	0.166	C	C	.	.	H	α-helix	trans	-62.8	-37.6	174.9	169.2	0	0	0	0	111.8	R333 V335 K341	R333-V337 HydrophobicContact CG-CG2 4.31Å; R333-V337 WeakPolarHBondContact O-CG2 3.48Å; R333-V337 PolarHBondContact O-N 3.38Å; V335-V337 PolarHBondContact O-N 3.32Å; V337-K341 WeakPolarHBondContact O-CG 3.38Å; V337-K341 PolarHBondContact O-N 2.87Å
338	E	97.6	Very high	98.1	Very high	78 Å²	78	32.4 Å²	32.4	36%	0.364	18%	0.176	S	C	.	.	H	α-helix	trans	-69.9	-45.2	175.1	178.4	53.5	-154.1	0	0	112	T334 V335 M336 F340 K341 Q342	T334-E338 WeakPolarHBondContact O-CB 3.35Å; T334-E338 PolarHBondContact O-N 3.31Å; V335-E338 PolarHBondContact O-N 2.85Å; M336-E338 VanDerWaalsContact C-N 3.31Å; M336-E338 PolarHBondContact O-N 3.06Å; E338-F340 VanDerWaalsContact C-N 3.28Å; E338-F340 PolarHBondContact O-N 3.43Å; E338-K341 WeakPolarHBondContact O-CB 3.42Å; E338-K341 PolarHBondContact O-N 2.95Å; E338-K341 VanDerWaalsContact O-N 3.12Å; E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-N 2.88Å; E338-Q342 PolarHBondContact OE1-NE2 3.14Å
339	E	98.1	Very high	98.1	Very high	1 Å²	1	34.9 Å²	34.9	1%	0.005	19%	0.187	C	C	.	.	H	α-helix	trans	-64.9	-30.3	176.5	-60.6	-66.7	145.2	0	0	111.8	W229 R233 I235 V335 M336 Q342 G343 K369	W229-E339 HydrophobicContact CZ2-CB 4.12Å; R233-E339 IonicContact CZ-OE2 3.97Å; R233-E339 IonicContact NE-OE2 3.21Å; R233-E339 PolarHBondContact NE-OE2 2.86Å; R233-E339 IonicContact NH2-OE1 2.74Å; R233-E339 IonicContact NH2-OE2 2.92Å; R233-E339 PolarHBondContact NH2-OE2 3.13Å; I235-E339 HydrophobicContact CD1-CB 4.12Å; I235-E339 HydrophobicContact CG2-CG 4.4Å; V335-E339 HydrophobicContact CG1-CG 4.21Å; V335-E339 WeakPolarHBondContact O-CG 3.3Å; V335-E339 PolarHBondContact O-N 2.73Å; M336-E339 PolarHBondContact O-N 3.37Å; E339-Q342 PolarHBondContact O-N 2.55Å; E339-G343 PolarHBondContact O-N 2.92Å; E339-K369 IonicContact OE1-NZ 2.6Å; E339-K369 PolarHBondContact OE1-NZ 3.07Å
340	F	98.8	Very high	98.1	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-65.2	-39.6	170.2	-68.2	-39.2	0	0	0	113.1	W229 W248 L251 F271 F272 F275 M312 M336 E338 G343 L344	W229-F340 AromaticContact CH2-CD1 3.53Å; W229-F340 HydrophobicContact CH2-CD1 3.53Å; W229-F340 AromaticContact CH2-CE1 3.63Å; W229-F340 HydrophobicContact CH2-CE1 3.63Å; W229-F340 HydrophobicContact CZ2-CD1 4.37Å; W229-F340 HydrophobicContact CZ3-CD1 4.2Å; W229-F340 AromaticContact CZ3-CE1 3.9Å; W229-F340 HydrophobicContact CZ3-CE1 3.9Å; W248-F340 AromaticContact CH2-CE1 3.96Å; W248-F340 HydrophobicContact CH2-CE1 3.96Å; W248-F340 HydrophobicContact CH2-CZ 4.01Å; W248-F340 AromaticContact CZ3-CE1 3.73Å; W248-F340 HydrophobicContact CZ3-CE1 3.73Å; W248-F340 AromaticContact CZ3-CZ 3.85Å; W248-F340 HydrophobicContact CZ3-CZ 3.85Å; L251-F340 HydrophobicContact CD1-CZ 4.18Å; F271-F340 HydrophobicContact CE1-CD1 4.27Å; F271-F340 AromaticContact CE1-CE1 3.87Å; F271-F340 HydrophobicContact CE1-CE1 3.87Å; F271-F340 HydrophobicContact CZ-CE1 4.16Å; F272-F340 HydrophobicContact CD1-CD1 4.14Å; F272-F340 HydrophobicContact CE1-CD1 4.44Å; F275-F340 HydrophobicContact CB-CD1 4.46Å; F275-F340 HydrophobicContact CB-CD2 3.96Å; F275-F340 HydrophobicContact CB-CE1 4.41Å; F275-F340 HydrophobicContact CB-CE2 3.92Å; F275-F340 HydrophobicContact CB-CG 4.27Å; F275-F340 HydrophobicContact CB-CZ 4.16Å; F275-F340 WeakPolarHBondContact O-CD2 3.12Å; M312-F340 HydrophobicContact CE-CE2 3.85Å; M312-F340 HydrophobicContact CE-CZ 4.17Å; M336-F340 HydrophobicContact CB-CE2 4.37Å; M336-F340 WeakPolarHBondContact O-CD2 3.32Å; M336-F340 VanDerWaalsContact O-CG 3.22Å; M336-F340 WeakPolarHBondContact O-CG 3.32Å; M336-F340 PolarHBondContact O-N 3.22Å; E338-F340 VanDerWaalsContact C-N 3.28Å; E338-F340 PolarHBondContact O-N 3.43Å; F340-G343 PolarHBondContact O-N 3.01Å; F340-L344 PolarHBondContact O-N 2.88Å
341	K	98.6	Very high	97.9	Very high	106 Å²	106	33 Å²	33	46%	0.461	17%	0.172	S	C	.	.	H	α-helix	trans	-65.8	-41.3	175.6	-68.9	168.7	-174.5	175.5	0	111.4	V337 E338 L344 A345	V337-K341 WeakPolarHBondContact O-CG 3.38Å; V337-K341 PolarHBondContact O-N 2.87Å; E338-K341 WeakPolarHBondContact O-CB 3.42Å; E338-K341 PolarHBondContact O-N 2.95Å; E338-K341 VanDerWaalsContact O-N 3.12Å; K341-L344 PolarHBondContact O-N 2.92Å; K341-A345 PolarHBondContact O-N 3.13Å; K341-A345 VanDerWaalsContact O-N 3.07Å
342	Q	97.8	Very high	97.7	Very high	66 Å²	66	38.2 Å²	38.2	31%	0.308	20%	0.196	S	C	.	.	H	α-helix	trans	-65.5	-41.4	174.7	-65.9	-178.1	23.6	0	0	111.4	E338 E339 L344 A345 V346	E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-N 2.88Å; E338-Q342 PolarHBondContact OE1-NE2 3.14Å; E339-Q342 PolarHBondContact O-N 2.55Å; Q342-L344 PolarHBondContact O-N 2.79Å; Q342-A345 PolarHBondContact O-N 2.91Å; Q342-V346 WeakPolarHBondContact O-CG2 3.43Å; Q342-V346 PolarHBondContact O-N 2.87Å
343	G	98.3	Very high	97.5	Very high	2 Å²	2	40.8 Å²	40.8	2%	0.021	22%	0.223	C	C	.	.	H	α-helix	trans	-57.3	-46.8	172.6	0	0	0	0	0	112.4	F272 E339 F340 V346 T347	F272-G343 VanDerWaalsContact CD2-C 3.49Å; E339-G343 PolarHBondContact O-N 2.92Å; F340-G343 PolarHBondContact O-N 3.01Å; G343-V346 PolarHBondContact O-N 3.46Å; G343-T347 WeakPolarHBondContact O-CG2 3.42Å; G343-T347 PolarHBondContact O-N 3.22Å; G343-T347 PolarHBondContact O-OG1 2.8Å; G343-T347 VanDerWaalsContact O-OG1 3.1Å
344	L	98.6	Very high	97.4	Very high	22 Å²	22	44.6 Å²	44.6	12%	0.115	24%	0.241	C	C	.	.	H	α-helix	trans	-56.8	-56.8	176.3	176.9	57.6	0	0	0	110.8	F272 L273 F340 K341 Q342 V346 T347 D348	F272-L344 HydrophobicContact CB-CB 3.8Å; L273-L344 HydrophobicContact CB-CD1 3.97Å; L273-L344 HydrophobicContact CD1-CD1 4.23Å; L273-L344 HydrophobicContact CD1-CD2 4.11Å; F340-L344 PolarHBondContact O-N 2.88Å; K341-L344 PolarHBondContact O-N 2.92Å; Q342-L344 PolarHBondContact O-N 2.79Å; L344-V346 VanDerWaalsContact C-N 3.3Å; L344-V346 PolarHBondContact O-N 3.28Å; L344-T347 CarbonylContact O-C 3.44Å; L344-T347 PolarHBondContact O-N 3.27Å; L344-T347 PolarHBondContact O-OG1 2.89Å; L344-D348 WeakPolarHBondContact CG-OD2 3.49Å; L344-D348 PolarHBondContact O-N 2.9Å
345	A	98.4	Very high	97.3	Very high	49 Å²	49	42.7 Å²	42.7	41%	0.405	23%	0.231	S	C	.	.	H	α-helix	trans	-57.1	-40.6	-178.2	0	0	0	0	0	113	K341 Q342 D348 E349	K341-A345 PolarHBondContact O-N 3.13Å; K341-A345 VanDerWaalsContact O-N 3.07Å; Q342-A345 PolarHBondContact O-N 2.91Å; A345-D348 PolarHBondContact O-N 2.77Å; A345-E349 PolarHBondContact O-N 2.9Å; A345-E349 VanDerWaalsContact O-N 3.1Å
346	V	98.3	Very high	97.2	Very high	22 Å²	22	46.2 Å²	46.2	13%	0.133	25%	0.249	C	C	.	.	H	α-helix	trans	-66.3	-41.4	175.2	173.5	0	0	0	0	111.4	Q342 G343 L344 E349 I350 K359 L360	Q342-V346 WeakPolarHBondContact O-CG2 3.43Å; Q342-V346 PolarHBondContact O-N 2.87Å; G343-V346 PolarHBondContact O-N 3.46Å; L344-V346 VanDerWaalsContact C-N 3.3Å; L344-V346 PolarHBondContact O-N 3.28Å; V346-E349 PolarHBondContact O-N 3.28Å; V346-I350 HydrophobicContact CG1-CD1 3.83Å; V346-I350 WeakPolarHBondContact O-CD1 3.26Å; V346-I350 VanDerWaalsContact O-CG1 3.26Å; V346-I350 WeakPolarHBondContact O-CG1 3.43Å; V346-I350 PolarHBondContact O-N 2.85Å; V346-K359 HydrophobicContact CG1-CB 4.2Å; V346-K359 HydrophobicContact CG1-CD 4.22Å; V346-K359 HydrophobicContact CG1-CG 3.98Å; V346-K359 HydrophobicContact CG2-CD 4.46Å; V346-K359 HydrophobicContact CG2-CG 4.43Å; V346-L360 HydrophobicContact CB-CD1 4.4Å; V346-L360 HydrophobicContact CG1-CB 3.97Å; V346-L360 HydrophobicContact CG1-CD1 4.22Å
347	T	98.4	Very high	97.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-70.7	-30.7	176	56	0	0	0	0	113.9	V268 H269 F272 G343 L344 I350 L351 W357 L360	V268-T347 HydrophobicContact CG1-CG2 4.22Å; H269-T347 PolarHBondContact CD2-OG1 3.15Å; F272-T347 HydrophobicContact CD2-CG2 3.69Å; F272-T347 HydrophobicContact CE2-CG2 3.76Å; G343-T347 WeakPolarHBondContact O-CG2 3.42Å; G343-T347 PolarHBondContact O-N 3.22Å; G343-T347 PolarHBondContact O-OG1 2.8Å; G343-T347 VanDerWaalsContact O-OG1 3.1Å; L344-T347 CarbonylContact O-C 3.44Å; L344-T347 PolarHBondContact O-N 3.27Å; L344-T347 PolarHBondContact O-OG1 2.89Å; T347-I350 PolarHBondContact O-N 3.5Å; T347-L351 WeakPolarHBondContact O-CG 3.26Å; T347-L351 PolarHBondContact O-N 2.89Å; T347-W357 HydrophobicContact CG2-CH2 4.48Å; T347-W357 HydrophobicContact CG2-CZ3 3.93Å; T347-L360 HydrophobicContact CG2-CD1 4.45Å; T347-L360 HydrophobicContact CG2-CD2 4.06Å
348	D	98	Very high	97	Very high	58 Å²	58	48.3 Å²	48.3	31%	0.31	27%	0.265	S	S	.	.	H	α-helix	trans	-62.5	-43.9	170.8	-79.3	-42.6	0	0	0	110.8	H269 L344 A345 Q352	H269-D348 IonicContact CD2-OD1 3.56Å; H269-D348 IonicContact CE1-OD1 3.69Å; H269-D348 IonicContact NE2-OD1 2.72Å; H269-D348 PolarHBondContact NE2-OD1 2.98Å; L344-D348 WeakPolarHBondContact CG-OD2 3.49Å; L344-D348 PolarHBondContact O-N 2.9Å; A345-D348 PolarHBondContact O-N 2.77Å; D348-Q352 WeakPolarHBondContact O-CB 3.32Å; D348-Q352 VanDerWaalsContact O-CD 3.31Å; D348-Q352 WeakPolarHBondContact O-CG 3.46Å; D348-Q352 PolarHBondContact O-N 2.96Å; D348-Q352 VanDerWaalsContact O-N 3.14Å; D348-Q352 PolarHBondContact O-NE2 2.96Å
349	E	98.1	Very high	97	Very high	62 Å²	62	47.5 Å²	47.5	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-62.5	-43.3	173.4	-72.3	180	-142	0	0	112.6	A345 V346 Q352 G353 K354 K359	A345-E349 PolarHBondContact O-N 2.9Å; A345-E349 VanDerWaalsContact O-N 3.1Å; V346-E349 PolarHBondContact O-N 3.28Å; E349-Q352 CarbonylContact O-C 3.31Å; E349-Q352 PolarHBondContact O-N 3.48Å; E349-G353 PolarHBondContact O-N 3Å; E349-K354 HydrophobicContact CB-CB 4.23Å; E349-K354 WeakPolarHBondContact O-CB 3.38Å; E349-K354 PolarHBondContact O-N 3Å; E349-K359 IonicContact OE1-NZ 3.3Å; E349-K359 PolarHBondContact OE1-NZ 2.64Å; E349-K359 IonicContact OE2-NZ 3.88Å; E349-K359 PolarHBondContact OE2-NZ 2.62Å
350	I	97.5	Very high	96.9	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-49.5	-179.2	-69.1	161.9	0	0	0	110.8	Y37 V346 T347 Q352 G353 S355 W357 L360	Y37-I350 HydrophobicContact CD1-CG2 4.02Å; Y37-I350 HydrophobicContact CE1-CG2 3.97Å; Y37-I350 WeakPolarHBondContact CE1-O 3.42Å; Y37-I350 PolarHBondContact OH-O 3.35Å; V346-I350 HydrophobicContact CG1-CD1 3.83Å; V346-I350 WeakPolarHBondContact O-CD1 3.26Å; V346-I350 VanDerWaalsContact O-CG1 3.26Å; V346-I350 WeakPolarHBondContact O-CG1 3.43Å; V346-I350 PolarHBondContact O-N 2.85Å; T347-I350 PolarHBondContact O-N 3.5Å; I350-Q352 PolarHBondContact O-N 3.11Å; I350-G353 PolarHBondContact O-N 2.95Å; I350-S355 WeakPolarHBondContact CA-O 3.39Å; I350-W357 HydrophobicContact CD1-CD2 4.15Å; I350-W357 HydrophobicContact CD1-CE3 3.81Å; I350-W357 HydrophobicContact CD1-CZ3 4.31Å; I350-W357 HydrophobicContact CG2-CD2 4.08Å; I350-W357 HydrophobicContact CG2-CG 4.49Å; I350-W357 HydrophobicContact CG2-CZ2 4.11Å; I350-L360 HydrophobicContact CD1-CB 4.38Å
351	L	92.6	Very high	96.7	Very high	52 Å²	52	48.1 Å²	48.1	27%	0.272	26%	0.263	S	S	.	.	H	α-helix	trans	-68.7	-18.6	178.6	-64.9	-176.2	0	0	0	113.3	Y37 H269 T347 G353	Y37-L351 HydrophobicContact CD2-CD2 4.04Å; Y37-L351 HydrophobicContact CE2-CD2 4.42Å; Y37-L351 HydrophobicContact CG-CD2 4.16Å; H269-L351 HydrophobicContact CB-CD1 3.69Å; T347-L351 WeakPolarHBondContact O-CG 3.26Å; T347-L351 PolarHBondContact O-N 2.89Å; L351-G353 VanDerWaalsContact C-N 3.3Å
352	Q	94.4	Very high	96.4	Very high	112 Å²	112	47.9 Å²	47.9	52%	0.523	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	1.7	169.1	-71.5	168.7	52.1	0	0	113.4	D348 E349 I350 K354	D348-Q352 WeakPolarHBondContact O-CB 3.32Å; D348-Q352 VanDerWaalsContact O-CD 3.31Å; D348-Q352 WeakPolarHBondContact O-CG 3.46Å; D348-Q352 PolarHBondContact O-N 2.96Å; D348-Q352 VanDerWaalsContact O-N 3.14Å; D348-Q352 PolarHBondContact O-NE2 2.96Å; E349-Q352 CarbonylContact O-C 3.31Å; E349-Q352 PolarHBondContact O-N 3.48Å; I350-Q352 PolarHBondContact O-N 3.11Å; Q352-K354 VanDerWaalsContact C-N 3.26Å; Q352-K354 HydrophobicContact CB-CD 4.02Å; Q352-K354 HydrophobicContact CB-CG 4.13Å; Q352-K354 PolarHBondContact O-N 2.97Å
353	G	93.3	Very high	96	Very high	55 Å²	55	47.4 Å²	47.4	57%	0.567	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.7	13.9	-178	0	0	0	0	0	114.7	Y37 E349 I350 L351	Y37-G353 WeakPolarHBondContact OH-CA 3.35Å; Y37-G353 PolarHBondContact OH-N 3.46Å; E349-G353 PolarHBondContact O-N 3Å; I350-G353 PolarHBondContact O-N 2.95Å; L351-G353 VanDerWaalsContact C-N 3.3Å
354	K	96.1	Very high	95.3	Very high	143 Å²	143	48.8 Å²	48.8	62%	0.622	28%	0.275	S	S	*	.	S	Bend	trans	-91.7	-10.2	-176.6	-63.6	172.6	179	170.8	0	113.5	E349 Q352	E349-K354 HydrophobicContact CB-CB 4.23Å; E349-K354 WeakPolarHBondContact O-CB 3.38Å; E349-K354 PolarHBondContact O-N 3Å; Q352-K354 VanDerWaalsContact C-N 3.26Å; Q352-K354 HydrophobicContact CB-CD 4.02Å; Q352-K354 HydrophobicContact CB-CG 4.13Å; Q352-K354 PolarHBondContact O-N 2.97Å
355	S	95.9	Very high	94.8	Very high	31 Å²	31	50.2 Å²	50.2	22%	0.217	28%	0.283	C	S	.	.	S	Bend	trans	-158.1	170.3	178	-136.5	0	0	0	0	112	I350 K359	I350-S355 WeakPolarHBondContact CA-O 3.39Å; S355-K359 WeakPolarHBondContact OG-CD 3.4Å
356	D	95.8	Very high	94.5	Very high	79 Å²	79	48.5 Å²	48.5	42%	0.422	27%	0.266	S	S	.	.			trans	-113.2	162.1	176.5	-71.9	-68.4	0	0	0	111.9	K40 S358 K359	K40-D356 IonicContact NZ-OD1 3.31Å; K40-D356 PolarHBondContact NZ-OD1 3.07Å; D356-S358 PolarHBondContact O-N 3.37Å; D356-K359 WeakPolarHBondContact O-CB 3.45Å; D356-K359 PolarHBondContact O-N 2.81Å
357	W	97.6	Very high	94.2	Very high	3 Å²	3	48.1 Å²	48.1	1%	0.011	26%	0.263	C	S	.	.	G	3₁₀ helix	trans	-56.9	-22.2	-178.5	-67	110.1	0	0	0	114.8	Y37 L41 A44 V268 T347 I350 K359 L360 L361	Y37-W357 PolarHBondContact O-NE1 2.77Å; L41-W357 HydrophobicContact CB-CD2 4.07Å; L41-W357 HydrophobicContact CB-CG 4.15Å; L41-W357 HydrophobicContact CB-CZ2 4.29Å; L41-W357 HydrophobicContact CD1-CB 4.45Å; L41-W357 HydrophobicContact CD1-CD2 3.81Å; L41-W357 HydrophobicContact CD1-CE3 3.84Å; L41-W357 HydrophobicContact CD1-CG 4.1Å; L41-W357 HydrophobicContact CD1-CZ3 4.35Å; L41-W357 HydrophobicContact CD2-CH2 4.5Å; L41-W357 HydrophobicContact CD2-CZ2 4.45Å; L41-W357 HydrophobicContact CG-CD2 4.43Å; A44-W357 HydrophobicContact CB-CB 3.65Å; V268-W357 HydrophobicContact CB-CH2 4.22Å; V268-W357 HydrophobicContact CB-CZ3 4.22Å; V268-W357 HydrophobicContact CG1-CH2 4.24Å; V268-W357 HydrophobicContact CG1-CZ3 3.76Å; T347-W357 HydrophobicContact CG2-CH2 4.48Å; T347-W357 HydrophobicContact CG2-CZ3 3.93Å; I350-W357 HydrophobicContact CD1-CD2 4.15Å; I350-W357 HydrophobicContact CD1-CE3 3.81Å; I350-W357 HydrophobicContact CD1-CZ3 4.31Å; I350-W357 HydrophobicContact CG2-CD2 4.08Å; I350-W357 HydrophobicContact CG2-CG 4.49Å; I350-W357 HydrophobicContact CG2-CZ2 4.11Å; W357-K359 PolarHBondContact O-N 3.09Å; W357-L360 HydrophobicContact CE3-CD2 3.82Å; W357-L360 HydrophobicContact CZ3-CD2 3.85Å; W357-L360 WeakPolarHBondContact O-CB 3.33Å; W357-L360 PolarHBondContact O-N 2.93Å; W357-L360 VanDerWaalsContact O-N 3.11Å; W357-L361 PolarHBondContact O-N 2.86Å
358	S	95.8	Very high	93.8	Very high	72 Å²	72	52.1 Å²	52.1	50%	0.503	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-53.3	-40.1	171.7	50.5	0	0	0	0	112.5	D356 L360 L361 E362	D356-S358 PolarHBondContact O-N 3.37Å; S358-L360 VanDerWaalsContact C-N 3.29Å; S358-L360 PolarHBondContact O-N 3.14Å; S358-L361 CarbonylContact O-C 3.56Å; S358-L361 PolarHBondContact O-N 3Å; S358-E362 PolarHBondContact O-N 3.17Å
359	K	96	Very high	93.5	Very high	61 Å²	61	53.4 Å²	53.4	27%	0.265	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-61.9	-34.2	178.3	-175.5	177.1	173.1	-175.1	0	112.7	V346 E349 S355 D356 W357 L361 E362	V346-K359 HydrophobicContact CG1-CB 4.2Å; V346-K359 HydrophobicContact CG1-CD 4.22Å; V346-K359 HydrophobicContact CG1-CG 3.98Å; V346-K359 HydrophobicContact CG2-CD 4.46Å; V346-K359 HydrophobicContact CG2-CG 4.43Å; E349-K359 IonicContact OE1-NZ 3.3Å; E349-K359 PolarHBondContact OE1-NZ 2.64Å; E349-K359 IonicContact OE2-NZ 3.88Å; E349-K359 PolarHBondContact OE2-NZ 2.62Å; S355-K359 WeakPolarHBondContact OG-CD 3.4Å; D356-K359 WeakPolarHBondContact O-CB 3.45Å; D356-K359 PolarHBondContact O-N 2.81Å; W357-K359 PolarHBondContact O-N 3.09Å; K359-L361 VanDerWaalsContact C-N 3.27Å; K359-L361 PolarHBondContact O-N 3.42Å; K359-E362 PolarHBondContact O-N 2.97Å
360	L	96.9	Very high	93.4	Very high	9 Å²	9	51 Å²	51	5%	0.047	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-69.2	-28.2	175.8	-175.1	64.4	0	0	0	111.8	V268 F272 V346 T347 I350 W357 S358	V268-L360 HydrophobicContact CG1-CD2 3.93Å; F272-L360 HydrophobicContact CE2-CD1 3.82Å; F272-L360 HydrophobicContact CE2-CD2 3.98Å; F272-L360 HydrophobicContact CZ-CD1 3.97Å; F272-L360 HydrophobicContact CZ-CD2 4.4Å; V346-L360 HydrophobicContact CB-CD1 4.4Å; V346-L360 HydrophobicContact CG1-CB 3.97Å; V346-L360 HydrophobicContact CG1-CD1 4.22Å; T347-L360 HydrophobicContact CG2-CD1 4.45Å; T347-L360 HydrophobicContact CG2-CD2 4.06Å; I350-L360 HydrophobicContact CD1-CB 4.38Å; W357-L360 HydrophobicContact CE3-CD2 3.82Å; W357-L360 HydrophobicContact CZ3-CD2 3.85Å; W357-L360 WeakPolarHBondContact O-CB 3.33Å; W357-L360 PolarHBondContact O-N 2.93Å; W357-L360 VanDerWaalsContact O-N 3.11Å; S358-L360 VanDerWaalsContact C-N 3.29Å; S358-L360 PolarHBondContact O-N 3.14Å
361	L	95.4	Very high	93.1	Very high	5 Å²	5	59.9 Å²	59.9	3%	0.026	31%	0.306	C	S	.	.	G	3₁₀ helix	trans	-95.5	5.4	-177.5	-53.6	178.6	0	0	0	112.9	M45 F48 L228 W229 R232 W357 S358 K359	M45-L361 HydrophobicContact CG-CD1 4.33Å; F48-L361 HydrophobicContact CD2-CD1 4.13Å; F48-L361 HydrophobicContact CE2-CB 4.28Å; F48-L361 HydrophobicContact CE2-CD1 3.75Å; F48-L361 HydrophobicContact CZ-CB 4.3Å; L228-L361 HydrophobicContact CD2-CD1 3.78Å; L228-L361 HydrophobicContact CD2-CD2 3.88Å; L228-L361 HydrophobicContact CD2-CG 4.4Å; L228-L361 HydrophobicContact CG-CD2 4.01Å; W229-L361 HydrophobicContact CB-CD2 4.49Å; R232-L361 PolarHBondContact NE-O 2.84Å; R232-L361 PolarHBondContact NH2-O 3.37Å; W357-L361 PolarHBondContact O-N 2.86Å; S358-L361 CarbonylContact O-C 3.56Å; S358-L361 PolarHBondContact O-N 3Å; K359-L361 VanDerWaalsContact C-N 3.27Å; K359-L361 PolarHBondContact O-N 3.42Å
362	E	92.3	Very high	93.2	Very high	101 Å²	101	58.7 Å²	58.7	47%	0.472	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-68.7	130.1	172	-76	-175.4	-164.4	0	0	111.2	R233 S358 K359	R233-E362 PolarHBondContact NH1-O 2.91Å; S358-E362 PolarHBondContact O-N 3.17Å; K359-E362 PolarHBondContact O-N 2.97Å
363	P	89.1	Confident	93.2	Very high	57 Å²	57	53.4 Å²	53.4	37%	0.37	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-72.8	139.1	177.2	31.7	-32.8	0	0	0	110	R232	R232-P363 WeakPolarHBondContact O-CA 3.4Å
364	P	83.9	Confident	93.3	Very high	31 Å²	31	50.8 Å²	50.8	20%	0.201	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-65.3	142.7	176.8	28.5	-32.7	0	0	0	108.7	R232 F366	R232-P364 WeakPolarHBondContact O-CD 3.5Å; P364-F366 PolarHBondContact O-N 2.86Å
365	N	86.4	Confident	93.2	Very high	52 Å²	52	44 Å²	44	28%	0.278	22%	0.218	S	C	.	.			trans	-78.7	70.1	176.4	-160.4	-28	0	0	0	110.4	F367 Q368 K369 K503	N365-F367 VanDerWaalsContact C-N 3.33Å; N365-F367 PolarHBondContact O-N 3.1Å; N365-Q368 HydrophobicContact CB-CB 4.2Å; N365-Q368 HydrophobicContact CB-CG 4.47Å; N365-Q368 WeakPolarHBondContact ND2-CG 3.43Å; N365-Q368 CarbonylContact O-C 3.57Å; N365-Q368 WeakPolarHBondContact O-CA 3.42Å; N365-Q368 PolarHBondContact O-N 3.13Å; N365-Q368 WeakPolarHBondContact OD1-CB 3.31Å; N365-Q368 WeakPolarHBondContact OD1-CG 3.39Å; N365-Q368 PolarHBondContact OD1-N 3.21Å; N365-K369 PolarHBondContact O-N 3.31Å; N365-K503 PolarHBondContact ND2-O 3.24Å
366	F	92.4	Very high	93.2	Very high	13 Å²	13	42.5 Å²	42.5	6%	0.057	21%	0.207	C	C	.	.	H	α-helix	trans	-50.9	-49.3	-173.1	176.3	-87.1	0	0	0	112.1	P364 Q368 K369 Y370 Y373 H414 N416 F437	P364-F366 PolarHBondContact O-N 2.86Å; F366-Q368 PolarHBondContact O-N 2.98Å; F366-K369 WeakPolarHBondContact O-CB 3.48Å; F366-K369 PolarHBondContact O-N 3.08Å; F366-Y370 HydrophobicContact CD2-CE2 4.15Å; F366-Y370 HydrophobicContact CE2-CD2 4.5Å; F366-Y370 HydrophobicContact CE2-CE2 4.05Å; F366-Y373 HydrophobicContact CD1-CE1 4.12Å; F366-Y373 AromaticContact CE1-CD1 3.96Å; F366-Y373 HydrophobicContact CE1-CD1 3.96Å; F366-Y373 AromaticContact CE1-CE1 3.74Å; F366-Y373 HydrophobicContact CE1-CE1 3.74Å; F366-Y373 HydrophobicContact CZ-CE1 4.4Å; F366-Y373 PolarHBondContact O-OH 3.11Å; F366-H414 AromaticContact CD2-CE1 3.83Å; F366-H414 AromaticContact CE2-CE1 3.77Å; F366-H414 AromaticContact CE2-CG 3.87Å; F366-H414 AromaticContact CE2-ND1 3.68Å; F366-H414 WeakPolarHBondContact CZ-O 3.49Å; F366-N416 HydrophobicContact CD1-CB 4.26Å; F366-N416 HydrophobicContact CD2-CB 4.29Å; F366-N416 HydrophobicContact CE1-CB 3.88Å; F366-N416 HydrophobicContact CE2-CB 3.9Å; F366-N416 HydrophobicContact CG-CB 4.47Å; F366-N416 HydrophobicContact CZ-CB 3.69Å; F366-F437 HydrophobicContact CE1-CB 3.98Å; F366-F437 WeakPolarHBondContact CZ-O 3.47Å
367	F	93.2	Very high	93.1	Very high	13 Å²	13	39.7 Å²	39.7	6%	0.057	19%	0.193	C	C	.	.	H	α-helix	trans	-68.7	-10.4	179.7	-57.9	-65.3	0	0	0	114.3	N365 Y373 F420 F437 L492 L496 I500 L501	N365-F367 VanDerWaalsContact C-N 3.33Å; N365-F367 PolarHBondContact O-N 3.1Å; F367-Y373 WeakPolarHBondContact CA-OH 3.48Å; F367-Y373 PolarHBondContact O-OH 3.33Å; F367-F420 HydrophobicContact CE2-CZ 4.04Å; F367-F420 HydrophobicContact CZ-CE1 4.5Å; F367-F420 AromaticContact CZ-CE2 3.8Å; F367-F420 HydrophobicContact CZ-CE2 3.8Å; F367-F420 AromaticContact CZ-CZ 3.74Å; F367-F420 HydrophobicContact CZ-CZ 3.74Å; F367-F437 HydrophobicContact CE1-CB 3.89Å; F367-F437 HydrophobicContact CE1-CD1 4.05Å; F367-F437 AromaticContact CE1-CD2 4Å; F367-F437 HydrophobicContact CE1-CD2 4Å; F367-F437 AromaticContact CE1-CG 3.71Å; F367-F437 HydrophobicContact CE1-CG 3.71Å; F367-F437 HydrophobicContact CZ-CD2 4.34Å; F367-F437 HydrophobicContact CZ-CG 4.47Å; F367-L492 HydrophobicContact CB-CD1 3.98Å; F367-L492 HydrophobicContact CD1-CD1 4.05Å; F367-L492 HydrophobicContact CG-CD1 4.47Å; F367-L496 HydrophobicContact CD1-CD1 3.64Å; F367-L496 HydrophobicContact CD2-CD1 4.28Å; F367-L496 HydrophobicContact CE1-CD1 3.31Å; F367-L496 HydrophobicContact CE2-CD1 4Å; F367-L496 HydrophobicContact CG-CD1 4.12Å; F367-L496 HydrophobicContact CZ-CD1 3.5Å; F367-I500 HydrophobicContact CD2-CG2 3.78Å; F367-I500 HydrophobicContact CE2-CG2 3.46Å; F367-I500 VanDerWaalsContact CE2-CG2 3.46Å; F367-I500 HydrophobicContact CZ-CG2 4.34Å; F367-L501 HydrophobicContact CB-CD2 3.66Å; F367-L501 HydrophobicContact CD1-CD2 4.46Å; F367-L501 HydrophobicContact CD2-CD2 4.38Å; F367-L501 HydrophobicContact CG-CD2 3.92Å
368	Q	90.1	Very high	92.9	Very high	84 Å²	84	39.5 Å²	39.5	39%	0.393	19%	0.193	S	C	.	.	H	α-helix	trans	-103.6	-18.1	170.9	-59.5	-73.3	-21.9	0	0	112.9	N365 F366 K489 L501	N365-Q368 HydrophobicContact CB-CB 4.2Å; N365-Q368 HydrophobicContact CB-CG 4.47Å; N365-Q368 WeakPolarHBondContact ND2-CG 3.43Å; N365-Q368 CarbonylContact O-C 3.57Å; N365-Q368 WeakPolarHBondContact O-CA 3.42Å; N365-Q368 PolarHBondContact O-N 3.13Å; N365-Q368 WeakPolarHBondContact OD1-CB 3.31Å; N365-Q368 WeakPolarHBondContact OD1-CG 3.39Å; N365-Q368 PolarHBondContact OD1-N 3.21Å; F366-Q368 PolarHBondContact O-N 2.98Å; Q368-K489 PolarHBondContact O-NZ 2.95Å; Q368-L501 PolarHBondContact NE2-O 2.87Å
369	K	91.5	Very high	92.8	Very high	86 Å²	86	36.8 Å²	36.8	37%	0.374	17%	0.174	S	C	.	.	H	α-helix	trans	-70	-35.5	-175	-168.7	172.4	-177.2	179.1	0	113.3	E339 N365 F366	E339-K369 IonicContact OE1-NZ 2.6Å; E339-K369 PolarHBondContact OE1-NZ 3.07Å; N365-K369 PolarHBondContact O-N 3.31Å; F366-K369 WeakPolarHBondContact O-CB 3.48Å; F366-K369 PolarHBondContact O-N 3.08Å
370	Y	94.2	Very high	92.6	Very high	12 Å²	12	33.9 Å²	33.9	5%	0.047	16%	0.161	C	C	.	.			trans	-109.7	150.8	-177.5	-54	-85.2	0	0	0	112.9	F366 Y373 L412 H414 I441 K489	F366-Y370 HydrophobicContact CD2-CE2 4.15Å; F366-Y370 HydrophobicContact CE2-CD2 4.5Å; F366-Y370 HydrophobicContact CE2-CE2 4.05Å; Y370-Y373 WeakPolarHBondContact CA-OH 3.28Å; Y370-Y373 AromaticContact CD2-CE1 3.97Å; Y370-Y373 HydrophobicContact CD2-CE1 3.97Å; Y370-Y373 HydrophobicContact CG-CE1 4.34Å; Y370-Y373 PolarHBondContact N-OH 3Å; Y370-Y373 VanDerWaalsContact O-CE2 3.27Å; Y370-Y373 WeakPolarHBondContact O-CE2 3.45Å; Y370-Y373 PolarHBondContact O-OH 3.23Å; Y370-L412 HydrophobicContact CE1-CD2 3.91Å; Y370-H414 HydrophobicContact CE2-CB 4.38Å; Y370-H414 AromaticContact CE2-ND1 3.66Å; Y370-H414 AromaticContact CZ-ND1 3.53Å; Y370-H414 PolarHBondContact OH-ND1 2.67Å; Y370-I441 HydrophobicContact CD1-CD1 4.3Å; Y370-I441 HydrophobicContact CD1-CG1 3.69Å; Y370-I441 HydrophobicContact CE1-CD1 3.89Å; Y370-I441 HydrophobicContact CE1-CG1 3.71Å; Y370-K489 WeakPolarHBondContact O-CD 3.48Å
371	R	92.6	Very high	92.3	Very high	186 Å²	186	36.1 Å²	36.1	70%	0.702	18%	0.177	S	C	*	.	S	Bend	trans	-80.6	-28.2	174.3	-72.8	-175.7	177	-167.7	-1.4	112.6	K489	R371-K489 WeakPolarHBondContact O-CB 3.17Å; R371-K489 PolarHBondContact O-N 2.9Å
372	H	93.8	Very high	91.9	Very high	28 Å²	28	38.5 Å²	38.5	13%	0.13	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	147.3	-174	-62.8	-93.6	0	0	0	110.1	I440 F442 H486	H372-I440 HydrophobicContact CB-CB 4.38Å; H372-I440 PolarHBondContact O-N 3.24Å; H372-F442 HydrophobicContact CB-CD2 4.47Å; H372-F442 HydrophobicContact CB-CE2 3.81Å; H372-F442 AromaticContact CD2-CD2 3.94Å; H372-F442 AromaticContact CD2-CE2 3.92Å; H372-F442 AromaticContact CG-CE2 3.67Å; H372-H486 AromaticContact CE1-NE2 3.89Å; H372-H486 AromaticContact ND1-NE2 3.27Å; H372-H486 PolarHBondContact ND1-NE2 2.89Å
373	Y	95.3	Very high	91.7	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	153.6	175.8	-54.7	-101.1	0	0	0	110	F366 F367 Y370 L438 H486 V487 K489 L492	F366-Y373 HydrophobicContact CD1-CE1 4.12Å; F366-Y373 AromaticContact CE1-CD1 3.96Å; F366-Y373 HydrophobicContact CE1-CD1 3.96Å; F366-Y373 AromaticContact CE1-CE1 3.74Å; F366-Y373 HydrophobicContact CE1-CE1 3.74Å; F366-Y373 HydrophobicContact CZ-CE1 4.4Å; F366-Y373 PolarHBondContact O-OH 3.11Å; F367-Y373 WeakPolarHBondContact CA-OH 3.48Å; F367-Y373 PolarHBondContact O-OH 3.33Å; Y370-Y373 WeakPolarHBondContact CA-OH 3.28Å; Y370-Y373 AromaticContact CD2-CE1 3.97Å; Y370-Y373 HydrophobicContact CD2-CE1 3.97Å; Y370-Y373 HydrophobicContact CG-CE1 4.34Å; Y370-Y373 PolarHBondContact N-OH 3Å; Y370-Y373 VanDerWaalsContact O-CE2 3.27Å; Y370-Y373 WeakPolarHBondContact O-CE2 3.45Å; Y370-Y373 PolarHBondContact O-OH 3.23Å; Y373-L438 CarbonylContact C-O 3.51Å; Y373-L438 WeakPolarHBondContact CA-O 3.23Å; Y373-H486 WeakPolarHBondContact O-CA 3.46Å; Y373-V487 PolarHBondContact N-O 2.89Å; Y373-V487 PolarHBondContact O-N 2.7Å; Y373-K489 HydrophobicContact CE2-CB 4.06Å; Y373-K489 HydrophobicContact CE2-CG 4.42Å; Y373-L492 HydrophobicContact CD2-CD1 3.81Å; Y373-L492 HydrophobicContact CD2-CD2 4.16Å; Y373-L492 HydrophobicContact CD2-CG 4.19Å; Y373-L492 HydrophobicContact CE2-CD1 3.58Å; Y373-L492 HydrophobicContact CE2-CG 4.41Å; Y373-L492 HydrophobicContact CG-CD1 4.42Å; Y373-L492 HydrophobicContact CG-CD2 4.28Å
374	I	94.9	Very high	91.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	126.1	157.3	-63.7	168.5	0	0	0	106.7	L404 L438 I440 L455 I459 A484 T485	I374-L404 HydrophobicContact CD1-CD1 3.79Å; I374-L404 HydrophobicContact CD1-CD2 3.99Å; I374-L438 HydrophobicContact CB-CB 4.34Å; I374-L438 PolarHBondContact N-O 2.9Å; I374-L438 PolarHBondContact O-N 3.31Å; I374-I440 HydrophobicContact CD1-CD1 4.15Å; I374-I440 HydrophobicContact CD1-CG1 4.31Å; I374-I440 HydrophobicContact CG1-CD1 4.45Å; I374-I440 HydrophobicContact CG1-CG1 4.21Å; I374-L455 HydrophobicContact CD1-CD1 4.33Å; I374-I459 HydrophobicContact CD1-CD1 4.3Å; I374-A484 HydrophobicContact CG2-CB 4.11Å; I374-T485 CarbonylContact C-O 3.54Å; I374-T485 VanDerWaalsContact CA-O 3.3Å; I374-T485 WeakPolarHBondContact CA-O 3.4Å
375	V	95.1	Very high	91.7	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	128.9	166.4	-167.1	0	0	0	0	106.9	M435 W436 F437 A484 T485 V487 Y495	V375-M435 HydrophobicContact CG1-CB 4.23Å; V375-M435 HydrophobicContact CG1-CG 4.47Å; V375-M435 HydrophobicContact CG1-SD 4.29Å; V375-W436 WeakPolarHBondContact CA-O 3.18Å; V375-F437 HydrophobicContact CB-CD1 4.48Å; V375-F437 HydrophobicContact CB-CE1 4.31Å; V375-F437 HydrophobicContact CG1-CD1 4.27Å; V375-F437 HydrophobicContact CG1-CE1 3.82Å; V375-F437 HydrophobicContact CG1-CZ 4Å; V375-F437 HydrophobicContact CG2-CD1 3.86Å; V375-F437 HydrophobicContact CG2-CE1 3.64Å; V375-A484 CarbonylContact O-C 3.58Å; V375-A484 WeakPolarHBondContact O-CA 3.28Å; V375-T485 PolarHBondContact N-O 3.46Å; V375-T485 PolarHBondContact O-N 2.89Å; V375-V487 HydrophobicContact CG2-CB 4.49Å; V375-V487 HydrophobicContact CG2-CG1 3.94Å; V375-V487 HydrophobicContact CG2-CG2 3.67Å; V375-Y495 HydrophobicContact CB-CD1 4.46Å; V375-Y495 HydrophobicContact CB-CE1 4.26Å; V375-Y495 HydrophobicContact CG1-CD1 3.93Å; V375-Y495 HydrophobicContact CG1-CE1 4.09Å; V375-Y495 HydrophobicContact CG2-CD1 4.16Å; V375-Y495 HydrophobicContact CG2-CE1 4.12Å; V375-Y495 HydrophobicContact CG2-CG 4.43Å
376	L	95	Very high	91.8	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	115.3	174.2	-177.9	70.5	0	0	0	108.6	V393 I397 M435 W436 F462 I482 A484	L376-V393 HydrophobicContact CD2-CG1 4.05Å; L376-I397 HydrophobicContact CD2-CD1 3.93Å; L376-I397 HydrophobicContact CD2-CG1 3.76Å; L376-M435 CarbonylContact O-C 3.59Å; L376-M435 VanDerWaalsContact O-CA 3.26Å; L376-M435 WeakPolarHBondContact O-CA 3.34Å; L376-W436 PolarHBondContact N-O 3.28Å; L376-W436 PolarHBondContact O-N 3.49Å; L376-F462 HydrophobicContact CD1-CE1 3.72Å; L376-F462 HydrophobicContact CD1-CZ 4.5Å; L376-F462 HydrophobicContact CD2-CE1 4.02Å; L376-F462 HydrophobicContact CD2-CZ 4Å; L376-I482 HydrophobicContact CD1-CD1 3.9Å; L376-I482 HydrophobicContact CD1-CG1 3.86Å; L376-I482 HydrophobicContact CD2-CD1 4.41Å; L376-I482 HydrophobicContact CG-CD1 4.42Å; L376-I482 HydrophobicContact CG-CG1 4.46Å; L376-A484 HydrophobicContact CD1-CB 3.85Å
377	T	94	Very high	91.5	Very high	20 Å²	20	47.5 Å²	47.5	12%	0.123	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126	-176.7	-56.6	0	0	0	0	109.7	V433 S434 M435 I482 E483	T377-V433 HydrophobicContact CG2-CG1 3.5Å; T377-S434 WeakPolarHBondContact CA-O 3.47Å; T377-M435 HydrophobicContact CG2-CG 4.19Å; T377-I482 WeakPolarHBondContact O-CA 3.34Å; T377-E483 PolarHBondContact N-O 2.71Å; T377-E483 PolarHBondContact O-N 2.88Å
378	A	93.9	Very high	91.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	135.2	169.9	0	0	0	0	0	109.5	V393 V433 S434 W436 K481	A378-V393 HydrophobicContact CB-CB 4.41Å; A378-V393 HydrophobicContact CB-CG1 4.29Å; A378-V393 HydrophobicContact CB-CG2 4.1Å; A378-V433 WeakPolarHBondContact O-CA 3.42Å; A378-S434 PolarHBondContact N-O 3.48Å; A378-S434 PolarHBondContact O-N 3.09Å; A378-W436 HydrophobicContact CB-CZ3 3.89Å; A378-K481 WeakPolarHBondContact CA-O 3.44Å
379	S	93.1	Very high	91.3	Very high	15 Å²	15	46.9 Å²	46.9	11%	0.105	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	155.6	179.4	58.9	0	0	0	0	113	Y432 M480 K481	S379-Y432 CarbonylContact C-O 3.57Å; S379-Y432 WeakPolarHBondContact CA-O 3.38Å; S379-Y432 VanDerWaalsContact CB-O 3.31Å; S379-Y432 WeakPolarHBondContact CB-O 3.37Å; S379-M480 CarbonylContact O-C 3.57Å; S379-M480 WeakPolarHBondContact O-CA 3.5Å; S379-K481 PolarHBondContact N-O 3.45Å; S379-K481 PolarHBondContact O-N 3.49Å
380	A	91.9	Very high	91.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	163.5	173.3	0	0	0	0	0	110.7	N385 H386 Y432 M480	A380-N385 HydrophobicContact CB-CB 4.13Å; A380-H386 HydrophobicContact CB-CB 4.07Å; A380-Y432 PolarHBondContact N-O 2.8Å; A380-Y432 PolarHBondContact O-N 2.81Å; A380-M480 HydrophobicContact CB-CG 4.1Å
381	S	89.9	Confident	91	Very high	56 Å²	56	44.9 Å²	44.9	39%	0.392	23%	0.229	S	C	.	.	S	Bend	trans	-91.9	-2.6	-172.1	-52.4	0	0	0	0	115.5	N431	S381-N431 WeakPolarHBondContact CA-OD1 3.37Å; S381-N431 PolarHBondContact OG-OD1 3.2Å
382	T	88.2	Confident	90.9	Very high	55 Å²	55	36.9 Å²	36.9	34%	0.337	20%	0.201	S	C	.	.	S	Bend	trans	-136.9	157.1	168.8	71.2	0	0	0	0	110.3	N385 H386	T382-N385 PolarHBondContact O-N 2.87Å; T382-N385 VanDerWaalsContact OG1-CB 3.31Å; T382-N385 WeakPolarHBondContact OG1-CB 3.42Å; T382-N385 PolarHBondContact OG1-N 3.24Å; T382-N385 PolarHBondContact OG1-ND2 3.48Å; T382-N385 VanDerWaalsContact OG1-ND2 3.15Å; T382-H386 VanDerWaalsContact O-CB 3.25Å; T382-H386 WeakPolarHBondContact O-CB 3.34Å; T382-H386 PolarHBondContact O-N 3.13Å
383	E	86.6	Confident	90.9	Very high	128 Å²	128	35.5 Å²	35.5	60%	0.598	19%	0.194	S	C	*	.	H	α-helix	trans	-64.5	-42.5	-178.2	-169.3	160.2	-156.1	0	0	112.8	H386 L387 Y432	E383-H386 WeakPolarHBondContact O-CB 3.26Å; E383-H386 PolarHBondContact O-N 3.06Å; E383-L387 PolarHBondContact O-N 2.88Å; E383-Y432 HydrophobicContact CB-CD1 4.05Å; E383-Y432 HydrophobicContact CB-CE1 3.57Å; E383-Y432 HydrophobicContact CB-CE2 4.4Å; E383-Y432 HydrophobicContact CG-CD1 4.24Å; E383-Y432 HydrophobicContact CG-CE1 3.91Å
384	E	85.3	Confident	90.7	Very high	149 Å²	149	37.7 Å²	37.7	70%	0.696	21%	0.205	S	C	*	.	H	α-helix	trans	-59	-50.2	176.4	-59.7	167.9	161.2	0	0	111.2	H386 L387 E388	E384-H386 VanDerWaalsContact C-N 3.3Å; E384-H386 PolarHBondContact O-N 2.96Å; E384-L387 PolarHBondContact O-N 2.84Å; E384-E388 PolarHBondContact O-N 3.03Å; E384-E388 VanDerWaalsContact O-N 3.14Å
385	N	88	Confident	90.5	Very high	25 Å²	25	38.9 Å²	38.9	13%	0.134	21%	0.213	C	C	.	.	H	α-helix	trans	-65.3	-35.8	177.6	-67.5	-11.2	0	0	0	111.2	A380 T382 W389 K477 M480	A380-N385 HydrophobicContact CB-CB 4.13Å; T382-N385 PolarHBondContact O-N 2.87Å; T382-N385 VanDerWaalsContact OG1-CB 3.31Å; T382-N385 WeakPolarHBondContact OG1-CB 3.42Å; T382-N385 PolarHBondContact OG1-N 3.24Å; T382-N385 PolarHBondContact OG1-ND2 3.48Å; T382-N385 VanDerWaalsContact OG1-ND2 3.15Å; N385-W389 WeakPolarHBondContact O-CB 3.42Å; N385-W389 PolarHBondContact O-N 3.41Å; N385-K477 HydrophobicContact CB-CD 4.43Å; N385-K477 VanDerWaalsContact CG-CD 3.44Å; N385-K477 WeakPolarHBondContact OD1-CD 3.36Å; N385-K477 WeakPolarHBondContact OD1-CE 3.39Å; N385-K477 PolarHBondContact OD1-NZ 3.42Å; N385-M480 HydrophobicContact CB-CE 3.84Å; N385-M480 WeakPolarHBondContact O-CE 3.34Å
386	H	89.2	Confident	90.4	Very high	26 Å²	26	40.8 Å²	40.8	12%	0.12	22%	0.221	C	C	.	.	H	α-helix	trans	-65.2	-43.5	176.3	176.3	-103.9	0	0	0	111.6	A380 T382 E383 E384 W389 V390 Y432 S434	A380-H386 HydrophobicContact CB-CB 4.07Å; T382-H386 VanDerWaalsContact O-CB 3.25Å; T382-H386 WeakPolarHBondContact O-CB 3.34Å; T382-H386 PolarHBondContact O-N 3.13Å; E383-H386 WeakPolarHBondContact O-CB 3.26Å; E383-H386 PolarHBondContact O-N 3.06Å; E384-H386 VanDerWaalsContact C-N 3.3Å; E384-H386 PolarHBondContact O-N 2.96Å; H386-W389 PolarHBondContact O-N 2.67Å; H386-V390 WeakPolarHBondContact NE2-CG2 3.38Å; H386-V390 VanDerWaalsContact O-CB 3.25Å; H386-V390 WeakPolarHBondContact O-CB 3.49Å; H386-V390 VanDerWaalsContact O-CG2 3.22Å; H386-V390 WeakPolarHBondContact O-CG2 3.47Å; H386-V390 PolarHBondContact O-N 3.38Å; H386-Y432 HydrophobicContact CB-CG 4.3Å; H386-Y432 PolarHBondContact CD2-O 3.17Å; H386-Y432 VanDerWaalsContact CG-CB 3.46Å; H386-S434 PolarHBondContact CE1-OG 2.81Å; H386-S434 PolarHBondContact NE2-N 2.94Å; H386-S434 PolarHBondContact NE2-OG 2.85Å; H386-S434 VanDerWaalsContact NE2-OG 3.07Å
387	L	86.8	Confident	90.4	Very high	114 Å²	114	40.8 Å²	40.8	60%	0.597	22%	0.221	S	C	*	.	H	α-helix	trans	-63.8	-44.8	178.5	-173.6	63.7	0	0	0	112.2	E383 E384 G391	E383-L387 PolarHBondContact O-N 2.88Å; E384-L387 PolarHBondContact O-N 2.84Å; L387-G391 PolarHBondContact O-N 3.29Å; L387-G391 VanDerWaalsContact O-N 3.11Å
388	E	86.4	Confident	90.4	Very high	84 Å²	84	44 Å²	44	39%	0.393	23%	0.231	S	C	.	.	H	α-helix	trans	-59.2	-48.7	172.1	-71.5	176.2	170.2	0	0	111.8	E384 G391 L392 M475 K477	E384-E388 PolarHBondContact O-N 3.03Å; E384-E388 VanDerWaalsContact O-N 3.14Å; E388-G391 PolarHBondContact O-N 2.85Å; E388-L392 PolarHBondContact O-N 2.89Å; E388-M475 HydrophobicContact CB-CE 4.34Å; E388-M475 HydrophobicContact CB-CG 4.41Å; E388-M475 HydrophobicContact CB-SD 4.08Å; E388-K477 VanDerWaalsContact CD-NZ 3.32Å; E388-K477 IonicContact OE1-NZ 3.74Å; E388-K477 PolarHBondContact OE1-NZ 2.9Å; E388-K477 IonicContact OE2-NZ 3.16Å; E388-K477 PolarHBondContact OE2-NZ 3.49Å
389	W	91.8	Very high	90.5	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-64.6	-45.2	-177.5	-174.2	-126	0	0	0	112	N385 H386 G391 L392 V393 V466 Y467 A470 M475 L476 M480 K481 I482	N385-W389 WeakPolarHBondContact O-CB 3.42Å; N385-W389 PolarHBondContact O-N 3.41Å; H386-W389 PolarHBondContact O-N 2.67Å; W389-G391 PolarHBondContact O-N 3.44Å; W389-L392 HydrophobicContact CE3-CD2 4.33Å; W389-L392 HydrophobicContact CZ3-CD2 4.1Å; W389-L392 PolarHBondContact O-N 3.18Å; W389-V393 HydrophobicContact CD2-CG2 4.09Å; W389-V393 HydrophobicContact CG-CG2 4.44Å; W389-V393 HydrophobicContact CZ2-CG2 4.24Å; W389-V393 WeakPolarHBondContact O-CB 3.23Å; W389-V393 VanDerWaalsContact O-CG2 3.26Å; W389-V393 WeakPolarHBondContact O-CG2 3.37Å; W389-V393 PolarHBondContact O-N 3.45Å; W389-V466 HydrophobicContact CH2-CG1 3.76Å; W389-V466 HydrophobicContact CZ2-CG1 4.34Å; W389-V466 HydrophobicContact CZ3-CG1 4.19Å; W389-Y467 AromaticContact CH2-CD1 3.85Å; W389-Y467 HydrophobicContact CH2-CD1 3.85Å; W389-Y467 AromaticContact CH2-CE1 3.84Å; W389-Y467 HydrophobicContact CH2-CE1 3.84Å; W389-Y467 HydrophobicContact CZ2-CD1 4.46Å; W389-Y467 AromaticContact CZ2-CE1 4Å; W389-Y467 HydrophobicContact CZ2-CE1 4Å; W389-A470 HydrophobicContact CH2-CB 4.49Å; W389-A470 HydrophobicContact CZ3-CB 3.72Å; W389-M475 HydrophobicContact CE3-CE 3.72Å; W389-M475 HydrophobicContact CZ3-CE 4.41Å; W389-L476 HydrophobicContact CE3-CD1 4.42Å; W389-L476 HydrophobicContact CH2-CD1 3.77Å; W389-L476 HydrophobicContact CZ3-CD1 3.66Å; W389-M480 HydrophobicContact CB-CE 4.19Å; W389-M480 HydrophobicContact CB-CG 4.32Å; W389-M480 HydrophobicContact CB-SD 4.22Å; W389-M480 HydrophobicContact CD2-CB 4.03Å; W389-M480 HydrophobicContact CD2-CG 4.2Å; W389-M480 HydrophobicContact CD2-SD 4.06Å; W389-M480 HydrophobicContact CE3-CB 4.28Å; W389-M480 HydrophobicContact CE3-CG 4.39Å; W389-M480 HydrophobicContact CE3-SD 3.7Å; W389-M480 HydrophobicContact CG-CB 4.34Å; W389-M480 HydrophobicContact CG-CG 4.18Å; W389-M480 HydrophobicContact CG-SD 4.31Å; W389-M480 HydrophobicContact CZ2-CB 4.49Å; W389-M480 HydrophobicContact CZ3-SD 4.37Å; W389-K481 PolarHBondContact NE1-O 3.23Å; W389-I482 HydrophobicContact CH2-CG2 4.48Å; W389-I482 HydrophobicContact CZ2-CB 3.83Å; W389-I482 HydrophobicContact CZ2-CG2 3.91Å
390	V	91.2	Very high	90.6	Very high	20 Å²	20	45.8 Å²	45.8	12%	0.121	24%	0.241	C	C	.	.	H	α-helix	trans	-56.2	-48.2	174	160.6	0	0	0	0	111	H386 L392 V393 E394 W436	H386-V390 WeakPolarHBondContact NE2-CG2 3.38Å; H386-V390 VanDerWaalsContact O-CB 3.25Å; H386-V390 WeakPolarHBondContact O-CB 3.49Å; H386-V390 VanDerWaalsContact O-CG2 3.22Å; H386-V390 WeakPolarHBondContact O-CG2 3.47Å; H386-V390 PolarHBondContact O-N 3.38Å; V390-L392 PolarHBondContact O-N 3.02Å; V390-V393 PolarHBondContact O-N 3.26Å; V390-E394 WeakPolarHBondContact O-CB 3.45Å; V390-E394 PolarHBondContact O-N 2.85Å; V390-W436 HydrophobicContact CB-CH2 4.25Å; V390-W436 HydrophobicContact CG1-CH2 3.87Å; V390-W436 HydrophobicContact CG1-CZ2 3.98Å; V390-W436 HydrophobicContact CG2-CH2 4.07Å
391	G	88.6	Confident	90.8	Very high	36 Å²	36	45.9 Å²	45.9	37%	0.371	24%	0.241	S	C	.	.	H	α-helix	trans	-61.7	-41.1	178.3	0	0	0	0	0	113	L387 E388 W389 S395	L387-G391 PolarHBondContact O-N 3.29Å; L387-G391 VanDerWaalsContact O-N 3.11Å; E388-G391 PolarHBondContact O-N 2.85Å; W389-G391 PolarHBondContact O-N 3.44Å; G391-S395 WeakPolarHBondContact O-CB 3.3Å; G391-S395 PolarHBondContact O-N 3.46Å
392	L	90.4	Very high	91	Very high	18 Å²	18	44.4 Å²	44.4	9%	0.094	24%	0.235	C	C	.	.	H	α-helix	trans	-64.7	-50.9	173.6	-177.6	65.5	0	0	0	111.2	E388 W389 V390 E394 S395 K396 A470 I473 M475	E388-L392 PolarHBondContact O-N 2.89Å; W389-L392 HydrophobicContact CE3-CD2 4.33Å; W389-L392 HydrophobicContact CZ3-CD2 4.1Å; W389-L392 PolarHBondContact O-N 3.18Å; V390-L392 PolarHBondContact O-N 3.02Å; L392-E394 PolarHBondContact O-N 3.3Å; L392-S395 WeakPolarHBondContact O-CB 3.35Å; L392-S395 PolarHBondContact O-N 2.9Å; L392-S395 PolarHBondContact O-OG 3.25Å; L392-K396 VanDerWaalsContact CD1-CE 3.44Å; L392-K396 WeakPolarHBondContact O-CG 3.28Å; L392-K396 PolarHBondContact O-N 3.1Å; L392-A470 HydrophobicContact CD2-CB 3.55Å; L392-I473 HydrophobicContact CD1-CD1 4.36Å; L392-I473 HydrophobicContact CD2-CD1 4.47Å; L392-M475 HydrophobicContact CB-CE 3.76Å; L392-M475 HydrophobicContact CB-SD 4.23Å; L392-M475 HydrophobicContact CD2-CE 3.6Å; L392-M475 HydrophobicContact CD2-SD 4.3Å; L392-M475 HydrophobicContact CG-CE 4.31Å
393	V	93	Very high	91.3	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-58.9	-50.2	-177	170.5	0	0	0	0	111.2	L376 A378 W389 V390 S395 K396 I397 W436 V466 I482	L376-V393 HydrophobicContact CD2-CG1 4.05Å; A378-V393 HydrophobicContact CB-CB 4.41Å; A378-V393 HydrophobicContact CB-CG1 4.29Å; A378-V393 HydrophobicContact CB-CG2 4.1Å; W389-V393 HydrophobicContact CD2-CG2 4.09Å; W389-V393 HydrophobicContact CG-CG2 4.44Å; W389-V393 HydrophobicContact CZ2-CG2 4.24Å; W389-V393 WeakPolarHBondContact O-CB 3.23Å; W389-V393 VanDerWaalsContact O-CG2 3.26Å; W389-V393 WeakPolarHBondContact O-CG2 3.37Å; W389-V393 PolarHBondContact O-N 3.45Å; V390-V393 PolarHBondContact O-N 3.26Å; V393-S395 VanDerWaalsContact C-N 3.25Å; V393-S395 PolarHBondContact O-N 3.49Å; V393-K396 PolarHBondContact O-N 3.48Å; V393-I397 WeakPolarHBondContact O-CG1 3.45Å; V393-I397 PolarHBondContact O-N 3.16Å; V393-W436 HydrophobicContact CG1-CH2 4.36Å; V393-W436 HydrophobicContact CG1-CZ3 4.12Å; V393-V466 HydrophobicContact CG2-CG1 4.15Å; V393-I482 HydrophobicContact CB-CD1 4.45Å; V393-I482 HydrophobicContact CG1-CD1 3.69Å; V393-I482 HydrophobicContact CG1-CG1 4.47Å; V393-I482 HydrophobicContact CG2-CD1 3.9Å
394	E	92.3	Very high	91.6	Very high	46 Å²	46	36 Å²	36	22%	0.215	19%	0.192	C	C	.	.	H	α-helix	trans	-55.4	-43.6	178.2	-166.9	-177.2	179.7	0	0	111.1	M239 L240 V390 L392 K396 I397 W436	M239-E394 HydrophobicContact SD-CB 4Å; M239-E394 HydrophobicContact SD-CG 3.83Å; L240-E394 HydrophobicContact CD1-CG 4.49Å; L240-E394 HydrophobicContact CD2-CG 3.89Å; L240-E394 HydrophobicContact CG-CG 4.33Å; V390-E394 WeakPolarHBondContact O-CB 3.45Å; V390-E394 PolarHBondContact O-N 2.85Å; L392-E394 PolarHBondContact O-N 3.3Å; E394-K396 PolarHBondContact O-N 2.88Å; E394-I397 PolarHBondContact O-N 2.85Å; E394-I397 VanDerWaalsContact O-N 3.13Å; E394-W436 HydrophobicContact CB-CZ2 4Å; E394-W436 HydrophobicContact CG-CZ2 4.39Å
395	S	89.3	Confident	92	Very high	24 Å²	24	31.5 Å²	31.5	17%	0.168	17%	0.171	C	C	.	.	H	α-helix	trans	-61.8	-14.9	178.8	84.4	0	0	0	0	114.7	M239 G391 L392 V393 R398	M239-S395 VanDerWaalsContact SD-CA 3.51Å; M239-S395 PolarHBondContact SD-N 3Å; G391-S395 WeakPolarHBondContact O-CB 3.3Å; G391-S395 PolarHBondContact O-N 3.46Å; L392-S395 WeakPolarHBondContact O-CB 3.35Å; L392-S395 PolarHBondContact O-N 2.9Å; L392-S395 PolarHBondContact O-OG 3.25Å; V393-S395 VanDerWaalsContact C-N 3.25Å; V393-S395 PolarHBondContact O-N 3.49Å; S395-R398 PolarHBondContact O-NH1 2.91Å
396	K	93.3	Very high	92.3	Very high	41 Å²	41	39.3 Å²	39.3	18%	0.178	20%	0.199	C	C	.	.	H	α-helix	trans	-109	-8.5	177.4	-46.9	-50.4	164.2	178.7	0	114.6	L392 V393 E394 R398 V399 F462 V466	L392-K396 VanDerWaalsContact CD1-CE 3.44Å; L392-K396 WeakPolarHBondContact O-CG 3.28Å; L392-K396 PolarHBondContact O-N 3.1Å; V393-K396 PolarHBondContact O-N 3.48Å; E394-K396 PolarHBondContact O-N 2.88Å; K396-R398 PolarHBondContact O-N 3.35Å; K396-R398 VanDerWaalsContact O-N 3.07Å; K396-V399 HydrophobicContact CB-CG2 4.47Å; K396-V399 WeakPolarHBondContact O-CA 3.4Å; K396-V399 WeakPolarHBondContact O-CB 3.37Å; K396-V399 WeakPolarHBondContact O-CG2 3.47Å; K396-V399 PolarHBondContact O-N 3.15Å; K396-F462 HydrophobicContact CB-CE2 3.87Å; K396-F462 WeakPolarHBondContact O-CE2 2.9Å; K396-V466 HydrophobicContact CB-CG2 4.01Å; K396-V466 HydrophobicContact CG-CG2 4.18Å
397	I	95.8	Very high	92.3	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-58	-30.9	-176.6	-58.7	178.6	0	0	0	111.9	L240 L376 V393 E394 V399 L400 V401 V415 W436 L438	L240-I397 HydrophobicContact CD2-CB 3.75Å; L240-I397 HydrophobicContact CD2-CD1 4.19Å; L240-I397 HydrophobicContact CD2-CG1 4.35Å; L240-I397 HydrophobicContact CD2-CG2 4.31Å; L376-I397 HydrophobicContact CD2-CD1 3.93Å; L376-I397 HydrophobicContact CD2-CG1 3.76Å; V393-I397 WeakPolarHBondContact O-CG1 3.45Å; V393-I397 PolarHBondContact O-N 3.16Å; E394-I397 PolarHBondContact O-N 2.85Å; E394-I397 VanDerWaalsContact O-N 3.13Å; I397-V399 PolarHBondContact O-N 3.47Å; I397-L400 WeakPolarHBondContact O-CB 3.46Å; I397-L400 PolarHBondContact O-N 3.11Å; I397-V401 PolarHBondContact O-N 3.41Å; I397-V415 HydrophobicContact CG2-CB 4.36Å; I397-V415 HydrophobicContact CG2-CG2 3.85Å; I397-W436 HydrophobicContact CD1-CB 4.08Å; I397-W436 HydrophobicContact CD1-CD2 3.69Å; I397-W436 HydrophobicContact CD1-CE3 4.31Å; I397-W436 HydrophobicContact CD1-CG 3.57Å; I397-L438 HydrophobicContact CG2-CD1 4.22Å; I397-L438 HydrophobicContact CG2-CD2 4.34Å
398	R	94.5	Very high	92.5	Very high	87 Å²	87	39.9 Å²	39.9	33%	0.328	20%	0.199	S	C	.	.	H	α-helix	trans	-61.5	-22.2	172.4	70.7	175.2	-179.8	-71.1	-6.9	114.6	M239 N327 S395 K396 G402	M239-R398 WeakPolarHBondContact O-CD 3.26Å; M239-R398 PolarHBondContact O-NH1 2.84Å; N327-R398 PolarHBondContact OD1-NE 3.3Å; S395-R398 PolarHBondContact O-NH1 2.91Å; K396-R398 PolarHBondContact O-N 3.35Å; K396-R398 VanDerWaalsContact O-N 3.07Å; R398-G402 PolarHBondContact O-N 2.8Å
399	V	94.2	Very high	92.7	Very high	52 Å²	52	38.4 Å²	38.4	32%	0.315	19%	0.192	S	C	.	.	H	α-helix	trans	-72.1	-40.1	171.6	-174.6	0	0	0	0	110.6	K396 I397 G402 N403 F462	K396-V399 HydrophobicContact CB-CG2 4.47Å; K396-V399 WeakPolarHBondContact O-CA 3.4Å; K396-V399 WeakPolarHBondContact O-CB 3.37Å; K396-V399 WeakPolarHBondContact O-CG2 3.47Å; K396-V399 PolarHBondContact O-N 3.15Å; I397-V399 PolarHBondContact O-N 3.47Å; V399-G402 CarbonylContact O-C 3.53Å; V399-G402 PolarHBondContact O-N 3.34Å; V399-N403 PolarHBondContact O-N 2.87Å; V399-N403 PolarHBondContact O-OD1 3.13Å; V399-F462 HydrophobicContact CB-CD2 4.3Å
400	L	95.4	Very high	92.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-62.8	-44.6	171.6	-179.5	58	0	0	0	110.8	I397 G402 N403 L404 L438 I459 F462	I397-L400 WeakPolarHBondContact O-CB 3.46Å; I397-L400 PolarHBondContact O-N 3.11Å; L400-G402 VanDerWaalsContact C-N 3.3Å; L400-G402 PolarHBondContact O-N 3.03Å; L400-N403 PolarHBondContact O-N 3.47Å; L400-N403 VanDerWaalsContact O-N 3.17Å; L400-L404 HydrophobicContact CD1-CD1 4.1Å; L400-L404 HydrophobicContact CD1-CG 4.19Å; L400-L404 HydrophobicContact CG-CD1 3.94Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 VanDerWaalsContact O-CG 3.26Å; L400-L404 WeakPolarHBondContact O-CG 3.22Å; L400-L404 PolarHBondContact O-N 3.36Å; L400-L438 HydrophobicContact CD2-CD2 3.88Å; L400-L438 HydrophobicContact CG-CD2 4.15Å; L400-I459 HydrophobicContact CD1-CG1 4.16Å; L400-F462 HydrophobicContact CB-CB 4.24Å; L400-F462 HydrophobicContact CB-CD1 4.07Å; L400-F462 HydrophobicContact CB-CD2 3.71Å; L400-F462 HydrophobicContact CB-CE1 4.38Å; L400-F462 HydrophobicContact CB-CE2 4.05Å; L400-F462 HydrophobicContact CB-CG 3.71Å; L400-F462 HydrophobicContact CB-CZ 4.37Å; L400-F462 HydrophobicContact CD1-CB 3.98Å; L400-F462 HydrophobicContact CD1-CD1 4.2Å; L400-F462 HydrophobicContact CD1-CG 4.12Å; L400-F462 HydrophobicContact CD2-CD1 4.11Å; L400-F462 HydrophobicContact CD2-CE1 4.2Å; L400-F462 HydrophobicContact CG-CD1 4.35Å; L400-F462 HydrophobicContact CG-CG 4.33Å
401	V	96.1	Very high	92.8	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.012	21%	0.211	C	C	.	.	H	α-helix	trans	-57.6	-43.2	173.3	176	0	0	0	0	111	I397 L404 E405 A413 V415 L438	I397-V401 PolarHBondContact O-N 3.41Å; V401-L404 PolarHBondContact O-N 3.48Å; V401-E405 HydrophobicContact CG1-CG 4.47Å; V401-E405 WeakPolarHBondContact CG1-OE1 3.49Å; V401-E405 WeakPolarHBondContact O-CB 3.25Å; V401-E405 WeakPolarHBondContact O-CG 3.48Å; V401-E405 PolarHBondContact O-N 3.38Å; V401-A413 HydrophobicContact CG1-CB 4.35Å; V401-V415 HydrophobicContact CG2-CG1 4.43Å; V401-L438 HydrophobicContact CG2-CD2 4.09Å
402	G	94.4	Very high	93.2	Very high	25 Å²	25	40.5 Å²	40.5	26%	0.258	20%	0.196	S	C	.	.	H	α-helix	trans	-69.9	-25.3	176	0	0	0	0	0	115.5	R398 V399 L400 R406	R398-G402 PolarHBondContact O-N 2.8Å; V399-G402 CarbonylContact O-C 3.53Å; V399-G402 PolarHBondContact O-N 3.34Å; L400-G402 VanDerWaalsContact C-N 3.3Å; L400-G402 PolarHBondContact O-N 3.03Å; G402-R406 PolarHBondContact O-NE 2.76Å
403	N	94.1	Very high	93.5	Very high	7 Å²	7	39.6 Å²	39.6	4%	0.037	19%	0.192	C	C	.	.	H	α-helix	trans	-69.5	-53.4	167.5	-72.5	-1.6	0	0	0	109.5	V399 L400 E405 R406 N407 D458	V399-N403 PolarHBondContact O-N 2.87Å; V399-N403 PolarHBondContact O-OD1 3.13Å; L400-N403 PolarHBondContact O-N 3.47Å; L400-N403 VanDerWaalsContact O-N 3.17Å; N403-E405 VanDerWaalsContact C-N 3.3Å; N403-E405 PolarHBondContact O-N 2.87Å; N403-R406 WeakPolarHBondContact O-CB 3.48Å; N403-R406 PolarHBondContact O-N 2.98Å; N403-R406 PolarHBondContact OD1-NH2 3.18Å; N403-N407 PolarHBondContact O-N 3.27Å; N403-D458 HydrophobicContact CB-CB 4.04Å; N403-D458 PolarHBondContact ND2-O 3.45Å
404	L	94.5	Very high	93.6	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.6	-33.6	-179	-63.1	168.5	0	0	0	112.9	I374 L400 V401 R406 N407 I410 A413 L438 I440 L455 D458	I374-L404 HydrophobicContact CD1-CD1 3.79Å; I374-L404 HydrophobicContact CD1-CD2 3.99Å; L400-L404 HydrophobicContact CD1-CD1 4.1Å; L400-L404 HydrophobicContact CD1-CG 4.19Å; L400-L404 HydrophobicContact CG-CD1 3.94Å; L400-L404 HydrophobicContact CG-CG 4.46Å; L400-L404 VanDerWaalsContact O-CG 3.26Å; L400-L404 WeakPolarHBondContact O-CG 3.22Å; L400-L404 PolarHBondContact O-N 3.36Å; V401-L404 PolarHBondContact O-N 3.48Å; L404-R406 PolarHBondContact O-N 3.19Å; L404-N407 WeakPolarHBondContact O-CB 3.44Å; L404-N407 PolarHBondContact O-N 3.42Å; L404-I410 HydrophobicContact CB-CD1 3.81Å; L404-I410 HydrophobicContact CD2-CD1 3.54Å; L404-I410 HydrophobicContact CG-CD1 4.23Å; L404-I410 WeakPolarHBondContact O-CB 2.9Å; L404-I410 WeakPolarHBondContact O-CG2 3.41Å; L404-A413 HydrophobicContact CB-CB 3.99Å; L404-A413 HydrophobicContact CD1-CB 4.02Å; L404-L438 HydrophobicContact CD1-CD2 4.18Å; L404-I440 HydrophobicContact CD1-CD1 4.18Å; L404-L455 HydrophobicContact CD2-CD1 4.48Å; L404-L455 HydrophobicContact CD2-CD2 4.42Å; L404-D458 HydrophobicContact CD2-CB 4.28Å
405	E	93.9	Very high	93.8	Very high	54 Å²	54	37.7 Å²	37.7	25%	0.252	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-18.5	173.8	-82.4	-178.1	-155.8	0	0	114.2	S329 T330 S331 V401 N403	S329-E405 WeakPolarHBondContact CB-OE1 3.21Å; S329-E405 PolarHBondContact OG-OE1 2.92Å; T330-E405 WeakPolarHBondContact CA-OE2 3.5Å; T330-E405 WeakPolarHBondContact CB-OE2 3.06Å; T330-E405 PolarHBondContact N-OE1 3.22Å; T330-E405 PolarHBondContact N-OE2 3.32Å; T330-E405 PolarHBondContact OG1-OE2 3.29Å; T330-E405 VanDerWaalsContact OG1-OE2 3.06Å; S331-E405 WeakPolarHBondContact CA-OE1 3.49Å; S331-E405 WeakPolarHBondContact CB-OE1 3.44Å; S331-E405 PolarHBondContact N-OE1 3.49Å; S331-E405 WeakPolarHBondContact OG-CG 3.41Å; S331-E405 PolarHBondContact OG-OE1 2.95Å; V401-E405 HydrophobicContact CG1-CG 4.47Å; V401-E405 WeakPolarHBondContact CG1-OE1 3.49Å; V401-E405 WeakPolarHBondContact O-CB 3.25Å; V401-E405 WeakPolarHBondContact O-CG 3.48Å; V401-E405 PolarHBondContact O-N 3.38Å; N403-E405 VanDerWaalsContact C-N 3.3Å; N403-E405 PolarHBondContact O-N 2.87Å
406	R	92.3	Very high	94.1	Very high	189 Å²	189	37.4 Å²	37.4	71%	0.713	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-12.8	174.7	-69.1	179	-72.4	-168.4	2.8	113.1	G402 N403 L404 E408	G402-R406 PolarHBondContact O-NE 2.76Å; N403-R406 WeakPolarHBondContact O-CB 3.48Å; N403-R406 PolarHBondContact O-N 2.98Å; N403-R406 PolarHBondContact OD1-NH2 3.18Å; L404-R406 PolarHBondContact O-N 3.19Å; R406-E408 PolarHBondContact O-N 2.83Å
407	N	91.2	Very high	94	Very high	22 Å²	22	36.6 Å²	36.6	12%	0.118	18%	0.178	C	C	.	.	S	Bend	trans	-74	121.5	177.2	-169.8	-62.9	0	0	0	110.1	N403 L404 F409 I410 L455 D458	N403-N407 PolarHBondContact O-N 3.27Å; L404-N407 WeakPolarHBondContact O-CB 3.44Å; L404-N407 PolarHBondContact O-N 3.42Å; N407-F409 PolarHBondContact O-N 3.29Å; N407-F409 VanDerWaalsContact O-N 3.13Å; N407-F409 PolarHBondContact OD1-N 2.65Å; N407-F409 VanDerWaalsContact OD1-N 3.13Å; N407-I410 HydrophobicContact CB-CB 4.36Å; N407-I410 HydrophobicContact CB-CD1 4.06Å; N407-I410 HydrophobicContact CB-CG1 4.15Å; N407-I410 PolarHBondContact O-N 3Å; N407-L455 WeakPolarHBondContact ND2-CD2 3.32Å; N407-D458 PolarHBondContact ND2-OD2 2.86Å
408	E	89.5	Confident	93.8	Very high	130 Å²	130	42.3 Å²	42.3	61%	0.607	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-25.2	-173.4	67.3	-177.3	162.1	0	0	114.2	R406 I410 R443	R406-E408 PolarHBondContact O-N 2.83Å; E408-I410 VanDerWaalsContact C-N 3.32Å; E408-R443 PolarHBondContact O-NE 2.94Å; E408-R443 VanDerWaalsContact O-NE 3.09Å; E408-R443 PolarHBondContact O-NH1 3.36Å; E408-R443 PolarHBondContact O-NH2 3.2Å; E408-R443 VanDerWaalsContact O-NH2 3.17Å
409	F	90.1	Very high	93.7	Very high	53 Å²	53	40.6 Å²	40.6	23%	0.232	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.1	178.3	-54.8	-74.7	0	0	0	113.1	N407 F442 R443 V445 V451 I453	N407-F409 PolarHBondContact O-N 3.29Å; N407-F409 VanDerWaalsContact O-N 3.13Å; N407-F409 PolarHBondContact OD1-N 2.65Å; N407-F409 VanDerWaalsContact OD1-N 3.13Å; F409-F442 CarbonylContact O-C 3.59Å; F409-F442 VanDerWaalsContact O-CA 3.24Å; F409-F442 WeakPolarHBondContact O-CA 3.5Å; F409-F442 WeakPolarHBondContact O-CD1 3.27Å; F409-R443 PolarHBondContact O-N 3.36Å; F409-V445 HydrophobicContact CD1-CG2 4.49Å; F409-V451 HydrophobicContact CD1-CG1 3.81Å; F409-V451 HydrophobicContact CE1-CG1 3.75Å; F409-I453 HydrophobicContact CB-CD1 3.56Å; F409-I453 HydrophobicContact CB-CG1 3.86Å; F409-I453 HydrophobicContact CB-CG2 4.15Å; F409-I453 HydrophobicContact CD1-CG1 4.31Å; F409-I453 HydrophobicContact CD2-CG1 4.2Å; F409-I453 HydrophobicContact CD2-CG2 4.1Å; F409-I453 HydrophobicContact CG-CD1 4.1Å; F409-I453 HydrophobicContact CG-CG1 3.85Å; F409-I453 HydrophobicContact CG-CG2 4.36Å
410	I	92.4	Very high	93.6	Very high	7 Å²	7	38.8 Å²	38.8	4%	0.036	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	146.7	178.9	-63.6	-177.4	0	0	0	110.3	L404 N407 E408 I440 F442 R443 L455	L404-I410 HydrophobicContact CB-CD1 3.81Å; L404-I410 HydrophobicContact CD2-CD1 3.54Å; L404-I410 HydrophobicContact CG-CD1 4.23Å; L404-I410 WeakPolarHBondContact O-CB 2.9Å; L404-I410 WeakPolarHBondContact O-CG2 3.41Å; N407-I410 HydrophobicContact CB-CB 4.36Å; N407-I410 HydrophobicContact CB-CD1 4.06Å; N407-I410 HydrophobicContact CB-CG1 4.15Å; N407-I410 PolarHBondContact O-N 3Å; E408-I410 VanDerWaalsContact C-N 3.32Å; I410-I440 HydrophobicContact CD1-CG2 4.42Å; I410-I440 HydrophobicContact CG1-CG2 4.44Å; I410-F442 HydrophobicContact CD1-CE1 4.43Å; I410-F442 HydrophobicContact CG1-CD1 3.98Å; I410-F442 HydrophobicContact CG1-CE1 4.01Å; I410-R443 PolarHBondContact O-NH2 3.01Å; I410-L455 HydrophobicContact CD1-CD2 4Å
411	T	93.8	Very high	93.3	Very high	82 Å²	82	43.8 Å²	43.8	50%	0.503	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-28.2	175	-57.6	0	0	0	0	111.6	I441 R443	T411-I441 PolarHBondContact N-O 3.14Å; T411-R443 VanDerWaalsContact OG1-CA 3.25Å; T411-R443 WeakPolarHBondContact OG1-CA 3.48Å; T411-R443 WeakPolarHBondContact OG1-CB 3.05Å; T411-R443 PolarHBondContact OG1-N 3.08Å
412	L	95.8	Very high	92.6	Very high	11 Å²	11	44.5 Å²	44.5	6%	0.058	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	135.5	176.4	-160.8	84.1	0	0	0	111.1	T334 V335 Y370 H414 I440 I441	T334-L412 HydrophobicContact CG2-CD1 3.98Å; V335-L412 HydrophobicContact CG2-CD1 4.39Å; V335-L412 HydrophobicContact CG2-CD2 3.97Å; Y370-L412 HydrophobicContact CE1-CD2 3.91Å; L412-H414 HydrophobicContact CD2-CB 4.08Å; L412-I440 WeakPolarHBondContact O-CA 3.49Å; L412-I441 HydrophobicContact CB-CB 3.84Å; L412-I441 HydrophobicContact CB-CD1 4.02Å; L412-I441 HydrophobicContact CB-CG1 3.96Å; L412-I441 HydrophobicContact CD2-CD1 3.87Å; L412-I441 HydrophobicContact CD2-CG1 4.28Å; L412-I441 PolarHBondContact N-O 2.81Å; L412-I441 VanDerWaalsContact N-O 3.17Å; L412-I441 PolarHBondContact O-N 3.39Å
413	A	96.8	Very high	91.5	Very high	0 Å²	0	46 Å²	46	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	104.8	162.7	0	0	0	0	0	109.6	S331 V401 L404 I440	S331-A413 WeakPolarHBondContact CB-O 3.34Å; S331-A413 PolarHBondContact OG-N 3.43Å; V401-A413 HydrophobicContact CG1-CB 4.35Å; L404-A413 HydrophobicContact CB-CB 3.99Å; L404-A413 HydrophobicContact CD1-CB 4.02Å; A413-I440 HydrophobicContact CB-CD1 3.97Å
414	H	96.9	Very high	89.9	Confident	5 Å²	5	54.8 Å²	54.8	2%	0.023	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	100.4	-177.8	178.8	-169.4	0	0	0	110.8	F242 V335 F366 Y370 L412 L438 G439	F242-H414 AromaticContact CZ-CD2 3.66Å; F242-H414 AromaticContact CZ-NE2 3.72Å; V335-H414 HydrophobicContact CG2-CB 4.04Å; F366-H414 AromaticContact CD2-CE1 3.83Å; F366-H414 AromaticContact CE2-CE1 3.77Å; F366-H414 AromaticContact CE2-CG 3.87Å; F366-H414 AromaticContact CE2-ND1 3.68Å; F366-H414 WeakPolarHBondContact CZ-O 3.49Å; Y370-H414 HydrophobicContact CE2-CB 4.38Å; Y370-H414 AromaticContact CE2-ND1 3.66Å; Y370-H414 AromaticContact CZ-ND1 3.53Å; Y370-H414 PolarHBondContact OH-ND1 2.67Å; L412-H414 HydrophobicContact CD2-CB 4.08Å; H414-L438 CarbonylContact O-C 3.34Å; H414-L438 WeakPolarHBondContact O-CA 3.39Å; H414-G439 PolarHBondContact N-O 3.5Å; H414-G439 PolarHBondContact O-N 3.35Å
415	V	96.4	Very high	87.9	Confident	1 Å²	1	62.8 Å²	62.8	1%	0.006	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69	129.9	169.6	59.5	0	0	0	0	111.2	L240 F242 I397 V401 P417 L438	L240-V415 HydrophobicContact CB-CG1 4.06Å; L240-V415 HydrophobicContact CD1-CG2 4.27Å; L240-V415 HydrophobicContact CD2-CG2 4.43Å; F242-V415 HydrophobicContact CE2-CG1 4.14Å; I397-V415 HydrophobicContact CG2-CB 4.36Å; I397-V415 HydrophobicContact CG2-CG2 3.85Å; V401-V415 HydrophobicContact CG2-CG1 4.43Å; V415-P417 WeakPolarHBondContact O-CD 3.41Å; V415-L438 HydrophobicContact CB-CG 4.03Å; V415-L438 HydrophobicContact CG2-CD1 4.31Å; V415-L438 HydrophobicContact CG2-CG 4.33Å
416	N	94.9	Very high	85.8	Confident	17 Å²	17	66.5 Å²	66.5	9%	0.091	33%	0.329	C	S	.	.			trans	-75.5	123.3	164.6	-176.5	-6.5	0	0	0	109.2	F366 Q418 F437	F366-N416 HydrophobicContact CD1-CB 4.26Å; F366-N416 HydrophobicContact CD2-CB 4.29Å; F366-N416 HydrophobicContact CE1-CB 3.88Å; F366-N416 HydrophobicContact CE2-CB 3.9Å; F366-N416 HydrophobicContact CG-CB 4.47Å; F366-N416 HydrophobicContact CZ-CB 3.69Å; N416-Q418 PolarHBondContact O-N 3.31Å; N416-Q418 PolarHBondContact OD1-N 2.83Å; N416-F437 PolarHBondContact N-O 3.1Å
417	P	91.9	Very high	84	Confident	24 Å²	24	61.1 Å²	61.1	16%	0.156	31%	0.312	C	S	.	.	S	Bend	trans	-66.1	-16.8	177.8	-24.4	36.5	0	0	0	115.4	G234 L240 F242 V415	G234-P417 WeakPolarHBondContact O-CD 3.43Å; G234-P417 WeakPolarHBondContact O-CG 3.43Å; L240-P417 HydrophobicContact CD1-CB 3.95Å; L240-P417 HydrophobicContact CD1-CG 4.42Å; F242-P417 HydrophobicContact CD2-CG 3.94Å; F242-P417 HydrophobicContact CE2-CG 3.96Å; V415-P417 WeakPolarHBondContact O-CD 3.41Å
418	Q	91.2	Very high	82	Confident	120 Å²	120	70 Å²	70	56%	0.561	35%	0.349	S	S	*	.			trans	-81.8	125.1	173.5	-178.1	168.2	12.1	0	0	110.6	N416 F420	N416-Q418 PolarHBondContact O-N 3.31Å; N416-Q418 PolarHBondContact OD1-N 2.83Å; Q418-F420 HydrophobicContact CB-CE2 4.14Å; Q418-F420 HydrophobicContact CB-CZ 4.11Å; Q418-F420 HydrophobicContact CG-CE1 4.17Å; Q418-F420 HydrophobicContact CG-CE2 3.99Å; Q418-F420 HydrophobicContact CG-CZ 3.75Å; Q418-F420 WeakPolarHBondContact O-CD2 3.24Å; Q418-F420 WeakPolarHBondContact O-CE2 3.42Å
419	S	92.4	Very high	80.5	Confident	51 Å²	51	68.7 Å²	68.7	36%	0.357	35%	0.347	S	S	.	.			trans	-82.6	156.6	163.8	60.9	0	0	0	0	111.2	M435	S419-M435 CarbonylContact C-O 3.53Å; S419-M435 WeakPolarHBondContact CA-O 3.27Å
420	F	91.8	Very high	79.1	Confident	14 Å²	14	73.8 Å²	73.8	6%	0.061	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	144.1	-179.5	-61.5	-92.3	0	0	0	109.9	F367 Q418 S434 M435 F437 L496 I500	F367-F420 HydrophobicContact CE2-CZ 4.04Å; F367-F420 HydrophobicContact CZ-CE1 4.5Å; F367-F420 AromaticContact CZ-CE2 3.8Å; F367-F420 HydrophobicContact CZ-CE2 3.8Å; F367-F420 AromaticContact CZ-CZ 3.74Å; F367-F420 HydrophobicContact CZ-CZ 3.74Å; Q418-F420 HydrophobicContact CB-CE2 4.14Å; Q418-F420 HydrophobicContact CB-CZ 4.11Å; Q418-F420 HydrophobicContact CG-CE1 4.17Å; Q418-F420 HydrophobicContact CG-CE2 3.99Å; Q418-F420 HydrophobicContact CG-CZ 3.75Å; Q418-F420 WeakPolarHBondContact O-CD2 3.24Å; Q418-F420 WeakPolarHBondContact O-CE2 3.42Å; F420-S434 CarbonylContact O-C 3.54Å; F420-S434 WeakPolarHBondContact O-CA 3.41Å; F420-M435 PolarHBondContact N-O 3.27Å; F420-M435 PolarHBondContact O-N 3.07Å; F420-F437 HydrophobicContact CB-CE2 4.28Å; F420-F437 AromaticContact CD2-CD2 3.74Å; F420-F437 HydrophobicContact CD2-CD2 3.74Å; F420-F437 AromaticContact CD2-CE2 3.71Å; F420-F437 HydrophobicContact CD2-CE2 3.71Å; F420-F437 HydrophobicContact CE2-CD2 4.13Å; F420-F437 HydrophobicContact CE2-CE2 4.45Å; F420-F437 HydrophobicContact CG-CE2 4.19Å; F420-L496 HydrophobicContact CB-CD2 4.08Å; F420-L496 HydrophobicContact CD1-CD2 3.84Å; F420-L496 HydrophobicContact CD2-CD2 4.44Å; F420-L496 HydrophobicContact CE1-CD2 4.45Å; F420-L496 HydrophobicContact CG-CD2 3.84Å; F420-I500 HydrophobicContact CD1-CD1 3.99Å; F420-I500 HydrophobicContact CE1-CD1 4.01Å; F420-I500 HydrophobicContact CE1-CG2 4.24Å
421	P	89.3	Confident	78.4	Confident	106 Å²	106	75.3 Å²	75.3	69%	0.688	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.2	146.2	174.9	29.3	-34.8	0	0	0	111	M435	P421-M435 WeakPolarHBondContact O-CE 3.47Å
422	G	81.4	Confident	78.2	Confident	16 Å²	16	76.1 Å²	76.1	17%	0.165	38%	0.379	C	S	.	.	P	Polyproline II helix	trans	-63.1	148.6	173.8	0	0	0	0	0	112.8	K424 V433	G422-K424 PolarHBondContact O-N 3.34Å; G422-V433 PolarHBondContact N-O 2.87Å
423	N	70.6	Confident	77.9	Confident	58 Å²	58	76.4 Å²	76.4	31%	0.31	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-79.2	117.5	-176.6	-164.5	11.2	0	0	0	110.9	E425 H426	N423-E425 VanDerWaalsContact C-N 3.26Å; N423-E425 PolarHBondContact O-N 3.44Å; N423-H426 PolarHBondContact O-N 3.16Å
424	K	60.4	Low	77.8	Confident	190 Å²	190	77 Å²	77	83%	0.826	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-62.4	-28.5	-167.3	-67.6	-169.6	176.6	-172	0	114.1	G422 H426 H427	G422-K424 PolarHBondContact O-N 3.34Å; K424-H426 VanDerWaalsContact C-N 3.25Å; K424-H426 PolarHBondContact O-N 3.12Å; K424-H427 PolarHBondContact O-N 3.08Å
425	E	53	Low	77.7	Confident	168 Å²	168	77.1 Å²	77.1	79%	0.785	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-68.3	-21.5	-177	-60.3	-178	151	0	0	113.8	N423	N423-E425 VanDerWaalsContact C-N 3.26Å; N423-E425 PolarHBondContact O-N 3.44Å
426	H	50.4	Low	77.7	Confident	133 Å²	133	77.1 Å²	77.1	62%	0.616	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-96	-11.7	-179.3	-74.5	-52.3	0	0	0	114.4	N423 K424	N423-H426 PolarHBondContact O-N 3.16Å; K424-H426 VanDerWaalsContact C-N 3.25Å; K424-H426 PolarHBondContact O-N 3.12Å
427	H	53.7	Low	77.7	Confident	76 Å²	76	76.3 Å²	76.3	35%	0.352	38%	0.381	S	S	.	.			trans	-109.4	103.6	178.9	-63.7	-66.3	0	0	0	110	K424 D429	K424-H427 PolarHBondContact O-N 3.08Å; H427-D429 PolarHBondContact O-N 2.93Å
428	K	49.8	Very low	78	Confident	208 Å²	208	75.1 Å²	75.1	90%	0.904	37%	0.374	S	S	*	.			trans	-72.3	-10.1	178	-67.9	-172.6	175.7	-175.4	0	114.1
429	D	56.8	Low	78.2	Confident	103 Å²	103	69.4 Å²	69.4	55%	0.551	35%	0.347	S	S	*	.	S	Bend	trans	-104.4	150.9	-179.6	-49.3	-37.2	0	0	0	109.9	H427 N431	H427-D429 PolarHBondContact O-N 2.93Å; D429-N431 VanDerWaalsContact CB-ND2 3.31Å; D429-N431 WeakPolarHBondContact CB-ND2 3.46Å; D429-N431 PolarHBondContact O-N 2.76Å; D429-N431 PolarHBondContact OD2-ND2 3.34Å
430	N	62.4	Low	78.4	Confident	160 Å²	160	67.1 Å²	67.1	86%	0.856	33%	0.331	S	S	*	.			trans	-72	46.4	174.2	-73.9	-19.7	0	0	0	113.2
431	N	77.6	Confident	78.5	Confident	38 Å²	38	70.1 Å²	70.1	20%	0.203	35%	0.347	C	S	.	.			trans	-87.1	138.6	176.7	-69.8	-46.3	0	0	0	110.9	S381 D429 V433	S381-N431 WeakPolarHBondContact CA-OD1 3.37Å; S381-N431 PolarHBondContact OG-OD1 3.2Å; D429-N431 VanDerWaalsContact CB-ND2 3.31Å; D429-N431 WeakPolarHBondContact CB-ND2 3.46Å; D429-N431 PolarHBondContact O-N 2.76Å; D429-N431 PolarHBondContact OD2-ND2 3.34Å; N431-V433 HydrophobicContact CB-CG2 4.46Å
432	Y	87.8	Confident	78.5	Confident	99 Å²	99	66.1 Å²	66.1	39%	0.388	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	134.5	169.9	-64.2	-104.4	0	0	0	108.1	S379 A380 E383 H386	S379-Y432 CarbonylContact C-O 3.57Å; S379-Y432 WeakPolarHBondContact CA-O 3.38Å; S379-Y432 VanDerWaalsContact CB-O 3.31Å; S379-Y432 WeakPolarHBondContact CB-O 3.37Å; A380-Y432 PolarHBondContact N-O 2.8Å; A380-Y432 PolarHBondContact O-N 2.81Å; E383-Y432 HydrophobicContact CB-CD1 4.05Å; E383-Y432 HydrophobicContact CB-CE1 3.57Å; E383-Y432 HydrophobicContact CB-CE2 4.4Å; E383-Y432 HydrophobicContact CG-CD1 4.24Å; E383-Y432 HydrophobicContact CG-CE1 3.91Å; H386-Y432 HydrophobicContact CB-CG 4.3Å; H386-Y432 PolarHBondContact CD2-O 3.17Å; H386-Y432 VanDerWaalsContact CG-CB 3.46Å
433	V	91.1	Very high	78.8	Confident	17 Å²	17	72 Å²	72	10%	0.103	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	132.6	-169	-173.5	0	0	0	0	111.4	T377 A378 G422 N431	T377-V433 HydrophobicContact CG2-CG1 3.5Å; A378-V433 WeakPolarHBondContact O-CA 3.42Å; G422-V433 PolarHBondContact N-O 2.87Å; N431-V433 HydrophobicContact CB-CG2 4.46Å
434	S	94	Very high	79	Confident	13 Å²	13	79.8 Å²	79.8	9%	0.091	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	144.5	170.1	-63.8	0	0	0	0	111.6	T377 A378 H386 F420	T377-S434 WeakPolarHBondContact CA-O 3.47Å; A378-S434 PolarHBondContact N-O 3.48Å; A378-S434 PolarHBondContact O-N 3.09Å; H386-S434 PolarHBondContact CE1-OG 2.81Å; H386-S434 PolarHBondContact NE2-N 2.94Å; H386-S434 PolarHBondContact NE2-OG 2.85Å; H386-S434 VanDerWaalsContact NE2-OG 3.07Å; F420-S434 CarbonylContact O-C 3.54Å; F420-S434 WeakPolarHBondContact O-CA 3.41Å
435	M	94.9	Very high	79.6	Confident	7 Å²	7	73.6 Å²	73.6	3%	0.034	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.3	-177.7	-59.4	-176	-59	0	0	111.2	V375 L376 T377 S419 F420 P421 F437 Y495	V375-M435 HydrophobicContact CG1-CB 4.23Å; V375-M435 HydrophobicContact CG1-CG 4.47Å; V375-M435 HydrophobicContact CG1-SD 4.29Å; L376-M435 CarbonylContact O-C 3.59Å; L376-M435 VanDerWaalsContact O-CA 3.26Å; L376-M435 WeakPolarHBondContact O-CA 3.34Å; T377-M435 HydrophobicContact CG2-CG 4.19Å; S419-M435 CarbonylContact C-O 3.53Å; S419-M435 WeakPolarHBondContact CA-O 3.27Å; F420-M435 PolarHBondContact N-O 3.27Å; F420-M435 PolarHBondContact O-N 3.07Å; P421-M435 WeakPolarHBondContact O-CE 3.47Å; M435-F437 HydrophobicContact CB-CE2 4.04Å; M435-F437 HydrophobicContact CB-CZ 4.38Å; M435-F437 HydrophobicContact CE-CZ 4.3Å; M435-Y495 WeakPolarHBondContact CE-O 3.35Å; M435-Y495 HydrophobicContact SD-CD1 3.93Å
436	W	95.9	Very high	80	Confident	1 Å²	1	72.7 Å²	72.7	0%	0.004	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	154.6	167.4	-65.2	-102.3	0	0	0	109.9	V375 L376 A378 V390 V393 E394 I397	V375-W436 WeakPolarHBondContact CA-O 3.18Å; L376-W436 PolarHBondContact N-O 3.28Å; L376-W436 PolarHBondContact O-N 3.49Å; A378-W436 HydrophobicContact CB-CZ3 3.89Å; V390-W436 HydrophobicContact CB-CH2 4.25Å; V390-W436 HydrophobicContact CG1-CH2 3.87Å; V390-W436 HydrophobicContact CG1-CZ2 3.98Å; V390-W436 HydrophobicContact CG2-CH2 4.07Å; V393-W436 HydrophobicContact CG1-CH2 4.36Å; V393-W436 HydrophobicContact CG1-CZ3 4.12Å; E394-W436 HydrophobicContact CB-CZ2 4Å; E394-W436 HydrophobicContact CG-CZ2 4.39Å; I397-W436 HydrophobicContact CD1-CB 4.08Å; I397-W436 HydrophobicContact CD1-CD2 3.69Å; I397-W436 HydrophobicContact CD1-CE3 4.31Å; I397-W436 HydrophobicContact CD1-CG 3.57Å
437	F	95.9	Very high	80.5	Confident	0 Å²	0	74 Å²	74	0%	0	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	123.1	-177.9	-64.6	-98.2	0	0	0	110.2	F366 F367 V375 N416 F420 M435 L492 L496	F366-F437 HydrophobicContact CE1-CB 3.98Å; F366-F437 WeakPolarHBondContact CZ-O 3.47Å; F367-F437 HydrophobicContact CE1-CB 3.89Å; F367-F437 HydrophobicContact CE1-CD1 4.05Å; F367-F437 AromaticContact CE1-CD2 4Å; F367-F437 HydrophobicContact CE1-CD2 4Å; F367-F437 AromaticContact CE1-CG 3.71Å; F367-F437 HydrophobicContact CE1-CG 3.71Å; F367-F437 HydrophobicContact CZ-CD2 4.34Å; F367-F437 HydrophobicContact CZ-CG 4.47Å; V375-F437 HydrophobicContact CB-CD1 4.48Å; V375-F437 HydrophobicContact CB-CE1 4.31Å; V375-F437 HydrophobicContact CG1-CD1 4.27Å; V375-F437 HydrophobicContact CG1-CE1 3.82Å; V375-F437 HydrophobicContact CG1-CZ 4Å; V375-F437 HydrophobicContact CG2-CD1 3.86Å; V375-F437 HydrophobicContact CG2-CE1 3.64Å; N416-F437 PolarHBondContact N-O 3.1Å; F420-F437 HydrophobicContact CB-CE2 4.28Å; F420-F437 AromaticContact CD2-CD2 3.74Å; F420-F437 HydrophobicContact CD2-CD2 3.74Å; F420-F437 AromaticContact CD2-CE2 3.71Å; F420-F437 HydrophobicContact CD2-CE2 3.71Å; F420-F437 HydrophobicContact CE2-CD2 4.13Å; F420-F437 HydrophobicContact CE2-CE2 4.45Å; F420-F437 HydrophobicContact CG-CE2 4.19Å; M435-F437 HydrophobicContact CB-CE2 4.04Å; M435-F437 HydrophobicContact CB-CZ 4.38Å; M435-F437 HydrophobicContact CE-CZ 4.3Å; F437-L492 HydrophobicContact CD1-CD2 3.93Å; F437-L492 HydrophobicContact CE1-CD2 3.9Å; F437-L496 HydrophobicContact CD1-CD1 4.39Å; F437-L496 HydrophobicContact CD2-CD1 4.47Å; F437-L496 HydrophobicContact CE1-CD1 3.87Å; F437-L496 HydrophobicContact CE1-CG 4.18Å; F437-L496 HydrophobicContact CE2-CD1 3.99Å; F437-L496 HydrophobicContact CE2-CD2 3.85Å; F437-L496 HydrophobicContact CE2-CG 4.1Å; F437-L496 HydrophobicContact CZ-CD1 3.67Å; F437-L496 HydrophobicContact CZ-CD2 3.83Å; F437-L496 HydrophobicContact CZ-CG 3.62Å
438	L	96.9	Very high	80.9	Confident	0 Å²	0	71.7 Å²	71.7	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	109.9	175.8	-71.1	74.2	0	0	0	108.6	Y373 I374 I397 L400 V401 L404 H414 V415 I440	Y373-L438 CarbonylContact C-O 3.51Å; Y373-L438 WeakPolarHBondContact CA-O 3.23Å; I374-L438 HydrophobicContact CB-CB 4.34Å; I374-L438 PolarHBondContact N-O 2.9Å; I374-L438 PolarHBondContact O-N 3.31Å; I397-L438 HydrophobicContact CG2-CD1 4.22Å; I397-L438 HydrophobicContact CG2-CD2 4.34Å; L400-L438 HydrophobicContact CD2-CD2 3.88Å; L400-L438 HydrophobicContact CG-CD2 4.15Å; V401-L438 HydrophobicContact CG2-CD2 4.09Å; L404-L438 HydrophobicContact CD1-CD2 4.18Å; H414-L438 CarbonylContact O-C 3.34Å; H414-L438 WeakPolarHBondContact O-CA 3.39Å; V415-L438 HydrophobicContact CB-CG 4.03Å; V415-L438 HydrophobicContact CG2-CD1 4.31Å; V415-L438 HydrophobicContact CG2-CG 4.33Å; L438-I440 HydrophobicContact CB-CD1 4.3Å
439	G	96.6	Very high	81.4	Confident	0 Å²	0	69.9 Å²	69.9	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76	124.7	174.9	0	0	0	0	0	111.2	H414	H414-G439 PolarHBondContact N-O 3.5Å; H414-G439 PolarHBondContact O-N 3.35Å
440	I	95.4	Very high	81.9	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.015	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.6	-173.7	-51.6	-56.1	0	0	0	110.9	H372 I374 L404 I410 L412 A413 L438 F442	H372-I440 HydrophobicContact CB-CB 4.38Å; H372-I440 PolarHBondContact O-N 3.24Å; I374-I440 HydrophobicContact CD1-CD1 4.15Å; I374-I440 HydrophobicContact CD1-CG1 4.31Å; I374-I440 HydrophobicContact CG1-CD1 4.45Å; I374-I440 HydrophobicContact CG1-CG1 4.21Å; L404-I440 HydrophobicContact CD1-CD1 4.18Å; I410-I440 HydrophobicContact CD1-CG2 4.42Å; I410-I440 HydrophobicContact CG1-CG2 4.44Å; L412-I440 WeakPolarHBondContact O-CA 3.49Å; A413-I440 HydrophobicContact CB-CD1 3.97Å; L438-I440 HydrophobicContact CB-CD1 4.3Å; I440-F442 HydrophobicContact CB-CE2 4.49Å; I440-F442 HydrophobicContact CG2-CD1 4.13Å; I440-F442 HydrophobicContact CG2-CD2 4.17Å; I440-F442 HydrophobicContact CG2-CE1 3.86Å; I440-F442 HydrophobicContact CG2-CE2 3.91Å; I440-F442 HydrophobicContact CG2-CG 4.28Å; I440-F442 HydrophobicContact CG2-CZ 3.75Å
441	I	94.3	Very high	82.6	Confident	76 Å²	76	61.5 Å²	61.5	39%	0.39	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.1	162.1	-55.3	-178.3	0	0	0	108	Y370 T411 L412	Y370-I441 HydrophobicContact CD1-CD1 4.3Å; Y370-I441 HydrophobicContact CD1-CG1 3.69Å; Y370-I441 HydrophobicContact CE1-CD1 3.89Å; Y370-I441 HydrophobicContact CE1-CG1 3.71Å; T411-I441 PolarHBondContact N-O 3.14Å; L412-I441 HydrophobicContact CB-CB 3.84Å; L412-I441 HydrophobicContact CB-CD1 4.02Å; L412-I441 HydrophobicContact CB-CG1 3.96Å; L412-I441 HydrophobicContact CD2-CD1 3.87Å; L412-I441 HydrophobicContact CD2-CG1 4.28Å; L412-I441 PolarHBondContact N-O 2.81Å; L412-I441 VanDerWaalsContact N-O 3.17Å; L412-I441 PolarHBondContact O-N 3.39Å
442	F	90.5	Very high	82.6	Confident	23 Å²	23	65.3 Å²	65.3	10%	0.101	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	148.2	170.4	-63.8	-73.9	0	0	0	111.2	H372 F409 I410 I440 I453 L455 L732 L734	H372-F442 HydrophobicContact CB-CD2 4.47Å; H372-F442 HydrophobicContact CB-CE2 3.81Å; H372-F442 AromaticContact CD2-CD2 3.94Å; H372-F442 AromaticContact CD2-CE2 3.92Å; H372-F442 AromaticContact CG-CE2 3.67Å; F409-F442 CarbonylContact O-C 3.59Å; F409-F442 VanDerWaalsContact O-CA 3.24Å; F409-F442 WeakPolarHBondContact O-CA 3.5Å; F409-F442 WeakPolarHBondContact O-CD1 3.27Å; I410-F442 HydrophobicContact CD1-CE1 4.43Å; I410-F442 HydrophobicContact CG1-CD1 3.98Å; I410-F442 HydrophobicContact CG1-CE1 4.01Å; I440-F442 HydrophobicContact CB-CE2 4.49Å; I440-F442 HydrophobicContact CG2-CD1 4.13Å; I440-F442 HydrophobicContact CG2-CD2 4.17Å; I440-F442 HydrophobicContact CG2-CE1 3.86Å; I440-F442 HydrophobicContact CG2-CE2 3.91Å; I440-F442 HydrophobicContact CG2-CG 4.28Å; I440-F442 HydrophobicContact CG2-CZ 3.75Å; F442-I453 HydrophobicContact CD1-CD1 3.48Å; F442-I453 VanDerWaalsContact CD1-CD1 3.48Å; F442-I453 HydrophobicContact CE1-CD1 3.71Å; F442-I453 HydrophobicContact CE1-CG2 4.44Å; F442-I453 HydrophobicContact CG-CD1 4.1Å; F442-I453 HydrophobicContact CZ-CD1 4.48Å; F442-L455 HydrophobicContact CE1-CD1 4.34Å; F442-L455 HydrophobicContact CZ-CD1 4.34Å; F442-L732 HydrophobicContact CZ-CD1 3.84Å; F442-L734 HydrophobicContact CB-CD1 3.64Å; F442-L734 HydrophobicContact CD1-CD1 4.12Å; F442-L734 HydrophobicContact CD2-CD1 3.51Å; F442-L734 HydrophobicContact CD2-CD2 4.18Å; F442-L734 HydrophobicContact CD2-CG 4.45Å; F442-L734 HydrophobicContact CE2-CD1 4.13Å; F442-L734 HydrophobicContact CE2-CD2 4.17Å; F442-L734 HydrophobicContact CG-CD1 3.49Å; F442-L734 VanDerWaalsContact CG-CD1 3.49Å
443	R	86.6	Confident	82.4	Confident	138 Å²	138	60.8 Å²	60.8	52%	0.521	30%	0.299	S	S	.	.	P	Polyproline II helix	trans	-66.7	136.7	173.5	-166.7	174.8	-61.3	176.6	10.7	109.1	E408 F409 I410 T411 V445	E408-R443 PolarHBondContact O-NE 2.94Å; E408-R443 VanDerWaalsContact O-NE 3.09Å; E408-R443 PolarHBondContact O-NH1 3.36Å; E408-R443 PolarHBondContact O-NH2 3.2Å; E408-R443 VanDerWaalsContact O-NH2 3.17Å; F409-R443 PolarHBondContact O-N 3.36Å; I410-R443 PolarHBondContact O-NH2 3.01Å; T411-R443 VanDerWaalsContact OG1-CA 3.25Å; T411-R443 WeakPolarHBondContact OG1-CA 3.48Å; T411-R443 WeakPolarHBondContact OG1-CB 3.05Å; T411-R443 PolarHBondContact OG1-N 3.08Å; R443-V445 PolarHBondContact O-N 2.91Å
444	R	75.5	Confident	82.1	Confident	222 Å²	222	62.9 Å²	62.9	84%	0.838	31%	0.309	S	S	*	.	P	Polyproline II helix	trans	-74.8	123.6	169.9	-68.8	-176.2	178.3	-176	-0.3	108.6
445	V	71.9	Confident	81.9	Confident	61 Å²	61	62.3 Å²	62.3	37%	0.37	31%	0.305	S	S	.	.			trans	-98.7	113.9	169.3	-178.7	0	0	0	0	106.7	F409 R443 N447 A448 V451	F409-V445 HydrophobicContact CD1-CG2 4.49Å; R443-V445 PolarHBondContact O-N 2.91Å; V445-N447 VanDerWaalsContact C-N 3.27Å; V445-N447 PolarHBondContact O-N 3.09Å; V445-A448 HydrophobicContact CG1-CB 4.09Å; V445-V451 HydrophobicContact CB-CG2 4.04Å; V445-V451 HydrophobicContact CG2-CG2 4.12Å
446	E	61.8	Low	81.5	Confident	149 Å²	149	63.4 Å²	63.4	70%	0.696	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-14.9	-165.7	-57.7	-170.6	140.7	0	0	113.6	R736	E446-R736 VanDerWaalsContact O-CZ 3.31Å; E446-R736 PolarHBondContact O-NH1 2.77Å; E446-R736 VanDerWaalsContact O-NH1 3.16Å; E446-R736 PolarHBondContact O-NH2 2.87Å
447	N	60.4	Low	81.2	Confident	161 Å²	161	71.8 Å²	71.8	86%	0.861	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114	18.5	-172.1	-62.1	-14.4	0	0	0	114	V445	V445-N447 VanDerWaalsContact C-N 3.27Å; V445-N447 PolarHBondContact O-N 3.09Å
448	A	61.9	Low	81	Confident	27 Å²	27	72.7 Å²	72.7	22%	0.223	35%	0.35	C	S	.	.			trans	-129.5	138.4	178.9	0	0	0	0	0	111.9	V445 V451	V445-A448 HydrophobicContact CG1-CB 4.09Å; A448-V451 HydrophobicContact CB-CG2 3.76Å
449	E	60.5	Low	80.7	Confident	170 Å²	170	73 Å²	73	79%	0.794	35%	0.351	S	S	*	.	S	Bend	trans	-80.8	-33.9	174.1	-60.8	-172	146.4	0	0	112.1	R736	E449-R736 PolarHBondContact O-N 2.77Å; E449-R736 VanDerWaalsContact O-N 3.12Å
450	S	67.9	Low	80.5	Confident	59 Å²	59	74.2 Å²	74.2	41%	0.413	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	146.6	166.9	64.4	0	0	0	0	111	L734	S450-L734 CarbonylContact C-O 3.52Å; S450-L734 WeakPolarHBondContact CA-O 3.26Å
451	V	76.5	Confident	80.3	Confident	27 Å²	27	75.8 Å²	75.8	16%	0.164	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	124.8	175.9	-177.2	0	0	0	0	108.6	F409 V445 A448 I453 L734	F409-V451 HydrophobicContact CD1-CG1 3.81Å; F409-V451 HydrophobicContact CE1-CG1 3.75Å; V445-V451 HydrophobicContact CB-CG2 4.04Å; V445-V451 HydrophobicContact CG2-CG2 4.12Å; A448-V451 HydrophobicContact CB-CG2 3.76Å; V451-I453 HydrophobicContact CG1-CG1 3.93Å; V451-L734 PolarHBondContact N-O 3.45Å; V451-L734 PolarHBondContact O-N 2.7Å
452	N	78.8	Confident	80.3	Confident	118 Å²	118	72.1 Å²	72.1	63%	0.631	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.9	111.7	172.8	-72.7	-50.1	0	0	0	109.6	L732 T733	N452-L732 WeakPolarHBondContact CA-O 3.44Å; N452-T733 WeakPolarHBondContact OD1-CB 3.36Å; N452-T733 WeakPolarHBondContact OD1-CG2 3.5Å; N452-T733 PolarHBondContact OD1-OG1 2.71Å
453	I	83.5	Confident	80.4	Confident	4 Å²	4	71.4 Å²	71.4	2%	0.021	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	124.9	178.5	-54.1	173.3	0	0	0	108.4	F409 F442 V451 L455 L732 L734	F409-I453 HydrophobicContact CB-CD1 3.56Å; F409-I453 HydrophobicContact CB-CG1 3.86Å; F409-I453 HydrophobicContact CB-CG2 4.15Å; F409-I453 HydrophobicContact CD1-CG1 4.31Å; F409-I453 HydrophobicContact CD2-CG1 4.2Å; F409-I453 HydrophobicContact CD2-CG2 4.1Å; F409-I453 HydrophobicContact CG-CD1 4.1Å; F409-I453 HydrophobicContact CG-CG1 3.85Å; F409-I453 HydrophobicContact CG-CG2 4.36Å; F442-I453 HydrophobicContact CD1-CD1 3.48Å; F442-I453 VanDerWaalsContact CD1-CD1 3.48Å; F442-I453 HydrophobicContact CE1-CD1 3.71Å; F442-I453 HydrophobicContact CE1-CG2 4.44Å; F442-I453 HydrophobicContact CG-CD1 4.1Å; F442-I453 HydrophobicContact CZ-CD1 4.48Å; V451-I453 HydrophobicContact CG1-CG1 3.93Å; I453-L455 HydrophobicContact CG2-CD2 3.62Å; I453-L455 HydrophobicContact CG2-CG 4.02Å; I453-L732 HydrophobicContact CB-CB 4.47Å; I453-L732 PolarHBondContact N-O 2.94Å; I453-L732 PolarHBondContact O-N 3.28Å; I453-L734 HydrophobicContact CD1-CD1 3.44Å; I453-L734 VanDerWaalsContact CD1-CD1 3.44Å; I453-L734 HydrophobicContact CD1-CG 3.96Å
454	D	85.1	Confident	80.7	Confident	62 Å²	62	68 Å²	68	33%	0.332	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	112.6	171.1	-162.8	-20.8	0	0	0	109.4	T456 R731	D454-T456 WeakPolarHBondContact OD1-CB 3.24Å; D454-T456 PolarHBondContact OD1-N 3.04Å; D454-T456 PolarHBondContact OD1-OG1 3.4Å; D454-R731 HydrophobicContact CB-CG 4.22Å; D454-R731 WeakPolarHBondContact OD2-CG 3.12Å; D454-R731 IonicContact OD2-CZ 2.83Å; D454-R731 IonicContact OD2-NE 2.63Å; D454-R731 PolarHBondContact OD2-NE 2.86Å; D454-R731 IonicContact OD2-NH2 3.34Å; D454-R731 PolarHBondContact OD2-NH2 3.01Å
455	L	89.3	Confident	81.5	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	31%	0.305	C	S	.	.			trans	-98.7	4	175.8	-58.5	-176.4	0	0	0	112.2	I374 L404 N407 I410 F442 I453 Y457 D458 I459 I730 L732	I374-L455 HydrophobicContact CD1-CD1 4.33Å; L404-L455 HydrophobicContact CD2-CD1 4.48Å; L404-L455 HydrophobicContact CD2-CD2 4.42Å; N407-L455 WeakPolarHBondContact ND2-CD2 3.32Å; I410-L455 HydrophobicContact CD1-CD2 4Å; F442-L455 HydrophobicContact CE1-CD1 4.34Å; F442-L455 HydrophobicContact CZ-CD1 4.34Å; I453-L455 HydrophobicContact CG2-CD2 3.62Å; I453-L455 HydrophobicContact CG2-CG 4.02Å; L455-Y457 VanDerWaalsContact C-N 3.28Å; L455-Y457 PolarHBondContact O-N 2.98Å; L455-D458 PolarHBondContact O-N 3.03Å; L455-I459 HydrophobicContact CB-CD1 4.25Å; L455-I459 WeakPolarHBondContact O-CB 3.36Å; L455-I459 WeakPolarHBondContact O-CG1 3.42Å; L455-I459 PolarHBondContact O-N 3.14Å; L455-I459 VanDerWaalsContact O-N 3.14Å; L455-I730 HydrophobicContact CB-CB 4.28Å; L455-I730 HydrophobicContact CB-CG2 4.15Å; L455-I730 PolarHBondContact N-O 2.74Å; L455-L732 HydrophobicContact CD1-CD1 3.78Å; L455-L732 HydrophobicContact CG-CD1 4.26Å
456	T	87.2	Confident	82.5	Confident	30 Å²	30	55.5 Å²	55.5	18%	0.184	29%	0.288	C	S	.	.	H	α-helix	trans	-57.3	-41.7	-177.5	-51.8	0	0	0	0	111.6	D454 Q460 S729 I730	D454-T456 WeakPolarHBondContact OD1-CB 3.24Å; D454-T456 PolarHBondContact OD1-N 3.04Å; D454-T456 PolarHBondContact OD1-OG1 3.4Å; T456-Q460 WeakPolarHBondContact O-CB 3.41Å; T456-Q460 PolarHBondContact O-N 3.25Å; T456-S729 VanDerWaalsContact OG1-CA 3.3Å; T456-S729 WeakPolarHBondContact OG1-CA 3.31Å; T456-I730 PolarHBondContact OG1-N 2.96Å
457	Y	89.4	Confident	84	Confident	178 Å²	178	49.3 Å²	49.3	70%	0.698	26%	0.258	S	S	*	.	H	α-helix	trans	-67.5	-47.3	-178.6	-177.9	-94.8	0	0	0	112.4	L455 I459 Q460 S461	L455-Y457 VanDerWaalsContact C-N 3.28Å; L455-Y457 PolarHBondContact O-N 2.98Å; Y457-I459 VanDerWaalsContact C-N 3.25Å; Y457-I459 PolarHBondContact O-N 2.87Å; Y457-Q460 PolarHBondContact O-N 3.07Å; Y457-S461 WeakPolarHBondContact O-CB 3.46Å; Y457-S461 PolarHBondContact O-N 3.28Å
458	D	91.3	Very high	85.5	Confident	18 Å²	18	47.5 Å²	47.5	10%	0.096	24%	0.239	C	C	.	.	H	α-helix	trans	-59.6	-38.8	179.6	-69.3	-45.2	0	0	0	112	N403 L404 N407 L455 F462	N403-D458 HydrophobicContact CB-CB 4.04Å; N403-D458 PolarHBondContact ND2-O 3.45Å; L404-D458 HydrophobicContact CD2-CB 4.28Å; N407-D458 PolarHBondContact ND2-OD2 2.86Å; L455-D458 PolarHBondContact O-N 3.03Å; D458-F462 PolarHBondContact O-N 3.32Å
459	I	91.1	Very high	86.8	Confident	6 Å²	6	49.4 Å²	49.4	3%	0.031	24%	0.243	C	C	.	.	H	α-helix	trans	-75.6	-47.7	178.9	-72	172.9	0	0	0	111.4	I374 L400 L455 Y457 S461 F462 T463 A484 I730	I374-I459 HydrophobicContact CD1-CD1 4.3Å; L400-I459 HydrophobicContact CD1-CG1 4.16Å; L455-I459 HydrophobicContact CB-CD1 4.25Å; L455-I459 WeakPolarHBondContact O-CB 3.36Å; L455-I459 WeakPolarHBondContact O-CG1 3.42Å; L455-I459 PolarHBondContact O-N 3.14Å; L455-I459 VanDerWaalsContact O-N 3.14Å; Y457-I459 VanDerWaalsContact C-N 3.25Å; Y457-I459 PolarHBondContact O-N 2.87Å; I459-S461 VanDerWaalsContact C-N 3.35Å; I459-S461 PolarHBondContact O-N 2.98Å; I459-F462 WeakPolarHBondContact O-CB 3.25Å; I459-F462 PolarHBondContact O-N 3.44Å; I459-T463 WeakPolarHBondContact O-CB 3.37Å; I459-T463 PolarHBondContact O-N 2.95Å; I459-T463 PolarHBondContact O-OG1 2.8Å; I459-T463 VanDerWaalsContact O-OG1 3.13Å; I459-A484 HydrophobicContact CD1-CB 4.39Å; I459-A484 HydrophobicContact CG2-CB 3.76Å; I459-I730 HydrophobicContact CD1-CB 4.24Å; I459-I730 HydrophobicContact CD1-CD1 3.51Å; I459-I730 HydrophobicContact CD1-CG1 3.9Å
460	Q	90.9	Very high	88.2	Confident	26 Å²	26	41.3 Å²	41.3	12%	0.121	21%	0.206	C	C	.	.	H	α-helix	trans	-62.4	-42.8	178.5	-169.5	70.1	59.6	0	0	111.1	T456 Y457 F462 T463 D464	T456-Q460 WeakPolarHBondContact O-CB 3.41Å; T456-Q460 PolarHBondContact O-N 3.25Å; Y457-Q460 PolarHBondContact O-N 3.07Å; Q460-F462 VanDerWaalsContact C-N 3.27Å; Q460-F462 PolarHBondContact O-N 2.89Å; Q460-T463 PolarHBondContact O-N 2.88Å; Q460-D464 PolarHBondContact NE2-OD1 3.03Å; Q460-D464 WeakPolarHBondContact O-CB 3.49Å; Q460-D464 PolarHBondContact O-N 3.29Å
461	S	92.4	Very high	89.3	Confident	36 Å²	36	41.6 Å²	41.6	25%	0.252	20%	0.203	S	C	.	.	H	α-helix	trans	-57.5	-38.4	175.1	175.1	0	0	0	0	112.6	Y457 I459 T465	Y457-S461 WeakPolarHBondContact O-CB 3.46Å; Y457-S461 PolarHBondContact O-N 3.28Å; I459-S461 VanDerWaalsContact C-N 3.35Å; I459-S461 PolarHBondContact O-N 2.98Å; S461-T465 VanDerWaalsContact O-CB 3.26Å; S461-T465 WeakPolarHBondContact O-CB 3.31Å; S461-T465 PolarHBondContact O-N 2.83Å; S461-T465 PolarHBondContact O-OG1 3.32Å
462	F	94.3	Very high	89.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-69.1	-52.2	172.5	163.9	-105.5	0	0	0	111.9	L376 K396 V399 L400 D458 I459 Q460 D464 T465 V466 I482	L376-F462 HydrophobicContact CD1-CE1 3.72Å; L376-F462 HydrophobicContact CD1-CZ 4.5Å; L376-F462 HydrophobicContact CD2-CE1 4.02Å; L376-F462 HydrophobicContact CD2-CZ 4Å; K396-F462 HydrophobicContact CB-CE2 3.87Å; K396-F462 WeakPolarHBondContact O-CE2 2.9Å; V399-F462 HydrophobicContact CB-CD2 4.3Å; L400-F462 HydrophobicContact CB-CB 4.24Å; L400-F462 HydrophobicContact CB-CD1 4.07Å; L400-F462 HydrophobicContact CB-CD2 3.71Å; L400-F462 HydrophobicContact CB-CE1 4.38Å; L400-F462 HydrophobicContact CB-CE2 4.05Å; L400-F462 HydrophobicContact CB-CG 3.71Å; L400-F462 HydrophobicContact CB-CZ 4.37Å; L400-F462 HydrophobicContact CD1-CB 3.98Å; L400-F462 HydrophobicContact CD1-CD1 4.2Å; L400-F462 HydrophobicContact CD1-CG 4.12Å; L400-F462 HydrophobicContact CD2-CD1 4.11Å; L400-F462 HydrophobicContact CD2-CE1 4.2Å; L400-F462 HydrophobicContact CG-CD1 4.35Å; L400-F462 HydrophobicContact CG-CG 4.33Å; D458-F462 PolarHBondContact O-N 3.32Å; I459-F462 WeakPolarHBondContact O-CB 3.25Å; I459-F462 PolarHBondContact O-N 3.44Å; Q460-F462 VanDerWaalsContact C-N 3.27Å; Q460-F462 PolarHBondContact O-N 2.89Å; F462-D464 PolarHBondContact O-N 3.22Å; F462-T465 CarbonylContact O-C 3.55Å; F462-T465 WeakPolarHBondContact O-CA 3.12Å; F462-T465 WeakPolarHBondContact O-CB 3.43Å; F462-T465 PolarHBondContact O-N 3.49Å; F462-V466 HydrophobicContact CD2-CG2 4.13Å; F462-V466 HydrophobicContact CE1-CG2 4.24Å; F462-V466 HydrophobicContact CE2-CG2 3.57Å; F462-V466 HydrophobicContact CZ-CG2 3.65Å; F462-V466 PolarHBondContact O-N 3.35Å; F462-I482 HydrophobicContact CE1-CD1 3.6Å; F462-I482 HydrophobicContact CZ-CD1 3.82Å
463	T	92.9	Very high	90.2	Very high	8 Å²	8	45.5 Å²	45.5	5%	0.049	22%	0.221	C	C	.	.	H	α-helix	trans	-54.8	-49.2	179.3	-66.5	0	0	0	0	112.1	I459 Q460 T465 V466 Y467 I482 V725	I459-T463 WeakPolarHBondContact O-CB 3.37Å; I459-T463 PolarHBondContact O-N 2.95Å; I459-T463 PolarHBondContact O-OG1 2.8Å; I459-T463 VanDerWaalsContact O-OG1 3.13Å; Q460-T463 PolarHBondContact O-N 2.88Å; T463-T465 PolarHBondContact O-N 3.28Å; T463-V466 PolarHBondContact O-N 3.49Å; T463-Y467 HydrophobicContact CG2-CD2 3.73Å; T463-Y467 HydrophobicContact CG2-CE2 3.48Å; T463-Y467 VanDerWaalsContact CG2-CE2 3.48Å; T463-Y467 VanDerWaalsContact O-CD2 3.3Å; T463-Y467 WeakPolarHBondContact O-CD2 3.31Å; T463-Y467 PolarHBondContact O-N 2.88Å; T463-I482 HydrophobicContact CG2-CG2 4.23Å; T463-V725 HydrophobicContact CG2-CG1 3.92Å
464	D	92.1	Very high	90.3	Very high	65 Å²	65	52.5 Å²	52.5	35%	0.348	26%	0.259	S	S	.	.	H	α-helix	trans	-62.7	-33.2	176.9	-66.2	-10.4	0	0	0	111.5	Q460 F462 R468	Q460-D464 PolarHBondContact NE2-OD1 3.03Å; Q460-D464 WeakPolarHBondContact O-CB 3.49Å; Q460-D464 PolarHBondContact O-N 3.29Å; F462-D464 PolarHBondContact O-N 3.22Å; D464-R468 WeakPolarHBondContact O-CB 3.22Å; D464-R468 PolarHBondContact O-N 3.48Å
465	T	92.5	Very high	90.4	Very high	20 Å²	20	50.9 Å²	50.9	12%	0.123	25%	0.25	C	C	.	.	H	α-helix	trans	-71.9	-35.3	176.2	-64.4	0	0	0	0	112.4	S461 F462 T463 R468 Q469	S461-T465 VanDerWaalsContact O-CB 3.26Å; S461-T465 WeakPolarHBondContact O-CB 3.31Å; S461-T465 PolarHBondContact O-N 2.83Å; S461-T465 PolarHBondContact O-OG1 3.32Å; F462-T465 CarbonylContact O-C 3.55Å; F462-T465 WeakPolarHBondContact O-CA 3.12Å; F462-T465 WeakPolarHBondContact O-CB 3.43Å; F462-T465 PolarHBondContact O-N 3.49Å; T463-T465 PolarHBondContact O-N 3.28Å; T465-R468 PolarHBondContact OG1-NH2 3.43Å; T465-Q469 WeakPolarHBondContact O-CB 3.47Å; T465-Q469 WeakPolarHBondContact O-CG 3.25Å; T465-Q469 PolarHBondContact O-N 2.78Å; T465-Q469 VanDerWaalsContact O-N 3.11Å
466	V	93.1	Very high	90.3	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-66.3	-55.2	172.9	177.5	0	0	0	0	110.4	W389 V393 K396 F462 T463 R468 Q469 A470 I482	W389-V466 HydrophobicContact CH2-CG1 3.76Å; W389-V466 HydrophobicContact CZ2-CG1 4.34Å; W389-V466 HydrophobicContact CZ3-CG1 4.19Å; V393-V466 HydrophobicContact CG2-CG1 4.15Å; K396-V466 HydrophobicContact CB-CG2 4.01Å; K396-V466 HydrophobicContact CG-CG2 4.18Å; F462-V466 HydrophobicContact CD2-CG2 4.13Å; F462-V466 HydrophobicContact CE1-CG2 4.24Å; F462-V466 HydrophobicContact CE2-CG2 3.57Å; F462-V466 HydrophobicContact CZ-CG2 3.65Å; F462-V466 PolarHBondContact O-N 3.35Å; T463-V466 PolarHBondContact O-N 3.49Å; V466-R468 PolarHBondContact O-N 3.04Å; V466-Q469 PolarHBondContact O-N 2.83Å; V466-Q469 VanDerWaalsContact O-N 3.16Å; V466-A470 WeakPolarHBondContact O-CB 3.16Å; V466-A470 PolarHBondContact O-N 2.63Å; V466-I482 HydrophobicContact CB-CD1 4.5Å; V466-I482 HydrophobicContact CG1-CD1 4.32Å; V466-I482 HydrophobicContact CG1-CG2 4.43Å; V466-I482 HydrophobicContact CG2-CD1 4.14Å
467	Y	93.6	Very high	90.4	Very high	19 Å²	19	54.3 Å²	54.3	8%	0.075	26%	0.263	C	S	.	.	H	α-helix	trans	-60.8	-41.4	-179.9	-72	-63.4	0	0	0	112.4	W389 T463 Q469 A470 N471 L476 K481 I482 V725	W389-Y467 AromaticContact CH2-CD1 3.85Å; W389-Y467 HydrophobicContact CH2-CD1 3.85Å; W389-Y467 AromaticContact CH2-CE1 3.84Å; W389-Y467 HydrophobicContact CH2-CE1 3.84Å; W389-Y467 HydrophobicContact CZ2-CD1 4.46Å; W389-Y467 AromaticContact CZ2-CE1 4Å; W389-Y467 HydrophobicContact CZ2-CE1 4Å; T463-Y467 HydrophobicContact CG2-CD2 3.73Å; T463-Y467 HydrophobicContact CG2-CE2 3.48Å; T463-Y467 VanDerWaalsContact CG2-CE2 3.48Å; T463-Y467 VanDerWaalsContact O-CD2 3.3Å; T463-Y467 WeakPolarHBondContact O-CD2 3.31Å; T463-Y467 PolarHBondContact O-N 2.88Å; Y467-Q469 VanDerWaalsContact C-N 3.35Å; Y467-Q469 PolarHBondContact O-N 3.47Å; Y467-A470 PolarHBondContact O-N 3.37Å; Y467-N471 WeakPolarHBondContact O-CB 3.37Å; Y467-N471 PolarHBondContact O-N 3.23Å; Y467-N471 PolarHBondContact O-ND2 3.02Å; Y467-L476 HydrophobicContact CD1-CD1 3.82Å; Y467-L476 HydrophobicContact CD1-CD2 3.83Å; Y467-L476 HydrophobicContact CE1-CD1 4.11Å; Y467-K481 WeakPolarHBondContact OH-CA 3.41Å; Y467-I482 HydrophobicContact CD2-CG2 4.34Å; Y467-I482 HydrophobicContact CE1-CG2 4.33Å; Y467-I482 HydrophobicContact CE2-CG2 3.71Å; Y467-I482 PolarHBondContact OH-N 2.98Å; Y467-I482 PolarHBondContact OH-O 3.29Å; Y467-V725 HydrophobicContact CD2-CG1 4.32Å; Y467-V725 HydrophobicContact CD2-CG2 3.79Å; Y467-V725 HydrophobicContact CE2-CB 4.46Å; Y467-V725 HydrophobicContact CE2-CG1 3.98Å; Y467-V725 HydrophobicContact CE2-CG2 3.85Å; Y467-V725 HydrophobicContact CG-CG2 4.44Å
468	R	92.4	Very high	90.1	Very high	124 Å²	124	54.6 Å²	54.6	47%	0.468	27%	0.271	S	S	.	.	H	α-helix	trans	-60.1	-42.5	175.1	-178.3	173.7	65.6	-108.5	-3.6	111.9	D464 T465 V466 N472	D464-R468 WeakPolarHBondContact O-CB 3.22Å; D464-R468 PolarHBondContact O-N 3.48Å; T465-R468 PolarHBondContact OG1-NH2 3.43Å; V466-R468 PolarHBondContact O-N 3.04Å; R468-N472 WeakPolarHBondContact O-CB 3.44Å; R468-N472 PolarHBondContact O-N 3.07Å; R468-N472 VanDerWaalsContact O-N 3.08Å; R468-N472 PolarHBondContact O-OD1 3.39Å; R468-N472 VanDerWaalsContact O-OD1 3.12Å
469	Q	88.5	Confident	89.8	Confident	66 Å²	66	54.6 Å²	54.6	31%	0.308	28%	0.275	S	S	.	.	H	α-helix	trans	-71	-38.4	177.8	-72.7	-174.5	9.9	0	0	112.1	T465 V466 Y467 N471 N472 I473	T465-Q469 WeakPolarHBondContact O-CB 3.47Å; T465-Q469 WeakPolarHBondContact O-CG 3.25Å; T465-Q469 PolarHBondContact O-N 2.78Å; T465-Q469 VanDerWaalsContact O-N 3.11Å; V466-Q469 PolarHBondContact O-N 2.83Å; V466-Q469 VanDerWaalsContact O-N 3.16Å; Y467-Q469 VanDerWaalsContact C-N 3.35Å; Y467-Q469 PolarHBondContact O-N 3.47Å; Q469-N471 PolarHBondContact O-N 3.47Å; Q469-N472 PolarHBondContact O-N 2.97Å; Q469-I473 WeakPolarHBondContact O-CG1 3.34Å; Q469-I473 PolarHBondContact O-N 2.74Å
470	A	89.6	Confident	89.8	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.6	-41.3	175.7	0	0	0	0	0	113	W389 L392 V466 Y467 I473 N474 M475 L476	W389-A470 HydrophobicContact CH2-CB 4.49Å; W389-A470 HydrophobicContact CZ3-CB 3.72Å; L392-A470 HydrophobicContact CD2-CB 3.55Å; V466-A470 WeakPolarHBondContact O-CB 3.16Å; V466-A470 PolarHBondContact O-N 2.63Å; Y467-A470 PolarHBondContact O-N 3.37Å; A470-I473 WeakPolarHBondContact O-CG1 3.37Å; A470-I473 PolarHBondContact O-N 3.28Å; A470-N474 PolarHBondContact O-N 3.47Å; A470-M475 PolarHBondContact O-N 3.14Å; A470-L476 HydrophobicContact CB-CB 3.86Å; A470-L476 HydrophobicContact CB-CD1 4.18Å; A470-L476 HydrophobicContact CB-CG 4.48Å; A470-L476 PolarHBondContact O-N 3.41Å
471	N	90.6	Very high	89.9	Confident	66 Å²	66	57.4 Å²	57.4	35%	0.353	29%	0.287	S	S	.	.	H	α-helix	trans	-63.2	-45.9	172.1	-77.3	-29.9	0	0	0	111.6	Y467 Q469 I473 N474 L476	Y467-N471 WeakPolarHBondContact O-CB 3.37Å; Y467-N471 PolarHBondContact O-N 3.23Å; Y467-N471 PolarHBondContact O-ND2 3.02Å; Q469-N471 PolarHBondContact O-N 3.47Å; N471-I473 PolarHBondContact O-N 3.11Å; N471-I473 VanDerWaalsContact O-N 3.13Å; N471-N474 PolarHBondContact O-N 3.43Å; N471-L476 VanDerWaalsContact OD1-CD2 3.22Å; N471-L476 WeakPolarHBondContact OD1-CD2 3.28Å
472	N	88.2	Confident	89.9	Confident	123 Å²	123	56 Å²	56	66%	0.658	28%	0.276	S	S	*	.	H	α-helix	trans	-62.5	-20.2	-179.2	-72.7	6.8	0	0	0	114.2	R468 Q469	R468-N472 WeakPolarHBondContact O-CB 3.44Å; R468-N472 PolarHBondContact O-N 3.07Å; R468-N472 VanDerWaalsContact O-N 3.08Å; R468-N472 PolarHBondContact O-OD1 3.39Å; R468-N472 VanDerWaalsContact O-OD1 3.12Å; Q469-N472 PolarHBondContact O-N 2.97Å
473	I	85.8	Confident	89.8	Confident	103 Å²	103	59.2 Å²	59.2	53%	0.528	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	10.2	175.2	64.2	166.5	0	0	0	112.7	L392 Q469 A470 N471 M475	L392-I473 HydrophobicContact CD1-CD1 4.36Å; L392-I473 HydrophobicContact CD2-CD1 4.47Å; Q469-I473 WeakPolarHBondContact O-CG1 3.34Å; Q469-I473 PolarHBondContact O-N 2.74Å; A470-I473 WeakPolarHBondContact O-CG1 3.37Å; A470-I473 PolarHBondContact O-N 3.28Å; N471-I473 PolarHBondContact O-N 3.11Å; N471-I473 VanDerWaalsContact O-N 3.13Å; I473-M475 HydrophobicContact CD1-CB 3.69Å; I473-M475 HydrophobicContact CD1-CG 4.33Å; I473-M475 HydrophobicContact CD1-SD 3.89Å; I473-M475 HydrophobicContact CG1-CB 3.69Å; I473-M475 PolarHBondContact O-N 3.13Å; I473-M475 VanDerWaalsContact O-N 3.11Å
474	N	85.8	Confident	89.7	Confident	152 Å²	152	59 Å²	59	81%	0.813	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.8	24.5	-177.3	-56.2	-58.6	0	0	0	115.2	A470 N471	A470-N474 PolarHBondContact O-N 3.47Å; N471-N474 PolarHBondContact O-N 3.43Å
475	M	87.1	Confident	89.7	Confident	28 Å²	28	57.5 Å²	57.5	14%	0.138	28%	0.284	C	S	.	.			trans	-92.9	-16.3	-176.7	-164.2	-157.5	87.4	0	0	112.5	E388 W389 L392 A470 I473 K477 M480	E388-M475 HydrophobicContact CB-CE 4.34Å; E388-M475 HydrophobicContact CB-CG 4.41Å; E388-M475 HydrophobicContact CB-SD 4.08Å; W389-M475 HydrophobicContact CE3-CE 3.72Å; W389-M475 HydrophobicContact CZ3-CE 4.41Å; L392-M475 HydrophobicContact CB-CE 3.76Å; L392-M475 HydrophobicContact CB-SD 4.23Å; L392-M475 HydrophobicContact CD2-CE 3.6Å; L392-M475 HydrophobicContact CD2-SD 4.3Å; L392-M475 HydrophobicContact CG-CE 4.31Å; A470-M475 PolarHBondContact O-N 3.14Å; I473-M475 HydrophobicContact CD1-CB 3.69Å; I473-M475 HydrophobicContact CD1-CG 4.33Å; I473-M475 HydrophobicContact CD1-SD 3.89Å; I473-M475 HydrophobicContact CG1-CB 3.69Å; I473-M475 PolarHBondContact O-N 3.13Å; I473-M475 VanDerWaalsContact O-N 3.11Å; M475-K477 PolarHBondContact O-N 3Å; M475-K477 VanDerWaalsContact O-N 3.11Å; M475-M480 HydrophobicContact CE-CE 4.32Å; M475-M480 HydrophobicContact CE-SD 4.35Å; M475-M480 VanDerWaalsContact O-CE 3.27Å; M475-M480 WeakPolarHBondContact O-CE 3.37Å
476	L	88.3	Confident	89.7	Confident	26 Å²	26	58.4 Å²	58.4	14%	0.136	29%	0.287	C	S	.	.			trans	-72.1	106.1	-179.2	-168.5	66.3	0	0	0	111.2	W389 Y467 A470 N471 M480 I723	W389-L476 HydrophobicContact CE3-CD1 4.42Å; W389-L476 HydrophobicContact CH2-CD1 3.77Å; W389-L476 HydrophobicContact CZ3-CD1 3.66Å; Y467-L476 HydrophobicContact CD1-CD1 3.82Å; Y467-L476 HydrophobicContact CD1-CD2 3.83Å; Y467-L476 HydrophobicContact CE1-CD1 4.11Å; A470-L476 HydrophobicContact CB-CB 3.86Å; A470-L476 HydrophobicContact CB-CD1 4.18Å; A470-L476 HydrophobicContact CB-CG 4.48Å; A470-L476 PolarHBondContact O-N 3.41Å; N471-L476 VanDerWaalsContact OD1-CD2 3.22Å; N471-L476 WeakPolarHBondContact OD1-CD2 3.28Å; L476-M480 HydrophobicContact CD1-CB 3.83Å; L476-M480 HydrophobicContact CD1-SD 4.15Å; L476-I723 HydrophobicContact CD2-CD1 3.55Å; L476-I723 HydrophobicContact CG-CD1 3.88Å
477	K	88.2	Confident	89.6	Confident	75 Å²	75	58.5 Å²	58.5	33%	0.326	29%	0.287	S	S	.	.			trans	-102.9	161.5	178.1	-62.8	163.5	-175.7	164.5	0	110.6	N385 E388 M475 M480	N385-K477 HydrophobicContact CB-CD 4.43Å; N385-K477 VanDerWaalsContact CG-CD 3.44Å; N385-K477 WeakPolarHBondContact OD1-CD 3.36Å; N385-K477 WeakPolarHBondContact OD1-CE 3.39Å; N385-K477 PolarHBondContact OD1-NZ 3.42Å; E388-K477 VanDerWaalsContact CD-NZ 3.32Å; E388-K477 IonicContact OE1-NZ 3.74Å; E388-K477 PolarHBondContact OE1-NZ 2.9Å; E388-K477 IonicContact OE2-NZ 3.16Å; E388-K477 PolarHBondContact OE2-NZ 3.49Å; M475-K477 PolarHBondContact O-N 3Å; M475-K477 VanDerWaalsContact O-N 3.11Å; K477-M480 HydrophobicContact CB-CE 4.07Å; K477-M480 HydrophobicContact CB-CG 4.46Å; K477-M480 HydrophobicContact CB-SD 4.25Å; K477-M480 HydrophobicContact CD-CE 3.94Å; K477-M480 HydrophobicContact CG-CE 4.21Å; K477-M480 PolarHBondContact N-SD 3Å; K477-M480 VanDerWaalsContact N-SD 3.37Å; K477-M480 WeakPolarHBondContact O-CB 3.41Å; K477-M480 PolarHBondContact O-N 2.61Å
478	E	83.9	Confident	89.5	Confident	184 Å²	184	62.8 Å²	62.8	86%	0.86	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.8	146.9	175.5	-172.2	165.3	-165.2	0	0	111.3	M480	E478-M480 PolarHBondContact O-N 2.87Å
479	G	84.2	Confident	89.6	Confident	18 Å²	18	60.3 Å²	60.3	19%	0.186	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	-20.2	-174.4	0	0	0	0	0	115.1	K481	G479-K481 PolarHBondContact O-N 3.11Å
480	M	91.3	Very high	89.7	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.015	32%	0.323	C	S	.	.			trans	-65.3	120.3	173.8	-70.9	-175.8	175.8	0	0	111.3	S379 A380 N385 W389 M475 L476 K477 E478	S379-M480 CarbonylContact O-C 3.57Å; S379-M480 WeakPolarHBondContact O-CA 3.5Å; A380-M480 HydrophobicContact CB-CG 4.1Å; N385-M480 HydrophobicContact CB-CE 3.84Å; N385-M480 WeakPolarHBondContact O-CE 3.34Å; W389-M480 HydrophobicContact CB-CE 4.19Å; W389-M480 HydrophobicContact CB-CG 4.32Å; W389-M480 HydrophobicContact CB-SD 4.22Å; W389-M480 HydrophobicContact CD2-CB 4.03Å; W389-M480 HydrophobicContact CD2-CG 4.2Å; W389-M480 HydrophobicContact CD2-SD 4.06Å; W389-M480 HydrophobicContact CE3-CB 4.28Å; W389-M480 HydrophobicContact CE3-CG 4.39Å; W389-M480 HydrophobicContact CE3-SD 3.7Å; W389-M480 HydrophobicContact CG-CB 4.34Å; W389-M480 HydrophobicContact CG-CG 4.18Å; W389-M480 HydrophobicContact CG-SD 4.31Å; W389-M480 HydrophobicContact CZ2-CB 4.49Å; W389-M480 HydrophobicContact CZ3-SD 4.37Å; M475-M480 HydrophobicContact CE-CE 4.32Å; M475-M480 HydrophobicContact CE-SD 4.35Å; M475-M480 VanDerWaalsContact O-CE 3.27Å; M475-M480 WeakPolarHBondContact O-CE 3.37Å; L476-M480 HydrophobicContact CD1-CB 3.83Å; L476-M480 HydrophobicContact CD1-SD 4.15Å; K477-M480 HydrophobicContact CB-CE 4.07Å; K477-M480 HydrophobicContact CB-CG 4.46Å; K477-M480 HydrophobicContact CB-SD 4.25Å; K477-M480 HydrophobicContact CD-CE 3.94Å; K477-M480 HydrophobicContact CG-CE 4.21Å; K477-M480 PolarHBondContact N-SD 3Å; K477-M480 VanDerWaalsContact N-SD 3.37Å; K477-M480 WeakPolarHBondContact O-CB 3.41Å; K477-M480 PolarHBondContact O-N 2.61Å; E478-M480 PolarHBondContact O-N 2.87Å
481	K	92.4	Very high	89.8	Confident	89 Å²	89	70 Å²	70	39%	0.387	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	145.3	-179.9	-65.5	173.3	-173.4	170.5	0	111.5	A378 S379 W389 Y467 G479	A378-K481 WeakPolarHBondContact CA-O 3.44Å; S379-K481 PolarHBondContact N-O 3.45Å; S379-K481 PolarHBondContact O-N 3.49Å; W389-K481 PolarHBondContact NE1-O 3.23Å; Y467-K481 WeakPolarHBondContact OH-CA 3.41Å; G479-K481 PolarHBondContact O-N 3.11Å
482	I	93.6	Very high	89.8	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	132.2	167.3	-171.3	-179.8	0	0	0	109.5	L376 T377 W389 V393 F462 T463 V466 Y467	L376-I482 HydrophobicContact CD1-CD1 3.9Å; L376-I482 HydrophobicContact CD1-CG1 3.86Å; L376-I482 HydrophobicContact CD2-CD1 4.41Å; L376-I482 HydrophobicContact CG-CD1 4.42Å; L376-I482 HydrophobicContact CG-CG1 4.46Å; T377-I482 WeakPolarHBondContact O-CA 3.34Å; W389-I482 HydrophobicContact CH2-CG2 4.48Å; W389-I482 HydrophobicContact CZ2-CB 3.83Å; W389-I482 HydrophobicContact CZ2-CG2 3.91Å; V393-I482 HydrophobicContact CB-CD1 4.45Å; V393-I482 HydrophobicContact CG1-CD1 3.69Å; V393-I482 HydrophobicContact CG1-CG1 4.47Å; V393-I482 HydrophobicContact CG2-CD1 3.9Å; F462-I482 HydrophobicContact CE1-CD1 3.6Å; F462-I482 HydrophobicContact CZ-CD1 3.82Å; T463-I482 HydrophobicContact CG2-CG2 4.23Å; V466-I482 HydrophobicContact CB-CD1 4.5Å; V466-I482 HydrophobicContact CG1-CD1 4.32Å; V466-I482 HydrophobicContact CG1-CG2 4.43Å; V466-I482 HydrophobicContact CG2-CD1 4.14Å; Y467-I482 HydrophobicContact CD2-CG2 4.34Å; Y467-I482 HydrophobicContact CE1-CG2 4.33Å; Y467-I482 HydrophobicContact CE2-CG2 3.71Å; Y467-I482 PolarHBondContact OH-N 2.98Å; Y467-I482 PolarHBondContact OH-O 3.29Å
483	E	91.6	Very high	89.8	Confident	68 Å²	68	66.7 Å²	66.7	32%	0.318	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	141.9	180	-66	-178.9	-159.6	0	0	109.5	T377	T377-E483 PolarHBondContact N-O 2.71Å; T377-E483 PolarHBondContact O-N 2.88Å
484	A	91.8	Very high	89.8	Confident	4 Å²	4	66 Å²	66	3%	0.033	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.5	171	0	0	0	0	0	110	I374 V375 L376 I459	I374-A484 HydrophobicContact CG2-CB 4.11Å; V375-A484 CarbonylContact O-C 3.58Å; V375-A484 WeakPolarHBondContact O-CA 3.28Å; L376-A484 HydrophobicContact CD1-CB 3.85Å; I459-A484 HydrophobicContact CD1-CB 4.39Å; I459-A484 HydrophobicContact CG2-CB 3.76Å
485	T	91.4	Very high	89.9	Confident	34 Å²	34	61.7 Å²	61.7	21%	0.209	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	145.3	178.6	64.9	0	0	0	0	110.6	I374 V375 Y495	I374-T485 CarbonylContact C-O 3.54Å; I374-T485 VanDerWaalsContact CA-O 3.3Å; I374-T485 WeakPolarHBondContact CA-O 3.4Å; V375-T485 PolarHBondContact N-O 3.46Å; V375-T485 PolarHBondContact O-N 2.89Å; T485-Y495 PolarHBondContact OG1-OH 3.49Å
486	H	92.3	Very high	90	Very high	38 Å²	38	60.7 Å²	60.7	18%	0.176	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	136.2	171.7	166.5	-83.5	0	0	0	110	H372 Y373 K488 I730 L732	H372-H486 AromaticContact CE1-NE2 3.89Å; H372-H486 AromaticContact ND1-NE2 3.27Å; H372-H486 PolarHBondContact ND1-NE2 2.89Å; Y373-H486 WeakPolarHBondContact O-CA 3.46Å; H486-K488 WeakPolarHBondContact NE2-CG 3.37Å; H486-I730 HydrophobicContact CB-CD1 4.2Å; H486-I730 HydrophobicContact CB-CG2 3.6Å; H486-L732 HydrophobicContact CB-CD1 4.49Å; H486-L732 HydrophobicContact CB-CD2 3.97Å; H486-L732 VanDerWaalsContact CD2-CD1 3.47Å; H486-L732 WeakPolarHBondContact CD2-CD1 3.48Å; H486-L732 VanDerWaalsContact CG-CD2 3.45Å; H486-L732 VanDerWaalsContact ND1-CD2 3.32Å; H486-L732 WeakPolarHBondContact ND1-CD2 3.39Å
487	V	91.8	Very high	89.8	Confident	4 Å²	4	62.8 Å²	62.8	2%	0.024	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	137.2	174.9	-59.7	0	0	0	0	111	Y373 V375 Q491 L492 Y495	Y373-V487 PolarHBondContact N-O 2.89Å; Y373-V487 PolarHBondContact O-N 2.7Å; V375-V487 HydrophobicContact CG2-CB 4.49Å; V375-V487 HydrophobicContact CG2-CG1 3.94Å; V375-V487 HydrophobicContact CG2-CG2 3.67Å; V487-Q491 HydrophobicContact CB-CB 4.41Å; V487-L492 HydrophobicContact CG2-CD2 3.69Å; V487-L492 HydrophobicContact CG2-CG 4.43Å; V487-Y495 HydrophobicContact CG1-CD2 4.34Å; V487-Y495 HydrophobicContact CG1-CE2 3.58Å
488	K	91.6	Very high	89.5	Confident	108 Å²	108	61.6 Å²	61.6	47%	0.47	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	148.2	166	-60.1	-179.1	-179	-179.8	0	108	H486 K490 Q491	H486-K488 WeakPolarHBondContact NE2-CG 3.37Å; K488-K490 PolarHBondContact O-N 3.14Å; K488-Q491 WeakPolarHBondContact O-CB 3.27Å; K488-Q491 PolarHBondContact O-N 3.28Å
489	K	93	Very high	89.3	Confident	73 Å²	73	59.2 Å²	59.2	32%	0.317	29%	0.29	S	S	.	.	G	3₁₀ helix	trans	-43	-39.8	179.4	176.4	178.7	170.5	169.9	0	114.3	Q368 Y370 R371 Y373 Q491 L492	Q368-K489 PolarHBondContact O-NZ 2.95Å; Y370-K489 WeakPolarHBondContact O-CD 3.48Å; R371-K489 WeakPolarHBondContact O-CB 3.17Å; R371-K489 PolarHBondContact O-N 2.9Å; Y373-K489 HydrophobicContact CE2-CB 4.06Å; Y373-K489 HydrophobicContact CE2-CG 4.42Å; K489-Q491 PolarHBondContact O-N 3.22Å; K489-L492 PolarHBondContact O-N 3.02Å
490	K	91.3	Very high	89.2	Confident	188 Å²	188	60.7 Å²	60.7	82%	0.817	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-61.4	-26.6	178.9	-67	-171.4	176.9	-174.2	0	113.8	K488 H493	K488-K490 PolarHBondContact O-N 3.14Å; K490-H493 PolarHBondContact O-CE1 3.11Å; K490-H493 PolarHBondContact O-ND1 3.03Å
491	Q	91	Very high	88.5	Confident	80 Å²	80	61.3 Å²	61.3	37%	0.374	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-91.8	-5.5	-174	-61.9	167.1	-73.4	0	0	113.8	V487 K488 K489 H493 H494	V487-Q491 HydrophobicContact CB-CB 4.41Å; K488-Q491 WeakPolarHBondContact O-CB 3.27Å; K488-Q491 PolarHBondContact O-N 3.28Å; K489-Q491 PolarHBondContact O-N 3.22Å; Q491-H493 PolarHBondContact O-N 3.37Å; Q491-H493 VanDerWaalsContact O-N 3.09Å; Q491-H494 PolarHBondContact O-CD2 2.66Å; Q491-H494 PolarHBondContact O-N 2.98Å
492	L	90.7	Very high	87	Confident	2 Å²	2	62.8 Å²	62.8	1%	0.01	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-59.5	-22.7	-179.1	-73.9	174.6	0	0	0	113.7	F367 Y373 F437 V487 K489 H494 Y495 L496 L501	F367-L492 HydrophobicContact CB-CD1 3.98Å; F367-L492 HydrophobicContact CD1-CD1 4.05Å; F367-L492 HydrophobicContact CG-CD1 4.47Å; Y373-L492 HydrophobicContact CD2-CD1 3.81Å; Y373-L492 HydrophobicContact CD2-CD2 4.16Å; Y373-L492 HydrophobicContact CD2-CG 4.19Å; Y373-L492 HydrophobicContact CE2-CD1 3.58Å; Y373-L492 HydrophobicContact CE2-CG 4.41Å; Y373-L492 HydrophobicContact CG-CD1 4.42Å; Y373-L492 HydrophobicContact CG-CD2 4.28Å; F437-L492 HydrophobicContact CD1-CD2 3.93Å; F437-L492 HydrophobicContact CE1-CD2 3.9Å; V487-L492 HydrophobicContact CG2-CD2 3.69Å; V487-L492 HydrophobicContact CG2-CG 4.43Å; K489-L492 PolarHBondContact O-N 3.02Å; L492-H494 PolarHBondContact O-N 3.47Å; L492-Y495 PolarHBondContact O-N 3.04Å; L492-L496 PolarHBondContact O-N 3.11Å; L492-L501 HydrophobicContact CB-CD1 4.16Å; L492-L501 HydrophobicContact CB-CD2 3.9Å; L492-L501 HydrophobicContact CD1-CD2 4.25Å
493	H	88.6	Confident	85.3	Confident	119 Å²	119	69.1 Å²	69.1	55%	0.551	33%	0.332	S	S	*	.	G	3₁₀ helix	trans	-69.4	-8.1	-180	74.5	-84.6	0	0	0	114.7	K490 Q491 L501	K490-H493 PolarHBondContact O-CE1 3.11Å; K490-H493 PolarHBondContact O-ND1 3.03Å; Q491-H493 PolarHBondContact O-N 3.37Å; Q491-H493 VanDerWaalsContact O-N 3.09Å; H493-L501 VanDerWaalsContact CA-CD1 3.45Å; H493-L501 HydrophobicContact CB-CD1 3.84Å
494	H	86.9	Confident	82.8	Confident	88 Å²	88	73.5 Å²	73.5	41%	0.407	35%	0.35	S	S	.	.	G	3₁₀ helix	trans	-82	-21.7	167.6	-51.4	-39.1	0	0	0	112.5	Q491 L492	Q491-H494 PolarHBondContact O-CD2 2.66Å; Q491-H494 PolarHBondContact O-N 2.98Å; L492-H494 PolarHBondContact O-N 3.47Å
495	Y	87.1	Confident	80.3	Confident	62 Å²	62	82.3 Å²	82.3	24%	0.243	39%	0.388	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-25.2	-173	-66.6	-98.1	0	0	0	113.4	V375 M435 T485 V487 L492	V375-Y495 HydrophobicContact CB-CD1 4.46Å; V375-Y495 HydrophobicContact CB-CE1 4.26Å; V375-Y495 HydrophobicContact CG1-CD1 3.93Å; V375-Y495 HydrophobicContact CG1-CE1 4.09Å; V375-Y495 HydrophobicContact CG2-CD1 4.16Å; V375-Y495 HydrophobicContact CG2-CE1 4.12Å; V375-Y495 HydrophobicContact CG2-CG 4.43Å; M435-Y495 WeakPolarHBondContact CE-O 3.35Å; M435-Y495 HydrophobicContact SD-CD1 3.93Å; T485-Y495 PolarHBondContact OG1-OH 3.49Å; V487-Y495 HydrophobicContact CG1-CD2 4.34Å; V487-Y495 HydrophobicContact CG1-CE2 3.58Å; L492-Y495 PolarHBondContact O-N 3.04Å
496	L	88.1	Confident	77.6	Confident	7 Å²	7	90.7 Å²	90.7	4%	0.037	42%	0.421	C	S	.	.	S	Bend	trans	-135	134.9	-172.3	-69.7	171.6	0	0	0	111.5	F367 F420 F437 L492 I500 L501	F367-L496 HydrophobicContact CD1-CD1 3.64Å; F367-L496 HydrophobicContact CD2-CD1 4.28Å; F367-L496 HydrophobicContact CE1-CD1 3.31Å; F367-L496 HydrophobicContact CE2-CD1 4Å; F367-L496 HydrophobicContact CG-CD1 4.12Å; F367-L496 HydrophobicContact CZ-CD1 3.5Å; F420-L496 HydrophobicContact CB-CD2 4.08Å; F420-L496 HydrophobicContact CD1-CD2 3.84Å; F420-L496 HydrophobicContact CD2-CD2 4.44Å; F420-L496 HydrophobicContact CE1-CD2 4.45Å; F420-L496 HydrophobicContact CG-CD2 3.84Å; F437-L496 HydrophobicContact CD1-CD1 4.39Å; F437-L496 HydrophobicContact CD2-CD1 4.47Å; F437-L496 HydrophobicContact CE1-CD1 3.87Å; F437-L496 HydrophobicContact CE1-CG 4.18Å; F437-L496 HydrophobicContact CE2-CD1 3.99Å; F437-L496 HydrophobicContact CE2-CD2 3.85Å; F437-L496 HydrophobicContact CE2-CG 4.1Å; F437-L496 HydrophobicContact CZ-CD1 3.67Å; F437-L496 HydrophobicContact CZ-CD2 3.83Å; F437-L496 HydrophobicContact CZ-CG 3.62Å; L492-L496 PolarHBondContact O-N 3.11Å; L496-I500 HydrophobicContact CD1-CG2 4.37Å; L496-I500 HydrophobicContact CD2-CD1 4.28Å; L496-L501 HydrophobicContact CB-CD1 4.17Å; L496-L501 HydrophobicContact CB-CD2 4.04Å; L496-L501 HydrophobicContact CB-CG 4.01Å; L496-L501 HydrophobicContact CD1-CD2 3.98Å; L496-L501 WeakPolarHBondContact O-CD1 3.05Å
497	P	85.4	Confident	74.7	Confident	69 Å²	69	97 Å²	97	45%	0.448	45%	0.451	S	S	.	.			trans	-53.9	153	173.4	-28.1	34.8	0	0	0	114.2	E499 I500 L501	P497-E499 WeakPolarHBondContact CB-OE2 3.5Å; P497-E499 VanDerWaalsContact O-N 3.15Å; P497-E499 PolarHBondContact O-N 3.45Å; P497-I500 PolarHBondContact O-N 2.93Å; P497-L501 PolarHBondContact O-N 3.37Å
498	A	80.6	Confident	71.8	Confident	50 Å²	50	102 Å²	102	41%	0.413	49%	0.486	S	S	.	.	H	α-helix	trans	-59.6	-30.2	-174.7	0	0	0	0	0	112.7	I500 L501 Q502	A498-I500 VanDerWaalsContact C-N 3.28Å; A498-I500 PolarHBondContact O-N 3.04Å; A498-L501 PolarHBondContact O-N 3.38Å; A498-Q502 WeakPolarHBondContact O-CA 3.41Å; A498-Q502 VanDerWaalsContact O-CB 3.23Å; A498-Q502 WeakPolarHBondContact O-CB 3.39Å; A498-Q502 PolarHBondContact O-N 2.66Å
499	E	81.4	Confident	69.1	Low	135 Å²	135	105.2 Å²	105.2	63%	0.631	51%	0.507	S	S	*	.	H	α-helix	trans	-68.2	-28.1	-179	-57.2	63.9	-134	0	0	112	P497	P497-E499 WeakPolarHBondContact CB-OE2 3.5Å; P497-E499 VanDerWaalsContact O-N 3.15Å; P497-E499 PolarHBondContact O-N 3.45Å
500	I	80.7	Confident	66	Low	49 Å²	49	106.6 Å²	106.6	25%	0.251	53%	0.526	S	S	.	.	H	α-helix	trans	-81.1	-36	176.6	-56.8	-173	0	0	0	110	F367 F420 L496 P497 A498	F367-I500 HydrophobicContact CD2-CG2 3.78Å; F367-I500 HydrophobicContact CE2-CG2 3.46Å; F367-I500 VanDerWaalsContact CE2-CG2 3.46Å; F367-I500 HydrophobicContact CZ-CG2 4.34Å; F420-I500 HydrophobicContact CD1-CD1 3.99Å; F420-I500 HydrophobicContact CE1-CD1 4.01Å; F420-I500 HydrophobicContact CE1-CG2 4.24Å; L496-I500 HydrophobicContact CD1-CG2 4.37Å; L496-I500 HydrophobicContact CD2-CD1 4.28Å; P497-I500 PolarHBondContact O-N 2.93Å; A498-I500 VanDerWaalsContact C-N 3.28Å; A498-I500 PolarHBondContact O-N 3.04Å
501	L	77.8	Confident	63	Low	16 Å²	16	105 Å²	105	8%	0.084	53%	0.526	C	S	.	.	H	α-helix	trans	-87.8	-29.9	-176	-60.8	178.4	0	0	0	114.1	F367 Q368 L492 H493 L496 P497 A498	F367-L501 HydrophobicContact CB-CD2 3.66Å; F367-L501 HydrophobicContact CD1-CD2 4.46Å; F367-L501 HydrophobicContact CD2-CD2 4.38Å; F367-L501 HydrophobicContact CG-CD2 3.92Å; Q368-L501 PolarHBondContact NE2-O 2.87Å; L492-L501 HydrophobicContact CB-CD1 4.16Å; L492-L501 HydrophobicContact CB-CD2 3.9Å; L492-L501 HydrophobicContact CD1-CD2 4.25Å; H493-L501 VanDerWaalsContact CA-CD1 3.45Å; H493-L501 HydrophobicContact CB-CD1 3.84Å; L496-L501 HydrophobicContact CB-CD1 4.17Å; L496-L501 HydrophobicContact CB-CD2 4.04Å; L496-L501 HydrophobicContact CB-CG 4.01Å; L496-L501 HydrophobicContact CD1-CD2 3.98Å; L496-L501 WeakPolarHBondContact O-CD1 3.05Å; P497-L501 PolarHBondContact O-N 3.37Å; A498-L501 PolarHBondContact O-N 3.38Å
502	Q	60.8	Low	60	Low	120 Å²	120	108.7 Å²	108.7	56%	0.561	55%	0.554	S	S	*	*			trans	-105.3	37	-174.7	-62.2	-146.8	64.1	0	0	113.6	A498 K504	A498-Q502 WeakPolarHBondContact O-CA 3.41Å; A498-Q502 VanDerWaalsContact O-CB 3.23Å; A498-Q502 WeakPolarHBondContact O-CB 3.39Å; A498-Q502 PolarHBondContact O-N 2.66Å; Q502-K504 PolarHBondContact O-N 2.82Å
503	K	56.5	Low	57.1	Low	137 Å²	137	113.4 Å²	113.4	60%	0.596	59%	0.587	S	S	*	*			trans	-69.8	60.7	160.4	-69.1	-175.9	179.5	173.7	0	111.7	N365	N365-K503 PolarHBondContact ND2-O 3.24Å
504	K	40.3	Very low	54.2	Low	161 Å²	161	119.3 Å²	119.3	70%	0.7	61%	0.605	S	S	*	*			trans	-67.4	156.9	156.1	-69.6	175.2	177.1	167.2	0	107.9	Q502 K506	Q502-K504 PolarHBondContact O-N 2.82Å; K504-K506 PolarHBondContact O-N 3.28Å
505	K	39.8	Very low	51.4	Low	189 Å²	189	120.8 Å²	120.8	82%	0.822	63%	0.625	S	S	*	*			trans	-57.6	111.9	168	-76	-175.9	171.3	-174.7	0	109.1	Q507	K505-Q507 PolarHBondContact O-N 3.28Å
506	K	33.6	Very low	48.6	Very low	209 Å²	209	122.9 Å²	122.9	91%	0.909	65%	0.649	S	S	*	*			trans	-78.2	112.7	156.5	-156.3	176.8	-174.8	-174.4	0	105.8	K504	K504-K506 PolarHBondContact O-N 3.28Å
507	Q	32.8	Very low	45.7	Very low	171 Å²	171	128.4 Å²	128.4	80%	0.799	69%	0.688	S	S	*	*			trans	-66.9	152.9	177.4	-68.7	158.5	-84.5	0	0	110.1	K505	K505-Q507 PolarHBondContact O-N 3.28Å
508	S	29.6	Very low	42.9	Very low	110 Å²	110	128.8 Å²	128.8	77%	0.769	70%	0.704	S	S	*	*			trans	49.6	133.1	164	-149.6	0	0	0	0	118.5
509	L	34.5	Very low	40.4	Very low	175 Å²	175	133.8 Å²	133.8	92%	0.916	72%	0.723	S	S	*	*			trans	-62.7	138.7	151.7	-70.7	162.8	0	0	0	108.4
510	S	28.6	Very low	38	Very low	101 Å²	101	135.9 Å²	135.9	71%	0.706	73%	0.733	S	S	*	*			trans	-147.2	99.1	167.5	61.6	0	0	0	0	108.1
511	D	27.3	Very low	35.4	Very low	155 Å²	155	139.5 Å²	139.5	83%	0.829	76%	0.762	S	S	*	*			trans	40.9	104.7	156.6	-50	-34.5	0	0	0	119.3
512	V	29.9	Very low	33.1	Very low	157 Å²	157	147.8 Å²	147.8	95%	0.952	80%	0.798	S	S	*	*			trans	-87	108.5	157.6	176.7	0	0	0	0	108.4
513	S	28.9	Very low	31.5	Very low	101 Å²	101	154.2 Å²	154.2	71%	0.706	82%	0.817	S	S	*	*			trans	-149.6	152.9	161.6	79.6	0	0	0	0	112.6
514	R	28.6	Very low	30	Very low	244 Å²	244	153.1 Å²	153.1	92%	0.921	83%	0.826	S	S	*	*			trans	63.1	89.3	172.1	-68.1	-174	165	173.4	-4	118.1
515	S	26.2	Very low	29.3	Very low	118 Å²	118	150.4 Å²	150.4	83%	0.825	83%	0.828	S	S	*	*			trans	-74.9	142.4	146.9	53.5	0	0	0	0	112.4
516	S	29.2	Very low	28.8	Very low	107 Å²	107	149.1 Å²	149.1	75%	0.748	83%	0.829	S	S	*	*			trans	-173.3	126.2	140	54.5	0	0	0	0	113.7
517	S	27.1	Very low	28.4	Very low	122 Å²	122	145.7 Å²	145.7	85%	0.853	82%	0.821	S	S	*	*			trans	45.5	124.5	146.1	60.7	0	0	0	0	122.1
518	G	26.3	Very low	28.1	Very low	77 Å²	77	141.7 Å²	141.7	79%	0.794	81%	0.812	S	S	*	*			trans	176.3	122.3	159	0	0	0	0	0	111.9
519	L	29.3	Very low	28.1	Very low	156 Å²	156	141.3 Å²	141.3	82%	0.817	81%	0.809	S	S	*	*			trans	-107.8	144.3	-174.1	-120.4	74.8	0	0	0	112.8
520	Q	29.6	Very low	27.7	Very low	179 Å²	179	138.6 Å²	138.6	84%	0.836	80%	0.803	S	S	*	*			trans	48.3	122.7	152.9	-58.5	-177.6	21.8	0	0	120.7
521	S	26.6	Very low	27.8	Very low	124 Å²	124	141.8 Å²	141.8	87%	0.867	81%	0.811	S	S	*	*				-155.5	159.7	120.9	-165.5	0	0	0	0	111.6
522	K	30.5	Very low	27.7	Very low	191 Å²	191	140.6 Å²	140.6	83%	0.83	81%	0.805	S	S	*	*			trans	-116.7	131.5	174.2	-70.1	176.2	176.7	175.7	0	109.7
523	R	26.7	Very low	27.5	Very low	255 Å²	255	138 Å²	138	96%	0.962	79%	0.794	S	S	*	*			trans	-178.8	175.5	130	-103.7	168.1	178.9	179.7	-0.4	112.8
524	S	24	Very low	27.6	Very low	113 Å²	113	137.3 Å²	137.3	79%	0.79	79%	0.789	S	S	*	*			trans	-133.6	134.6	-159.8	52.7	0	0	0	0	113.5
525	S	25.7	Very low	27.8	Very low	105 Å²	105	136.2 Å²	136.2	73%	0.734	79%	0.785	S	S	*	*			trans	-162.7	132.9	159.2	48.1	0	0	0	0	106.3
526	L	29.3	Very low	28	Very low	161 Å²	161	135.9 Å²	135.9	84%	0.843	77%	0.774	S	S	*	*				58.5	127.2	70.7	-63	175.6	0	0	0	111.6
527	D	26.6	Very low	28.1	Very low	137 Å²	137	136.8 Å²	136.8	73%	0.733	78%	0.775	S	S	*	*			cis	-157.9	-172.5	1.5	-173.5	34.6	0	0	0	111.6
528	S	26.5	Very low	28.2	Very low	88 Å²	88	137 Å²	137	62%	0.615	77%	0.767	S	S	*	*			trans	-2.2	149.9	156.1	62.5	0	0	0	0	119.7
529	S	27.7	Very low	28.2	Very low	102 Å²	102	140.4 Å²	140.4	71%	0.713	77%	0.767	S	S	*	*			cis	-165	146.6	36.3	24.1	0	0	0	0	109.1
530	C	27.3	Very low	28.1	Very low	118 Å²	118	136.7 Å²	136.7	80%	0.797	77%	0.766	S	S	*	*				66.7	140.8	78.4	-59.9	0	0	0	0	116.7
531	L	30.1	Very low	28.2	Very low	167 Å²	167	134.9 Å²	134.9	87%	0.874	77%	0.768	S	S	*	*			trans	75.6	160.1	176.6	-50.7	177.5	0	0	0	117.4
532	D	25.3	Very low	29	Very low	130 Å²	130	134.6 Å²	134.6	70%	0.695	76%	0.763	S	S	*	*			cis	-169.6	143.6	-45	-166.6	-15.1	0	0	0	107.2
533	S	26.6	Very low	28.8	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	76%	0.763	S	S	*	*			trans	63	163.2	158.7	-74.8	0	0	0	0	117.4
534	S	30.3	Very low	28.7	Very low	88 Å²	88	129.3 Å²	129.3	62%	0.615	75%	0.754	S	S	*	*			cis	-169.3	148.4	-21.1	53.9	0	0	0	0	109.6
535	R	32.7	Very low	29	Very low	220 Å²	220	129 Å²	129	83%	0.83	75%	0.752	S	S	*	*			trans	62.3	164.4	150.1	-67.5	-179	133.6	137.3	3	118.2
536	D	29.6	Very low	29.8	Very low	111 Å²	111	130.4 Å²	130.4	59%	0.594	76%	0.758	S	S	*	*			cis	-160.3	148.4	-25.8	-97.9	-22.6	0	0	0	105.8
537	T	31.9	Very low	29.7	Very low	126 Å²	126	127.5 Å²	127.5	77%	0.773	76%	0.758	S	S	*	*			trans	62.1	159.2	157.8	55.8	0	0	0	0	118.6
538	D	28.9	Very low	29.7	Very low	127 Å²	127	126.1 Å²	126.1	68%	0.679	76%	0.759	S	S	*	*			cis	-155.3	167.8	-14.9	-127.9	-12.3	0	0	0	112.7
539	N	27.7	Very low	29.7	Very low	148 Å²	148	131.2 Å²	131.2	79%	0.791	77%	0.77	S	S	*	*			trans	45.5	141.5	148.8	-67.6	-51	0	0	0	123
540	G	26.7	Very low	29.6	Very low	78 Å²	78	131 Å²	131	80%	0.804	77%	0.769	S	S	*	*			trans	155.2	63.4	158.8	0	0	0	0	0	118.4
541	T	31.8	Very low	29.6	Very low	142 Å²	142	132.2 Å²	132.2	87%	0.871	77%	0.767	S	S	*	*			trans	-83	152.2	163.6	52.4	0	0	0	0	110.5
542	P	42.3	Very low	29.4	Very low	118 Å²	118	128.8 Å²	128.8	77%	0.766	76%	0.757	S	S	*	*				-149.5	176	92.7	38.5	-20.3	0	0	0	116.7
543	F	26.8	Very low	30.1	Very low	191 Å²	191	127.6 Å²	127.6	84%	0.838	76%	0.756	S	S	*	*			trans	-25	152.9	160.3	-74.5	-105.2	0	0	0	116.3
544	N	25.8	Very low	30.1	Very low	144 Å²	144	127.4 Å²	127.4	77%	0.77	76%	0.755	S	S	*	*			cis	-166.8	175.6	50	-136.7	-24.2	0	0	0	114.7
545	S	28.6	Very low	30.1	Very low	105 Å²	105	130.1 Å²	130.1	73%	0.734	77%	0.768	S	S	*	*			trans	-91.2	-174.2	167.4	-40.3	0	0	0	0	110.7
546	P	43.5	Very low	29.9	Very low	135 Å²	135	122.5 Å²	122.5	88%	0.877	76%	0.758	S	S	*	*			cis	-137.7	-145.5	19.5	43.7	-21	0	0	0	115.2
547	A	26.4	Very low	30	Very low	101 Å²	101	126.1 Å²	126.1	84%	0.835	77%	0.771	S	S	*	*			trans	-133.3	160	-161.4	0	0	0	0	0	116.4
548	S	27.2	Very low	29.8	Very low	107 Å²	107	125.8 Å²	125.8	75%	0.748	77%	0.769	S	S	*	*			trans	-154	140.3	163	56.1	0	0	0	0	107.8
549	K	27.4	Very low	30	Very low	195 Å²	195	126.6 Å²	126.6	85%	0.848	77%	0.769	S	S	*	*				46.3	131.7	77.8	-61.5	-173.1	179.5	-174.9	0	113
550	S	25	Very low	30.3	Very low	99 Å²	99	128.6 Å²	128.6	69%	0.692	77%	0.765	S	S	*	*			cis	-158.4	-158.5	-4.8	48.7	0	0	0	0	108.2
551	D	26.5	Very low	30.5	Very low	142 Å²	142	131.2 Å²	131.2	76%	0.759	76%	0.761	S	S	*	*			cis	-160.1	-163.3	11.8	-139.6	-58.4	0	0	0	112.2
552	S	27.4	Very low	30.6	Very low	96 Å²	96	129.3 Å²	129.3	67%	0.671	75%	0.753	S	S	*	*			trans	-111.5	-169.5	173.9	61.4	0	0	0	0	110.9
553	P	38.8	Very low	29.9	Very low	104 Å²	104	128.9 Å²	128.9	68%	0.675	76%	0.76	S	S	*	*			cis	-146.6	174.2	7.2	45.5	-25.5	0	0	0	119.1
554	S	26.2	Very low	29.9	Very low	99 Å²	99	128.5 Å²	128.5	69%	0.692	76%	0.76	S	S	*	*			trans	45	152.1	136	70.9	0	0	0	0	126.7
555	V	30.2	Very low	31	Very low	144 Å²	144	126.7 Å²	126.7	87%	0.873	76%	0.757	S	S	*	*			trans	79.9	135.4	161.3	-165.8	0	0	0	0	116.4
556	G	29	Very low	31	Very low	61 Å²	61	126.7 Å²	126.7	63%	0.629	76%	0.763	S	S	*	*			cis	163.6	159.6	-10.9	0	0	0	0	0	114.9
557	E	31.2	Very low	30.2	Very low	187 Å²	187	125 Å²	125	87%	0.874	76%	0.76	S	S	*	*			trans	64	149.3	159.3	-54.6	-167.9	156.1	0	0	118.5
558	T	29.1	Very low	30.2	Very low	118 Å²	118	126.2 Å²	126.2	72%	0.724	76%	0.757	S	S	*	*				-160.5	149.1	54.8	10.7	0	0	0	0	114.1
559	E	33.5	Very low	30.3	Very low	144 Å²	144	128 Å²	128	67%	0.673	76%	0.757	S	S	*	*			trans	48.4	147.1	142.1	-70.9	-170.8	159.2	0	0	122.2
560	R	32.6	Very low	30.3	Very low	190 Å²	190	125.1 Å²	125.1	72%	0.717	76%	0.755	S	S	*	*			cis	-149.5	-176.5	5.8	-113.7	169	-131.8	-137.8	-7.9	106.2
561	N	31.3	Very low	30.3	Very low	134 Å²	134	129.4 Å²	129.4	72%	0.717	76%	0.764	S	S	*	*			cis	-165.4	171.2	9	-119.2	-8.1	0	0	0	105
562	S	33.2	Very low	30.4	Very low	101 Å²	101	132.1 Å²	132.1	71%	0.706	77%	0.77	S	S	*	*			cis	-179.1	177	-32.5	-91.7	0	0	0	0	108.9
563	A	27.3	Very low	30.7	Very low	109 Å²	109	133.1 Å²	133.1	90%	0.901	77%	0.774	S	S	*	*			trans	88.7	152.4	173.4	0	0	0	0	0	118.8
564	E	27.8	Very low	30.1	Very low	183 Å²	183	136.7 Å²	136.7	86%	0.855	79%	0.786	S	S	*	*			trans	-151	-166.7	-155.9	-125.5	-161.1	-155	0	0	108.7
565	P	49.1	Very low	30.1	Very low	107 Å²	107	137 Å²	137	70%	0.695	79%	0.788	S	S	*	*			cis	-138.1	-167.4	4.9	41.1	-20.4	0	0	0	116.8
566	A	27.5	Very low	29.9	Very low	105 Å²	105	136.4 Å²	136.4	87%	0.868	78%	0.784	S	S	*	*			trans	93.2	157.5	153	0	0	0	0	0	120.7
567	A	28.3	Very low	30	Very low	99 Å²	99	138.7 Å²	138.7	82%	0.818	79%	0.788	S	S	*	*			trans	-152.2	161.7	-160.7	0	0	0	0	0	115.6
568	V	25.6	Very low	29.9	Very low	127 Å²	127	135.5 Å²	135.5	77%	0.77	78%	0.784	S	S	*	*			trans	169.8	115.3	157.1	146.1	0	0	0	0	106.7
569	I	28.7	Very low	29.8	Very low	144 Å²	144	134.8 Å²	134.8	74%	0.738	79%	0.79	S	S	*	*				69	136.2	79	-48.8	163.9	0	0	0	115.5
570	V	27.2	Very low	29.6	Very low	134 Å²	134	137 Å²	137	81%	0.812	80%	0.8	S	S	*	*			trans	64.5	150.6	177.3	-87	0	0	0	0	117.9
571	E	25.5	Very low	29.3	Very low	189 Å²	189	131.3 Å²	131.3	88%	0.883	80%	0.801	S	S	*	*			cis	-129.3	-176	22.6	-85.8	-159.5	132.8	0	0	116.8
572	K	28.8	Very low	29	Very low	200 Å²	200	133.4 Å²	133.4	87%	0.87	81%	0.811	S	S	*	*			trans	-101	169.8	179.6	-116.5	-163.9	173.6	-179.9	0	112.5
573	P	33.4	Very low	28.6	Very low	117 Å²	117	134 Å²	134	76%	0.76	82%	0.815	S	S	*	*			trans	-90.7	159.2	-172.7	36.6	-35.7	0	0	0	115.3
574	L	26.2	Very low	28.8	Very low	179 Å²	179	136.5 Å²	136.5	94%	0.937	81%	0.812	S	S	*	*			trans	-109.5	166.2	163.3	-84	161.8	0	0	0	110.9
575	S	26.1	Very low	28.8	Very low	104 Å²	104	133.1 Å²	133.1	73%	0.727	81%	0.805	S	S	*	*			trans	-145.4	169.3	-159.3	57.6	0	0	0	0	115
576	V	26.6	Very low	27.9	Very low	132 Å²	132	134.6 Å²	134.6	80%	0.8	81%	0.813	S	S	*	*			trans	76.3	146.3	170.7	-172.4	0	0	0	0	114.8
577	P	30.8	Very low	27.9	Very low	109 Å²	109	138 Å²	138	71%	0.708	81%	0.814	S	S	*	*			cis	-116.3	172.8	-8.7	23.8	-2.4	0	0	0	114.6
578	P	29.7	Very low	27.8	Very low	121 Å²	121	136.4 Å²	136.4	79%	0.786	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-78.7	138.4	169	32.4	-34.1	0	0	0	112.7
579	A	26.3	Very low	28.1	Very low	103 Å²	103	135.5 Å²	135.5	85%	0.851	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-79.7	142.7	171.3	0	0	0	0	0	111.7
580	Q	28.6	Very low	28	Very low	189 Å²	189	138.1 Å²	138.1	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.7	154.3	-176.5	-67.8	170.5	-27.2	0	0	112.2	L582	Q580-L582 PolarHBondContact O-N 3.16Å
581	G	26.9	Very low	28.1	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-62.8	129.7	-178	0	0	0	0	0	113.3	S583	G581-S583 PolarHBondContact O-N 2.68Å; G581-S583 VanDerWaalsContact O-N 3.14Å
582	L	25.6	Very low	28.1	Very low	179 Å²	179	135.6 Å²	135.6	94%	0.937	81%	0.811	S	S	*	*			trans	-68.1	109.2	179.6	-73.1	170.1	0	0	0	111	Q580	Q580-L582 PolarHBondContact O-N 3.16Å
583	S	25.6	Very low	28.1	Very low	112 Å²	112	130.4 Å²	130.4	78%	0.783	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-77.9	127.2	171.3	-62.3	0	0	0	0	109.9	G581 P585	G581-S583 PolarHBondContact O-N 2.68Å; G581-S583 VanDerWaalsContact O-N 3.14Å; S583-P585 WeakPolarHBondContact O-CD 3.46Å
584	I	30	Very low	27.6	Very low	163 Å²	163	131.4 Å²	131.4	84%	0.836	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-61.1	119.6	178.8	-60.3	169.5	0	0	0	109.3
585	P	28.3	Very low	27.8	Very low	111 Å²	111	129.2 Å²	129.2	72%	0.721	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-75.4	130.8	-175.4	29	-33.8	0	0	0	111.7	S583	S583-P585 WeakPolarHBondContact O-CD 3.46Å
586	V	29.3	Very low	27.7	Very low	139 Å²	139	134.2 Å²	134.2	84%	0.842	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-71	128.9	163.3	175.9	0	0	0	0	108.2	G588	V586-G588 PolarHBondContact O-N 3.34Å
587	I	28.3	Very low	27.6	Very low	175 Å²	175	132.5 Å²	132.5	90%	0.897	81%	0.806	S	S	*	*			trans	-64.1	110	178.5	-61.1	173.5	0	0	0	109.3
588	G	26.6	Very low	27.5	Very low	67 Å²	67	134.4 Å²	134.4	69%	0.691	82%	0.815	S	S	*	*			trans	-144	111.8	175.7	0	0	0	0	0	110.1	V586	V586-G588 PolarHBondContact O-N 3.34Å
589	A	31.7	Very low	27.5	Very low	107 Å²	107	133.6 Å²	133.6	88%	0.884	81%	0.813	S	S	*	*			trans	-76.4	136.3	-173	0	0	0	0	0	113
590	K	26.5	Very low	27.7	Very low	199 Å²	199	134.3 Å²	134.3	87%	0.865	81%	0.809	S	S	*	*			trans	-160.4	146.7	170.2	-85.5	-149.4	171.4	-174.8	0	108.9
591	V	30.3	Very low	27.9	Very low	108 Å²	108	131.5 Å²	131.5	66%	0.655	81%	0.807	S	S	*	*			cis	-152.5	150.4	-31.3	164.1	0	0	0	0	103
592	D	23.7	Very low	27.9	Very low	163 Å²	163	132.5 Å²	132.5	87%	0.872	81%	0.808	S	S	*	*			trans	-127.9	152.9	148	-131.7	-35	0	0	0	110.9
593	S	29.5	Very low	27.9	Very low	90 Å²	90	130.2 Å²	130.2	63%	0.629	80%	0.801	S	S	*	*			trans	-137	145.6	-146.9	69.4	0	0	0	0	116.2
594	T	24.1	Very low	27.9	Very low	138 Å²	138	130.6 Å²	130.6	85%	0.847	80%	0.803	S	S	*	*			trans	-155.3	97.6	163.9	-15.8	0	0	0	0	114
595	V	28.6	Very low	27.8	Very low	133 Å²	133	128.6 Å²	128.6	81%	0.806	80%	0.798	S	S	*	*			trans	36.8	112.9	142.4	-166.4	0	0	0	0	120.1
596	K	25.2	Very low	27.8	Very low	209 Å²	209	130 Å²	130	91%	0.909	80%	0.798	S	S	*	*				-165.7	152.6	111.2	-105.3	176.6	-174.3	177.5	0	111.9
597	A	25.3	Very low	27.8	Very low	97 Å²	97	129.4 Å²	129.4	80%	0.802	80%	0.798	S	S	*	*			trans	-118	146	-176.1	0	0	0	0	0	112
598	V	27	Very low	27.8	Very low	148 Å²	148	126.5 Å²	126.5	90%	0.897	79%	0.788	S	S	*	*			trans	-141.5	144.3	168	-178.4	0	0	0	0	108.1
599	S	29.9	Very low	27.8	Very low	104 Å²	104	130 Å²	130	73%	0.727	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-89.2	159.2	-175.2	42.6	0	0	0	0	114
600	P	31.6	Very low	27.7	Very low	118 Å²	118	131.2 Å²	131.2	77%	0.766	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-89.8	148.2	177.4	35.2	-34.3	0	0	0	113.3
601	P	31.3	Very low	27.8	Very low	130 Å²	130	124.7 Å²	124.7	84%	0.844	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-81.4	168	162.4	35	-33.8	0	0	0	111.8
602	A	28.5	Very low	27.6	Very low	92 Å²	92	131.6 Å²	131.6	76%	0.76	80%	0.795	S	S	*	*			trans	-121	155.8	-164.6	0	0	0	0	0	115.2
603	V	25.9	Very low	27.8	Very low	131 Å²	131	131.2 Å²	131.2	79%	0.794	79%	0.793	S	S	*	*			trans	45.1	119.2	144.3	177.8	0	0	0	0	120.2
604	C	24.3	Very low	27.7	Very low	121 Å²	121	133.7 Å²	133.7	82%	0.818	80%	0.804	S	S	*	*			trans	-158.6	102.7	134.5	-151.8	0	0	0	0	108.5
605	T	27.3	Very low	27.8	Very low	120 Å²	120	134.5 Å²	134.5	74%	0.736	80%	0.802	S	S	*	*				83	136	82.9	-51.9	0	0	0	0	114.1
606	I	29.2	Very low	28.3	Very low	140 Å²	140	133.2 Å²	133.2	72%	0.718	80%	0.796	S	S	*	*			trans	-96.2	160.1	-171.4	-55.1	158.1	0	0	0	110.2	T608	I606-T608 WeakPolarHBondContact CG2-OG1 3.02Å
607	P	30	Very low	28.4	Very low	128 Å²	128	133.9 Å²	133.9	83%	0.831	79%	0.793	S	S	*	*			trans	-127.6	133.1	132.4	35.6	-28.8	0	0	0	113.3
608	T	27.2	Very low	28.6	Very low	113 Å²	113	136 Å²	136	69%	0.693	79%	0.789	S	S	*	*			trans	-104.6	140.2	178.7	-55.9	0	0	0	0	109.7	I606	I606-T608 WeakPolarHBondContact CG2-OG1 3.02Å
609	V	27.6	Very low	28.5	Very low	141 Å²	141	135.4 Å²	135.4	86%	0.855	79%	0.787	S	S	*	*			trans	-126.4	121.8	165.9	179.4	0	0	0	0	110.1
610	V	29.8	Very low	28.5	Very low	133 Å²	133	136.6 Å²	136.6	81%	0.806	79%	0.789	S	S	*	*			trans	-81.2	143.3	171	-178.6	0	0	0	0	107.9
611	G	26.9	Very low	28.8	Very low	62 Å²	62	136.3 Å²	136.3	64%	0.639	79%	0.787	S	S	*	*			cis	125.2	153.7	11.2	0	0	0	0	0	110.3
612	R	27.6	Very low	28.7	Very low	252 Å²	252	138.9 Å²	138.9	95%	0.951	79%	0.788	S	S	*	*			trans	-165	143.4	166.4	-115	168.4	-171.8	-169.6	1.2	113.1
613	N	27	Very low	28.9	Very low	156 Å²	156	141.3 Å²	141.3	83%	0.834	79%	0.788	S	S	*	*			trans	-101.6	150	-178.9	-54	-38.5	0	0	0	111.7
614	V	27	Very low	29.4	Very low	142 Å²	142	141.2 Å²	141.2	86%	0.861	79%	0.79	S	S	*	*			trans	-145.8	132.1	141.2	-173.2	0	0	0	0	110.3
615	I	26.9	Very low	29.7	Very low	155 Å²	155	139.6 Å²	139.6	80%	0.795	79%	0.785	S	S	*	*			trans	-150	152.3	173.3	-75.2	-179.3	0	0	0	104.3
616	P	39	Very low	29.9	Very low	106 Å²	106	143.6 Å²	143.6	69%	0.688	80%	0.796	S	S	*	*			cis	-115.2	-137.1	9.1	26.1	0.4	0	0	0	110.6
617	R	26.7	Very low	29.8	Very low	222 Å²	222	140.8 Å²	140.8	84%	0.838	80%	0.802	S	S	*	*			cis	-157.4	161.8	8.4	-154.7	169.6	-170.6	155.7	4.2	115.3
618	I	29.7	Very low	29.9	Very low	141 Å²	141	143.8 Å²	143.8	72%	0.723	80%	0.804	S	S	*	*			trans	-56.8	143.1	173	-59.7	148.6	0	0	0	115.2
619	T	25	Very low	30.6	Very low	137 Å²	137	142.7 Å²	142.7	84%	0.84	80%	0.799	S	S	*	*			trans	-164.1	136.2	130.3	20.3	0	0	0	0	113.2
620	T	29.8	Very low	30.7	Very low	128 Å²	128	143.9 Å²	143.9	79%	0.785	80%	0.795	S	S	*	*			trans	-105.8	160.3	148.5	52.1	0	0	0	0	108.1
621	P	39	Very low	30.7	Very low	112 Å²	112	143.6 Å²	143.6	73%	0.727	79%	0.788	S	S	*	*				-155.3	157.8	102.1	39.5	-21.3	0	0	0	117.9
622	H	28.7	Very low	30.8	Very low	184 Å²	184	148 Å²	148	85%	0.852	80%	0.797	S	S	*	*			trans	49.4	140.4	144.2	-87.7	-88.3	0	0	0	126.3
623	N	31.4	Very low	30.8	Very low	143 Å²	143	139 Å²	139	77%	0.765	78%	0.783	S	S	*	*			trans	-61	161.9	156.6	-77.1	-7.3	0	0	0	113.2
624	P	38.3	Very low	30.8	Very low	129 Å²	129	139.7 Å²	139.7	84%	0.838	78%	0.783	S	S	*	*				-122.7	-171.7	110.3	37.2	-33.8	0	0	0	113.2
625	A	29.5	Very low	30.8	Very low	87 Å²	87	137.1 Å²	137.1	72%	0.719	77%	0.772	S	S	*	*			trans	-135.5	177.7	-164.3	0	0	0	0	0	114.5
626	Q	32.2	Very low	30.8	Very low	205 Å²	205	136.2 Å²	136.2	96%	0.958	77%	0.768	S	S	*	*			trans	74.1	140.4	171.1	-60.4	179.9	-27.7	0	0	117.1
627	G	26.3	Very low	30.4	Very low	81 Å²	81	137.8 Å²	137.8	84%	0.835	77%	0.77	S	S	*	*			trans	153.6	56.4	178.6	0	0	0	0	0	117.3
628	Q	31.6	Very low	30.4	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	76%	0.762	S	S	*	*			trans	-89	162.1	150.9	-99.4	-170.1	-6	0	0	108.2
629	P	43.2	Very low	30.4	Very low	90 Å²	90	134.2 Å²	134.2	58%	0.584	76%	0.764	S	S	*	*			cis	-147.3	-176.1	33.9	44.3	-25.3	0	0	0	117.9
630	H	28.4	Very low	30.5	Very low	166 Å²	166	133.6 Å²	133.6	77%	0.769	76%	0.76	S	S	*	*			trans	65.8	159	154	-66.4	-41.4	0	0	0	118.4
631	L	29.6	Very low	30.4	Very low	127 Å²	127	133.9 Å²	133.9	67%	0.665	76%	0.762	S	S	*	*			cis	-158.7	150.5	-10.9	-115.7	164.3	0	0	0	109.7
632	N	29	Very low	30.1	Very low	155 Å²	155	134.2 Å²	134.2	83%	0.829	76%	0.762	S	S	*	*			trans	61.3	160.2	161.9	-62.1	-21.5	0	0	0	118.6
633	G	27.5	Very low	30.5	Very low	63 Å²	63	131.6 Å²	131.6	65%	0.649	76%	0.761	S	S	*	*			cis	177.4	164.8	-7.8	0	0	0	0	0	113.5
634	M	27.6	Very low	30.4	Very low	171 Å²	171	134.7 Å²	134.7	84%	0.842	77%	0.768	S	S	*	*			trans	34.8	107	168.3	-83.6	76	87.1	0	0	122.2
635	S	27.5	Very low	30.1	Very low	88 Å²	88	138.6 Å²	138.6	62%	0.615	77%	0.766	S	S	*	*				20.9	130.9	116.5	64	0	0	0	0	121.4
636	N	27.6	Very low	29.8	Very low	136 Å²	136	138.8 Å²	138.8	73%	0.727	77%	0.767	S	S	*	*				158.8	146.6	99.3	-97.8	-29.1	0	0	0	115.6
637	I	29.3	Very low	29.9	Very low	139 Å²	139	136 Å²	136	71%	0.713	75%	0.754	S	S	*	*			trans	60.3	123	141.4	-61.4	166.1	0	0	0	116.8
638	T	27	Very low	30.2	Very low	110 Å²	110	136.9 Å²	136.9	68%	0.675	75%	0.747	S	S	*	*				-172.3	156.7	58.1	-16.1	0	0	0	0	114.4
639	K	29.3	Very low	30.6	Very low	178 Å²	178	134 Å²	134	77%	0.774	75%	0.745	S	S	*	*			trans	45.1	107.8	140.3	-77.3	175	-165.6	175.2	0	124
640	T	27.1	Very low	29.8	Very low	123 Å²	123	134.9 Å²	134.9	76%	0.755	75%	0.754	S	S	*	*				43.9	127.4	118.6	62	0	0	0	0	123.3
641	V	28.9	Very low	30.2	Very low	135 Å²	135	134 Å²	134	82%	0.818	75%	0.753	S	S	*	*				165	155.7	116.5	158.3	0	0	0	0	110.6
642	T	32.9	Very low	30.1	Very low	118 Å²	118	135.4 Å²	135.4	72%	0.724	76%	0.761	S	S	*	*			trans	-97.8	168.4	-176.2	52.1	0	0	0	0	114.4
643	P	36.5	Very low	29.9	Very low	130 Å²	130	131 Å²	131	84%	0.844	75%	0.753	S	S	*	*			trans	-120.5	179.6	138.3	36.4	-30.2	0	0	0	113.4
644	K	29.3	Very low	29.9	Very low	207 Å²	207	134.6 Å²	134.6	90%	0.9	76%	0.762	S	S	*	*			trans	-111	172.3	-161.7	-71.8	178.6	178.9	173.8	0	115.4
645	R	31.2	Very low	31	Very low	211 Å²	211	131.2 Å²	131.2	80%	0.796	75%	0.753	S	S	*	*			trans	-84	144	-176.9	179.4	-159.4	-156.9	-178	9.7	114.5
646	A	24.9	Very low	31	Very low	91 Å²	91	136.2 Å²	136.2	75%	0.752	76%	0.764	S	S	*	*			trans	-146.5	134.9	146.8	0	0	0	0	0	107
647	H	32.4	Very low	31	Very low	146 Å²	146	140 Å²	140	68%	0.676	77%	0.768	S	S	*	*			cis	93.3	140.3	43.4	-83	-76.7	0	0	0	115.1
648	S	32.7	Very low	30.9	Very low	100 Å²	100	140.1 Å²	140.1	70%	0.699	77%	0.769	S	S	*	*			trans	-87.6	162.8	-160	48.2	0	0	0	0	115.5
649	P	40.1	Very low	31	Very low	129 Å²	129	142.5 Å²	142.5	84%	0.838	77%	0.77	S	S	*	*			trans	-92.9	151.3	168.4	36.6	-33.2	0	0	0	114.4
650	S	28	Very low	30.9	Very low	110 Å²	110	139.4 Å²	139.4	77%	0.769	76%	0.762	S	S	*	*			trans	-156.6	168.8	159.8	61.5	0	0	0	0	106
651	I	36.7	Very low	30.9	Very low	147 Å²	147	141.1 Å²	141.1	75%	0.754	77%	0.765	S	S	*	*			cis	-160.2	-162.4	26.2	-147	158.7	0	0	0	110
652	D	27.6	Very low	30.7	Very low	156 Å²	156	142.1 Å²	142.1	83%	0.834	76%	0.761	S	S	*	*			trans	84.3	140.4	170	-73.1	-41.8	0	0	0	119.6
653	G	23.7	Very low	30.5	Very low	64 Å²	64	144 Å²	144	66%	0.66	76%	0.759	S	S	*	*			cis	-156.2	174.4	4.9	0	0	0	0	0	115.4
654	T	28.2	Very low	29.9	Very low	138 Å²	138	146.4 Å²	146.4	85%	0.847	76%	0.756	S	S	*	*			trans	-130.2	-155.1	-179.6	59.8	0	0	0	0	108.4
655	P	50.6	Low	29.9	Very low	99 Å²	99	143.6 Å²	143.6	64%	0.643	75%	0.75	S	S	*	*			cis	-138.4	-169.5	-13.4	35.6	-13.6	0	0	0	115.1
656	K	27.5	Very low	29.6	Very low	193 Å²	193	141.9 Å²	141.9	84%	0.839	74%	0.743	S	S	*	*			trans	127.1	152	148.7	-70.6	161.2	-174.2	172.9	0	113.8
657	R	28	Very low	29.6	Very low	216 Å²	216	145.5 Å²	145.5	82%	0.815	75%	0.749	S	S	*	*			cis	-175.4	165.6	-29.9	-157.5	-178.2	-168.2	-171	4.6	107.8
658	L	26.1	Very low	29.4	Very low	142 Å²	142	144.1 Å²	144.1	74%	0.743	74%	0.743	S	S	*	*			trans	76.5	156.4	164.2	-54.7	170.1	0	0	0	117
659	K	28.8	Very low	29	Very low	159 Å²	159	145.2 Å²	145.2	69%	0.691	75%	0.75	S	S	*	*			cis	-171.1	145	-40.2	-126.4	-173	167.8	-101.4	0	110.8
660	D	27	Very low	28.4	Very low	113 Å²	113	144.2 Å²	144.2	60%	0.604	74%	0.742	S	S	*	*			trans	54.3	167.3	149.1	-51.3	-20.1	0	0	0	124
661	I	26.9	Very low	28.4	Very low	160 Å²	160	147.9 Å²	147.9	82%	0.821	75%	0.745	S	S	*	*			trans	74.4	115.6	172.8	-52.8	175.4	0	0	0	114.4
662	E	25.9	Very low	28	Very low	155 Å²	155	149.1 Å²	149.1	72%	0.724	75%	0.745	S	S	*	*			cis	91.9	108.9	26.1	-158.7	-156.5	-112	0	0	115.6
663	K	28	Very low	28.1	Very low	157 Å²	157	149.2 Å²	149.2	68%	0.683	75%	0.745	S	S	*	*				153.3	134.8	128.1	-84.9	-170.4	-173.4	-179	0	116.7
664	F	25.3	Very low	29	Very low	181 Å²	181	152.1 Å²	152.1	79%	0.794	75%	0.753	S	S	*	*			trans	63	150.6	149.2	-78.1	-118.7	0	0	0	118
665	I	27.8	Very low	29	Very low	148 Å²	148	157.4 Å²	157.4	76%	0.759	76%	0.757	S	S	*	*			cis	-132.6	147.8	6.6	-57.8	171.4	0	0	0	106.4
666	R	24.4	Very low	27.8	Very low	175 Å²	175	157.8 Å²	157.8	66%	0.66	77%	0.768	S	S	*	*			cis	81	70.7	17.9	-154.3	-161.8	164.3	-156.7	-10.8	119.6	E668	R666-E668 PolarHBondContact NH2-OE2 3.47Å; R666-E668 IonicContact NH2-OE2 2.77Å; R666-E668 PolarHBondContact NH2-OE1 3.48Å; R666-E668 IonicContact NH2-OE1 2.87Å; R666-E668 PolarHBondContact NE-OE1 3.25Å; R666-E668 IonicContact NE-OE1 2.69Å; R666-E668 IonicContact CZ-OE2 3.27Å; R666-E668 VanDerWaalsContact CZ-OE1 3.23Å; R666-E668 IonicContact CZ-OE1 2.94Å; R666-E668 IonicContact NE-OE2 2.77Å
667	L	26.9	Very low	27.9	Very low	168 Å²	168	153.3 Å²	153.3	88%	0.88	77%	0.767	S	S	*	*			trans	-148.8	120.7	148	-134.2	77.2	0	0	0	106.8
668	E	26.4	Very low	27.9	Very low	116 Å²	116	151.5 Å²	151.5	54%	0.542	77%	0.768	S	S	.	*			cis	91.1	105.9	15.3	-155.6	172.2	-66.1	0	0	115.8	R666	R666-E668 PolarHBondContact NH2-OE2 3.47Å; R666-E668 IonicContact NH2-OE2 2.77Å; R666-E668 PolarHBondContact NH2-OE1 3.48Å; R666-E668 IonicContact NH2-OE1 2.87Å; R666-E668 PolarHBondContact NE-OE1 3.25Å; R666-E668 IonicContact NE-OE1 2.69Å; R666-E668 IonicContact CZ-OE2 3.27Å; R666-E668 VanDerWaalsContact CZ-OE1 3.23Å; R666-E668 IonicContact CZ-OE1 2.94Å; R666-E668 IonicContact NE-OE2 2.77Å
669	S	25.9	Very low	28	Very low	123 Å²	123	151.4 Å²	151.4	86%	0.86	76%	0.764	S	S	*	*			trans	-151	87.4	162.4	62.2	0	0	0	0	110.6
670	T	27.1	Very low	28	Very low	109 Å²	109	152.7 Å²	152.7	67%	0.669	76%	0.764	S	S	*	*			trans	-78.7	159.3	174.7	-34.7	0	0	0	0	111.3
671	F	26.7	Very low	28.1	Very low	186 Å²	186	154.8 Å²	154.8	82%	0.816	77%	0.768	S	S	*	*			trans	158.4	140.7	146.2	-83.9	-54.1	0	0	0	108.2
672	K	28.2	Very low	28.1	Very low	174 Å²	174	157.6 Å²	157.6	76%	0.757	77%	0.768	S	S	*	*			cis	178.3	130.7	-15.4	-135.9	-171.3	-163.2	177.6	0	105
673	D	30.7	Very low	28.3	Very low	158 Å²	158	158.7 Å²	158.7	85%	0.845	77%	0.771	S	S	*	*			trans	-73.3	158.4	160.8	-83.2	-41	0	0	0	110.7
674	P	41.6	Very low	28.2	Very low	125 Å²	125	156.3 Å²	156.3	81%	0.812	77%	0.774	S	S	*	*				-130.2	156.2	126.7	37.2	-29.4	0	0	0	113.8
675	R	28.5	Very low	28.5	Very low	249 Å²	249	152.9 Å²	152.9	94%	0.94	77%	0.768	S	S	*	*			trans	-81.4	155.7	-178.2	-55.5	168.5	-178.8	157.6	-2.6	112.5
676	A	26.8	Very low	28.5	Very low	106 Å²	106	152.7 Å²	152.7	88%	0.876	77%	0.768	S	S	*	*			trans	-137.9	157	151.6	0	0	0	0	0	109.5
677	A	28.3	Very low	28.7	Very low	100 Å²	100	148.4 Å²	148.4	83%	0.826	77%	0.77	S	S	*	*			trans	-156.1	139.1	-178.3	0	0	0	0	0	112.9
678	E	28.6	Very low	29	Very low	178 Å²	178	148.4 Å²	148.4	83%	0.832	77%	0.769	S	S	*	*			trans	-135.3	124.8	156.8	-68.4	-166.9	125.2	0	0	106.1
679	E	28.2	Very low	29	Very low	140 Å²	140	146.8 Å²	146.8	65%	0.654	78%	0.783	S	S	*	*				77.9	103.6	60.5	-154.6	-150.9	-123	0	0	113.8
680	R	28.7	Very low	29.1	Very low	186 Å²	186	144.5 Å²	144.5	70%	0.702	78%	0.78	S	S	*	*				180	126.5	114.3	-95.5	158.7	-169.8	-178.4	10.8	116.8
681	K	28.2	Very low	29.2	Very low	156 Å²	156	148.5 Å²	148.5	68%	0.678	79%	0.791	S	S	*	*			trans	63.8	116.6	138.3	-66.1	172.4	-175.9	174.9	0	118.2
682	R	28.5	Very low	29.3	Very low	220 Å²	220	144.6 Å²	144.6	83%	0.83	79%	0.786	S	S	*	*				68.1	138.2	79.7	-71.1	178.8	-172.7	-177.1	2.1	112.5
683	K	29	Very low	29.3	Very low	178 Å²	178	143.6 Å²	143.6	77%	0.774	79%	0.786	S	S	*	*			cis	-157	154	-0.4	-103.8	176.5	173.6	-165.9	0	106
684	S	27.3	Very low	29.7	Very low	107 Å²	107	141.9 Å²	141.9	75%	0.748	78%	0.784	S	S	*	*				-168.8	150.1	76.7	47.8	0	0	0	0	109.3
685	V	30.5	Very low	29.1	Very low	109 Å²	109	142.3 Å²	142.3	66%	0.661	78%	0.778	S	S	*	*				67.5	120.4	54.3	179.2	0	0	0	0	110
686	D	29.1	Very low	29.2	Very low	143 Å²	143	136 Å²	136	77%	0.765	77%	0.769	S	S	*	*			cis	-123.5	160.2	17.2	-84.2	-60.3	0	0	0	113.3
687	A	28.6	Very low	29.2	Very low	85 Å²	85	136.6 Å²	136.6	70%	0.702	76%	0.762	S	S	*	*				61.5	141.7	70.6	0	0	0	0	0	114.4
688	I	31.2	Very low	29.3	Very low	169 Å²	169	139.5 Å²	139.5	87%	0.867	76%	0.762	S	S	*	*			cis	-156	148.7	36.4	-67.9	166.4	0	0	0	112.1
689	G	28.3	Very low	29	Very low	81 Å²	81	138.3 Å²	138.3	84%	0.835	76%	0.761	S	S	*	*			trans	69.6	164	150.9	0	0	0	0	0	120.2
690	G	27.2	Very low	28.9	Very low	76 Å²	76	137.2 Å²	137.2	78%	0.784	76%	0.764	S	S	*	*			cis	173.9	132.2	-10.7	0	0	0	0	0	114.3
691	E	29.6	Very low	28.7	Very low	193 Å²	193	133.8 Å²	133.8	90%	0.902	77%	0.769	S	S	*	*			trans	64	130.9	158.5	-54.4	-163.1	127.3	0	0	125.2
692	S	28.1	Very low	28.7	Very low	104 Å²	104	137.7 Å²	137.7	73%	0.727	78%	0.779	S	S	*	*			trans	41.1	111.4	146.9	61	0	0	0	0	125.3
693	M	29.6	Very low	28.6	Very low	152 Å²	152	136.8 Å²	136.8	75%	0.749	78%	0.781	S	S	*	*				25.5	146	117.4	-67.2	-76.5	-89.6	0	0	121	I695	M693-I695 HydrophobicContact CE-CD1 4.1Å; M693-I695 HydrophobicContact SD-CD1 4.46Å
694	P	37.3	Very low	28.5	Very low	122 Å²	122	137.8 Å²	137.8	79%	0.792	79%	0.786	S	S	*	*			cis	-139.7	177.1	31.8	39.8	-20	0	0	0	119.2
695	I	28.9	Very low	28.5	Very low	135 Å²	135	144.8 Å²	144.8	69%	0.692	80%	0.796	S	S	*	*			trans	-66.7	145.6	177.8	-69	163.8	0	0	0	111.6	M693	M693-I695 HydrophobicContact CE-CD1 4.1Å; M693-I695 HydrophobicContact SD-CD1 4.46Å
696	P	32.3	Very low	28.5	Very low	115 Å²	115	147.3 Å²	147.3	75%	0.747	81%	0.805	S	S	*	*				-140.2	167.2	55.4	43.4	-25.6	0	0	0	116.3
697	T	25.8	Very low	28.3	Very low	119 Å²	119	146.4 Å²	146.4	73%	0.73	81%	0.806	S	S	*	*			cis	-149.1	147.7	34.9	43.5	0	0	0	0	114.4
698	I	29.6	Very low	28.3	Very low	161 Å²	161	146.6 Å²	146.6	83%	0.826	80%	0.803	S	S	*	*			trans	32.3	105.9	142.4	-46.3	175.1	0	0	0	117.9
699	D	23.6	Very low	28.3	Very low	154 Å²	154	148.9 Å²	148.9	82%	0.824	81%	0.807	S	S	*	*			trans	-125.7	162.7	150.7	-169.8	19.1	0	0	0	110.3
700	T	26.2	Very low	28.5	Very low	117 Å²	117	152.9 Å²	152.9	72%	0.718	80%	0.803	S	S	*	*			trans	-100.1	150.2	-162.6	65.4	0	0	0	0	113.3
701	S	24.9	Very low	28.9	Very low	114 Å²	114	157.3 Å²	157.3	80%	0.797	81%	0.808	S	S	*	*			trans	-145.1	99.1	159.2	55	0	0	0	0	114.4
702	R	26.6	Very low	29	Very low	237 Å²	237	154 Å²	154	89%	0.894	80%	0.804	S	S	*	*			trans	43.5	123.9	143.4	-65.5	175.6	168.6	170.4	-3.4	119.8
703	K	26.8	Very low	29	Very low	202 Å²	202	155.7 Å²	155.7	88%	0.878	80%	0.804	S	S	*	*				-150.9	107.8	124.6	-113.3	159.4	-169.3	170.6	0	114.3
704	K	27	Very low	29.2	Very low	199 Å²	199	154.3 Å²	154.3	87%	0.865	81%	0.809	S	S	*	*			trans	37	119.7	146.3	-58.5	-176.2	177.1	-174	0	119.6
705	R	27.1	Very low	29.1	Very low	254 Å²	254	152.8 Å²	152.8	96%	0.958	80%	0.802	S	S	*	*			trans	-137.5	163.2	138.6	-122.6	178	-176.9	178.9	0.4	110.8
706	L	29.8	Very low	29.1	Very low	161 Å²	161	151.4 Å²	151.4	84%	0.843	80%	0.804	S	S	*	*			trans	-90	148.1	-170.8	-64.1	139.6	0	0	0	111	S708	L706-S708 PolarHBondContact O-N 3.15Å
707	P	26.5	Very low	29.2	Very low	124 Å²	124	152.3 Å²	152.3	81%	0.805	81%	0.81	S	S	*	*			trans	-81.2	107.3	176.4	31.6	-32.6	0	0	0	111.8
708	S	27.1	Very low	29.6	Very low	89 Å²	89	152.7 Å²	152.7	62%	0.622	81%	0.812	S	S	*	*			trans	-64.5	138.3	152.1	36.9	0	0	0	0	109.1	L706 E710	L706-S708 PolarHBondContact O-N 3.15Å; S708-E710 PolarHBondContact O-N 2.75Å
709	K	31.8	Very low	29.7	Very low	218 Å²	218	151 Å²	151	95%	0.948	81%	0.811	S	S	*	*			trans	-81.3	69.7	173	-78.6	-169	173.8	-175.5	0	110.9
710	E	32.5	Very low	30.3	Very low	164 Å²	164	147.5 Å²	147.5	77%	0.766	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-84.6	157.5	160.1	-68.5	177.4	143.5	0	0	109.6	S708	S708-E710 PolarHBondContact O-N 2.75Å
711	L	35.5	Very low	30.8	Very low	170 Å²	170	148.8 Å²	148.8	89%	0.89	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.9	134.7	-179.4	-68	163.1	0	0	0	109.8
712	P	31.9	Very low	31.3	Very low	124 Å²	124	151.4 Å²	151.4	81%	0.805	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-69.8	150	174.5	29.9	-34.4	0	0	0	111.4
713	D	28.6	Very low	32.1	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-70.5	157.1	-168.5	-152.8	-14.5	0	0	0	113.9	S715	D713-S715 VanDerWaalsContact C-N 3.26Å; D713-S715 PolarHBondContact O-N 3.15Å; D713-S715 VanDerWaalsContact O-N 3.14Å
714	S	34.1	Very low	32.8	Very low	122 Å²	122	145.2 Å²	145.2	85%	0.853	79%	0.787	S	S	*	*	S	Bend	trans	-79.2	14.1	-167.1	58.1	0	0	0	0	116
715	S	35.4	Very low	33.8	Very low	91 Å²	91	138 Å²	138	64%	0.636	76%	0.76	S	S	*	*			trans	-139	76.8	-172.5	63.3	0	0	0	0	114.1	D713	D713-S715 VanDerWaalsContact C-N 3.26Å; D713-S715 PolarHBondContact O-N 3.15Å; D713-S715 VanDerWaalsContact O-N 3.14Å
716	S	28.6	Very low	35	Very low	106 Å²	106	130.6 Å²	130.6	74%	0.741	74%	0.738	S	S	*	*			trans	-158.3	123.2	160.3	-81.4	0	0	0	0	111.7	V718	S716-V718 PolarHBondContact O-N 3.4Å
717	P	33	Very low	36.1	Very low	133 Å²	133	130.8 Å²	130.8	86%	0.864	73%	0.732	S	S	*	*			trans	-82	115.5	175.5	31.7	-31.6	0	0	0	111.1
718	V	34	Very low	37.6	Very low	128 Å²	128	127.7 Å²	127.7	78%	0.776	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-87	140.5	166.3	-179.1	0	0	0	0	108.5	S716 A720	S716-V718 PolarHBondContact O-N 3.4Å; V718-A720 PolarHBondContact O-N 2.77Å
719	P	33.6	Very low	39.6	Very low	124 Å²	124	127.7 Å²	127.7	81%	0.805	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-58.9	124.9	179.7	-24.5	34.6	0	0	0	112.2
720	A	35.9	Very low	41.7	Very low	81 Å²	81	117.9 Å²	117.9	67%	0.669	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-81.1	142.9	172.3	0	0	0	0	0	110.5	V718	V718-A720 PolarHBondContact O-N 2.77Å
721	N	35.8	Very low	43.8	Very low	144 Å²	144	119.2 Å²	119.2	77%	0.77	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-58.6	151.7	164.9	-87	-20.4	0	0	0	110.6	I723	N721-I723 PolarHBondContact O-N 3.26Å
722	N	35.9	Very low	45.9	Very low	170 Å²	170	111.8 Å²	111.8	91%	0.909	63%	0.625	S	S	*	*	S	Bend	trans	-71.7	49.2	-163.8	-75.6	-46.5	0	0	0	116.3
723	I	43.4	Very low	47.9	Very low	71 Å²	71	109.1 Å²	109.1	36%	0.364	61%	0.607	S	S	.	*			trans	-93.2	108.3	170.7	-63.6	172.4	0	0	0	108.5	L476 N721 V725	L476-I723 HydrophobicContact CD2-CD1 3.55Å; L476-I723 HydrophobicContact CG-CD1 3.88Å; N721-I723 PolarHBondContact O-N 3.26Å; I723-V725 PolarHBondContact O-N 3.31Å
724	R	40.7	Very low	49.8	Very low	238 Å²	238	104.1 Å²	104.1	90%	0.898	58%	0.58	S	S	*	*			trans	-68.4	97.6	175.5	-78.9	-173.6	173.1	-172.3	-0.5	110.7	I726	R724-I726 PolarHBondContact O-N 2.86Å
725	V	49.2	Very low	51.3	Low	47 Å²	47	104 Å²	104	29%	0.285	57%	0.57	S	S	.	*			trans	-64	117.1	167.6	180	0	0	0	0	109.2	T463 Y467 I723 K727	T463-V725 HydrophobicContact CG2-CG1 3.92Å; Y467-V725 HydrophobicContact CD2-CG1 4.32Å; Y467-V725 HydrophobicContact CD2-CG2 3.79Å; Y467-V725 HydrophobicContact CE2-CB 4.46Å; Y467-V725 HydrophobicContact CE2-CG1 3.98Å; Y467-V725 HydrophobicContact CE2-CG2 3.85Å; Y467-V725 HydrophobicContact CG-CG2 4.44Å; I723-V725 PolarHBondContact O-N 3.31Å; V725-K727 PolarHBondContact O-N 3.2Å
726	I	51.7	Low	52.2	Low	98 Å²	98	109.8 Å²	109.8	50%	0.503	58%	0.578	S	S	.	*			trans	-73.4	117.9	177.6	-56.4	177.5	0	0	0	108.8	R724 N728	R724-I726 PolarHBondContact O-N 2.86Å; I726-N728 WeakPolarHBondContact CG2-OD1 3.41Å; I726-N728 PolarHBondContact O-N 3.28Å
727	K	52.4	Low	53.4	Low	165 Å²	165	110 Å²	110	72%	0.717	57%	0.57	S	S	*	*			trans	-89	82.3	-179.2	-62.1	-166.3	176.2	-175.8	0	111.2	V725 S729	V725-K727 PolarHBondContact O-N 3.2Å; K727-S729 PolarHBondContact O-N 2.75Å
728	N	59.3	Low	54.5	Low	60 Å²	60	108.8 Å²	108.8	32%	0.321	55%	0.554	S	S	.	*			trans	-75.8	117	174.4	-71.3	-17	0	0	0	110.4	I726	I726-N728 WeakPolarHBondContact CG2-OD1 3.41Å; I726-N728 PolarHBondContact O-N 3.28Å
729	S	67.4	Low	55.6	Low	88 Å²	88	107.7 Å²	107.7	62%	0.615	54%	0.542	S	S	*	.			trans	-84	135.1	173.7	55.6	0	0	0	0	111.6	T456 K727	T456-S729 VanDerWaalsContact OG1-CA 3.3Å; T456-S729 WeakPolarHBondContact OG1-CA 3.31Å; K727-S729 PolarHBondContact O-N 2.75Å
730	I	76.3	Confident	56.9	Low	13 Å²	13	106.8 Å²	106.8	7%	0.067	53%	0.527	C	S	.	.			trans	-120.5	85.4	-178.1	-53.4	-141.8	0	0	0	109	L455 T456 I459 H486 L732	L455-I730 HydrophobicContact CB-CB 4.28Å; L455-I730 HydrophobicContact CB-CG2 4.15Å; L455-I730 PolarHBondContact N-O 2.74Å; T456-I730 PolarHBondContact OG1-N 2.96Å; I459-I730 HydrophobicContact CD1-CB 4.24Å; I459-I730 HydrophobicContact CD1-CD1 3.51Å; I459-I730 HydrophobicContact CD1-CG1 3.9Å; H486-I730 HydrophobicContact CB-CD1 4.2Å; H486-I730 HydrophobicContact CB-CG2 3.6Å; I730-L732 HydrophobicContact CG2-CD1 4.2Å; I730-L732 HydrophobicContact CG2-CD2 3.92Å; I730-L732 HydrophobicContact CG2-CG 4.02Å
731	R	77.3	Confident	58.2	Low	192 Å²	192	108.4 Å²	108.4	73%	0.725	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.9	175.4	-71.4	178.2	173.6	176.5	-2.9	110.3	D454	D454-R731 HydrophobicContact CB-CG 4.22Å; D454-R731 WeakPolarHBondContact OD2-CG 3.12Å; D454-R731 IonicContact OD2-CZ 2.83Å; D454-R731 IonicContact OD2-NE 2.63Å; D454-R731 PolarHBondContact OD2-NE 2.86Å; D454-R731 IonicContact OD2-NH2 3.34Å; D454-R731 PolarHBondContact OD2-NH2 3.01Å
732	L	79.6	Confident	59.7	Low	13 Å²	13	106 Å²	106	7%	0.068	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	112.5	-167.9	-54	179.5	0	0	0	110.3	F442 N452 I453 L455 H486 I730	F442-L732 HydrophobicContact CZ-CD1 3.84Å; N452-L732 WeakPolarHBondContact CA-O 3.44Å; I453-L732 HydrophobicContact CB-CB 4.47Å; I453-L732 PolarHBondContact N-O 2.94Å; I453-L732 PolarHBondContact O-N 3.28Å; L455-L732 HydrophobicContact CD1-CD1 3.78Å; L455-L732 HydrophobicContact CG-CD1 4.26Å; H486-L732 HydrophobicContact CB-CD1 4.49Å; H486-L732 HydrophobicContact CB-CD2 3.97Å; H486-L732 VanDerWaalsContact CD2-CD1 3.47Å; H486-L732 WeakPolarHBondContact CD2-CD1 3.48Å; H486-L732 VanDerWaalsContact CG-CD2 3.45Å; H486-L732 VanDerWaalsContact ND1-CD2 3.32Å; H486-L732 WeakPolarHBondContact ND1-CD2 3.39Å; I730-L732 HydrophobicContact CG2-CD1 4.2Å; I730-L732 HydrophobicContact CG2-CD2 3.92Å; I730-L732 HydrophobicContact CG2-CG 4.02Å
733	T	73.6	Confident	61.4	Low	69 Å²	69	101.4 Å²	101.4	42%	0.423	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	113.6	165	-44.6	0	0	0	0	108.9	N452 N735	N452-T733 WeakPolarHBondContact OD1-CB 3.36Å; N452-T733 WeakPolarHBondContact OD1-CG2 3.5Å; N452-T733 PolarHBondContact OD1-OG1 2.71Å; T733-N735 WeakPolarHBondContact CG2-OD1 3.41Å
734	L	69.6	Low	62.8	Low	33 Å²	33	103.8 Å²	103.8	17%	0.173	48%	0.48	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	107.7	168.7	-62.1	-171.1	0	0	0	109.1	F442 S450 V451 I453	F442-L734 HydrophobicContact CB-CD1 3.64Å; F442-L734 HydrophobicContact CD1-CD1 4.12Å; F442-L734 HydrophobicContact CD2-CD1 3.51Å; F442-L734 HydrophobicContact CD2-CD2 4.18Å; F442-L734 HydrophobicContact CD2-CG 4.45Å; F442-L734 HydrophobicContact CE2-CD1 4.13Å; F442-L734 HydrophobicContact CE2-CD2 4.17Å; F442-L734 HydrophobicContact CG-CD1 3.49Å; F442-L734 VanDerWaalsContact CG-CD1 3.49Å; S450-L734 CarbonylContact C-O 3.52Å; S450-L734 WeakPolarHBondContact CA-O 3.26Å; V451-L734 PolarHBondContact N-O 3.45Å; V451-L734 PolarHBondContact O-N 2.7Å; I453-L734 HydrophobicContact CD1-CD1 3.44Å; I453-L734 VanDerWaalsContact CD1-CD1 3.44Å; I453-L734 HydrophobicContact CD1-CG 3.96Å
735	N	63.8	Low	64.6	Low	121 Å²	121	92.6 Å²	92.6	65%	0.647	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.9	150.9	166.5	-60	8.4	0	0	0	109.1	T733	T733-N735 WeakPolarHBondContact CG2-OD1 3.41Å
736	R	55.3	Low	66	Low	212 Å²	212	96.7 Å²	96.7	80%	0.8	46%	0.46	S	S	*	.			trans	-57.9	0	-172.6	-155.7	168.6	-177.9	148.5	5.2	114.9	E446 E449	E446-R736 VanDerWaalsContact O-CZ 3.31Å; E446-R736 PolarHBondContact O-NH1 2.77Å; E446-R736 VanDerWaalsContact O-NH1 3.16Å; E446-R736 PolarHBondContact O-NH2 2.87Å; E449-R736 PolarHBondContact O-N 2.77Å; E449-R736 VanDerWaalsContact O-N 3.12Å

Retrieved 736 of 736 residues in 3819.2 ms (Link to these results)

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