X5D2G4_HUMAN Loading...

D(3) dopamine receptor

Dopamine receptor that is primarily expressed in limbic areas of the brain and is involved in the modulation of cognitive, emotional, and endocrine functions. Plays a key role in regulating neuronal signaling pathways associated with motivation, reward, and behavior. Coupled to G(i)/G(o) proteins; activation leads to inhibition of adenylate cyclase and decreased intracellular cAMP levels. Involved in the control of locomotor activity and implicated in several neuropsychiatric disorders, including schizophrenia and substance use disorders. Promotes cell proliferation through MAP kinase signaling. Also involved in autophagy regulation: receptor activation stimulates AMPK, which phosphorylates RPTOR and enhances its interaction with MTOR, thereby inhibiting MTORC1 signaling and its downstream target RPS6KB1. This leads to activation of ULK1 and initiation of the autophagy cascade. Forms heterotetramers with DRD1 to potentiate beta-arrestin recruitment and mediate locomotor activity.

AlphaFold DB , UniProt , Accession X5D2G4, Species HUMAN (Homo sapiens, Human), Gene DRD3, Length 400 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	36.2	Very low	30.3	Very low	252 Å²	252	140.6 Å²	140.6	100%	1.241	82%	0.824	S	S	*	*				0	100.5	0	-145.4	174.9	-85.2	0	0	106.6
2	A	26.3	Very low	30.6	Very low	81 Å²	81	140.2 Å²	140.2	67%	0.669	82%	0.816	S	S	*	*			trans	-93.8	159.8	-179.6	0	0	0	0	0	110.6
3	S	27.2	Very low	30.9	Very low	118 Å²	118	146.3 Å²	146.3	83%	0.825	82%	0.819	S	S	*	*			trans	179.4	108.7	133.1	-70.5	0	0	0	0	107.5
4	L	28.5	Very low	31.1	Very low	138 Å²	138	143.9 Å²	143.9	72%	0.723	81%	0.81	S	S	*	*				67.9	108.6	61.8	-78.2	164.2	0	0	0	115.3	Q6	L4-Q6 HydrophobicContact CD2-CG 4.05Å
5	S	31.6	Very low	31.8	Very low	113 Å²	113	143.8 Å²	143.8	79%	0.79	82%	0.82	S	S	*	*				-172.4	92.8	126.3	55.1	0	0	0	0	107.9
6	Q	32.1	Very low	31.7	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.734	81%	0.809	S	S	*	*				50.1	118.1	85.4	-71.7	-163.9	-19.2	0	0	114.6	L4	L4-Q6 HydrophobicContact CD2-CG 4.05Å
7	L	29.8	Very low	32.4	Very low	156 Å²	156	136.8 Å²	136.8	82%	0.817	81%	0.813	S	S	*	*				-174.5	116.9	96.6	-109.7	96.8	0	0	0	107.3
8	S	29	Very low	32.5	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	81%	0.813	S	S	*	*				72.4	116.8	84.8	-161.2	0	0	0	0	113.8
9	G	28.1	Very low	33.1	Very low	76 Å²	76	140.4 Å²	140.4	78%	0.784	82%	0.818	S	S	*	*			trans	-171.8	58.5	176.9	0	0	0	0	0	110.7	L11	G9-L11 PolarHBondContact O-N 2.89Å
10	H	32.7	Very low	33.2	Very low	178 Å²	178	137.9 Å²	137.9	82%	0.824	81%	0.809	S	S	*	*			trans	-56.3	122.3	165.6	-119.6	-39.8	0	0	0	109.7
11	L	32.3	Very low	33.7	Very low	161 Å²	161	138 Å²	138	84%	0.843	81%	0.811	S	S	*	*			trans	-141	115.6	156.5	-100	159.5	0	0	0	109.9	G9	G9-L11 PolarHBondContact O-N 2.89Å
12	N	33.9	Very low	33.7	Very low	135 Å²	135	129.1 Å²	129.1	72%	0.722	78%	0.784	S	S	*	*			trans	-44	137.3	170.1	-73.7	-34.2	0	0	0	113.1
13	Y	34.7	Very low	34.2	Very low	220 Å²	220	129.8 Å²	129.8	86%	0.863	79%	0.789	S	S	*	*			trans	-133.1	95.4	145.1	-94	-83.9	0	0	0	110.2
14	T	32.6	Very low	34.9	Very low	112 Å²	112	129.7 Å²	129.7	69%	0.687	79%	0.788	S	S	*	*			trans	2.7	128.4	142.5	46.9	0	0	0	0	118	G16	T14-G16 PolarHBondContact O-N 3.36Å
15	C	41.5	Very low	35.7	Very low	143 Å²	143	132.1 Å²	132.1	97%	0.966	80%	0.796	S	S	*	*			trans	-50.9	97.8	149.9	-71.8	0	0	0	0	109.9
16	G	31	Very low	36.4	Very low	62 Å²	62	130.8 Å²	130.8	64%	0.639	79%	0.792	S	S	*	*			trans	-96.8	109.4	165.9	0	0	0	0	0	108.6	T14 E18	T14-G16 PolarHBondContact O-N 3.36Å; G16-E18 VanDerWaalsContact C-N 3.26Å; G16-E18 PolarHBondContact O-N 3.37Å
17	A	43.5	Very low	37.7	Very low	107 Å²	107	132.9 Å²	132.9	88%	0.884	79%	0.793	S	S	*	*			trans	-66.1	88.5	163.6	0	0	0	0	0	108.5	N19	A17-N19 PolarHBondContact O-N 3.07Å
18	E	34.4	Very low	39.1	Very low	171 Å²	171	129 Å²	129	80%	0.799	78%	0.777	S	S	*	*			trans	-86.5	96.7	164.4	-74.7	-167	157.8	0	0	108.8	G16 S20	G16-E18 VanDerWaalsContact C-N 3.26Å; G16-E18 PolarHBondContact O-N 3.37Å; E18-S20 PolarHBondContact O-N 2.92Å
19	N	43.3	Very low	40.7	Very low	171 Å²	171	127.8 Å²	127.8	91%	0.914	76%	0.758	S	S	*	*			trans	-61.2	76.5	158.3	-123.9	1.3	0	0	0	108.3	A17	A17-N19 PolarHBondContact O-N 3.07Å
20	S	36.1	Very low	42.9	Very low	90 Å²	90	126.5 Å²	126.5	63%	0.629	74%	0.741	S	S	*	*			trans	-98	107.3	162.4	36.9	0	0	0	0	106.2	E18 G22	E18-S20 PolarHBondContact O-N 2.92Å; S20-G22 PolarHBondContact O-N 2.96Å
21	T	42.5	Very low	45.4	Very low	141 Å²	141	123.8 Å²	123.8	87%	0.865	72%	0.724	S	S	*	*			trans	-53.4	89.8	161.5	40.8	0	0	0	0	107.8	A23	T21-A23 VanDerWaalsContact C-N 3.28Å; T21-A23 PolarHBondContact O-N 3.22Å
22	G	35.8	Very low	47.9	Very low	64 Å²	64	118 Å²	118	66%	0.66	69%	0.691	S	S	*	*			trans	-64.7	94.7	169.7	0	0	0	0	0	107.2	S20 S24	S20-G22 PolarHBondContact O-N 2.96Å; G22-S24 VanDerWaalsContact C-N 3.34Å; G22-S24 PolarHBondContact O-N 3.24Å
23	A	38.2	Very low	50.5	Low	95 Å²	95	112.1 Å²	112.1	79%	0.785	66%	0.661	S	S	*	*			trans	-48.2	111.1	154.3	0	0	0	0	0	105.5	T21 Q25	T21-A23 VanDerWaalsContact C-N 3.28Å; T21-A23 PolarHBondContact O-N 3.22Å; A23-Q25 PolarHBondContact O-N 2.94Å
24	S	42	Very low	53.2	Low	116 Å²	116	107.7 Å²	107.7	81%	0.811	65%	0.652	S	S	*	*			trans	-55.2	104.2	-173.3	-32.2	0	0	0	0	107	G22 A26	G22-S24 VanDerWaalsContact C-N 3.34Å; G22-S24 PolarHBondContact O-N 3.24Å; S24-A26 PolarHBondContact O-N 2.87Å
25	Q	44	Very low	56.2	Low	189 Å²	189	104.1 Å²	104.1	88%	0.883	63%	0.631	S	S	*	*			trans	-65.8	91.2	173.8	-157	168	20.5	0	0	104.9	A23 R27	A23-Q25 PolarHBondContact O-N 2.94Å; Q25-R27 PolarHBondContact O-N 2.97Å
26	A	47.8	Very low	58.7	Low	85 Å²	85	97.3 Å²	97.3	70%	0.702	59%	0.585	S	S	*	*			trans	-52.8	113.9	180	0	0	0	0	0	106.5	S24	S24-A26 PolarHBondContact O-N 2.87Å
27	R	57.7	Low	61.8	Low	202 Å²	202	97 Å²	97	76%	0.762	57%	0.573	S	S	*	*			trans	-52.5	131.9	-177	-70	179.4	178.3	171.3	-1.3	108.2	Q25 H29 A30	Q25-R27 PolarHBondContact O-N 2.97Å; R27-H29 PolarHBondContact O-N 2.84Å; R27-A30 WeakPolarHBondContact O-CB 3.44Å; R27-A30 PolarHBondContact O-N 3.27Å
28	P	60.5	Low	64.3	Low	74 Å²	74	94.8 Å²	94.8	48%	0.481	55%	0.554	S	S	.	*	H	α-helix	trans	-55	-25	-178	16.5	-28.7	0	0	0	113.5	A30 Y31	P28-A30 VanDerWaalsContact C-N 3.3Å; P28-A30 PolarHBondContact O-N 2.99Å; P28-Y31 VanDerWaalsContact C-CE1 3.44Å; P28-Y31 HydrophobicContact CB-CD1 4.26Å; P28-Y31 HydrophobicContact CB-CE1 3.52Å; P28-Y31 WeakPolarHBondContact O-CD1 3.18Å; P28-Y31 WeakPolarHBondContact O-CE1 3.49Å
29	H	62.4	Low	67.3	Low	91 Å²	91	87.4 Å²	87.4	42%	0.421	52%	0.52	S	S	.	.	H	α-helix	trans	-65.4	-28.1	175.1	-57.2	-66.2	0	0	0	114.5	R27 Y31 A33	R27-H29 PolarHBondContact O-N 2.84Å; H29-Y31 PolarHBondContact O-N 2.99Å; H29-A33 WeakPolarHBondContact O-CB 3.46Å; H29-A33 PolarHBondContact O-N 3.04Å; H29-A33 VanDerWaalsContact O-N 3.15Å
30	A	73.5	Confident	69.9	Low	50 Å²	50	80.7 Å²	80.7	41%	0.413	48%	0.484	S	S	.	.	H	α-helix	trans	-70.1	-33.9	-176.5	0	0	0	0	0	112.7	R27 P28 L34	R27-A30 WeakPolarHBondContact O-CB 3.44Å; R27-A30 PolarHBondContact O-N 3.27Å; P28-A30 VanDerWaalsContact C-N 3.3Å; P28-A30 PolarHBondContact O-N 2.99Å; A30-L34 WeakPolarHBondContact O-CG 3.39Å; A30-L34 PolarHBondContact O-N 3.4Å
31	Y	85.1	Confident	72.9	Confident	120 Å²	120	82.4 Å²	82.4	47%	0.471	49%	0.485	S	S	.	.	H	α-helix	trans	-72.9	-40	179	73.4	-104.8	0	0	0	111.7	P28 H29 L34 S35	P28-Y31 VanDerWaalsContact C-CE1 3.44Å; P28-Y31 HydrophobicContact CB-CD1 4.26Å; P28-Y31 HydrophobicContact CB-CE1 3.52Å; P28-Y31 WeakPolarHBondContact O-CD1 3.18Å; P28-Y31 WeakPolarHBondContact O-CE1 3.49Å; H29-Y31 PolarHBondContact O-N 2.99Å; Y31-L34 PolarHBondContact O-N 3.24Å; Y31-S35 WeakPolarHBondContact O-CB 3.4Å; Y31-S35 PolarHBondContact O-N 3.3Å
32	Y	84.8	Confident	75.5	Confident	41 Å²	41	78 Å²	78	16%	0.161	46%	0.463	C	S	.	.	H	α-helix	trans	-64.1	-45.7	176.8	-80.6	-60.7	0	0	0	110.8	L34 S35 Y36	Y32-L34 PolarHBondContact O-N 2.84Å; Y32-S35 WeakPolarHBondContact CA-OG 3.36Å; Y32-S35 WeakPolarHBondContact O-CB 3.47Å; Y32-S35 PolarHBondContact O-N 3.31Å; Y32-S35 VanDerWaalsContact O-N 3.11Å; Y32-S35 PolarHBondContact O-OG 3.24Å; Y32-Y36 WeakPolarHBondContact O-CD2 3.33Å; Y32-Y36 PolarHBondContact O-N 3.47Å
33	A	88.9	Confident	78.5	Confident	10 Å²	10	74.9 Å²	74.9	8%	0.083	43%	0.432	C	S	.	.	H	α-helix	trans	-56.2	-48.2	176.5	0	0	0	0	0	112.3	H29 S35 Y36 C37 V91	H29-A33 WeakPolarHBondContact O-CB 3.46Å; H29-A33 PolarHBondContact O-N 3.04Å; H29-A33 VanDerWaalsContact O-N 3.15Å; A33-S35 VanDerWaalsContact C-N 3.34Å; A33-S35 PolarHBondContact O-N 3.41Å; A33-Y36 PolarHBondContact O-N 3.18Å; A33-C37 PolarHBondContact O-N 2.92Å; A33-C37 PolarHBondContact O-SG 2.89Å; A33-C37 VanDerWaalsContact O-SG 3.33Å; A33-V91 HydrophobicContact CB-CG2 3.77Å
34	L	91.6	Very high	81.4	Confident	128 Å²	128	73 Å²	73	67%	0.67	41%	0.41	S	S	*	.	H	α-helix	trans	-63.2	-39.6	175.6	-71.5	173.7	0	0	0	112.3	A30 Y31 Y32 Y36 C37 A38	A30-L34 WeakPolarHBondContact O-CG 3.39Å; A30-L34 PolarHBondContact O-N 3.4Å; Y31-L34 PolarHBondContact O-N 3.24Å; Y32-L34 PolarHBondContact O-N 2.84Å; L34-Y36 VanDerWaalsContact C-N 3.33Å; L34-Y36 PolarHBondContact O-N 3.42Å; L34-C37 PolarHBondContact O-N 3.42Å; L34-A38 PolarHBondContact O-N 3.48Å
35	S	94.6	Very high	84	Confident	36 Å²	36	73.3 Å²	73.3	25%	0.252	40%	0.397	S	S	.	.	H	α-helix	trans	-63.6	-38.7	177.2	82.1	0	0	0	0	112.1	Y31 Y32 A33 A38 L39 W370	Y31-S35 WeakPolarHBondContact O-CB 3.4Å; Y31-S35 PolarHBondContact O-N 3.3Å; Y32-S35 WeakPolarHBondContact CA-OG 3.36Å; Y32-S35 WeakPolarHBondContact O-CB 3.47Å; Y32-S35 PolarHBondContact O-N 3.31Å; Y32-S35 VanDerWaalsContact O-N 3.11Å; Y32-S35 PolarHBondContact O-OG 3.24Å; A33-S35 VanDerWaalsContact C-N 3.34Å; A33-S35 PolarHBondContact O-N 3.41Å; S35-A38 PolarHBondContact O-N 3.29Å; S35-L39 WeakPolarHBondContact O-CB 3.28Å; S35-L39 PolarHBondContact O-N 3.21Å; S35-W370 PolarHBondContact OG-NE1 3.27Å
36	Y	95.1	Very high	86.5	Confident	0 Å²	0	64.7 Å²	64.7	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-66.9	-40.8	175.1	-82.5	-64.2	0	0	0	111.5	Y32 A33 L34 A38 L39 I40 M83 V86 V87 E90 W370 Y373	Y32-Y36 WeakPolarHBondContact O-CD2 3.33Å; Y32-Y36 PolarHBondContact O-N 3.47Å; A33-Y36 PolarHBondContact O-N 3.18Å; L34-Y36 VanDerWaalsContact C-N 3.33Å; L34-Y36 PolarHBondContact O-N 3.42Å; Y36-A38 PolarHBondContact O-N 2.93Å; Y36-L39 CarbonylContact O-C 3.53Å; Y36-L39 WeakPolarHBondContact O-CB 3.2Å; Y36-L39 PolarHBondContact O-N 3.46Å; Y36-L39 VanDerWaalsContact O-N 3.16Å; Y36-I40 VanDerWaalsContact O-CG1 3.29Å; Y36-I40 WeakPolarHBondContact O-CG1 3.45Å; Y36-I40 PolarHBondContact O-N 3.06Å; Y36-M83 HydrophobicContact CD1-CE 3.74Å; Y36-M83 HydrophobicContact CE1-CE 4.45Å; Y36-V86 HydrophobicContact CE1-CG1 4.11Å; Y36-V86 HydrophobicContact CE2-CG1 4.23Å; Y36-V87 VanDerWaalsContact CB-CG2 3.5Å; Y36-V87 HydrophobicContact CG-CG2 4.32Å; Y36-E90 HydrophobicContact CD2-CG 4.11Å; Y36-E90 HydrophobicContact CE2-CG 3.77Å; Y36-W370 AromaticContact CD1-CD1 3.95Å; Y36-W370 HydrophobicContact CE1-CB 4.28Å; Y36-W370 AromaticContact CE1-CD1 3.61Å; Y36-W370 HydrophobicContact CE1-CG 4.29Å; Y36-W370 AromaticContact CZ-CD1 3.71Å; Y36-W370 WeakPolarHBondContact OH-CA 3.48Å; Y36-W370 PolarHBondContact OH-N 3.22Å; Y36-Y373 AromaticContact CE1-CD2 3.82Å; Y36-Y373 HydrophobicContact CE1-CD2 3.82Å; Y36-Y373 HydrophobicContact CE1-CE2 4.48Å
37	C	95.8	Very high	88.9	Confident	57 Å²	57	60.7 Å²	60.7	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-59.6	-45.5	173.8	-67.5	0	0	0	0	111.9	A33 L34 L39 I40 L41	A33-C37 PolarHBondContact O-N 2.92Å; A33-C37 PolarHBondContact O-SG 2.89Å; A33-C37 VanDerWaalsContact O-SG 3.33Å; L34-C37 PolarHBondContact O-N 3.42Å; C37-L39 VanDerWaalsContact C-N 3.29Å; C37-L39 PolarHBondContact O-N 3.23Å; C37-I40 PolarHBondContact O-N 3.42Å; C37-L41 WeakPolarHBondContact O-CG 3.31Å; C37-L41 PolarHBondContact O-N 2.98Å
38	A	96.8	Very high	90.8	Very high	60 Å²	60	52.2 Å²	52.2	50%	0.496	30%	0.301	S	S	.	.	H	α-helix	trans	-61.5	-40	174.7	0	0	0	0	0	111.7	L34 S35 Y36 L41 A42	L34-A38 PolarHBondContact O-N 3.48Å; S35-A38 PolarHBondContact O-N 3.29Å; Y36-A38 PolarHBondContact O-N 2.93Å; A38-L41 PolarHBondContact O-N 3.33Å; A38-A42 PolarHBondContact O-N 2.94Å
39	L	97.1	Very high	92.6	Very high	15 Å²	15	49.6 Å²	49.6	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-42.4	177.8	-172.8	60.9	0	0	0	112.3	S35 Y36 C37 L41 A42 I43 M83 V374 A377	S35-L39 WeakPolarHBondContact O-CB 3.28Å; S35-L39 PolarHBondContact O-N 3.21Å; Y36-L39 CarbonylContact O-C 3.53Å; Y36-L39 WeakPolarHBondContact O-CB 3.2Å; Y36-L39 PolarHBondContact O-N 3.46Å; Y36-L39 VanDerWaalsContact O-N 3.16Å; C37-L39 VanDerWaalsContact C-N 3.29Å; C37-L39 PolarHBondContact O-N 3.23Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 2.69Å; L39-A42 WeakPolarHBondContact O-CB 3.29Å; L39-A42 PolarHBondContact O-N 3.02Å; L39-I43 HydrophobicContact CD1-CD1 4.33Å; L39-I43 HydrophobicContact CD1-CG1 4.41Å; L39-I43 HydrophobicContact CG-CD1 3.89Å; L39-I43 HydrophobicContact CG-CG1 4.41Å; L39-I43 VanDerWaalsContact O-CG1 3.26Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 3.46Å; L39-M83 HydrophobicContact CB-CE 4.19Å; L39-M83 HydrophobicContact CD2-CE 3.83Å; L39-M83 HydrophobicContact CG-CE 4Å; L39-V374 HydrophobicContact CD1-CG2 4.15Å; L39-V374 HydrophobicContact CD2-CG2 3.9Å; L39-A377 HydrophobicContact CD1-CB 3.68Å
40	I	98.1	Very high	94.2	Very high	31 Å²	31	45.2 Å²	45.2	16%	0.159	26%	0.263	C	S	.	.	H	α-helix	trans	-55.1	-49.8	174.3	-71.8	166.1	0	0	0	110	Y36 C37 A42 I43 V44 A79 M83 V87	Y36-I40 VanDerWaalsContact O-CG1 3.29Å; Y36-I40 WeakPolarHBondContact O-CG1 3.45Å; Y36-I40 PolarHBondContact O-N 3.06Å; C37-I40 PolarHBondContact O-N 3.42Å; I40-A42 VanDerWaalsContact C-N 3.33Å; I40-A42 PolarHBondContact O-N 3.32Å; I40-I43 PolarHBondContact O-N 3.38Å; I40-V44 HydrophobicContact CG2-CG2 4.36Å; I40-V44 WeakPolarHBondContact O-CB 3.4Å; I40-V44 WeakPolarHBondContact O-CG2 3.35Å; I40-V44 PolarHBondContact O-N 2.97Å; I40-A79 HydrophobicContact CG2-CB 4.39Å; I40-M83 HydrophobicContact CD1-CB 3.74Å; I40-M83 HydrophobicContact CG1-CB 3.66Å; I40-M83 HydrophobicContact CG1-CE 3.71Å; I40-M83 HydrophobicContact CG1-CG 4.36Å; I40-M83 HydrophobicContact CG1-SD 3.78Å; I40-V87 HydrophobicContact CD1-CG2 4.06Å
41	L	98	Very high	95.3	Very high	125 Å²	125	43.7 Å²	43.7	65%	0.654	25%	0.249	S	C	*	.	H	α-helix	trans	-60.8	-42.7	178.8	-65.9	176.1	0	0	0	111.7	C37 A38 L39 F45	C37-L41 WeakPolarHBondContact O-CG 3.31Å; C37-L41 PolarHBondContact O-N 2.98Å; A38-L41 PolarHBondContact O-N 3.33Å; L39-L41 VanDerWaalsContact C-N 3.32Å; L39-L41 PolarHBondContact O-N 2.69Å; L41-F45 WeakPolarHBondContact O-CB 3.48Å; L41-F45 PolarHBondContact O-N 3.24Å
42	A	98.1	Very high	95.9	Very high	48 Å²	48	41.6 Å²	41.6	40%	0.397	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-42.6	177.1	0	0	0	0	0	112.4	A38 L39 I40 G46	A38-A42 PolarHBondContact O-N 2.94Å; L39-A42 WeakPolarHBondContact O-CB 3.29Å; L39-A42 PolarHBondContact O-N 3.02Å; I40-A42 VanDerWaalsContact C-N 3.33Å; I40-A42 PolarHBondContact O-N 3.32Å; A42-G46 PolarHBondContact O-N 3Å
43	I	98.2	Very high	96.4	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-65.6	-49.1	178.2	-65.4	165	0	0	0	110.4	L39 I40 N47 D75 A79 M83 A377	L39-I43 HydrophobicContact CD1-CD1 4.33Å; L39-I43 HydrophobicContact CD1-CG1 4.41Å; L39-I43 HydrophobicContact CG-CD1 3.89Å; L39-I43 HydrophobicContact CG-CG1 4.41Å; L39-I43 VanDerWaalsContact O-CG1 3.26Å; L39-I43 WeakPolarHBondContact O-CG1 3.45Å; L39-I43 PolarHBondContact O-N 3.46Å; I40-I43 PolarHBondContact O-N 3.38Å; I43-N47 VanDerWaalsContact O-CB 3.32Å; I43-N47 WeakPolarHBondContact O-CB 3.36Å; I43-N47 PolarHBondContact O-N 3.41Å; I43-N47 PolarHBondContact O-ND2 3.01Å; I43-N47 VanDerWaalsContact O-ND2 3.1Å; I43-D75 HydrophobicContact CG2-CB 4.22Å; I43-D75 VanDerWaalsContact CG2-O 3.32Å; I43-D75 WeakPolarHBondContact CG2-O 3.36Å; I43-A79 HydrophobicContact CB-CB 3.92Å; I43-A79 HydrophobicContact CD1-CB 4.47Å; I43-A79 HydrophobicContact CG2-CB 3.65Å; I43-M83 HydrophobicContact CD1-CE 4.17Å; I43-M83 HydrophobicContact CD1-SD 3.5Å; I43-M83 VanDerWaalsContact CD1-SD 3.5Å; I43-A377 HydrophobicContact CG1-CB 3.79Å
44	V	98.4	Very high	96.7	Very high	56 Å²	56	39.3 Å²	39.3	34%	0.339	23%	0.233	S	C	.	.	H	α-helix	trans	-61.6	-47.9	-179.7	173.1	0	0	0	0	110.9	I40 G48 L76 A79 T80	I40-V44 HydrophobicContact CG2-CG2 4.36Å; I40-V44 WeakPolarHBondContact O-CB 3.4Å; I40-V44 WeakPolarHBondContact O-CG2 3.35Å; I40-V44 PolarHBondContact O-N 2.97Å; V44-G48 WeakPolarHBondContact O-CA 3.41Å; V44-G48 PolarHBondContact O-N 2.74Å; V44-L76 HydrophobicContact CB-CD2 4.43Å; V44-L76 HydrophobicContact CG1-CD2 4.46Å; V44-L76 HydrophobicContact CG2-CD2 4.49Å; V44-A79 HydrophobicContact CG2-CB 3.83Å; V44-T80 HydrophobicContact CG2-CG2 4.28Å
45	F	97.7	Very high	96.8	Very high	122 Å²	122	38.6 Å²	38.6	54%	0.535	23%	0.23	S	C	.	.	H	α-helix	trans	-62.3	-53.5	178.5	176.8	-103.2	0	0	0	111.8	L41 G48 L49 L398	L41-F45 WeakPolarHBondContact O-CB 3.48Å; L41-F45 PolarHBondContact O-N 3.24Å; F45-G48 PolarHBondContact O-N 2.78Å; F45-L49 HydrophobicContact CD1-CD1 4.12Å; F45-L49 HydrophobicContact CE1-CD1 3.58Å; F45-L49 HydrophobicContact CE2-CD1 4.07Å; F45-L49 HydrophobicContact CZ-CD1 3.57Å; F45-L49 HydrophobicContact CZ-CG 4.47Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 3.15Å; F45-L398 HydrophobicContact CE2-CD2 4.14Å; F45-L398 HydrophobicContact CZ-CD2 3.8Å
46	G	97.3	Very high	96.7	Very high	8 Å²	8	43.8 Å²	43.8	8%	0.082	25%	0.248	C	C	.	.	H	α-helix	trans	-63.9	-49.5	-175.3	0	0	0	0	0	112.6	A42 L49 V50 P380	A42-G46 PolarHBondContact O-N 3Å; G46-L49 WeakPolarHBondContact O-CB 3.36Å; G46-L49 PolarHBondContact O-N 3.2Å; G46-V50 WeakPolarHBondContact O-CG2 3.25Å; G46-V50 PolarHBondContact O-N 2.91Å; G46-P380 WeakPolarHBondContact O-CG 3.5Å
47	N	97.8	Very high	96.6	Very high	1 Å²	1	46.3 Å²	46.3	1%	0.005	26%	0.26	C	S	.	.	H	α-helix	trans	-75	-28.3	-178.5	-70.4	-67.6	0	0	0	112.4	I43 V50 C51 A72 L76 S376	I43-N47 VanDerWaalsContact O-CB 3.32Å; I43-N47 WeakPolarHBondContact O-CB 3.36Å; I43-N47 PolarHBondContact O-N 3.41Å; I43-N47 PolarHBondContact O-ND2 3.01Å; I43-N47 VanDerWaalsContact O-ND2 3.1Å; N47-V50 PolarHBondContact O-N 3.34Å; N47-C51 PolarHBondContact O-N 3.33Å; N47-C51 PolarHBondContact O-SG 3.44Å; N47-A72 HydrophobicContact CB-CB 4.04Å; N47-L76 HydrophobicContact CB-CD2 3.98Å; N47-L76 HydrophobicContact CB-CG 3.87Å; N47-S376 PolarHBondContact ND2-O 3.43Å
48	G	97.8	Very high	96.3	Very high	24 Å²	24	53.8 Å²	53.8	25%	0.247	28%	0.28	C	S	.	.	H	α-helix	trans	-59.8	-45.1	167.4	0	0	0	0	0	112	V44 F45 V50 C51 M52	V44-G48 WeakPolarHBondContact O-CA 3.41Å; V44-G48 PolarHBondContact O-N 2.74Å; F45-G48 PolarHBondContact O-N 2.78Å; G48-V50 PolarHBondContact O-N 3.49Å; G48-C51 PolarHBondContact O-N 3.45Å; G48-M52 WeakPolarHBondContact O-CB 3.42Å; G48-M52 VanDerWaalsContact O-CG 3.29Å; G48-M52 WeakPolarHBondContact O-CG 3.33Å; G48-M52 PolarHBondContact O-N 3.29Å
49	L	96.8	Very high	95.9	Very high	18 Å²	18	53.3 Å²	53.3	9%	0.094	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-39.1	173.9	-72.9	175.8	0	0	0	112.7	F45 G46 M52 A53 F394 I397 L398	F45-L49 HydrophobicContact CD1-CD1 4.12Å; F45-L49 HydrophobicContact CE1-CD1 3.58Å; F45-L49 HydrophobicContact CE2-CD1 4.07Å; F45-L49 HydrophobicContact CZ-CD1 3.57Å; F45-L49 HydrophobicContact CZ-CG 4.47Å; F45-L49 WeakPolarHBondContact O-CG 3.49Å; F45-L49 PolarHBondContact O-N 3.15Å; G46-L49 WeakPolarHBondContact O-CB 3.36Å; G46-L49 PolarHBondContact O-N 3.2Å; L49-M52 PolarHBondContact O-N 2.95Å; L49-A53 WeakPolarHBondContact O-CB 3.4Å; L49-A53 PolarHBondContact O-N 3.34Å; L49-F394 HydrophobicContact CB-CD1 4.45Å; L49-F394 HydrophobicContact CB-CD2 4.07Å; L49-F394 HydrophobicContact CB-CE1 4Å; L49-F394 HydrophobicContact CB-CE2 3.58Å; L49-F394 HydrophobicContact CB-CG 4.49Å; L49-F394 HydrophobicContact CB-CZ 3.54Å; L49-F394 HydrophobicContact CD1-CD2 3.87Å; L49-F394 HydrophobicContact CD1-CE2 3.94Å; L49-F394 HydrophobicContact CG-CE2 4.44Å; L49-F394 WeakPolarHBondContact O-CE1 3.35Å; L49-I397 HydrophobicContact CD2-CB 4.46Å; L49-I397 HydrophobicContact CD2-CG2 3.73Å; L49-L398 HydrophobicContact CD1-CD1 4.35Å; L49-L398 HydrophobicContact CD1-CD2 4.28Å; L49-L398 HydrophobicContact CD2-CD2 4.23Å
50	V	96.9	Very high	95.5	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-57.9	-49.9	174.6	173.6	0	0	0	0	110.5	G46 N47 G48 A53 V54 V68 A72 P380 Y383 F390 F394	G46-V50 WeakPolarHBondContact O-CG2 3.25Å; G46-V50 PolarHBondContact O-N 2.91Å; N47-V50 PolarHBondContact O-N 3.34Å; G48-V50 PolarHBondContact O-N 3.49Å; V50-A53 PolarHBondContact O-N 3.25Å; V50-V54 PolarHBondContact O-N 3.45Å; V50-V68 HydrophobicContact CG1-CG1 3.84Å; V50-A72 HydrophobicContact CB-CB 4.22Å; V50-A72 HydrophobicContact CG1-CB 3.98Å; V50-P380 HydrophobicContact CG2-CB 3.94Å; V50-P380 HydrophobicContact CG2-CG 3.91Å; V50-Y383 HydrophobicContact CG1-CD2 4.31Å; V50-Y383 HydrophobicContact CG1-CE2 4.34Å; V50-Y383 HydrophobicContact CG2-CD2 3.82Å; V50-Y383 HydrophobicContact CG2-CE2 4.29Å; V50-F390 HydrophobicContact CG1-CE1 4.27Å; V50-F394 HydrophobicContact CB-CZ 4.48Å; V50-F394 HydrophobicContact CG2-CE1 4.46Å; V50-F394 HydrophobicContact CG2-CZ 3.77Å
51	C	97.4	Very high	95.2	Very high	17 Å²	17	55 Å²	55	12%	0.115	28%	0.283	C	S	.	.	H	α-helix	trans	-60	-50.1	178.4	-64.8	0	0	0	0	111	N47 G48 A53 V54 L55	N47-C51 PolarHBondContact O-N 3.33Å; N47-C51 PolarHBondContact O-SG 3.44Å; G48-C51 PolarHBondContact O-N 3.45Å; C51-A53 VanDerWaalsContact C-N 3.34Å; C51-A53 PolarHBondContact O-N 2.87Å; C51-V54 PolarHBondContact O-N 2.92Å; C51-L55 WeakPolarHBondContact O-CB 3.26Å; C51-L55 VanDerWaalsContact O-CG 3.22Å; C51-L55 WeakPolarHBondContact O-CG 3.48Å; C51-L55 PolarHBondContact O-N 3.41Å
52	M	96	Very high	94.7	Very high	77 Å²	77	51.6 Å²	51.6	38%	0.379	27%	0.267	S	S	.	.	H	α-helix	trans	-60.6	-40.8	179.8	-73.6	-66.3	-73.4	0	0	112.9	G48 L49 L55 K56 I397	G48-M52 WeakPolarHBondContact O-CB 3.42Å; G48-M52 VanDerWaalsContact O-CG 3.29Å; G48-M52 WeakPolarHBondContact O-CG 3.33Å; G48-M52 PolarHBondContact O-N 3.29Å; L49-M52 PolarHBondContact O-N 2.95Å; M52-L55 PolarHBondContact O-N 3.1Å; M52-K56 HydrophobicContact CE-CD 4.14Å; M52-K56 WeakPolarHBondContact O-CB 3.48Å; M52-K56 PolarHBondContact O-N 3.22Å; M52-I397 HydrophobicContact CB-CD1 4.02Å
53	A	95.8	Very high	94.1	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-46.3	178.6	0	0	0	0	0	111.9	L49 V50 C51 E57 L60 F390 A393 F394 I397	L49-A53 WeakPolarHBondContact O-CB 3.4Å; L49-A53 PolarHBondContact O-N 3.34Å; V50-A53 PolarHBondContact O-N 3.25Å; C51-A53 VanDerWaalsContact C-N 3.34Å; C51-A53 PolarHBondContact O-N 2.87Å; A53-E57 WeakPolarHBondContact O-CB 3.33Å; A53-E57 PolarHBondContact O-N 3.31Å; A53-L60 HydrophobicContact CB-CD1 4.02Å; A53-F390 HydrophobicContact CB-CD1 4.13Å; A53-F390 HydrophobicContact CB-CE1 4.23Å; A53-A393 HydrophobicContact CB-CB 3.87Å; A53-F394 HydrophobicContact CB-CD1 3.92Å; A53-F394 HydrophobicContact CB-CE1 3.75Å; A53-I397 HydrophobicContact CB-CD1 4.14Å
54	V	95.4	Very high	93.6	Very high	2 Å²	2	51 Å²	51	1%	0.012	26%	0.259	C	S	.	.	H	α-helix	trans	-69.5	-37.8	179.4	178.6	0	0	0	0	111.6	V50 C51 L60 Q61 N65 V69 F390	V50-V54 PolarHBondContact O-N 3.45Å; C51-V54 PolarHBondContact O-N 2.92Å; V54-L60 HydrophobicContact CG2-CB 4.48Å; V54-Q61 VanDerWaalsContact O-CG 3.27Å; V54-Q61 WeakPolarHBondContact O-CG 3.31Å; V54-N65 HydrophobicContact CG1-CB 4.25Å; V54-N65 HydrophobicContact CG2-CB 4.12Å; V54-V69 HydrophobicContact CB-CG2 3.64Å; V54-V69 HydrophobicContact CG1-CG2 3.75Å; V54-V69 HydrophobicContact CG2-CG2 3.8Å; V54-F390 HydrophobicContact CG2-CE1 3.73Å; V54-F390 HydrophobicContact CG2-CZ 3.71Å
55	L	93.3	Very high	93.3	Very high	113 Å²	113	49 Å²	49	59%	0.592	25%	0.246	S	C	*	.	H	α-helix	trans	-69	-40.4	179.6	-68.6	172.6	0	0	0	112.2	C51 M52 Q61	C51-L55 WeakPolarHBondContact O-CB 3.26Å; C51-L55 VanDerWaalsContact O-CG 3.22Å; C51-L55 WeakPolarHBondContact O-CG 3.48Å; C51-L55 PolarHBondContact O-N 3.41Å; M52-L55 PolarHBondContact O-N 3.1Å; L55-Q61 PolarHBondContact O-NE2 3.09Å
56	K	93.1	Very high	93.1	Very high	145 Å²	145	47.7 Å²	47.7	63%	0.63	24%	0.238	S	C	*	.	H	α-helix	trans	-84.8	-36.3	-177.5	-72.9	-170.6	167.4	-173.4	0	114.1	M52	M52-K56 HydrophobicContact CE-CD 4.14Å; M52-K56 WeakPolarHBondContact O-CB 3.48Å; M52-K56 PolarHBondContact O-N 3.22Å
57	E	93.8	Very high	92.9	Very high	53 Å²	53	47.3 Å²	47.3	25%	0.248	23%	0.234	C	C	.	.			trans	-96.6	109.3	-171	-169.3	53.3	-112.3	0	0	111.5	A53 A59 L60 A393 K396	A53-E57 WeakPolarHBondContact O-CB 3.33Å; A53-E57 PolarHBondContact O-N 3.31Å; E57-A59 HydrophobicContact CG-CB 4.19Å; E57-A59 PolarHBondContact O-N 2.92Å; E57-L60 HydrophobicContact CB-CB 4.28Å; E57-L60 HydrophobicContact CB-CD1 4.03Å; E57-L60 HydrophobicContact CB-CG 4.16Å; E57-L60 HydrophobicContact CG-CD1 4.27Å; E57-L60 HydrophobicContact CG-CG 4.11Å; E57-L60 WeakPolarHBondContact O-CB 3.44Å; E57-L60 PolarHBondContact O-N 3.07Å; E57-A393 HydrophobicContact CB-CB 4.38Å; E57-A393 HydrophobicContact CG-CB 4.48Å; E57-K396 IonicContact OE2-NZ 3.53Å
58	R	88.8	Confident	92.8	Very high	214 Å²	214	47.5 Å²	47.5	81%	0.808	24%	0.236	S	C	*	.	G	3₁₀ helix	trans	-58.7	-32.2	-179.7	-69.5	-174.3	-177.8	-178.3	1.1	112.5	L60 Q61	R58-L60 PolarHBondContact O-N 2.88Å; R58-Q61 PolarHBondContact O-N 3.32Å
59	A	88	Confident	92.7	Very high	50 Å²	50	47.6 Å²	47.6	41%	0.413	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-64.5	-22.5	176.6	0	0	0	0	0	113.3	E57	E57-A59 HydrophobicContact CG-CB 4.19Å; E57-A59 PolarHBondContact O-N 2.92Å
60	L	89.4	Confident	92.7	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.01	23%	0.229	C	C	.	.	G	3₁₀ helix	trans	-94.2	-5.2	178.2	-67.7	178.2	0	0	0	113.3	A53 V54 E57 R58 T62 N65 E389 F390 A393	A53-L60 HydrophobicContact CB-CD1 4.02Å; V54-L60 HydrophobicContact CG2-CB 4.48Å; E57-L60 HydrophobicContact CB-CB 4.28Å; E57-L60 HydrophobicContact CB-CD1 4.03Å; E57-L60 HydrophobicContact CB-CG 4.16Å; E57-L60 HydrophobicContact CG-CD1 4.27Å; E57-L60 HydrophobicContact CG-CG 4.11Å; E57-L60 WeakPolarHBondContact O-CB 3.44Å; E57-L60 PolarHBondContact O-N 3.07Å; R58-L60 PolarHBondContact O-N 2.88Å; L60-T62 PolarHBondContact O-N 3.38Å; L60-N65 WeakPolarHBondContact O-CB 3.34Å; L60-N65 PolarHBondContact O-ND2 3.48Å; L60-E389 HydrophobicContact CD2-CB 3.61Å; L60-E389 HydrophobicContact CG-CB 4.47Å; L60-F390 HydrophobicContact CD1-CD1 3.91Å; L60-F390 HydrophobicContact CD1-CE1 4.07Å; L60-F390 HydrophobicContact CD1-CG 4.35Å; L60-F390 HydrophobicContact CD2-CD2 4.25Å; L60-F390 HydrophobicContact CD2-CE2 4.34Å; L60-F390 HydrophobicContact CD2-CG 4.39Å; L60-A393 HydrophobicContact CD1-CB 3.71Å
61	Q	90.5	Very high	92.7	Very high	81 Å²	81	47.2 Å²	47.2	38%	0.379	23%	0.23	S	C	.	.			trans	-79.2	69.1	-179.1	-68.1	175	-8.1	0	0	111.7	V54 L55 R58	V54-Q61 VanDerWaalsContact O-CG 3.27Å; V54-Q61 WeakPolarHBondContact O-CG 3.31Å; L55-Q61 PolarHBondContact O-NE2 3.09Å; R58-Q61 PolarHBondContact O-N 3.32Å
62	T	87.5	Confident	92.7	Very high	53 Å²	53	46.4 Å²	46.4	33%	0.325	23%	0.225	S	C	.	.			trans	-113.7	156	177.9	68.5	0	0	0	0	110.8	L60 T64 N65 Y66	L60-T62 PolarHBondContact O-N 3.38Å; T62-T64 PolarHBondContact O-N 3.25Å; T62-N65 PolarHBondContact O-N 3.22Å; T62-N65 VanDerWaalsContact OG1-CG 3.29Å; T62-N65 PolarHBondContact OG1-N 3.01Å; T62-N65 PolarHBondContact OG1-ND2 3.44Å; T62-Y66 VanDerWaalsContact O-CD2 3.22Å; T62-Y66 WeakPolarHBondContact O-CD2 3.37Å; T62-Y66 PolarHBondContact O-N 2.94Å
63	T	86	Confident	92.8	Very high	21 Å²	21	45.4 Å²	45.4	13%	0.129	22%	0.223	C	C	.	.	H	α-helix	trans	-51.1	-42.9	179.8	50.9	0	0	0	0	113.2	Y66 L67 Y138 V150	T63-Y66 PolarHBondContact O-N 3.06Å; T63-L67 PolarHBondContact O-N 2.86Å; T63-Y138 PolarHBondContact OG1-OH 3.15Å; T63-V150 HydrophobicContact CG2-CG2 3.73Å
64	T	88.1	Confident	92.8	Very high	15 Å²	15	45.4 Å²	45.4	9%	0.092	22%	0.223	C	C	.	.	H	α-helix	trans	-66	-40.2	177.9	-45.6	0	0	0	0	112	T62 Y66 L67 V68 I124 D127 R128	T62-T64 PolarHBondContact O-N 3.25Å; T64-Y66 VanDerWaalsContact C-N 3.29Å; T64-Y66 PolarHBondContact O-N 2.96Å; T64-L67 WeakPolarHBondContact O-CB 3.16Å; T64-L67 PolarHBondContact O-N 2.79Å; T64-L67 VanDerWaalsContact O-N 3.15Å; T64-V68 WeakPolarHBondContact O-CG2 3.32Å; T64-V68 PolarHBondContact O-N 2.65Å; T64-I124 HydrophobicContact CG2-CG2 4.29Å; T64-D127 PolarHBondContact OG1-OD2 3.25Å; T64-R128 PolarHBondContact OG1-NE 2.85Å; T64-R128 VanDerWaalsContact OG1-NE 3.14Å; T64-R128 PolarHBondContact OG1-NH1 2.96Å; T64-R128 PolarHBondContact OG1-NH2 3.34Å
65	N	91.9	Very high	92.9	Very high	14 Å²	14	45.3 Å²	45.3	8%	0.075	22%	0.222	C	C	.	.	H	α-helix	trans	-71.3	-26.9	-178.8	-70.6	-13.5	0	0	0	111.8	V54 L60 T62 V68 V69	V54-N65 HydrophobicContact CG1-CB 4.25Å; V54-N65 HydrophobicContact CG2-CB 4.12Å; L60-N65 WeakPolarHBondContact O-CB 3.34Å; L60-N65 PolarHBondContact O-ND2 3.48Å; T62-N65 PolarHBondContact O-N 3.22Å; T62-N65 VanDerWaalsContact OG1-CG 3.29Å; T62-N65 PolarHBondContact OG1-N 3.01Å; T62-N65 PolarHBondContact OG1-ND2 3.44Å; N65-V68 WeakPolarHBondContact O-CB 3.42Å; N65-V68 PolarHBondContact O-N 2.91Å; N65-V69 WeakPolarHBondContact O-CG2 3.43Å; N65-V69 PolarHBondContact O-N 3.29Å
66	Y	93.8	Very high	93.2	Very high	93 Å²	93	41.8 Å²	41.8	37%	0.365	20%	0.203	S	C	.	.	H	α-helix	trans	-65.4	-37.3	168.6	-71.3	-62.7	0	0	0	112.7	T62 T63 T64 V68 V69 S70	T62-Y66 VanDerWaalsContact O-CD2 3.22Å; T62-Y66 WeakPolarHBondContact O-CD2 3.37Å; T62-Y66 PolarHBondContact O-N 2.94Å; T63-Y66 PolarHBondContact O-N 3.06Å; T64-Y66 VanDerWaalsContact C-N 3.29Å; T64-Y66 PolarHBondContact O-N 2.96Å; Y66-V68 VanDerWaalsContact C-N 3.33Å; Y66-V69 PolarHBondContact O-N 3.47Å; Y66-S70 PolarHBondContact O-N 3.42Å
67	L	93.9	Very high	93.4	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-66.8	-36.5	171.1	-63.8	173.1	0	0	0	111.7	T63 T64 V69 S70 L71 A123 I124 D127 V150 M153 I154	T63-L67 PolarHBondContact O-N 2.86Å; T64-L67 WeakPolarHBondContact O-CB 3.16Å; T64-L67 PolarHBondContact O-N 2.79Å; T64-L67 VanDerWaalsContact O-N 3.15Å; L67-V69 VanDerWaalsContact C-N 3.32Å; L67-S70 WeakPolarHBondContact O-CB 3.47Å; L67-S70 PolarHBondContact O-N 2.89Å; L67-L71 PolarHBondContact O-N 3.28Å; L67-A123 HydrophobicContact CD1-CB 4.43Å; L67-A123 HydrophobicContact CD2-CB 4.3Å; L67-I124 HydrophobicContact CB-CD1 4.38Å; L67-I124 HydrophobicContact CB-CG1 3.63Å; L67-I124 HydrophobicContact CD1-CG1 4.21Å; L67-D127 HydrophobicContact CD1-CB 3.88Å; L67-V150 HydrophobicContact CD2-CG1 4.17Å; L67-V150 HydrophobicContact CG-CG1 4.31Å; L67-M153 HydrophobicContact CD1-CE 4.1Å; L67-M153 HydrophobicContact CD2-CB 4.31Å; L67-I154 HydrophobicContact CD2-CD1 4.33Å; L67-I154 HydrophobicContact CD2-CG1 3.69Å
68	V	93.9	Very high	93.6	Very high	6 Å²	6	35.2 Å²	35.2	4%	0.036	18%	0.177	C	C	.	.	H	α-helix	trans	-63.3	-37.7	172.7	169.9	0	0	0	0	111.6	V50 T64 N65 Y66 L71 A72 I124 Y383 F390	V50-V68 HydrophobicContact CG1-CG1 3.84Å; T64-V68 WeakPolarHBondContact O-CG2 3.32Å; T64-V68 PolarHBondContact O-N 2.65Å; N65-V68 WeakPolarHBondContact O-CB 3.42Å; N65-V68 PolarHBondContact O-N 2.91Å; Y66-V68 VanDerWaalsContact C-N 3.33Å; V68-L71 PolarHBondContact O-N 3.48Å; V68-A72 WeakPolarHBondContact O-CB 3.31Å; V68-A72 PolarHBondContact O-N 3.17Å; V68-I124 HydrophobicContact CG2-CD1 4.13Å; V68-Y383 HydrophobicContact CG1-CD2 3.98Å; V68-Y383 HydrophobicContact CG1-CE1 4.48Å; V68-Y383 HydrophobicContact CG1-CE2 3.29Å; V68-F390 HydrophobicContact CG1-CZ 4.43Å
69	V	96.6	Very high	94	Very high	26 Å²	26	25 Å²	25	16%	0.158	14%	0.139	C	C	.	.	H	α-helix	trans	-64	-43	172.3	171	0	0	0	0	110.9	V54 N65 Y66 L67 L71 A72 V73	V54-V69 HydrophobicContact CB-CG2 3.64Å; V54-V69 HydrophobicContact CG1-CG2 3.75Å; V54-V69 HydrophobicContact CG2-CG2 3.8Å; N65-V69 WeakPolarHBondContact O-CG2 3.43Å; N65-V69 PolarHBondContact O-N 3.29Å; Y66-V69 PolarHBondContact O-N 3.47Å; L67-V69 VanDerWaalsContact C-N 3.32Å; V69-L71 VanDerWaalsContact C-N 3.29Å; V69-L71 PolarHBondContact O-N 3.23Å; V69-A72 WeakPolarHBondContact O-CB 3.37Å; V69-A72 PolarHBondContact O-N 3.01Å; V69-A72 VanDerWaalsContact O-N 3.14Å; V69-V73 HydrophobicContact CG1-CG2 4.39Å; V69-V73 WeakPolarHBondContact O-CG2 3.29Å; V69-V73 PolarHBondContact O-N 3.35Å
70	S	97.2	Very high	94.4	Very high	7 Å²	7	26.1 Å²	26.1	5%	0.049	14%	0.14	C	C	.	.	H	α-helix	trans	-57.5	-41.9	174.6	179.8	0	0	0	0	112	Y66 L67 V73 A74 N120 W158	Y66-S70 PolarHBondContact O-N 3.42Å; L67-S70 WeakPolarHBondContact O-CB 3.47Å; L67-S70 PolarHBondContact O-N 2.89Å; S70-V73 PolarHBondContact O-N 3.36Å; S70-A74 PolarHBondContact O-N 2.95Å; S70-A74 VanDerWaalsContact O-N 3.13Å; S70-N120 VanDerWaalsContact CB-OD1 3.3Å; S70-N120 WeakPolarHBondContact CB-OD1 3.28Å; S70-N120 PolarHBondContact OG-OD1 3.16Å; S70-W158 PolarHBondContact OG-NE1 3.47Å
71	L	95.5	Very high	94.8	Very high	2 Å²	2	29.6 Å²	29.6	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-63.4	-45.8	172.9	-177	64.3	0	0	0	112.1	L67 V68 V69 V73 A74 D75 N120 L121	L67-L71 PolarHBondContact O-N 3.28Å; V68-L71 PolarHBondContact O-N 3.48Å; V69-L71 VanDerWaalsContact C-N 3.29Å; V69-L71 PolarHBondContact O-N 3.23Å; L71-V73 VanDerWaalsContact C-N 3.26Å; L71-V73 PolarHBondContact O-N 3.32Å; L71-A74 WeakPolarHBondContact O-CB 3.27Å; L71-A74 PolarHBondContact O-N 2.82Å; L71-A74 VanDerWaalsContact O-N 3.1Å; L71-D75 PolarHBondContact O-N 2.91Å; L71-N120 HydrophobicContact CB-CB 4.13Å; L71-N120 HydrophobicContact CD1-CB 4.04Å; L71-L121 HydrophobicContact CD2-CD2 3.84Å; L71-L121 HydrophobicContact CD2-CG 4.49Å
72	A	97.3	Very high	95.1	Very high	1 Å²	1	25.8 Å²	25.8	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-60.8	-35.3	177.6	0	0	0	0	0	112.1	N47 V50 V68 V69 D75 L76	N47-A72 HydrophobicContact CB-CB 4.04Å; V50-A72 HydrophobicContact CB-CB 4.22Å; V50-A72 HydrophobicContact CG1-CB 3.98Å; V68-A72 WeakPolarHBondContact O-CB 3.31Å; V68-A72 PolarHBondContact O-N 3.17Å; V69-A72 WeakPolarHBondContact O-CB 3.37Å; V69-A72 PolarHBondContact O-N 3.01Å; V69-A72 VanDerWaalsContact O-N 3.14Å; A72-D75 PolarHBondContact O-N 3.43Å; A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 VanDerWaalsContact O-CG 3.24Å; A72-L76 WeakPolarHBondContact O-CG 3.37Å; A72-L76 PolarHBondContact O-N 3.35Å
73	V	98.1	Very high	95.5	Very high	56 Å²	56	23.2 Å²	23.2	34%	0.339	13%	0.125	S	C	.	.	H	α-helix	trans	-66	-41.8	173.6	170.7	0	0	0	0	111.3	V69 S70 L71 D75 L76 L77 W158	V69-V73 HydrophobicContact CG1-CG2 4.39Å; V69-V73 WeakPolarHBondContact O-CG2 3.29Å; V69-V73 PolarHBondContact O-N 3.35Å; S70-V73 PolarHBondContact O-N 3.36Å; L71-V73 VanDerWaalsContact C-N 3.26Å; L71-V73 PolarHBondContact O-N 3.32Å; V73-D75 VanDerWaalsContact C-N 3.34Å; V73-D75 PolarHBondContact O-N 3.33Å; V73-L76 PolarHBondContact O-N 3.42Å; V73-L77 HydrophobicContact CG1-CD1 4.15Å; V73-L77 HydrophobicContact CG1-CG 4.46Å; V73-L77 WeakPolarHBondContact O-CG 3.49Å; V73-L77 PolarHBondContact O-N 3.07Å; V73-W158 HydrophobicContact CG1-CH2 4.49Å; V73-W158 HydrophobicContact CG1-CZ2 4.22Å
74	A	97.4	Very high	96	Very high	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-59.2	-46.1	173.8	0	0	0	0	0	111.2	S70 L71 L76 L77 V78 A116 W158	S70-A74 PolarHBondContact O-N 2.95Å; S70-A74 VanDerWaalsContact O-N 3.13Å; L71-A74 WeakPolarHBondContact O-CB 3.27Å; L71-A74 PolarHBondContact O-N 2.82Å; L71-A74 VanDerWaalsContact O-N 3.1Å; A74-L76 PolarHBondContact O-N 2.97Å; A74-L77 PolarHBondContact O-N 3.15Å; A74-V78 WeakPolarHBondContact O-CG2 3.31Å; A74-V78 PolarHBondContact O-N 3.42Å; A74-A116 HydrophobicContact CB-CB 4.35Å; A74-W158 HydrophobicContact CB-CH2 3.97Å; A74-W158 HydrophobicContact CB-CZ2 4.28Å
75	D	97.5	Very high	96.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.3	-38.7	176.8	-69.9	-32.7	0	0	0	112.6	I43 L71 A72 V73 V78 A79 S376 N379	I43-D75 HydrophobicContact CG2-CB 4.22Å; I43-D75 VanDerWaalsContact CG2-O 3.32Å; I43-D75 WeakPolarHBondContact CG2-O 3.36Å; L71-D75 PolarHBondContact O-N 2.91Å; A72-D75 PolarHBondContact O-N 3.43Å; V73-D75 VanDerWaalsContact C-N 3.34Å; V73-D75 PolarHBondContact O-N 3.33Å; D75-V78 WeakPolarHBondContact O-CB 3.44Å; D75-V78 PolarHBondContact O-N 3.03Å; D75-A79 PolarHBondContact O-N 2.86Å; D75-A79 VanDerWaalsContact O-N 3.09Å; D75-S376 WeakPolarHBondContact OD1-CA 3.41Å; D75-S376 WeakPolarHBondContact OD1-CB 3.48Å; D75-S376 PolarHBondContact OD1-OG 3.49Å; D75-N379 PolarHBondContact OD2-ND2 3.47Å
76	L	98.3	Very high	96.5	Very high	38 Å²	38	28.2 Å²	28.2	20%	0.199	15%	0.148	C	C	.	.	H	α-helix	trans	-64.5	-40.5	174	-73.6	172.4	0	0	0	112.3	V44 N47 A72 V73 A74 A79 T80	V44-L76 HydrophobicContact CB-CD2 4.43Å; V44-L76 HydrophobicContact CG1-CD2 4.46Å; V44-L76 HydrophobicContact CG2-CD2 4.49Å; N47-L76 HydrophobicContact CB-CD2 3.98Å; N47-L76 HydrophobicContact CB-CG 3.87Å; A72-L76 WeakPolarHBondContact O-CB 3.45Å; A72-L76 VanDerWaalsContact O-CG 3.24Å; A72-L76 WeakPolarHBondContact O-CG 3.37Å; A72-L76 PolarHBondContact O-N 3.35Å; V73-L76 PolarHBondContact O-N 3.42Å; A74-L76 PolarHBondContact O-N 2.97Å; L76-A79 PolarHBondContact O-N 3.38Å; L76-T80 WeakPolarHBondContact O-CB 3.47Å; L76-T80 WeakPolarHBondContact O-CG2 3.48Å; L76-T80 PolarHBondContact O-N 3.37Å; L76-T80 PolarHBondContact O-OG1 2.65Å
77	L	97.9	Very high	96.5	Very high	52 Å²	52	24.8 Å²	24.8	27%	0.272	14%	0.137	S	C	.	.	H	α-helix	trans	-67.9	-36.3	176.5	-69.1	173.6	0	0	0	111.6	V73 A74 T80 L81 M113 W158	V73-L77 HydrophobicContact CG1-CD1 4.15Å; V73-L77 HydrophobicContact CG1-CG 4.46Å; V73-L77 WeakPolarHBondContact O-CG 3.49Å; V73-L77 PolarHBondContact O-N 3.07Å; A74-L77 PolarHBondContact O-N 3.15Å; L77-T80 PolarHBondContact O-N 3.32Å; L77-L81 HydrophobicContact CD2-CD1 3.79Å; L77-L81 HydrophobicContact CD2-CG 4.36Å; L77-L81 VanDerWaalsContact O-CB 3.31Å; L77-L81 WeakPolarHBondContact O-CB 3.34Å; L77-L81 PolarHBondContact O-N 3.47Å; L77-M113 HydrophobicContact CB-CG 4.2Å; L77-M113 HydrophobicContact CB-SD 3.52Å; L77-M113 VanDerWaalsContact CB-SD 3.52Å; L77-M113 HydrophobicContact CD1-SD 3.75Å; L77-M113 HydrophobicContact CG-SD 4.3Å; L77-W158 HydrophobicContact CD1-CH2 3.83Å; L77-W158 HydrophobicContact CD1-CZ3 4.19Å
78	V	97.4	Very high	96.5	Very high	8 Å²	8	27.2 Å²	27.2	5%	0.048	15%	0.146	C	C	.	.	I	π-helix	trans	-57.2	-52.7	170.2	172.9	0	0	0	0	110.4	A74 D75 T80 V82 M83 M113 Y373	A74-V78 WeakPolarHBondContact O-CG2 3.31Å; A74-V78 PolarHBondContact O-N 3.42Å; D75-V78 WeakPolarHBondContact O-CB 3.44Å; D75-V78 PolarHBondContact O-N 3.03Å; V78-T80 VanDerWaalsContact C-N 3.3Å; V78-T80 PolarHBondContact O-N 3.17Å; V78-V82 WeakPolarHBondContact O-CA 3.45Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 PolarHBondContact O-N 3.32Å; V78-M83 HydrophobicContact CG1-CG 3.91Å; V78-M83 HydrophobicContact CG1-SD 4.22Å; V78-M83 WeakPolarHBondContact O-CG 3.27Å; V78-M83 PolarHBondContact O-N 2.93Å; V78-M113 HydrophobicContact CG2-CB 3.34Å; V78-M113 HydrophobicContact CG2-CG 3.9Å; V78-Y373 HydrophobicContact CG1-CD1 3.65Å; V78-Y373 HydrophobicContact CG1-CE1 3.72Å
79	A	97.9	Very high	96.4	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.151	C	C	.	.	I	π-helix	trans	-65.5	-31.9	-176.2	0	0	0	0	0	113.7	I40 I43 V44 D75 L76 M83 P84	I40-A79 HydrophobicContact CG2-CB 4.39Å; I43-A79 HydrophobicContact CB-CB 3.92Å; I43-A79 HydrophobicContact CD1-CB 4.47Å; I43-A79 HydrophobicContact CG2-CB 3.65Å; V44-A79 HydrophobicContact CG2-CB 3.83Å; D75-A79 PolarHBondContact O-N 2.86Å; D75-A79 VanDerWaalsContact O-N 3.09Å; L76-A79 PolarHBondContact O-N 3.38Å; A79-M83 HydrophobicContact CB-SD 4.27Å; A79-P84 WeakPolarHBondContact O-CD 3.41Å
80	T	97.3	Very high	96.1	Very high	73 Å²	73	28.1 Å²	28.1	45%	0.448	15%	0.149	S	C	.	.	I	π-helix	trans	-95.3	-32	-174.2	53.2	0	0	0	0	113.9	V44 L76 L77 V78 P84	V44-T80 HydrophobicContact CG2-CG2 4.28Å; L76-T80 WeakPolarHBondContact O-CB 3.47Å; L76-T80 WeakPolarHBondContact O-CG2 3.48Å; L76-T80 PolarHBondContact O-N 3.37Å; L76-T80 PolarHBondContact O-OG1 2.65Å; L77-T80 PolarHBondContact O-N 3.32Å; V78-T80 VanDerWaalsContact C-N 3.3Å; V78-T80 PolarHBondContact O-N 3.17Å; T80-P84 WeakPolarHBondContact O-CG 3.15Å
81	L	96.4	Very high	95.8	Very high	76 Å²	76	32.5 Å²	32.5	40%	0.398	18%	0.175	S	C	.	.	I	π-helix	trans	-111.4	-24.5	-173.7	-56.5	-176	0	0	0	113.9	L77 W85 L109	L77-L81 HydrophobicContact CD2-CD1 3.79Å; L77-L81 HydrophobicContact CD2-CG 4.36Å; L77-L81 VanDerWaalsContact O-CB 3.31Å; L77-L81 WeakPolarHBondContact O-CB 3.34Å; L77-L81 PolarHBondContact O-N 3.47Å; L81-W85 PolarHBondContact O-NE1 3.14Å; L81-W85 VanDerWaalsContact O-NE1 3.13Å; L81-L109 HydrophobicContact CB-CD1 4.32Å
82	V	96.8	Very high	95.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	I	π-helix	trans	-105.9	-56.4	-174.3	177.2	0	0	0	0	110.8	V78 P84 W85 V86 F106 L109 D110 Y373	V78-V82 WeakPolarHBondContact O-CA 3.45Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 PolarHBondContact O-N 3.32Å; V82-P84 VanDerWaalsContact C-N 3.33Å; V82-W85 WeakPolarHBondContact O-CB 3.34Å; V82-W85 PolarHBondContact O-N 3.42Å; V82-V86 HydrophobicContact CG1-CG2 4.33Å; V82-V86 PolarHBondContact O-N 3.1Å; V82-F106 HydrophobicContact CG1-CD2 4.34Å; V82-F106 HydrophobicContact CG1-CE2 3.81Å; V82-L109 HydrophobicContact CG2-CB 3.98Å; V82-D110 HydrophobicContact CG1-CB 3.75Å; V82-D110 VanDerWaalsContact CG1-OD1 3.3Å; V82-D110 WeakPolarHBondContact CG1-OD1 2.97Å; V82-D110 HydrophobicContact CG2-CB 4.45Å; V82-Y373 HydrophobicContact CG1-CE1 4.35Å
83	M	96.3	Very high	95.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-58.6	-31.3	-174.7	-67	-175.8	76.5	0	0	115.1	Y36 L39 I40 I43 V78 A79 W85 V86 V87 Y373	Y36-M83 HydrophobicContact CD1-CE 3.74Å; Y36-M83 HydrophobicContact CE1-CE 4.45Å; L39-M83 HydrophobicContact CB-CE 4.19Å; L39-M83 HydrophobicContact CD2-CE 3.83Å; L39-M83 HydrophobicContact CG-CE 4Å; I40-M83 HydrophobicContact CD1-CB 3.74Å; I40-M83 HydrophobicContact CG1-CB 3.66Å; I40-M83 HydrophobicContact CG1-CE 3.71Å; I40-M83 HydrophobicContact CG1-CG 4.36Å; I40-M83 HydrophobicContact CG1-SD 3.78Å; I43-M83 HydrophobicContact CD1-CE 4.17Å; I43-M83 HydrophobicContact CD1-SD 3.5Å; I43-M83 VanDerWaalsContact CD1-SD 3.5Å; V78-M83 HydrophobicContact CG1-CG 3.91Å; V78-M83 HydrophobicContact CG1-SD 4.22Å; V78-M83 WeakPolarHBondContact O-CG 3.27Å; V78-M83 PolarHBondContact O-N 2.93Å; A79-M83 HydrophobicContact CB-SD 4.27Å; M83-W85 VanDerWaalsContact C-N 3.27Å; M83-W85 PolarHBondContact O-N 2.92Å; M83-V86 WeakPolarHBondContact O-CB 3.08Å; M83-V86 PolarHBondContact O-N 2.81Å; M83-V86 VanDerWaalsContact O-N 3.15Å; M83-V87 WeakPolarHBondContact O-CG2 3.4Å; M83-V87 PolarHBondContact O-N 3.32Å; M83-Y373 HydrophobicContact CE-CG 4.42Å; M83-Y373 HydrophobicContact CG-CD1 4.15Å; M83-Y373 HydrophobicContact CG-CE1 4.34Å; M83-Y373 HydrophobicContact SD-CD1 4.44Å
84	P	96.6	Very high	94.5	Very high	59 Å²	59	36 Å²	36	38%	0.383	22%	0.215	S	C	.	.	H	α-helix	trans	-60	-36.8	173.7	-26.8	37.4	0	0	0	113.2	A79 T80 V82 V87 Y88	A79-P84 WeakPolarHBondContact O-CD 3.41Å; T80-P84 WeakPolarHBondContact O-CG 3.15Å; V82-P84 VanDerWaalsContact C-N 3.33Å; P84-V87 PolarHBondContact O-N 3.34Å; P84-Y88 WeakPolarHBondContact O-CB 3.49Å; P84-Y88 PolarHBondContact O-N 3.48Å
85	W	95.8	Very high	94.2	Very high	83 Å²	83	38.8 Å²	38.8	31%	0.314	23%	0.232	S	C	.	.	H	α-helix	trans	-71.5	-35.4	174.7	-56.5	112.1	0	0	0	111.9	L81 V82 M83 Y88 L89 W96 F98 F106	L81-W85 PolarHBondContact O-NE1 3.14Å; L81-W85 VanDerWaalsContact O-NE1 3.13Å; V82-W85 WeakPolarHBondContact O-CB 3.34Å; V82-W85 PolarHBondContact O-N 3.42Å; M83-W85 VanDerWaalsContact C-N 3.27Å; M83-W85 PolarHBondContact O-N 2.92Å; W85-Y88 WeakPolarHBondContact O-CB 3.16Å; W85-Y88 PolarHBondContact O-N 2.87Å; W85-L89 WeakPolarHBondContact O-CG 3.33Å; W85-L89 PolarHBondContact O-N 2.85Å; W85-W96 HydrophobicContact CD2-CH2 4.27Å; W85-W96 AromaticContact CE3-CH2 3.79Å; W85-W96 HydrophobicContact CE3-CH2 3.79Å; W85-W96 HydrophobicContact CE3-CZ3 4.01Å; W85-W96 HydrophobicContact CZ3-CH2 4.24Å; W85-F98 HydrophobicContact CZ3-CD2 4.11Å; W85-F98 AromaticContact CZ3-CE2 3.94Å; W85-F98 HydrophobicContact CZ3-CE2 3.94Å; W85-F98 HydrophobicContact CZ3-CG 4.48Å; W85-F98 HydrophobicContact CZ3-CZ 4.18Å; W85-F106 HydrophobicContact CB-CD1 4.49Å; W85-F106 HydrophobicContact CB-CD2 3.49Å; W85-F106 VanDerWaalsContact CB-CD2 3.49Å; W85-F106 HydrophobicContact CB-CE2 3.63Å; W85-F106 HydrophobicContact CB-CG 3.96Å; W85-F106 HydrophobicContact CB-CZ 4.21Å; W85-F106 AromaticContact CD1-CD2 3.65Å; W85-F106 HydrophobicContact CG-CB 4.37Å; W85-F106 AromaticContact CG-CD2 3.82Å; W85-F106 HydrophobicContact CG-CD2 3.82Å; W85-F106 HydrophobicContact CG-CE2 4.41Å; W85-F106 HydrophobicContact CG-CG 4.17Å
86	V	94	Very high	94	Very high	12 Å²	12	39 Å²	39	7%	0.073	23%	0.232	C	C	.	.	H	α-helix	trans	-61.2	-47.3	172.7	179.8	0	0	0	0	110.5	Y36 V82 M83 Y88 L89 E90 F106 Y373	Y36-V86 HydrophobicContact CE1-CG1 4.11Å; Y36-V86 HydrophobicContact CE2-CG1 4.23Å; V82-V86 HydrophobicContact CG1-CG2 4.33Å; V82-V86 PolarHBondContact O-N 3.1Å; M83-V86 WeakPolarHBondContact O-CB 3.08Å; M83-V86 PolarHBondContact O-N 2.81Å; M83-V86 VanDerWaalsContact O-N 3.15Å; V86-Y88 VanDerWaalsContact C-N 3.31Å; V86-Y88 PolarHBondContact O-N 3.4Å; V86-L89 PolarHBondContact O-N 3.33Å; V86-E90 WeakPolarHBondContact O-CG 3.23Å; V86-E90 PolarHBondContact O-N 3.46Å; V86-F106 HydrophobicContact CG2-CE2 4.04Å; V86-F106 HydrophobicContact CG2-CZ 4.08Å; V86-Y373 HydrophobicContact CG1-CE2 4.17Å; V86-Y373 HydrophobicContact CG2-CE2 4.01Å; V86-Y373 WeakPolarHBondContact CG2-OH 3.45Å
87	V	94.9	Very high	93.8	Very high	22 Å²	22	42.9 Å²	42.9	13%	0.133	25%	0.253	C	S	.	.	H	α-helix	trans	-60.1	-42.8	175.6	174.4	0	0	0	0	111	Y36 I40 M83 P84 L89 E90 V91	Y36-V87 VanDerWaalsContact CB-CG2 3.5Å; Y36-V87 HydrophobicContact CG-CG2 4.32Å; I40-V87 HydrophobicContact CD1-CG2 4.06Å; M83-V87 WeakPolarHBondContact O-CG2 3.4Å; M83-V87 PolarHBondContact O-N 3.32Å; P84-V87 PolarHBondContact O-N 3.34Å; V87-L89 PolarHBondContact O-N 3.19Å; V87-E90 PolarHBondContact O-N 2.94Å; V87-V91 HydrophobicContact CG1-CG2 4.39Å; V87-V91 VanDerWaalsContact O-CG2 3.3Å; V87-V91 WeakPolarHBondContact O-CG2 3.36Å; V87-V91 PolarHBondContact O-N 3.28Å
88	Y	94.1	Very high	93.6	Very high	50 Å²	50	45.1 Å²	45.1	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-59.2	-45.7	175.7	164.9	-98.6	0	0	0	112.2	P84 W85 V86 V91 T92 W96 N97 F98	P84-Y88 WeakPolarHBondContact O-CB 3.49Å; P84-Y88 PolarHBondContact O-N 3.48Å; W85-Y88 WeakPolarHBondContact O-CB 3.16Å; W85-Y88 PolarHBondContact O-N 2.87Å; V86-Y88 VanDerWaalsContact C-N 3.31Å; V86-Y88 PolarHBondContact O-N 3.4Å; Y88-V91 PolarHBondContact O-N 3.32Å; Y88-T92 HydrophobicContact CD2-CG2 4.04Å; Y88-T92 HydrophobicContact CE1-CG2 4.43Å; Y88-T92 HydrophobicContact CE2-CG2 3.53Å; Y88-T92 WeakPolarHBondContact O-CG2 3.37Å; Y88-T92 PolarHBondContact O-N 3.42Å; Y88-T92 PolarHBondContact O-OG1 2.82Å; Y88-W96 HydrophobicContact CD1-CE3 4.18Å; Y88-W96 HydrophobicContact CD1-CZ3 4.14Å; Y88-W96 AromaticContact CE1-CE3 3.85Å; Y88-W96 HydrophobicContact CE1-CE3 3.85Å; Y88-W96 HydrophobicContact CE1-CZ3 4.18Å; Y88-N97 WeakPolarHBondContact OH-CB 3.31Å; Y88-N97 PolarHBondContact OH-N 3.36Å; Y88-N97 VanDerWaalsContact OH-N 3.14Å; Y88-N97 PolarHBondContact OH-ND2 2.82Å; Y88-F98 HydrophobicContact CD1-CD2 4.41Å; Y88-F98 HydrophobicContact CD1-CE2 4.16Å; Y88-F98 HydrophobicContact CD2-CE2 4.11Å; Y88-F98 AromaticContact CE1-CD2 3.73Å; Y88-F98 HydrophobicContact CE1-CD2 3.73Å; Y88-F98 AromaticContact CE1-CE2 3.71Å; Y88-F98 HydrophobicContact CE1-CE2 3.71Å; Y88-F98 HydrophobicContact CE2-CD2 4.41Å; Y88-F98 AromaticContact CE2-CE2 3.65Å; Y88-F98 HydrophobicContact CE2-CE2 3.65Å; Y88-F98 HydrophobicContact CG-CE2 4.35Å; Y88-F98 AromaticContact CZ-CD2 3.73Å; Y88-F98 AromaticContact CZ-CE2 3.43Å; Y88-F98 VanDerWaalsContact CZ-CE2 3.43Å
89	L	91.3	Very high	93.3	Very high	27 Å²	27	47.6 Å²	47.6	14%	0.141	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-39.8	176.9	-76.1	172.8	0	0	0	111.9	W85 V86 V87 V91 T92 G93 G94 W96 F106	W85-L89 WeakPolarHBondContact O-CG 3.33Å; W85-L89 PolarHBondContact O-N 2.85Å; V86-L89 PolarHBondContact O-N 3.33Å; V87-L89 PolarHBondContact O-N 3.19Å; L89-V91 PolarHBondContact O-N 3Å; L89-T92 WeakPolarHBondContact CA-OG1 3.26Å; L89-T92 PolarHBondContact O-N 2.88Å; L89-T92 PolarHBondContact O-OG1 3.11Å; L89-G93 PolarHBondContact O-N 3.35Å; L89-G93 VanDerWaalsContact O-N 3.13Å; L89-G94 PolarHBondContact O-N 2.91Å; L89-W96 HydrophobicContact CD2-CB 4.37Å; L89-W96 HydrophobicContact CD2-CE3 3.86Å; L89-W96 HydrophobicContact CG-CE3 4.25Å; L89-F106 HydrophobicContact CD1-CE1 3.86Å; L89-F106 HydrophobicContact CD1-CZ 4.22Å
90	E	90.1	Very high	92.8	Very high	24 Å²	24	51.3 Å²	51.3	11%	0.112	29%	0.292	C	S	.	.	H	α-helix	trans	-63.4	-41.1	175.1	-73.7	-68.8	169.3	0	0	112.3	Y36 V86 V87 G93 S366	Y36-E90 HydrophobicContact CD2-CG 4.11Å; Y36-E90 HydrophobicContact CE2-CG 3.77Å; V86-E90 WeakPolarHBondContact O-CG 3.23Å; V86-E90 PolarHBondContact O-N 3.46Å; V87-E90 PolarHBondContact O-N 2.94Å; E90-G93 PolarHBondContact O-N 3.43Å; E90-S366 PolarHBondContact OE1-OG 3.48Å
91	V	91.1	Very high	92.4	Very high	100 Å²	100	53.9 Å²	53.9	61%	0.606	30%	0.302	S	S	*	.	H	α-helix	trans	-69.6	-36.1	179.4	171	0	0	0	0	112.2	A33 V87 Y88 L89 G93	A33-V91 HydrophobicContact CB-CG2 3.77Å; V87-V91 HydrophobicContact CG1-CG2 4.39Å; V87-V91 VanDerWaalsContact O-CG2 3.3Å; V87-V91 WeakPolarHBondContact O-CG2 3.36Å; V87-V91 PolarHBondContact O-N 3.28Å; Y88-V91 PolarHBondContact O-N 3.32Å; L89-V91 PolarHBondContact O-N 3Å; V91-G93 VanDerWaalsContact C-N 3.3Å
92	T	90.5	Very high	92.2	Very high	43 Å²	43	52.5 Å²	52.5	26%	0.264	30%	0.299	S	S	.	.	H	α-helix	trans	-83.6	-4.6	-179.9	51.8	0	0	0	0	113.6	Y88 L89 V95	Y88-T92 HydrophobicContact CD2-CG2 4.04Å; Y88-T92 HydrophobicContact CE1-CG2 4.43Å; Y88-T92 HydrophobicContact CE2-CG2 3.53Å; Y88-T92 WeakPolarHBondContact O-CG2 3.37Å; Y88-T92 PolarHBondContact O-N 3.42Å; Y88-T92 PolarHBondContact O-OG1 2.82Å; L89-T92 WeakPolarHBondContact CA-OG1 3.26Å; L89-T92 PolarHBondContact O-N 2.88Å; L89-T92 PolarHBondContact O-OG1 3.11Å; T92-V95 WeakPolarHBondContact CB-O 3.49Å; T92-V95 PolarHBondContact OG1-O 2.99Å; T92-V95 VanDerWaalsContact OG1-O 3.05Å
93	G	86.4	Confident	92	Very high	49 Å²	49	52.5 Å²	52.5	51%	0.505	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.8	30.3	-176.7	0	0	0	0	0	113.2	L89 E90 V91	L89-G93 PolarHBondContact O-N 3.35Å; L89-G93 VanDerWaalsContact O-N 3.13Å; E90-G93 PolarHBondContact O-N 3.43Å; V91-G93 VanDerWaalsContact C-N 3.3Å
94	G	86.9	Confident	91.7	Very high	40 Å²	40	53.8 Å²	53.8	41%	0.412	31%	0.306	S	S	.	.	S	Bend	trans	89.5	7	178.8	0	0	0	0	0	114.9	L89	L89-G94 PolarHBondContact O-N 2.91Å
95	V	91.2	Very high	91.6	Very high	59 Å²	59	54.1 Å²	54.1	36%	0.358	31%	0.306	S	S	.	.			trans	-91.1	119.2	-177.9	-174.9	0	0	0	0	111	T92 N97	T92-V95 WeakPolarHBondContact CB-O 3.49Å; T92-V95 PolarHBondContact OG1-O 2.99Å; T92-V95 VanDerWaalsContact OG1-O 3.05Å; V95-N97 WeakPolarHBondContact CG1-OD1 3.38Å
96	W	93.3	Very high	91.5	Very high	4 Å²	4	50.8 Å²	50.8	2%	0.015	29%	0.294	C	S	.	.			trans	-93.7	110.1	177.6	-175.1	-98.4	0	0	0	111.7	W85 Y88 L89 F98 S99 C102 C103 T179 C181	W85-W96 HydrophobicContact CD2-CH2 4.27Å; W85-W96 AromaticContact CE3-CH2 3.79Å; W85-W96 HydrophobicContact CE3-CH2 3.79Å; W85-W96 HydrophobicContact CE3-CZ3 4.01Å; W85-W96 HydrophobicContact CZ3-CH2 4.24Å; Y88-W96 HydrophobicContact CD1-CE3 4.18Å; Y88-W96 HydrophobicContact CD1-CZ3 4.14Å; Y88-W96 AromaticContact CE1-CE3 3.85Å; Y88-W96 HydrophobicContact CE1-CE3 3.85Å; Y88-W96 HydrophobicContact CE1-CZ3 4.18Å; L89-W96 HydrophobicContact CD2-CB 4.37Å; L89-W96 HydrophobicContact CD2-CE3 3.86Å; L89-W96 HydrophobicContact CG-CE3 4.25Å; W96-F98 HydrophobicContact CD2-CB 4.38Å; W96-F98 HydrophobicContact CH2-CB 4.32Å; W96-F98 HydrophobicContact CH2-CD2 4.38Å; W96-F98 HydrophobicContact CZ2-CB 3.58Å; W96-F98 HydrophobicContact CZ2-CD2 4.42Å; W96-F98 HydrophobicContact CZ2-CG 4.38Å; W96-F98 HydrophobicContact CZ3-CD2 4.48Å; W96-F98 PolarHBondContact NE1-O 3.33Å; W96-S99 PolarHBondContact NE1-O 3.39Å; W96-C102 HydrophobicContact CH2-CB 4.43Å; W96-C102 HydrophobicContact CZ2-CB 3.69Å; W96-C103 HydrophobicContact CD2-CB 4.45Å; W96-C103 HydrophobicContact CZ2-CB 3.94Å; W96-C103 VanDerWaalsContact CZ2-N 3.32Å; W96-T179 WeakPolarHBondContact CB-O 3.26Å; W96-T179 PolarHBondContact N-O 3.11Å; W96-C181 HydrophobicContact CB-CB 3.73Å; W96-C181 HydrophobicContact CD2-CB 3.66Å; W96-C181 HydrophobicContact CE3-CB 3.91Å; W96-C181 HydrophobicContact CG-CB 3.6Å
97	N	93.4	Very high	91.4	Very high	120 Å²	120	50.5 Å²	50.5	64%	0.642	29%	0.292	S	S	*	.			trans	-97.3	-4.1	179.4	-59.5	-34.8	0	0	0	114	Y88 V95	Y88-N97 WeakPolarHBondContact OH-CB 3.31Å; Y88-N97 PolarHBondContact OH-N 3.36Å; Y88-N97 VanDerWaalsContact OH-N 3.14Å; Y88-N97 PolarHBondContact OH-ND2 2.82Å; V95-N97 WeakPolarHBondContact CG1-OD1 3.38Å
98	F	93.3	Very high	91.4	Very high	99 Å²	99	49.7 Å²	49.7	43%	0.434	29%	0.287	S	S	.	.	S	Bend	trans	-88.4	174.6	-178.4	-67.6	-84.2	0	0	0	111.8	W85 Y88 W96 C102	W85-F98 HydrophobicContact CZ3-CD2 4.11Å; W85-F98 AromaticContact CZ3-CE2 3.94Å; W85-F98 HydrophobicContact CZ3-CE2 3.94Å; W85-F98 HydrophobicContact CZ3-CG 4.48Å; W85-F98 HydrophobicContact CZ3-CZ 4.18Å; Y88-F98 HydrophobicContact CD1-CD2 4.41Å; Y88-F98 HydrophobicContact CD1-CE2 4.16Å; Y88-F98 HydrophobicContact CD2-CE2 4.11Å; Y88-F98 AromaticContact CE1-CD2 3.73Å; Y88-F98 HydrophobicContact CE1-CD2 3.73Å; Y88-F98 AromaticContact CE1-CE2 3.71Å; Y88-F98 HydrophobicContact CE1-CE2 3.71Å; Y88-F98 HydrophobicContact CE2-CD2 4.41Å; Y88-F98 AromaticContact CE2-CE2 3.65Å; Y88-F98 HydrophobicContact CE2-CE2 3.65Å; Y88-F98 HydrophobicContact CG-CE2 4.35Å; Y88-F98 AromaticContact CZ-CD2 3.73Å; Y88-F98 AromaticContact CZ-CE2 3.43Å; Y88-F98 VanDerWaalsContact CZ-CE2 3.43Å; W96-F98 HydrophobicContact CD2-CB 4.38Å; W96-F98 HydrophobicContact CH2-CB 4.32Å; W96-F98 HydrophobicContact CH2-CD2 4.38Å; W96-F98 HydrophobicContact CZ2-CB 3.58Å; W96-F98 HydrophobicContact CZ2-CD2 4.42Å; W96-F98 HydrophobicContact CZ2-CG 4.38Å; W96-F98 HydrophobicContact CZ3-CD2 4.48Å; W96-F98 PolarHBondContact NE1-O 3.33Å; F98-C102 HydrophobicContact CB-CB 4.25Å
99	S	91.4	Very high	91.4	Very high	59 Å²	59	49.3 Å²	49.3	41%	0.413	29%	0.289	S	S	.	.			trans	-60.9	157.3	178	78.9	0	0	0	0	112.5	W96 I101 C102 C103	W96-S99 PolarHBondContact NE1-O 3.39Å; S99-I101 VanDerWaalsContact C-N 3.29Å; S99-I101 PolarHBondContact O-N 3.4Å; S99-C102 PolarHBondContact O-N 3.36Å; S99-C102 PolarHBondContact OG-N 3.39Å; S99-C102 PolarHBondContact OG-SG 2.81Å; S99-C103 PolarHBondContact O-N 2.97Å
100	R	87.5	Confident	91.5	Very high	78 Å²	78	49.6 Å²	49.6	29%	0.294	29%	0.29	S	S	.	.	H	α-helix	trans	-59.3	-39.5	172	-72.4	-58.1	-151.2	-172.1	13.7	112.6	C102 C103 D104 T175 D177 P178 V180	R100-C102 VanDerWaalsContact C-N 3.28Å; R100-C102 PolarHBondContact O-N 3.14Å; R100-C103 WeakPolarHBondContact O-CA 3.29Å; R100-C103 VanDerWaalsContact O-CB 3.29Å; R100-C103 WeakPolarHBondContact O-CB 3.36Å; R100-C103 PolarHBondContact O-N 2.87Å; R100-D104 VanDerWaalsContact O-CG 3.29Å; R100-D104 PolarHBondContact O-N 3.18Å; R100-T175 PolarHBondContact NH1-OG1 3.11Å; R100-T175 PolarHBondContact NH2-O 3.27Å; R100-T175 PolarHBondContact NH2-OG1 2.76Å; R100-D177 VanDerWaalsContact CZ-O 3.3Å; R100-D177 PolarHBondContact NH1-O 2.95Å; R100-D177 PolarHBondContact NH2-O 2.88Å; R100-P178 VanDerWaalsContact NH1-CA 3.34Å; R100-P178 PolarHBondContact NH1-O 3.48Å; R100-P178 VanDerWaalsContact NH1-O 3.14Å; R100-P178 VanDerWaalsContact NH2-N 3.17Å; R100-V180 PolarHBondContact NH1-O 3.09Å; R100-V180 VanDerWaalsContact NH1-O 3.12Å
101	I	89.6	Confident	91.6	Very high	127 Å²	127	49 Å²	49	65%	0.651	29%	0.288	S	S	*	.	H	α-helix	trans	-59.5	-41.8	178.4	-57.5	167	0	0	0	110.6	S99 C103 D104 V105	S99-I101 VanDerWaalsContact C-N 3.29Å; S99-I101 PolarHBondContact O-N 3.4Å; I101-C103 VanDerWaalsContact C-N 3.31Å; I101-C103 PolarHBondContact O-N 3.1Å; I101-D104 PolarHBondContact O-N 2.89Å; I101-V105 VanDerWaalsContact O-CG2 3.3Å; I101-V105 WeakPolarHBondContact O-CG2 3.44Å; I101-V105 PolarHBondContact O-N 2.87Å
102	C	92.4	Very high	91.8	Very high	48 Å²	48	45.7 Å²	45.7	32%	0.324	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-37.3	175.9	-66.4	0	0	0	0	111.8	W96 F98 S99 R100 F106	W96-C102 HydrophobicContact CH2-CB 4.43Å; W96-C102 HydrophobicContact CZ2-CB 3.69Å; F98-C102 HydrophobicContact CB-CB 4.25Å; S99-C102 PolarHBondContact O-N 3.36Å; S99-C102 PolarHBondContact OG-N 3.39Å; S99-C102 PolarHBondContact OG-SG 2.81Å; R100-C102 VanDerWaalsContact C-N 3.28Å; R100-C102 PolarHBondContact O-N 3.14Å; C102-F106 VanDerWaalsContact O-CB 3.3Å; C102-F106 WeakPolarHBondContact O-CB 3.46Å; C102-F106 PolarHBondContact O-N 2.96Å
103	C	91.9	Very high	92	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-65	-47.2	175	177.8	0	0	0	0	110.9	W96 S99 R100 I101 V105 F106 V107 C181	W96-C103 HydrophobicContact CD2-CB 4.45Å; W96-C103 HydrophobicContact CZ2-CB 3.94Å; W96-C103 VanDerWaalsContact CZ2-N 3.32Å; S99-C103 PolarHBondContact O-N 2.97Å; R100-C103 WeakPolarHBondContact O-CA 3.29Å; R100-C103 VanDerWaalsContact O-CB 3.29Å; R100-C103 WeakPolarHBondContact O-CB 3.36Å; R100-C103 PolarHBondContact O-N 2.87Å; I101-C103 VanDerWaalsContact C-N 3.31Å; I101-C103 PolarHBondContact O-N 3.1Å; C103-V105 VanDerWaalsContact C-N 3.32Å; C103-V105 PolarHBondContact O-N 3.4Å; C103-F106 PolarHBondContact O-N 2.94Å; C103-V107 WeakPolarHBondContact O-CB 3.36Å; C103-V107 VanDerWaalsContact O-CG2 3.31Å; C103-V107 WeakPolarHBondContact O-CG2 3.35Å; C103-V107 PolarHBondContact O-N 3.46Å; C103-C181 WeakPolarHBondContact CA-SG 3.14Å; C103-C181 HydrophobicContact CB-CB 3.97Å; C103-C181 WeakPolarHBondContact CB-SG 3.14Å; C103-C181 WeakPolarHBondContact SG-CA 3.23Å; C103-C181 WeakPolarHBondContact SG-CB 3.41Å; C103-C181 CovalentContact SG-SG 2.03Å; C103-C181 PolarHBondContact SG-SG 3.46Å
104	D	90.6	Very high	92.3	Very high	27 Å²	27	42.1 Å²	42.1	14%	0.144	24%	0.235	C	C	.	.	H	α-helix	trans	-61.8	-41.8	-179.5	-61.2	-27.1	0	0	0	111.4	R100 I101 T108 N173	R100-D104 VanDerWaalsContact O-CG 3.29Å; R100-D104 PolarHBondContact O-N 3.18Å; I101-D104 PolarHBondContact O-N 2.89Å; D104-T108 WeakPolarHBondContact O-CB 3.45Å; D104-T108 PolarHBondContact O-N 2.87Å; D104-T108 PolarHBondContact O-OG1 2.97Å; D104-N173 WeakPolarHBondContact OD1-CB 3.27Å; D104-N173 PolarHBondContact OD1-ND2 3.29Å
105	V	93	Very high	92.6	Very high	65 Å²	65	40.2 Å²	40.2	39%	0.394	22%	0.215	S	C	.	.	H	α-helix	trans	-63.9	-47	174.1	171.3	0	0	0	0	111.2	I101 C103 T108 L109 L169	I101-V105 VanDerWaalsContact O-CG2 3.3Å; I101-V105 WeakPolarHBondContact O-CG2 3.44Å; I101-V105 PolarHBondContact O-N 2.87Å; C103-V105 VanDerWaalsContact C-N 3.32Å; C103-V105 PolarHBondContact O-N 3.4Å; V105-T108 PolarHBondContact O-N 3.25Å; V105-L109 HydrophobicContact CG1-CD1 3.82Å; V105-L109 HydrophobicContact CG1-CG 4.36Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.23Å; V105-L109 PolarHBondContact O-N 3.36Å; V105-L169 HydrophobicContact CG2-CD2 4.14Å
106	F	94.6	Very high	92.9	Very high	13 Å²	13	37.4 Å²	37.4	6%	0.057	20%	0.198	C	C	.	.	H	α-helix	trans	-58	-52.4	178.3	157.3	-117.3	0	0	0	111.8	V82 W85 V86 L89 C102 C103 T108 L109 D110	V82-F106 HydrophobicContact CG1-CD2 4.34Å; V82-F106 HydrophobicContact CG1-CE2 3.81Å; W85-F106 HydrophobicContact CB-CD1 4.49Å; W85-F106 HydrophobicContact CB-CD2 3.49Å; W85-F106 VanDerWaalsContact CB-CD2 3.49Å; W85-F106 HydrophobicContact CB-CE2 3.63Å; W85-F106 HydrophobicContact CB-CG 3.96Å; W85-F106 HydrophobicContact CB-CZ 4.21Å; W85-F106 AromaticContact CD1-CD2 3.65Å; W85-F106 HydrophobicContact CG-CB 4.37Å; W85-F106 AromaticContact CG-CD2 3.82Å; W85-F106 HydrophobicContact CG-CD2 3.82Å; W85-F106 HydrophobicContact CG-CE2 4.41Å; W85-F106 HydrophobicContact CG-CG 4.17Å; V86-F106 HydrophobicContact CG2-CE2 4.04Å; V86-F106 HydrophobicContact CG2-CZ 4.08Å; L89-F106 HydrophobicContact CD1-CE1 3.86Å; L89-F106 HydrophobicContact CD1-CZ 4.22Å; C102-F106 VanDerWaalsContact O-CB 3.3Å; C102-F106 WeakPolarHBondContact O-CB 3.46Å; C102-F106 PolarHBondContact O-N 2.96Å; C103-F106 PolarHBondContact O-N 2.94Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3Å; F106-L109 PolarHBondContact O-N 2.72Å; F106-D110 PolarHBondContact O-N 2.87Å
107	V	92.2	Very high	92.9	Very high	6 Å²	6	37.4 Å²	37.4	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-65.3	-39.1	-178.9	177.6	0	0	0	0	111	C103 D110 V111 L168 I183	C103-V107 WeakPolarHBondContact O-CB 3.36Å; C103-V107 VanDerWaalsContact O-CG2 3.31Å; C103-V107 WeakPolarHBondContact O-CG2 3.35Å; C103-V107 PolarHBondContact O-N 3.46Å; V107-D110 PolarHBondContact O-N 3.49Å; V107-V111 WeakPolarHBondContact O-CG2 3.31Å; V107-V111 PolarHBondContact O-N 2.85Å; V107-L168 HydrophobicContact CG1-CD1 3.99Å; V107-L168 HydrophobicContact CG1-CD2 4.3Å; V107-I183 HydrophobicContact CG1-CD1 3.67Å; V107-I183 HydrophobicContact CG1-CG1 3.29Å
108	T	93.7	Very high	92.7	Very high	5 Å²	5	31.8 Å²	31.8	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-61.1	-45.8	174.4	-60.3	0	0	0	0	111.4	D104 V105 F106 M112 L168 L169	D104-T108 WeakPolarHBondContact O-CB 3.45Å; D104-T108 PolarHBondContact O-N 2.87Å; D104-T108 PolarHBondContact O-OG1 2.97Å; V105-T108 PolarHBondContact O-N 3.25Å; F106-T108 VanDerWaalsContact C-N 3.34Å; F106-T108 PolarHBondContact O-N 3Å; T108-M112 WeakPolarHBondContact O-CB 3.5Å; T108-M112 PolarHBondContact O-N 3.4Å; T108-L168 VanDerWaalsContact OG1-CB 3.31Å; T108-L168 WeakPolarHBondContact OG1-CB 3.08Å; T108-L169 HydrophobicContact CG2-CD1 4.03Å; T108-L169 HydrophobicContact CG2-CD2 4.09Å; T108-L169 HydrophobicContact CG2-CG 3.78Å; T108-L169 WeakPolarHBondContact OG1-CD2 3.13Å; T108-L169 WeakPolarHBondContact OG1-CG 3.27Å
109	L	94.8	Very high	92.7	Very high	43 Å²	43	28.4 Å²	28.4	23%	0.225	16%	0.155	C	C	.	.	H	α-helix	trans	-63.8	-42.3	178.7	-74.4	171	0	0	0	111.5	L81 V82 V105 F106 M112 M113	L81-L109 HydrophobicContact CB-CD1 4.32Å; V82-L109 HydrophobicContact CG2-CB 3.98Å; V105-L109 HydrophobicContact CG1-CD1 3.82Å; V105-L109 HydrophobicContact CG1-CG 4.36Å; V105-L109 WeakPolarHBondContact O-CB 3.5Å; V105-L109 VanDerWaalsContact O-CG 3.27Å; V105-L109 WeakPolarHBondContact O-CG 3.23Å; V105-L109 PolarHBondContact O-N 3.36Å; F106-L109 PolarHBondContact O-N 2.72Å; L109-M112 PolarHBondContact O-N 3.37Å; L109-M113 WeakPolarHBondContact O-CB 3.49Å; L109-M113 VanDerWaalsContact O-CG 3.29Å; L109-M113 WeakPolarHBondContact O-CG 3.38Å; L109-M113 PolarHBondContact O-N 3.22Å
110	D	93.8	Very high	92.9	Very high	33 Å²	33	25.6 Å²	25.6	18%	0.176	14%	0.135	C	C	.	.	H	α-helix	trans	-58.8	-52.1	177	-172.3	44.6	0	0	0	111.4	V82 F106 V107 M112 M113 C114 Y373	V82-D110 HydrophobicContact CG1-CB 3.75Å; V82-D110 VanDerWaalsContact CG1-OD1 3.3Å; V82-D110 WeakPolarHBondContact CG1-OD1 2.97Å; V82-D110 HydrophobicContact CG2-CB 4.45Å; F106-D110 PolarHBondContact O-N 2.87Å; V107-D110 PolarHBondContact O-N 3.49Å; D110-M112 PolarHBondContact O-N 2.94Å; D110-M113 PolarHBondContact O-N 3.5Å; D110-C114 WeakPolarHBondContact O-CB 3.18Å; D110-C114 PolarHBondContact O-N 2.91Å; D110-Y373 PolarHBondContact OD1-OH 3.4Å
111	V	92.4	Very high	92.9	Very high	12 Å²	12	22.4 Å²	22.4	7%	0.073	12%	0.124	C	C	.	.	H	α-helix	trans	-63.8	-41.5	177.4	179.9	0	0	0	0	111.1	V107 C114 T115 S165 L168 I183	V107-V111 WeakPolarHBondContact O-CG2 3.31Å; V107-V111 PolarHBondContact O-N 2.85Å; V111-C114 PolarHBondContact O-N 3.1Å; V111-T115 VanDerWaalsContact O-CB 3.27Å; V111-T115 WeakPolarHBondContact O-CB 3.02Å; V111-T115 PolarHBondContact O-N 3.47Å; V111-T115 PolarHBondContact O-OG1 3.4Å; V111-S165 WeakPolarHBondContact CG1-OG 3.21Å; V111-L168 HydrophobicContact CB-CD1 4.21Å; V111-L168 HydrophobicContact CG2-CD1 3.91Å; V111-I183 HydrophobicContact CG2-CD1 3.77Å
112	M	95.2	Very high	93	Very high	29 Å²	29	16.9 Å²	16.9	14%	0.143	10%	0.096	C	C	.	.	H	α-helix	trans	-63.5	-44.9	-179.7	-174.2	-174.3	163	0	0	111.7	T108 L109 D110 T115 A116 W158 A161 F162 S165	T108-M112 WeakPolarHBondContact O-CB 3.5Å; T108-M112 PolarHBondContact O-N 3.4Å; L109-M112 PolarHBondContact O-N 3.37Å; D110-M112 PolarHBondContact O-N 2.94Å; M112-T115 PolarHBondContact O-N 3.47Å; M112-A116 VanDerWaalsContact O-CB 3.27Å; M112-A116 WeakPolarHBondContact O-CB 3.32Å; M112-A116 PolarHBondContact O-N 2.85Å; M112-W158 HydrophobicContact CE-CE3 3.78Å; M112-W158 HydrophobicContact CE-CZ3 4.12Å; M112-A161 HydrophobicContact CG-CB 4.15Å; M112-F162 HydrophobicContact CE-CB 4.07Å; M112-F162 HydrophobicContact CE-CD2 4.49Å; M112-F162 HydrophobicContact SD-CB 4.31Å; M112-F162 HydrophobicContact SD-CD2 4.04Å; M112-S165 WeakPolarHBondContact CA-OG 3.2Å; M112-S165 WeakPolarHBondContact CB-OG 3.47Å; M112-S165 PolarHBondContact N-OG 3.36Å
113	M	95.1	Very high	92.9	Very high	5 Å²	5	14.9 Å²	14.9	3%	0.025	8%	0.084	C	C	.	.	H	α-helix	trans	-70.4	-39.8	-179.5	-64.8	-48.9	101.3	0	0	111.7	L77 V78 L109 D110 T115 A116 S117 W158	L77-M113 HydrophobicContact CB-CG 4.2Å; L77-M113 HydrophobicContact CB-SD 3.52Å; L77-M113 VanDerWaalsContact CB-SD 3.52Å; L77-M113 HydrophobicContact CD1-SD 3.75Å; L77-M113 HydrophobicContact CG-SD 4.3Å; V78-M113 HydrophobicContact CG2-CB 3.34Å; V78-M113 HydrophobicContact CG2-CG 3.9Å; L109-M113 WeakPolarHBondContact O-CB 3.49Å; L109-M113 VanDerWaalsContact O-CG 3.29Å; L109-M113 WeakPolarHBondContact O-CG 3.38Å; L109-M113 PolarHBondContact O-N 3.22Å; D110-M113 PolarHBondContact O-N 3.5Å; M113-T115 VanDerWaalsContact C-N 3.34Å; M113-T115 PolarHBondContact O-N 3.28Å; M113-A116 PolarHBondContact O-N 3.44Å; M113-S117 WeakPolarHBondContact O-CB 2.72Å; M113-S117 PolarHBondContact O-N 3.34Å; M113-S117 PolarHBondContact O-OG 3.3Å; M113-W158 HydrophobicContact CE-CZ3 3.81Å; M113-W158 HydrophobicContact SD-CH2 4.13Å; M113-W158 HydrophobicContact SD-CZ3 3.93Å
114	C	91.9	Very high	92.8	Very high	12 Å²	12	15.3 Å²	15.3	8%	0.081	9%	0.086	C	C	.	.	H	α-helix	trans	-60	-46	173.5	-175.8	0	0	0	0	111.3	D110 V111 S117 I118 W342	D110-C114 WeakPolarHBondContact O-CB 3.18Å; D110-C114 PolarHBondContact O-N 2.91Å; V111-C114 PolarHBondContact O-N 3.1Å; C114-S117 PolarHBondContact O-N 3.14Å; C114-I118 PolarHBondContact O-N 2.92Å; C114-I118 VanDerWaalsContact O-N 3.14Å; C114-W342 HydrophobicContact CB-CH2 4.08Å; C114-W342 HydrophobicContact CB-CZ3 4.45Å; C114-W342 VanDerWaalsContact SG-CH2 3.53Å; C114-W342 VanDerWaalsContact SG-CZ3 3.5Å
115	T	93.9	Very high	92.6	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-62.5	-45	176.7	-54.1	0	0	0	0	111.4	V111 M112 M113 S117 I118 L119 A161 V164 S196	V111-T115 VanDerWaalsContact O-CB 3.27Å; V111-T115 WeakPolarHBondContact O-CB 3.02Å; V111-T115 PolarHBondContact O-N 3.47Å; V111-T115 PolarHBondContact O-OG1 3.4Å; M112-T115 PolarHBondContact O-N 3.47Å; M113-T115 VanDerWaalsContact C-N 3.34Å; M113-T115 PolarHBondContact O-N 3.28Å; T115-S117 VanDerWaalsContact C-N 3.29Å; T115-S117 PolarHBondContact O-N 2.88Å; T115-I118 VanDerWaalsContact O-CG2 3.31Å; T115-I118 WeakPolarHBondContact O-CG2 3.18Å; T115-I118 PolarHBondContact O-N 3.35Å; T115-L119 HydrophobicContact CG2-CD1 3.8Å; T115-L119 HydrophobicContact CG2-CG 4.25Å; T115-L119 VanDerWaalsContact O-CB 3.32Å; T115-L119 WeakPolarHBondContact O-CB 3.33Å; T115-L119 VanDerWaalsContact O-CG 3.23Å; T115-L119 WeakPolarHBondContact O-CG 3.46Å; T115-L119 PolarHBondContact O-N 3.03Å; T115-A161 HydrophobicContact CG2-CB 4.1Å; T115-V164 HydrophobicContact CG2-CB 4.32Å; T115-V164 HydrophobicContact CG2-CG1 4.41Å; T115-S196 VanDerWaalsContact OG1-CB 3.26Å; T115-S196 WeakPolarHBondContact OG1-CB 3.4Å; T115-S196 PolarHBondContact OG1-OG 3.22Å
116	A	95.9	Very high	92.2	Very high	0 Å²	0	14.6 Å²	14.6	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.1	-40.4	176.1	0	0	0	0	0	111.3	A74 M112 M113 L119 N120 W158 A161	A74-A116 HydrophobicContact CB-CB 4.35Å; M112-A116 VanDerWaalsContact O-CB 3.27Å; M112-A116 WeakPolarHBondContact O-CB 3.32Å; M112-A116 PolarHBondContact O-N 2.85Å; M113-A116 PolarHBondContact O-N 3.44Å; A116-L119 PolarHBondContact O-N 2.85Å; A116-N120 VanDerWaalsContact O-CB 3.32Å; A116-N120 WeakPolarHBondContact O-CB 3.19Å; A116-N120 PolarHBondContact O-N 3.32Å; A116-N120 PolarHBondContact O-ND2 2.82Å; A116-W158 HydrophobicContact CB-CE3 4.32Å; A116-W158 HydrophobicContact CB-CH2 4.38Å; A116-W158 HydrophobicContact CB-CZ3 4.14Å; A116-A161 HydrophobicContact CB-CB 3.86Å
117	S	93.3	Very high	91.9	Very high	4 Å²	4	14 Å²	14	3%	0.028	8%	0.076	C	C	.	.	H	α-helix	trans	-62.4	-49.6	178.7	-73	0	0	0	0	112.4	M113 C114 T115 L119 N120 L121	M113-S117 WeakPolarHBondContact O-CB 2.72Å; M113-S117 PolarHBondContact O-N 3.34Å; M113-S117 PolarHBondContact O-OG 3.3Å; C114-S117 PolarHBondContact O-N 3.14Å; T115-S117 VanDerWaalsContact C-N 3.29Å; T115-S117 PolarHBondContact O-N 2.88Å; S117-L119 PolarHBondContact O-N 2.85Å; S117-N120 PolarHBondContact O-N 2.91Å; S117-L121 WeakPolarHBondContact O-CG 3.27Å; S117-L121 PolarHBondContact O-N 2.61Å
118	I	91.2	Very high	91.4	Very high	2 Å²	2	16.3 Å²	16.3	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-67.1	-36.9	178.3	-160	170.7	0	0	0	112.2	C114 T115 L121 C122 S196 F197 P200 F201 F338	C114-I118 PolarHBondContact O-N 2.92Å; C114-I118 VanDerWaalsContact O-N 3.14Å; T115-I118 VanDerWaalsContact O-CG2 3.31Å; T115-I118 WeakPolarHBondContact O-CG2 3.18Å; T115-I118 PolarHBondContact O-N 3.35Å; I118-L121 WeakPolarHBondContact O-CB 3.47Å; I118-L121 PolarHBondContact O-N 2.65Å; I118-C122 PolarHBondContact O-N 2.93Å; I118-C122 PolarHBondContact O-SG 3.36Å; I118-S196 WeakPolarHBondContact CG2-O 3.36Å; I118-F197 HydrophobicContact CD1-CD2 3.98Å; I118-F197 WeakPolarHBondContact CD1-O 3.42Å; I118-P200 HydrophobicContact CD1-CB 3.98Å; I118-P200 HydrophobicContact CG1-CB 4.04Å; I118-P200 HydrophobicContact CG2-CB 3.93Å; I118-P200 HydrophobicContact CG2-CG 4.14Å; I118-F201 HydrophobicContact CD1-CB 4.15Å; I118-F338 HydrophobicContact CB-CE1 4.18Å; I118-F338 HydrophobicContact CB-CE2 4.33Å; I118-F338 HydrophobicContact CB-CZ 3.69Å; I118-F338 HydrophobicContact CD1-CD1 4.45Å; I118-F338 HydrophobicContact CD1-CE1 3.47Å; I118-F338 VanDerWaalsContact CD1-CE1 3.47Å; I118-F338 HydrophobicContact CD1-CZ 3.84Å; I118-F338 HydrophobicContact CG1-CE1 3.73Å; I118-F338 HydrophobicContact CG1-CZ 3.79Å
119	L	93.3	Very high	90.9	Very high	29 Å²	29	20 Å²	20	15%	0.152	10%	0.098	C	C	.	.	H	α-helix	trans	-69.5	-35.3	178.7	-72.4	179.5	0	0	0	111.3	T115 A116 S117 C122 A123 V157 L160 A161 P200	T115-L119 HydrophobicContact CG2-CD1 3.8Å; T115-L119 HydrophobicContact CG2-CG 4.25Å; T115-L119 VanDerWaalsContact O-CB 3.32Å; T115-L119 WeakPolarHBondContact O-CB 3.33Å; T115-L119 VanDerWaalsContact O-CG 3.23Å; T115-L119 WeakPolarHBondContact O-CG 3.46Å; T115-L119 PolarHBondContact O-N 3.03Å; A116-L119 PolarHBondContact O-N 2.85Å; S117-L119 PolarHBondContact O-N 2.85Å; L119-C122 WeakPolarHBondContact O-CB 3.33Å; L119-C122 PolarHBondContact O-N 3.32Å; L119-A123 WeakPolarHBondContact O-CB 3.44Å; L119-A123 PolarHBondContact O-N 3.46Å; L119-V157 HydrophobicContact CB-CB 4.35Å; L119-V157 HydrophobicContact CB-CG1 3.71Å; L119-V157 HydrophobicContact CB-CG2 4.11Å; L119-L160 HydrophobicContact CD1-CB 3.83Å; L119-A161 HydrophobicContact CD1-CB 4.4Å; L119-P200 HydrophobicContact CD2-CB 4.23Å; L119-P200 HydrophobicContact CD2-CG 4.14Å
120	N	93.9	Very high	90.3	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-63.4	-41.5	169.8	-83.9	-65.7	0	0	0	111.1	S70 L71 A116 S117 C122 A123 I124	S70-N120 VanDerWaalsContact CB-OD1 3.3Å; S70-N120 WeakPolarHBondContact CB-OD1 3.28Å; S70-N120 PolarHBondContact OG-OD1 3.16Å; L71-N120 HydrophobicContact CB-CB 4.13Å; L71-N120 HydrophobicContact CD1-CB 4.04Å; A116-N120 VanDerWaalsContact O-CB 3.32Å; A116-N120 WeakPolarHBondContact O-CB 3.19Å; A116-N120 PolarHBondContact O-N 3.32Å; A116-N120 PolarHBondContact O-ND2 2.82Å; S117-N120 PolarHBondContact O-N 2.91Å; N120-C122 VanDerWaalsContact C-N 3.34Å; N120-C122 PolarHBondContact O-N 3.46Å; N120-A123 WeakPolarHBondContact O-CB 3.23Å; N120-A123 PolarHBondContact O-N 3.05Å; N120-I124 VanDerWaalsContact O-CG1 3.28Å; N120-I124 WeakPolarHBondContact O-CG1 3.32Å; N120-I124 PolarHBondContact O-N 3.35Å
121	L	88.9	Confident	89.6	Confident	11 Å²	11	18.4 Å²	18.4	6%	0.058	9%	0.093	C	C	.	.	H	α-helix	trans	-61.1	-41.8	172.7	-68.3	178.2	0	0	0	111.7	L71 S117 I118 A123 I124 S125 V334 F338	L71-L121 HydrophobicContact CD2-CD2 3.84Å; L71-L121 HydrophobicContact CD2-CG 4.49Å; S117-L121 WeakPolarHBondContact O-CG 3.27Å; S117-L121 PolarHBondContact O-N 2.61Å; I118-L121 WeakPolarHBondContact O-CB 3.47Å; I118-L121 PolarHBondContact O-N 2.65Å; L121-A123 PolarHBondContact O-N 3.38Å; L121-I124 PolarHBondContact O-N 3.03Å; L121-S125 WeakPolarHBondContact O-CB 3.29Å; L121-S125 PolarHBondContact O-N 2.87Å; L121-S125 PolarHBondContact O-OG 3.37Å; L121-V334 HydrophobicContact CD2-CG1 3.39Å; L121-F338 HydrophobicContact CD1-CB 3.93Å; L121-F338 HydrophobicContact CD1-CD1 4.45Å; L121-F338 HydrophobicContact CD1-CD2 3.47Å; L121-F338 VanDerWaalsContact CD1-CD2 3.47Å; L121-F338 HydrophobicContact CD1-CE2 4.1Å; L121-F338 HydrophobicContact CD1-CG 3.69Å
122	C	90.1	Very high	88.7	Confident	10 Å²	10	18.3 Å²	18.3	7%	0.068	9%	0.093	C	C	.	.	H	α-helix	trans	-58.5	-47.6	172.5	-63.1	0	0	0	0	111.6	I118 L119 N120 I124 S125 I126 P200 T204	I118-C122 PolarHBondContact O-N 2.93Å; I118-C122 PolarHBondContact O-SG 3.36Å; L119-C122 WeakPolarHBondContact O-CB 3.33Å; L119-C122 PolarHBondContact O-N 3.32Å; N120-C122 VanDerWaalsContact C-N 3.34Å; N120-C122 PolarHBondContact O-N 3.46Å; C122-I124 PolarHBondContact O-N 2.7Å; C122-S125 WeakPolarHBondContact O-CA 3.46Å; C122-S125 VanDerWaalsContact O-CB 3.23Å; C122-S125 WeakPolarHBondContact O-CB 3.27Å; C122-S125 PolarHBondContact O-N 3.1Å; C122-S125 VanDerWaalsContact O-N 3.1Å; C122-I126 WeakPolarHBondContact O-CG1 3.22Å; C122-I126 PolarHBondContact O-N 3.26Å; C122-P200 PolarHBondContact SG-O 2.79Å; C122-T204 HydrophobicContact CB-CG2 4.01Å; C122-T204 WeakPolarHBondContact SG-CG2 3.02Å
123	A	91.3	Very high	87.8	Confident	7 Å²	7	18.9 Å²	18.9	6%	0.058	10%	0.098	C	C	.	.	H	α-helix	trans	-61.2	-44	179.5	0	0	0	0	0	111.8	L67 L119 N120 L121 S125 I126 D127 M153 V157	L67-A123 HydrophobicContact CD1-CB 4.43Å; L67-A123 HydrophobicContact CD2-CB 4.3Å; L119-A123 WeakPolarHBondContact O-CB 3.44Å; L119-A123 PolarHBondContact O-N 3.46Å; N120-A123 WeakPolarHBondContact O-CB 3.23Å; N120-A123 PolarHBondContact O-N 3.05Å; L121-A123 PolarHBondContact O-N 3.38Å; A123-S125 VanDerWaalsContact C-N 3.3Å; A123-S125 PolarHBondContact O-N 3.25Å; A123-I126 PolarHBondContact O-N 3.38Å; A123-D127 WeakPolarHBondContact O-CB 3.4Å; A123-D127 PolarHBondContact O-N 3.3Å; A123-M153 HydrophobicContact CB-CE 3.87Å; A123-M153 VanDerWaalsContact O-CE 3.27Å; A123-M153 WeakPolarHBondContact O-CE 3.45Å; A123-V157 HydrophobicContact CB-CG2 4.03Å
124	I	89.7	Confident	86.7	Confident	9 Å²	9	23.1 Å²	23.1	5%	0.046	12%	0.119	C	C	.	.	H	α-helix	trans	-58.5	-45.5	172.9	-68.1	164.4	0	0	0	109.8	T64 L67 V68 N120 L121 C122 I126 D127 R128 V331	T64-I124 HydrophobicContact CG2-CG2 4.29Å; L67-I124 HydrophobicContact CB-CD1 4.38Å; L67-I124 HydrophobicContact CB-CG1 3.63Å; L67-I124 HydrophobicContact CD1-CG1 4.21Å; V68-I124 HydrophobicContact CG2-CD1 4.13Å; N120-I124 VanDerWaalsContact O-CG1 3.28Å; N120-I124 WeakPolarHBondContact O-CG1 3.32Å; N120-I124 PolarHBondContact O-N 3.35Å; L121-I124 PolarHBondContact O-N 3.03Å; C122-I124 PolarHBondContact O-N 2.7Å; I124-I126 PolarHBondContact O-N 3.49Å; I124-D127 PolarHBondContact O-N 3.34Å; I124-R128 HydrophobicContact CG2-CG 4.31Å; I124-R128 WeakPolarHBondContact O-CB 2.99Å; I124-R128 VanDerWaalsContact O-CG 3.27Å; I124-R128 WeakPolarHBondContact O-CG 3.26Å; I124-R128 PolarHBondContact O-N 2.81Å; I124-V331 HydrophobicContact CG2-CG1 4.43Å
125	S	85.8	Confident	85.7	Confident	1 Å²	1	25 Å²	25	1%	0.007	13%	0.13	C	C	.	.	H	α-helix	trans	-57.9	-46	178.5	-48.4	0	0	0	0	112.4	L121 C122 A123 R128 Y129 Y208	L121-S125 WeakPolarHBondContact O-CB 3.29Å; L121-S125 PolarHBondContact O-N 2.87Å; L121-S125 PolarHBondContact O-OG 3.37Å; C122-S125 WeakPolarHBondContact O-CA 3.46Å; C122-S125 VanDerWaalsContact O-CB 3.23Å; C122-S125 WeakPolarHBondContact O-CB 3.27Å; C122-S125 PolarHBondContact O-N 3.1Å; C122-S125 VanDerWaalsContact O-N 3.1Å; A123-S125 VanDerWaalsContact C-N 3.3Å; A123-S125 PolarHBondContact O-N 3.25Å; S125-R128 PolarHBondContact O-N 3.21Å; S125-Y129 WeakPolarHBondContact O-CB 3.39Å; S125-Y129 PolarHBondContact O-N 3.41Å; S125-Y208 WeakPolarHBondContact CA-OH 3.35Å; S125-Y208 WeakPolarHBondContact CB-OH 3.3Å; S125-Y208 WeakPolarHBondContact OG-CE2 3.4Å; S125-Y208 PolarHBondContact OG-OH 2.96Å
126	I	86.1	Confident	84.5	Confident	75 Å²	75	29.7 Å²	29.7	39%	0.385	16%	0.159	S	C	.	.	H	α-helix	trans	-67.9	-42.2	179.5	-67.2	165.8	0	0	0	111.2	C122 A123 I124 R128 Y129 T130	C122-I126 WeakPolarHBondContact O-CG1 3.22Å; C122-I126 PolarHBondContact O-N 3.26Å; A123-I126 PolarHBondContact O-N 3.38Å; I124-I126 PolarHBondContact O-N 3.49Å; I126-R128 VanDerWaalsContact C-N 3.34Å; I126-R128 PolarHBondContact O-N 2.97Å; I126-Y129 PolarHBondContact O-N 3.1Å; I126-T130 WeakPolarHBondContact O-CB 3.27Å; I126-T130 PolarHBondContact O-N 3.1Å; I126-T130 PolarHBondContact O-OG1 3.45Å
127	D	86.9	Confident	83.1	Confident	1 Å²	1	36.8 Å²	36.8	1%	0.005	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-43.7	175.8	176	72.6	0	0	0	110.9	T64 L67 A123 I124 T130 A131 R149 M153	T64-D127 PolarHBondContact OG1-OD2 3.25Å; L67-D127 HydrophobicContact CD1-CB 3.88Å; A123-D127 WeakPolarHBondContact O-CB 3.4Å; A123-D127 PolarHBondContact O-N 3.3Å; I124-D127 PolarHBondContact O-N 3.34Å; D127-T130 PolarHBondContact O-N 2.89Å; D127-A131 WeakPolarHBondContact O-CB 3.22Å; D127-A131 PolarHBondContact O-N 3.04Å; D127-R149 IonicContact OD1-NH2 2.84Å; D127-R149 PolarHBondContact OD1-NH2 3.31Å; D127-R149 VanDerWaalsContact OD1-NH2 3.1Å; D127-M153 HydrophobicContact CB-CE 4.28Å
128	R	82.4	Confident	82	Confident	54 Å²	54	38.8 Å²	38.8	20%	0.204	20%	0.199	C	C	.	.	H	α-helix	trans	-66.9	-41.9	175.2	-65	-56.6	77.3	-161.6	-12	112.6	T64 I124 S125 I126 T130 A131 V132 Y138 V331	T64-R128 PolarHBondContact OG1-NE 2.85Å; T64-R128 VanDerWaalsContact OG1-NE 3.14Å; T64-R128 PolarHBondContact OG1-NH1 2.96Å; T64-R128 PolarHBondContact OG1-NH2 3.34Å; I124-R128 HydrophobicContact CG2-CG 4.31Å; I124-R128 WeakPolarHBondContact O-CB 2.99Å; I124-R128 VanDerWaalsContact O-CG 3.27Å; I124-R128 WeakPolarHBondContact O-CG 3.26Å; I124-R128 PolarHBondContact O-N 2.81Å; S125-R128 PolarHBondContact O-N 3.21Å; I126-R128 VanDerWaalsContact C-N 3.34Å; I126-R128 PolarHBondContact O-N 2.97Å; R128-T130 VanDerWaalsContact C-N 3.3Å; R128-T130 PolarHBondContact O-N 2.91Å; R128-A131 PolarHBondContact O-N 3.12Å; R128-V132 WeakPolarHBondContact O-CB 3.32Å; R128-V132 WeakPolarHBondContact O-CG2 3.26Å; R128-V132 PolarHBondContact O-N 3.48Å; R128-Y138 PolarHBondContact NH2-OH 3.03Å; R128-V331 HydrophobicContact CG-CG2 4.4Å
129	Y	82.4	Confident	80.8	Confident	82 Å²	82	45.1 Å²	45.1	32%	0.322	23%	0.229	S	C	.	.	H	α-helix	trans	-56	-47.5	174	173.9	-97.6	0	0	0	110.9	S125 I126 A131 V132 V133 V207 R210 I211	S125-Y129 WeakPolarHBondContact O-CB 3.39Å; S125-Y129 PolarHBondContact O-N 3.41Å; I126-Y129 PolarHBondContact O-N 3.1Å; Y129-A131 PolarHBondContact O-N 3.22Å; Y129-V132 PolarHBondContact O-N 3.42Å; Y129-V133 HydrophobicContact CD1-CG2 4.49Å; Y129-V133 HydrophobicContact CD2-CG2 3.68Å; Y129-V133 HydrophobicContact CE1-CB 4.41Å; Y129-V133 HydrophobicContact CE1-CG2 4.22Å; Y129-V133 HydrophobicContact CE2-CB 4.36Å; Y129-V133 HydrophobicContact CE2-CG2 3.36Å; Y129-V133 HydrophobicContact CG-CG2 4.25Å; Y129-V133 WeakPolarHBondContact O-CB 3.31Å; Y129-V133 WeakPolarHBondContact O-CG2 3.32Å; Y129-V133 PolarHBondContact O-N 2.95Å; Y129-V207 HydrophobicContact CD2-CG1 4.4Å; Y129-V207 HydrophobicContact CG-CG1 4.28Å; Y129-R210 HydrophobicContact CE2-CB 4.04Å; Y129-I211 HydrophobicContact CD2-CG1 3.73Å; Y129-I211 HydrophobicContact CG-CG1 4.35Å
130	T	82.7	Confident	79.3	Confident	28 Å²	28	51.8 Å²	51.8	17%	0.172	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-44.8	179.8	-54.6	0	0	0	0	111.3	I126 D127 R128 V132 M134 Y138	I126-T130 WeakPolarHBondContact O-CB 3.27Å; I126-T130 PolarHBondContact O-N 3.1Å; I126-T130 PolarHBondContact O-OG1 3.45Å; D127-T130 PolarHBondContact O-N 2.89Å; R128-T130 VanDerWaalsContact C-N 3.3Å; R128-T130 PolarHBondContact O-N 2.91Å; T130-V132 VanDerWaalsContact C-N 3.33Å; T130-V132 PolarHBondContact O-N 3.45Å; T130-M134 HydrophobicContact CG2-CE 4.15Å; T130-M134 CarbonylContact O-C 3.6Å; T130-M134 WeakPolarHBondContact O-CA 3.28Å; T130-M134 PolarHBondContact O-N 3.32Å; T130-Y138 HydrophobicContact CG2-CD2 4.44Å
131	A	79.4	Confident	77.6	Confident	15 Å²	15	53 Å²	53	12%	0.124	27%	0.271	C	S	.	.	H	α-helix	trans	-61	-41	177.1	0	0	0	0	0	112.5	D127 R128 Y129 Y138	D127-A131 WeakPolarHBondContact O-CB 3.22Å; D127-A131 PolarHBondContact O-N 3.04Å; R128-A131 PolarHBondContact O-N 3.12Å; Y129-A131 PolarHBondContact O-N 3.22Å; A131-Y138 HydrophobicContact CB-CD1 4.21Å; A131-Y138 HydrophobicContact CB-CD2 3.7Å; A131-Y138 HydrophobicContact CB-CE1 4.17Å; A131-Y138 HydrophobicContact CB-CE2 3.63Å; A131-Y138 HydrophobicContact CB-CG 4Å
132	V	74.4	Confident	76	Confident	11 Å²	11	57.1 Å²	57.1	7%	0.067	30%	0.297	C	S	.	.	H	α-helix	trans	-74	-56	179.4	173.3	0	0	0	0	110.3	R128 Y129 T130 V214 L215 R218	R128-V132 WeakPolarHBondContact O-CB 3.32Å; R128-V132 WeakPolarHBondContact O-CG2 3.26Å; R128-V132 PolarHBondContact O-N 3.48Å; Y129-V132 PolarHBondContact O-N 3.42Å; T130-V132 VanDerWaalsContact C-N 3.33Å; T130-V132 PolarHBondContact O-N 3.45Å; V132-V214 HydrophobicContact CG1-CG1 4.49Å; V132-L215 HydrophobicContact CG1-CD2 3.69Å; V132-L215 HydrophobicContact CG1-CG 4.05Å; V132-R218 PolarHBondContact O-NH1 2.98Å; V132-R218 PolarHBondContact O-NH2 2.97Å
133	V	75.6	Confident	74.7	Confident	40 Å²	40	58.8 Å²	58.8	24%	0.242	32%	0.315	C	S	.	.	H	α-helix	trans	-71.2	-40	-171	179.4	0	0	0	0	112.1	Y129 P135 V214 R218	Y129-V133 HydrophobicContact CD1-CG2 4.49Å; Y129-V133 HydrophobicContact CD2-CG2 3.68Å; Y129-V133 HydrophobicContact CE1-CB 4.41Å; Y129-V133 HydrophobicContact CE1-CG2 4.22Å; Y129-V133 HydrophobicContact CE2-CB 4.36Å; Y129-V133 HydrophobicContact CE2-CG2 3.36Å; Y129-V133 HydrophobicContact CG-CG2 4.25Å; Y129-V133 WeakPolarHBondContact O-CB 3.31Å; Y129-V133 WeakPolarHBondContact O-CG2 3.32Å; Y129-V133 PolarHBondContact O-N 2.95Å; V133-P135 VanDerWaalsContact C-CD 3.43Å; V133-P135 WeakPolarHBondContact O-CD 3.18Å; V133-V214 HydrophobicContact CG2-CB 4.48Å; V133-V214 HydrophobicContact CG2-CG1 4.24Å; V133-V214 HydrophobicContact CG2-CG2 4.16Å; V133-R218 PolarHBondContact O-NH2 2.99Å
134	M	72.7	Confident	73.3	Confident	95 Å²	95	67.3 Å²	67.3	47%	0.468	35%	0.354	S	S	.	.			trans	-119.3	66.9	-174.8	-59.1	-159.1	-68	0	0	112.5	T130 V136 H137 Y138	T130-M134 HydrophobicContact CG2-CE 4.15Å; T130-M134 CarbonylContact O-C 3.6Å; T130-M134 WeakPolarHBondContact O-CA 3.28Å; T130-M134 PolarHBondContact O-N 3.32Å; M134-V136 VanDerWaalsContact C-N 3.35Å; M134-V136 PolarHBondContact O-N 2.9Å; M134-H137 HydrophobicContact CB-CB 4.17Å; M134-H137 PolarHBondContact O-N 2.76Å; M134-Y138 WeakPolarHBondContact O-CB 3.43Å; M134-Y138 PolarHBondContact O-N 3.12Å
135	P	70.9	Confident	72.1	Confident	50 Å²	50	70.3 Å²	70.3	33%	0.325	38%	0.376	S	S	.	.	H	α-helix	trans	-64.5	-36.1	-172.6	25.7	-34.1	0	0	0	113.1	V133 Y138 Q139	V133-P135 VanDerWaalsContact C-CD 3.43Å; V133-P135 WeakPolarHBondContact O-CD 3.18Å; P135-Y138 PolarHBondContact O-N 3.24Å; P135-Q139 WeakPolarHBondContact O-CB 3.43Å; P135-Q139 WeakPolarHBondContact O-CG 3.44Å; P135-Q139 PolarHBondContact O-N 3.3Å
136	V	67.9	Low	71.6	Confident	99 Å²	99	71.3 Å²	71.3	60%	0.6	38%	0.383	S	S	*	.	H	α-helix	trans	-69.9	-39.6	-178.8	-178.4	0	0	0	0	111.5	M134 H140	M134-V136 VanDerWaalsContact C-N 3.35Å; M134-V136 PolarHBondContact O-N 2.9Å; V136-H140 PolarHBondContact O-N 3.44Å; V136-H140 PolarHBondContact O-ND1 2.97Å
137	H	66.3	Low	71.4	Confident	149 Å²	149	71.4 Å²	71.4	69%	0.69	39%	0.389	S	S	*	.	H	α-helix	trans	-73.7	-35.1	177.7	-140.7	83.7	0	0	0	111.3	M134 G141	M134-H137 HydrophobicContact CB-CB 4.17Å; M134-H137 PolarHBondContact O-N 2.76Å; H137-G141 PolarHBondContact O-N 3.19Å
138	Y	70.8	Confident	71.4	Confident	47 Å²	47	80.3 Å²	80.3	18%	0.184	42%	0.423	C	S	.	.	H	α-helix	trans	-67.2	-38.2	174.6	-170.8	-87.2	0	0	0	112.3	T63 R128 T130 A131 M134 P135	T63-Y138 PolarHBondContact OG1-OH 3.15Å; R128-Y138 PolarHBondContact NH2-OH 3.03Å; T130-Y138 HydrophobicContact CG2-CD2 4.44Å; A131-Y138 HydrophobicContact CB-CD1 4.21Å; A131-Y138 HydrophobicContact CB-CD2 3.7Å; A131-Y138 HydrophobicContact CB-CE1 4.17Å; A131-Y138 HydrophobicContact CB-CE2 3.63Å; A131-Y138 HydrophobicContact CB-CG 4Å; M134-Y138 WeakPolarHBondContact O-CB 3.43Å; M134-Y138 PolarHBondContact O-N 3.12Å; P135-Y138 PolarHBondContact O-N 3.24Å
139	Q	65.9	Low	71.6	Confident	135 Å²	135	81.8 Å²	81.8	63%	0.631	43%	0.428	S	S	*	.	H	α-helix	trans	-75.6	-34.2	176.8	-75.7	-178.3	-39.3	0	0	113.9	P135 G141 T142	P135-Q139 WeakPolarHBondContact O-CB 3.43Å; P135-Q139 WeakPolarHBondContact O-CG 3.44Å; P135-Q139 PolarHBondContact O-N 3.3Å; Q139-G141 VanDerWaalsContact C-N 3.29Å; Q139-T142 PolarHBondContact O-OG1 3.07Å
140	H	61.1	Low	72	Confident	169 Å²	169	78.1 Å²	78.1	78%	0.782	41%	0.414	S	S	*	.	H	α-helix	trans	-74.4	-19.8	175	-91.7	82.8	0	0	0	113.4	V136	V136-H140 PolarHBondContact O-N 3.44Å; V136-H140 PolarHBondContact O-ND1 2.97Å
141	G	59	Low	72.4	Confident	24 Å²	24	79.1 Å²	79.1	25%	0.247	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	4.9	176.9	0	0	0	0	0	115.1	H137 Q139 G143 S145 S146	H137-G141 PolarHBondContact O-N 3.19Å; Q139-G141 VanDerWaalsContact C-N 3.29Å; G141-G143 PolarHBondContact O-N 3.25Å; G141-S145 PolarHBondContact O-OG 3.01Å; G141-S146 WeakPolarHBondContact O-CB 3.43Å
142	T	53.9	Low	73.1	Confident	99 Å²	99	83.6 Å²	83.6	61%	0.607	45%	0.447	S	S	*	.			trans	-76.9	118.1	-177.7	49.7	0	0	0	0	111.6	Q139	Q139-T142 PolarHBondContact O-OG1 3.07Å
143	G	63.4	Low	74	Confident	44 Å²	44	84.9 Å²	84.9	45%	0.454	45%	0.453	S	S	.	.	S	Bend	trans	148.9	-149.3	-176.2	0	0	0	0	0	112	G141 S145 S146	G141-G143 PolarHBondContact O-N 3.25Å; G143-S145 VanDerWaalsContact C-N 3.31Å; G143-S145 PolarHBondContact O-N 3.46Å; G143-S146 PolarHBondContact N-OG 3.4Å; G143-S146 PolarHBondContact O-N 3.13Å; G143-S146 VanDerWaalsContact O-N 3.17Å; G143-S146 PolarHBondContact O-OG 2.79Å
144	Q	61.8	Low	75	Confident	187 Å²	187	84.9 Å²	84.9	87%	0.874	45%	0.451	S	S	*	.	H	α-helix	trans	-58.4	-36.1	179.3	-111.9	167.2	-17.7	0	0	113.9	S146 C147 R148	Q144-S146 VanDerWaalsContact C-N 3.31Å; Q144-S146 PolarHBondContact O-N 3.2Å; Q144-C147 PolarHBondContact O-N 2.97Å; Q144-R148 PolarHBondContact O-N 3.28Å; Q144-R148 VanDerWaalsContact O-N 3.15Å
145	S	64.4	Low	76.1	Confident	71 Å²	71	84.2 Å²	84.2	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-65.2	-32.3	178	55.5	0	0	0	0	112.9	G141 G143 R149	G141-S145 PolarHBondContact O-OG 3.01Å; G143-S145 VanDerWaalsContact C-N 3.31Å; G143-S145 PolarHBondContact O-N 3.46Å; S145-R149 WeakPolarHBondContact O-CB 3.2Å; S145-R149 PolarHBondContact O-N 3.42Å
146	S	76.3	Confident	77.3	Confident	23 Å²	23	84 Å²	84	16%	0.161	46%	0.455	C	S	.	.	H	α-helix	trans	-69.1	-38.7	175.6	70.9	0	0	0	0	112.8	G141 G143 Q144 R149 V150	G141-S146 WeakPolarHBondContact O-CB 3.43Å; G143-S146 PolarHBondContact N-OG 3.4Å; G143-S146 PolarHBondContact O-N 3.13Å; G143-S146 VanDerWaalsContact O-N 3.17Å; G143-S146 PolarHBondContact O-OG 2.79Å; Q144-S146 VanDerWaalsContact C-N 3.31Å; Q144-S146 PolarHBondContact O-N 3.2Å; S146-R149 PolarHBondContact O-N 3.34Å; S146-V150 WeakPolarHBondContact O-CG2 3.12Å; S146-V150 PolarHBondContact O-N 2.96Å
147	C	80.8	Confident	78.7	Confident	76 Å²	76	79.8 Å²	79.8	51%	0.514	43%	0.429	S	S	.	.	H	α-helix	trans	-67.5	-43.9	177.2	-163.6	0	0	0	0	110.7	Q144 R149 V150 A151	Q144-C147 PolarHBondContact O-N 2.97Å; C147-R149 VanDerWaalsContact C-N 3.32Å; C147-R149 PolarHBondContact O-N 2.97Å; C147-V150 PolarHBondContact O-N 3.14Å; C147-A151 WeakPolarHBondContact O-CB 3.39Å; C147-A151 PolarHBondContact O-N 3.34Å
148	R	86.7	Confident	80.2	Confident	189 Å²	189	75.4 Å²	75.4	71%	0.713	41%	0.407	S	S	*	.	H	α-helix	trans	-58.7	-42.7	173.6	-167	177.9	81.5	179.7	5.6	111.9	Q144 A151 L152	Q144-R148 PolarHBondContact O-N 3.28Å; Q144-R148 VanDerWaalsContact O-N 3.15Å; R148-A151 PolarHBondContact O-N 2.67Å; R148-L152 HydrophobicContact CG-CD1 4.29Å; R148-L152 WeakPolarHBondContact O-CB 3.41Å; R148-L152 VanDerWaalsContact O-CG 3.29Å; R148-L152 WeakPolarHBondContact O-CG 3.5Å; R148-L152 PolarHBondContact O-N 3.43Å
149	R	88.1	Confident	81.5	Confident	85 Å²	85	77.4 Å²	77.4	32%	0.321	42%	0.424	S	S	.	.	H	α-helix	trans	-61.1	-48.1	176.5	-173.1	-176.5	76.4	-172.5	4.1	111.7	D127 S145 S146 C147 L152 M153	D127-R149 IonicContact OD1-NH2 2.84Å; D127-R149 PolarHBondContact OD1-NH2 3.31Å; D127-R149 VanDerWaalsContact OD1-NH2 3.1Å; S145-R149 WeakPolarHBondContact O-CB 3.2Å; S145-R149 PolarHBondContact O-N 3.42Å; S146-R149 PolarHBondContact O-N 3.34Å; C147-R149 VanDerWaalsContact C-N 3.32Å; C147-R149 PolarHBondContact O-N 2.97Å; R149-L152 PolarHBondContact O-N 3.14Å; R149-M153 HydrophobicContact CG-SD 4.29Å; R149-M153 VanDerWaalsContact O-CG 3.31Å; R149-M153 WeakPolarHBondContact O-CG 3.43Å; R149-M153 PolarHBondContact O-N 3.34Å
150	V	89.8	Confident	82.9	Confident	5 Å²	5	75.6 Å²	75.6	3%	0.03	42%	0.418	C	S	.	.	H	α-helix	trans	-65.1	-43.2	179.3	173.6	0	0	0	0	111.3	T63 L67 S146 C147 L152 M153 I154	T63-V150 HydrophobicContact CG2-CG2 3.73Å; L67-V150 HydrophobicContact CD2-CG1 4.17Å; L67-V150 HydrophobicContact CG-CG1 4.31Å; S146-V150 WeakPolarHBondContact O-CG2 3.12Å; S146-V150 PolarHBondContact O-N 2.96Å; C147-V150 PolarHBondContact O-N 3.14Å; V150-L152 VanDerWaalsContact C-N 3.31Å; V150-L152 PolarHBondContact O-N 2.8Å; V150-M153 WeakPolarHBondContact O-CB 3.22Å; V150-M153 PolarHBondContact O-N 3.38Å; V150-M153 VanDerWaalsContact O-N 3.14Å; V150-I154 HydrophobicContact CG1-CD1 3.78Å; V150-I154 HydrophobicContact CG1-CG1 4.29Å; V150-I154 WeakPolarHBondContact O-CG1 3.23Å; V150-I154 PolarHBondContact O-N 2.81Å
151	A	91.1	Very high	84.6	Confident	49 Å²	49	67.6 Å²	67.6	41%	0.405	38%	0.38	S	S	.	.	H	α-helix	trans	-59.2	-42.4	175.8	0	0	0	0	0	111.8	C147 R148 I154 T155	C147-A151 WeakPolarHBondContact O-CB 3.39Å; C147-A151 PolarHBondContact O-N 3.34Å; R148-A151 PolarHBondContact O-N 2.67Å; A151-I154 PolarHBondContact O-N 3.44Å; A151-T155 WeakPolarHBondContact O-CB 3.24Å; A151-T155 PolarHBondContact O-N 3Å; A151-T155 PolarHBondContact O-OG1 3.46Å
152	L	93.8	Very high	86.3	Confident	109 Å²	109	71.3 Å²	71.3	57%	0.571	39%	0.39	S	S	*	.	H	α-helix	trans	-63.4	-42.2	173.6	-75.2	170.2	0	0	0	112.2	R148 R149 V150 T155 A156	R148-L152 HydrophobicContact CG-CD1 4.29Å; R148-L152 WeakPolarHBondContact O-CB 3.41Å; R148-L152 VanDerWaalsContact O-CG 3.29Å; R148-L152 WeakPolarHBondContact O-CG 3.5Å; R148-L152 PolarHBondContact O-N 3.43Å; R149-L152 PolarHBondContact O-N 3.14Å; V150-L152 VanDerWaalsContact C-N 3.31Å; V150-L152 PolarHBondContact O-N 2.8Å; L152-T155 PolarHBondContact O-N 2.85Å; L152-A156 VanDerWaalsContact O-CB 3.26Å; L152-A156 WeakPolarHBondContact O-CB 3.42Å; L152-A156 PolarHBondContact O-N 3.26Å
153	M	93.9	Very high	88.2	Confident	38 Å²	38	69 Å²	69	19%	0.187	38%	0.38	C	S	.	.	H	α-helix	trans	-61.7	-47.3	176.1	-70.8	174.3	69.4	0	0	111.5	L67 A123 D127 R149 V150 A156 V157	L67-M153 HydrophobicContact CD1-CE 4.1Å; L67-M153 HydrophobicContact CD2-CB 4.31Å; A123-M153 HydrophobicContact CB-CE 3.87Å; A123-M153 VanDerWaalsContact O-CE 3.27Å; A123-M153 WeakPolarHBondContact O-CE 3.45Å; D127-M153 HydrophobicContact CB-CE 4.28Å; R149-M153 HydrophobicContact CG-SD 4.29Å; R149-M153 VanDerWaalsContact O-CG 3.31Å; R149-M153 WeakPolarHBondContact O-CG 3.43Å; R149-M153 PolarHBondContact O-N 3.34Å; V150-M153 WeakPolarHBondContact O-CB 3.22Å; V150-M153 PolarHBondContact O-N 3.38Å; V150-M153 VanDerWaalsContact O-N 3.14Å; M153-A156 PolarHBondContact O-N 2.97Å; M153-V157 VanDerWaalsContact O-CG2 3.29Å; M153-V157 WeakPolarHBondContact O-CG2 3.33Å; M153-V157 PolarHBondContact O-N 2.88Å
154	I	96.3	Very high	89.6	Confident	40 Å²	40	67.5 Å²	67.5	21%	0.205	36%	0.363	C	S	.	.	H	α-helix	trans	-61.2	-49.9	177.4	-67.7	171.6	0	0	0	109.9	L67 V150 A151 A156 V157 W158	L67-I154 HydrophobicContact CD2-CD1 4.33Å; L67-I154 HydrophobicContact CD2-CG1 3.69Å; V150-I154 HydrophobicContact CG1-CD1 3.78Å; V150-I154 HydrophobicContact CG1-CG1 4.29Å; V150-I154 WeakPolarHBondContact O-CG1 3.23Å; V150-I154 PolarHBondContact O-N 2.81Å; A151-I154 PolarHBondContact O-N 3.44Å; I154-A156 VanDerWaalsContact C-N 3.32Å; I154-A156 PolarHBondContact O-N 3Å; I154-V157 WeakPolarHBondContact O-CB 3.47Å; I154-V157 PolarHBondContact O-N 3.03Å; I154-V157 VanDerWaalsContact O-N 3.12Å; I154-W158 PolarHBondContact O-N 3.21Å
155	T	96.8	Very high	91	Very high	80 Å²	80	58.6 Å²	58.6	49%	0.491	32%	0.321	S	S	.	.	H	α-helix	trans	-58.3	-45.1	179.3	-54.5	0	0	0	0	111.2	A151 L152 V157 W158 V159	A151-T155 WeakPolarHBondContact O-CB 3.24Å; A151-T155 PolarHBondContact O-N 3Å; A151-T155 PolarHBondContact O-OG1 3.46Å; L152-T155 PolarHBondContact O-N 2.85Å; T155-V157 VanDerWaalsContact C-N 3.34Å; T155-V157 PolarHBondContact O-N 3.47Å; T155-W158 PolarHBondContact O-N 3.36Å; T155-V159 HydrophobicContact CG2-CG2 4.19Å; T155-V159 WeakPolarHBondContact O-CB 3.37Å; T155-V159 VanDerWaalsContact O-CG2 3.27Å; T155-V159 WeakPolarHBondContact O-CG2 3.48Å; T155-V159 PolarHBondContact O-N 3.22Å
156	A	96.3	Very high	92.3	Very high	47 Å²	47	56.6 Å²	56.6	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-61.2	-42.2	176.9	0	0	0	0	0	112	L152 M153 I154 L160	L152-A156 VanDerWaalsContact O-CB 3.26Å; L152-A156 WeakPolarHBondContact O-CB 3.42Å; L152-A156 PolarHBondContact O-N 3.26Å; M153-A156 PolarHBondContact O-N 2.97Å; I154-A156 VanDerWaalsContact C-N 3.32Å; I154-A156 PolarHBondContact O-N 3Å; A156-L160 VanDerWaalsContact O-CB 3.23Å; A156-L160 WeakPolarHBondContact O-CB 3.31Å; A156-L160 WeakPolarHBondContact O-CG 3.4Å; A156-L160 PolarHBondContact O-N 2.74Å
157	V	96.6	Very high	93	Very high	10 Å²	10	56.8 Å²	56.8	6%	0.061	31%	0.307	C	S	.	.	H	α-helix	trans	-58.4	-49.4	176	165.7	0	0	0	0	111.2	L119 A123 M153 I154 T155 A161	L119-V157 HydrophobicContact CB-CB 4.35Å; L119-V157 HydrophobicContact CB-CG1 3.71Å; L119-V157 HydrophobicContact CB-CG2 4.11Å; A123-V157 HydrophobicContact CB-CG2 4.03Å; M153-V157 VanDerWaalsContact O-CG2 3.29Å; M153-V157 WeakPolarHBondContact O-CG2 3.33Å; M153-V157 PolarHBondContact O-N 2.88Å; I154-V157 WeakPolarHBondContact O-CB 3.47Å; I154-V157 PolarHBondContact O-N 3.03Å; I154-V157 VanDerWaalsContact O-N 3.12Å; T155-V157 VanDerWaalsContact C-N 3.34Å; T155-V157 PolarHBondContact O-N 3.47Å; V157-A161 VanDerWaalsContact O-CB 3.29Å; V157-A161 WeakPolarHBondContact O-CB 3.27Å; V157-A161 PolarHBondContact O-N 2.84Å
158	W	98	Very high	93.3	Very high	57 Å²	57	53.2 Å²	53.2	22%	0.216	28%	0.283	C	S	.	.	H	α-helix	trans	-68.8	-40.2	-178.2	-74.1	102.8	0	0	0	112.9	S70 V73 A74 L77 M112 M113 A116 I154 T155 A161 F162	S70-W158 PolarHBondContact OG-NE1 3.47Å; V73-W158 HydrophobicContact CG1-CH2 4.49Å; V73-W158 HydrophobicContact CG1-CZ2 4.22Å; A74-W158 HydrophobicContact CB-CH2 3.97Å; A74-W158 HydrophobicContact CB-CZ2 4.28Å; L77-W158 HydrophobicContact CD1-CH2 3.83Å; L77-W158 HydrophobicContact CD1-CZ3 4.19Å; M112-W158 HydrophobicContact CE-CE3 3.78Å; M112-W158 HydrophobicContact CE-CZ3 4.12Å; M113-W158 HydrophobicContact CE-CZ3 3.81Å; M113-W158 HydrophobicContact SD-CH2 4.13Å; M113-W158 HydrophobicContact SD-CZ3 3.93Å; A116-W158 HydrophobicContact CB-CE3 4.32Å; A116-W158 HydrophobicContact CB-CH2 4.38Å; A116-W158 HydrophobicContact CB-CZ3 4.14Å; I154-W158 PolarHBondContact O-N 3.21Å; T155-W158 PolarHBondContact O-N 3.36Å; W158-A161 PolarHBondContact O-N 3.49Å; W158-F162 WeakPolarHBondContact O-CB 3.5Å; W158-F162 PolarHBondContact O-N 3.27Å
159	V	97.4	Very high	93.3	Very high	89 Å²	89	47.5 Å²	47.5	54%	0.539	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-44.5	176.3	170.4	0	0	0	0	110.9	T155 F162 A163	T155-V159 HydrophobicContact CG2-CG2 4.19Å; T155-V159 WeakPolarHBondContact O-CB 3.37Å; T155-V159 VanDerWaalsContact O-CG2 3.27Å; T155-V159 WeakPolarHBondContact O-CG2 3.48Å; T155-V159 PolarHBondContact O-N 3.22Å; V159-F162 PolarHBondContact O-N 3.29Å; V159-A163 WeakPolarHBondContact O-CB 3.07Å; V159-A163 PolarHBondContact O-N 3.17Å
160	L	95.3	Very high	93.2	Very high	97 Å²	97	51 Å²	51	51%	0.508	29%	0.285	S	S	.	.	H	α-helix	trans	-64.3	-44.1	176.4	-72.4	171.2	0	0	0	111.2	L119 A156 F162 A163 V164	L119-L160 HydrophobicContact CD1-CB 3.83Å; A156-L160 VanDerWaalsContact O-CB 3.23Å; A156-L160 WeakPolarHBondContact O-CB 3.31Å; A156-L160 WeakPolarHBondContact O-CG 3.4Å; A156-L160 PolarHBondContact O-N 2.74Å; L160-F162 VanDerWaalsContact C-N 3.33Å; L160-F162 PolarHBondContact O-N 3.42Å; L160-A163 PolarHBondContact O-N 3.46Å; L160-V164 VanDerWaalsContact O-CG2 3.26Å; L160-V164 WeakPolarHBondContact O-CG2 3.5Å; L160-V164 PolarHBondContact O-N 3.06Å
161	A	96.5	Very high	92.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.1	-44.5	176.5	0	0	0	0	0	111.9	M112 T115 A116 L119 V157 W158 V164 S165	M112-A161 HydrophobicContact CG-CB 4.15Å; T115-A161 HydrophobicContact CG2-CB 4.1Å; A116-A161 HydrophobicContact CB-CB 3.86Å; L119-A161 HydrophobicContact CD1-CB 4.4Å; V157-A161 VanDerWaalsContact O-CB 3.29Å; V157-A161 WeakPolarHBondContact O-CB 3.27Å; V157-A161 PolarHBondContact O-N 2.84Å; W158-A161 PolarHBondContact O-N 3.49Å; A161-V164 PolarHBondContact O-N 3.45Å; A161-S165 PolarHBondContact O-N 3.38Å; A161-S165 PolarHBondContact O-OG 2.92Å; A161-S165 VanDerWaalsContact O-OG 3.12Å
162	F	95.6	Very high	91.8	Very high	103 Å²	103	55.8 Å²	55.8	45%	0.452	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-44.8	175.5	179.8	-104.9	0	0	0	112.1	M112 W158 V159 L160 V164 S165 C166 L169	M112-F162 HydrophobicContact CE-CB 4.07Å; M112-F162 HydrophobicContact CE-CD2 4.49Å; M112-F162 HydrophobicContact SD-CB 4.31Å; M112-F162 HydrophobicContact SD-CD2 4.04Å; W158-F162 WeakPolarHBondContact O-CB 3.5Å; W158-F162 PolarHBondContact O-N 3.27Å; V159-F162 PolarHBondContact O-N 3.29Å; L160-F162 VanDerWaalsContact C-N 3.33Å; L160-F162 PolarHBondContact O-N 3.42Å; F162-V164 VanDerWaalsContact C-N 3.27Å; F162-V164 PolarHBondContact O-N 3.19Å; F162-S165 PolarHBondContact O-N 2.7Å; F162-C166 HydrophobicContact CE1-CB 4.18Å; F162-C166 HydrophobicContact CZ-CB 4.17Å; F162-C166 VanDerWaalsContact O-CB 3.28Å; F162-C166 WeakPolarHBondContact O-CB 3.49Å; F162-C166 PolarHBondContact O-N 2.92Å; F162-L169 HydrophobicContact CE2-CD1 4.36Å
163	A	93.8	Very high	90.9	Very high	49 Å²	49	51.3 Å²	51.3	41%	0.405	29%	0.285	S	S	.	.	H	α-helix	trans	-62.1	-34.3	-179.7	0	0	0	0	0	112.9	V159 L160 C166	V159-A163 WeakPolarHBondContact O-CB 3.07Å; V159-A163 PolarHBondContact O-N 3.17Å; L160-A163 PolarHBondContact O-N 3.46Å; A163-C166 PolarHBondContact O-SG 3.25Å; A163-C166 VanDerWaalsContact O-SG 3.34Å
164	V	91.6	Very high	89.6	Confident	14 Å²	14	53.5 Å²	53.5	9%	0.085	30%	0.3	C	S	.	.	H	α-helix	trans	-71	-39.3	176.7	174.1	0	0	0	0	111.4	T115 L160 A161 F162 P167 V195 S196	T115-V164 HydrophobicContact CG2-CB 4.32Å; T115-V164 HydrophobicContact CG2-CG1 4.41Å; L160-V164 VanDerWaalsContact O-CG2 3.26Å; L160-V164 WeakPolarHBondContact O-CG2 3.5Å; L160-V164 PolarHBondContact O-N 3.06Å; A161-V164 PolarHBondContact O-N 3.45Å; F162-V164 VanDerWaalsContact C-N 3.27Å; F162-V164 PolarHBondContact O-N 3.19Å; V164-P167 VanDerWaalsContact O-CD 3.32Å; V164-P167 WeakPolarHBondContact O-CD 3.42Å; V164-V195 HydrophobicContact CB-CG1 4.38Å; V164-V195 HydrophobicContact CG1-CB 4.27Å; V164-V195 HydrophobicContact CG1-CG1 3.91Å; V164-V195 HydrophobicContact CG2-CG1 3.47Å; V164-V195 VanDerWaalsContact CG2-CG1 3.47Å; V164-S196 VanDerWaalsContact CG1-OG 3.23Å; V164-S196 WeakPolarHBondContact CG1-OG 3.36Å
165	S	92.6	Very high	88.4	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-86.4	-22.1	-177	-52.5	0	0	0	0	114.4	V111 M112 A161 F162 P167 L168	V111-S165 WeakPolarHBondContact CG1-OG 3.21Å; M112-S165 WeakPolarHBondContact CA-OG 3.2Å; M112-S165 WeakPolarHBondContact CB-OG 3.47Å; M112-S165 PolarHBondContact N-OG 3.36Å; A161-S165 PolarHBondContact O-N 3.38Å; A161-S165 PolarHBondContact O-OG 2.92Å; A161-S165 VanDerWaalsContact O-OG 3.12Å; F162-S165 PolarHBondContact O-N 2.7Å; S165-P167 VanDerWaalsContact C-N 3.33Å; S165-P167 WeakPolarHBondContact O-CD 3.47Å; S165-L168 WeakPolarHBondContact O-CB 3.44Å; S165-L168 PolarHBondContact O-N 3.07Å
166	C	91.2	Very high	87.1	Confident	29 Å²	29	52.8 Å²	52.8	20%	0.196	32%	0.316	C	S	.	.	G	3₁₀ helix	trans	-58.1	-28.9	-173.2	77.6	0	0	0	0	116	F162 A163 L168 L169 F170	F162-C166 HydrophobicContact CE1-CB 4.18Å; F162-C166 HydrophobicContact CZ-CB 4.17Å; F162-C166 VanDerWaalsContact O-CB 3.28Å; F162-C166 WeakPolarHBondContact O-CB 3.49Å; F162-C166 PolarHBondContact O-N 2.92Å; A163-C166 PolarHBondContact O-SG 3.25Å; A163-C166 VanDerWaalsContact O-SG 3.34Å; C166-L168 PolarHBondContact O-N 3.04Å; C166-L168 VanDerWaalsContact O-N 3.11Å; C166-L169 WeakPolarHBondContact O-CB 3.44Å; C166-L169 PolarHBondContact O-N 3.47Å; C166-F170 HydrophobicContact CB-CE2 4.32Å; C166-F170 WeakPolarHBondContact O-CD2 3.36Å
167	P	90.4	Very high	86.3	Confident	26 Å²	26	54.1 Å²	54.1	17%	0.169	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-58	-28.6	178.3	-24.5	35.6	0	0	0	113	V164 S165 L169 F170 F172 F188	V164-P167 VanDerWaalsContact O-CD 3.32Å; V164-P167 WeakPolarHBondContact O-CD 3.42Å; S165-P167 VanDerWaalsContact C-N 3.33Å; S165-P167 WeakPolarHBondContact O-CD 3.47Å; P167-L169 VanDerWaalsContact C-N 3.28Å; P167-L169 PolarHBondContact O-N 3.43Å; P167-F170 PolarHBondContact O-N 3.43Å; P167-F170 VanDerWaalsContact O-N 3.11Å; P167-F172 HydrophobicContact CB-CD2 4.03Å; P167-F172 HydrophobicContact CB-CE2 4.47Å; P167-F172 HydrophobicContact CB-CG 4.24Å; P167-F172 WeakPolarHBondContact O-CB 3.31Å; P167-F172 WeakPolarHBondContact O-CD2 3.38Å; P167-F188 HydrophobicContact CB-CD2 4.46Å; P167-F188 HydrophobicContact CB-CE2 3.94Å; P167-F188 HydrophobicContact CG-CE2 4.29Å
168	L	86.9	Confident	85.6	Confident	1 Å²	1	57.8 Å²	57.8	1%	0.005	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-61.9	-33.8	177.1	-69.8	164.5	0	0	0	113	V107 T108 V111 S165 C166 F170 G171 N173 F188	V107-L168 HydrophobicContact CG1-CD1 3.99Å; V107-L168 HydrophobicContact CG1-CD2 4.3Å; T108-L168 VanDerWaalsContact OG1-CB 3.31Å; T108-L168 WeakPolarHBondContact OG1-CB 3.08Å; V111-L168 HydrophobicContact CB-CD1 4.21Å; V111-L168 HydrophobicContact CG2-CD1 3.91Å; S165-L168 WeakPolarHBondContact O-CB 3.44Å; S165-L168 PolarHBondContact O-N 3.07Å; C166-L168 PolarHBondContact O-N 3.04Å; C166-L168 VanDerWaalsContact O-N 3.11Å; L168-F170 PolarHBondContact O-N 3.03Å; L168-G171 PolarHBondContact O-N 3.29Å; L168-N173 HydrophobicContact CD2-CB 4.44Å; L168-F188 HydrophobicContact CD1-CE1 3.71Å; L168-F188 HydrophobicContact CD1-CZ 3.63Å; L168-F188 HydrophobicContact CD2-CD1 3.83Å; L168-F188 HydrophobicContact CD2-CE1 3.41Å; L168-F188 VanDerWaalsContact CD2-CE1 3.41Å; L168-F188 HydrophobicContact CD2-CE2 4.3Å; L168-F188 HydrophobicContact CD2-CG 4.44Å; L168-F188 HydrophobicContact CD2-CZ 3.69Å; L168-F188 HydrophobicContact CG-CD1 4.43Å; L168-F188 HydrophobicContact CG-CE1 3.59Å; L168-F188 HydrophobicContact CG-CE2 4.04Å; L168-F188 HydrophobicContact CG-CZ 3.36Å
169	L	86.6	Confident	85	Confident	70 Å²	70	57.7 Å²	57.7	37%	0.366	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-70.9	-20.5	177.5	-65.6	175.9	0	0	0	113.1	V105 T108 F162 C166 P167	V105-L169 HydrophobicContact CG2-CD2 4.14Å; T108-L169 HydrophobicContact CG2-CD1 4.03Å; T108-L169 HydrophobicContact CG2-CD2 4.09Å; T108-L169 HydrophobicContact CG2-CG 3.78Å; T108-L169 WeakPolarHBondContact OG1-CD2 3.13Å; T108-L169 WeakPolarHBondContact OG1-CG 3.27Å; F162-L169 HydrophobicContact CE2-CD1 4.36Å; C166-L169 WeakPolarHBondContact O-CB 3.44Å; C166-L169 PolarHBondContact O-N 3.47Å; P167-L169 VanDerWaalsContact C-N 3.28Å; P167-L169 PolarHBondContact O-N 3.43Å
170	F	86.4	Confident	84.5	Confident	159 Å²	159	56.2 Å²	56.2	70%	0.697	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-99.6	23.6	-178.3	-58.3	-69.3	0	0	0	112.6	C166 P167 L168	C166-F170 HydrophobicContact CB-CE2 4.32Å; C166-F170 WeakPolarHBondContact O-CD2 3.36Å; P167-F170 PolarHBondContact O-N 3.43Å; P167-F170 VanDerWaalsContact O-N 3.11Å; L168-F170 PolarHBondContact O-N 3.03Å
171	G	74	Confident	84.2	Confident	43 Å²	43	52.1 Å²	52.1	44%	0.443	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.7	15.1	170.3	0	0	0	0	0	115.5	L168 N173	L168-G171 PolarHBondContact O-N 3.29Å; G171-N173 PolarHBondContact O-N 3.32Å
172	F	78.1	Confident	83.6	Confident	111 Å²	111	54.2 Å²	54.2	49%	0.487	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-6	170.1	-78.2	-101.2	0	0	0	113.1	P167 T174 N185 F188	P167-F172 HydrophobicContact CB-CD2 4.03Å; P167-F172 HydrophobicContact CB-CE2 4.47Å; P167-F172 HydrophobicContact CB-CG 4.24Å; P167-F172 WeakPolarHBondContact O-CB 3.31Å; P167-F172 WeakPolarHBondContact O-CD2 3.38Å; F172-T174 VanDerWaalsContact C-N 3.3Å; F172-T174 PolarHBondContact O-N 3.08Å; F172-T174 VanDerWaalsContact O-N 3.12Å; F172-N185 WeakPolarHBondContact O-CB 3.5Å; F172-F188 HydrophobicContact CB-CD2 4.46Å
173	N	74	Confident	83	Confident	14 Å²	14	50.5 Å²	50.5	8%	0.075	32%	0.316	C	S	.	.			trans	-83.2	69.6	171.1	-169.4	17.8	0	0	0	111.4	D104 L168 G171 T175 S182	D104-N173 WeakPolarHBondContact OD1-CB 3.27Å; D104-N173 PolarHBondContact OD1-ND2 3.29Å; L168-N173 HydrophobicContact CD2-CB 4.44Å; G171-N173 PolarHBondContact O-N 3.32Å; N173-T175 PolarHBondContact O-N 3.21Å; N173-T175 VanDerWaalsContact O-N 3.08Å; N173-S182 PolarHBondContact OD1-O 2.89Å; N173-S182 VanDerWaalsContact OD1-O 3.11Å
174	T	66.7	Low	82.4	Confident	84 Å²	84	50.8 Å²	50.8	52%	0.515	32%	0.315	S	S	.	.			trans	-83.7	77.2	-178.9	54.2	0	0	0	0	111	F172	F172-T174 VanDerWaalsContact C-N 3.3Å; F172-T174 PolarHBondContact O-N 3.08Å; F172-T174 VanDerWaalsContact O-N 3.12Å
175	T	71	Confident	82.1	Confident	16 Å²	16	51.4 Å²	51.4	10%	0.098	32%	0.318	C	S	.	.			trans	-84.6	128.5	168.9	43.6	0	0	0	0	110.2	R100 N173 D177 S182	R100-T175 PolarHBondContact NH1-OG1 3.11Å; R100-T175 PolarHBondContact NH2-O 3.27Å; R100-T175 PolarHBondContact NH2-OG1 2.76Å; N173-T175 PolarHBondContact O-N 3.21Å; N173-T175 VanDerWaalsContact O-N 3.08Å; T175-D177 PolarHBondContact O-N 3.5Å; T175-S182 WeakPolarHBondContact CG2-O 3.48Å
176	G	69.6	Low	81.7	Confident	90 Å²	90	54.2 Å²	54.2	93%	0.928	34%	0.336	S	S	*	.	S	Bend	trans	-68.7	-19.9	178.5	0	0	0	0	0	114.1
177	D	79.3	Confident	81.6	Confident	75 Å²	75	58.8 Å²	58.8	40%	0.401	36%	0.358	S	S	.	.	S	Bend	trans	-118.7	125.2	-178.5	-170.7	-30.6	0	0	0	111.3	R100 T175 T179 V180	R100-D177 VanDerWaalsContact CZ-O 3.3Å; R100-D177 PolarHBondContact NH1-O 2.95Å; R100-D177 PolarHBondContact NH2-O 2.88Å; T175-D177 PolarHBondContact O-N 3.5Å; D177-T179 PolarHBondContact O-N 3.38Å; D177-T179 WeakPolarHBondContact OD1-CB 3.33Å; D177-T179 PolarHBondContact OD1-N 3.02Å; D177-T179 PolarHBondContact OD1-OG1 3.12Å; D177-T179 PolarHBondContact OD2-OG1 3.19Å; D177-V180 HydrophobicContact CB-CG2 4.22Å; D177-V180 PolarHBondContact O-N 3.34Å
178	P	82.3	Confident	81.4	Confident	86 Å²	86	57.9 Å²	57.9	56%	0.558	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	-28.5	174.8	22.3	-32.4	0	0	0	115.1	R100	R100-P178 VanDerWaalsContact NH1-CA 3.34Å; R100-P178 PolarHBondContact NH1-O 3.48Å; R100-P178 VanDerWaalsContact NH1-O 3.14Å; R100-P178 VanDerWaalsContact NH2-N 3.17Å
179	T	86.8	Confident	81.5	Confident	56 Å²	56	58 Å²	58	34%	0.344	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-8.4	-174	67.9	0	0	0	0	113.7	W96 D177	W96-T179 WeakPolarHBondContact CB-O 3.26Å; W96-T179 PolarHBondContact N-O 3.11Å; D177-T179 PolarHBondContact O-N 3.38Å; D177-T179 WeakPolarHBondContact OD1-CB 3.33Å; D177-T179 PolarHBondContact OD1-N 3.02Å; D177-T179 PolarHBondContact OD1-OG1 3.12Å; D177-T179 PolarHBondContact OD2-OG1 3.19Å
180	V	86.1	Confident	81.7	Confident	57 Å²	57	58.5 Å²	58.5	35%	0.345	36%	0.355	S	S	.	.			trans	-107.9	123.6	178.6	-178.2	0	0	0	0	109.5	R100 D177 S182	R100-V180 PolarHBondContact NH1-O 3.09Å; R100-V180 VanDerWaalsContact NH1-O 3.12Å; D177-V180 HydrophobicContact CB-CG2 4.22Å; D177-V180 PolarHBondContact O-N 3.34Å; V180-S182 WeakPolarHBondContact CG1-OG 3.45Å
181	C	88.2	Confident	82	Confident	12 Å²	12	55.4 Å²	55.4	8%	0.081	34%	0.339	C	S	.	.			trans	-110.3	88.2	174.3	-176.8	0	0	0	0	110.5	W96 C103	W96-C181 HydrophobicContact CB-CB 3.73Å; W96-C181 HydrophobicContact CD2-CB 3.66Å; W96-C181 HydrophobicContact CE3-CB 3.91Å; W96-C181 HydrophobicContact CG-CB 3.6Å; C103-C181 WeakPolarHBondContact CA-SG 3.14Å; C103-C181 HydrophobicContact CB-CB 3.97Å; C103-C181 WeakPolarHBondContact CB-SG 3.14Å; C103-C181 WeakPolarHBondContact SG-CA 3.23Å; C103-C181 WeakPolarHBondContact SG-CB 3.41Å; C103-C181 CovalentContact SG-SG 2.03Å; C103-C181 PolarHBondContact SG-SG 3.46Å
182	S	84.4	Confident	82.7	Confident	44 Å²	44	53.8 Å²	53.8	31%	0.308	32%	0.321	S	S	.	.	S	Bend	trans	-153.8	155.5	178.9	67.2	0	0	0	0	111.4	N173 T175 V180 S184	N173-S182 PolarHBondContact OD1-O 2.89Å; N173-S182 VanDerWaalsContact OD1-O 3.11Å; T175-S182 WeakPolarHBondContact CG2-O 3.48Å; V180-S182 WeakPolarHBondContact CG1-OG 3.45Å; S182-S184 PolarHBondContact O-N 2.99Å; S182-S184 VanDerWaalsContact O-N 3.09Å
183	I	83.8	Confident	83.3	Confident	24 Å²	24	48.7 Å²	48.7	12%	0.123	30%	0.299	C	S	.	.			trans	-72.1	103.9	175.2	-54.5	171.4	0	0	0	108.7	V107 V111 F188 V189	V107-I183 HydrophobicContact CG1-CD1 3.67Å; V107-I183 HydrophobicContact CG1-CG1 3.29Å; V111-I183 HydrophobicContact CG2-CD1 3.77Å; I183-F188 HydrophobicContact CD1-CE1 4.42Å; I183-F188 HydrophobicContact CG2-CD1 3.64Å; I183-F188 HydrophobicContact CG2-CE1 4.26Å; I183-V189 HydrophobicContact CB-CG2 4.38Å; I183-V189 HydrophobicContact CG2-CG2 3.59Å
184	S	79.9	Confident	84.1	Confident	55 Å²	55	51 Å²	51	39%	0.385	31%	0.314	S	S	.	.			trans	-104.3	-12.5	-178.4	-61.4	0	0	0	0	114.2	S182 P186	S182-S184 PolarHBondContact O-N 2.99Å; S182-S184 VanDerWaalsContact O-N 3.09Å; S184-P186 WeakPolarHBondContact O-CD 3.49Å
185	N	85.5	Confident	85.2	Confident	28 Å²	28	49.1 Å²	49.1	15%	0.15	30%	0.302	C	S	.	.			trans	-74.3	114.3	-177.9	-176.9	-58.6	0	0	0	110.4	F172 D187 F188 V189	F172-N185 WeakPolarHBondContact O-CB 3.5Å; N185-D187 PolarHBondContact O-N 3.42Å; N185-D187 PolarHBondContact OD1-N 3.44Å; N185-D187 VanDerWaalsContact OD1-N 3.13Å; N185-F188 HydrophobicContact CB-CB 3.95Å; N185-F188 PolarHBondContact O-N 3.33Å; N185-F188 PolarHBondContact OD1-N 3.43Å; N185-V189 VanDerWaalsContact O-CG2 3.26Å; N185-V189 WeakPolarHBondContact O-CG2 3.41Å; N185-V189 PolarHBondContact O-N 3.13Å
186	P	85.6	Confident	86.1	Confident	59 Å²	59	48.5 Å²	48.5	38%	0.383	30%	0.298	S	S	.	.	H	α-helix	trans	-64.7	-38.5	-172.6	25.3	-33.9	0	0	0	112.7	S184 V189 I190 H354	S184-P186 WeakPolarHBondContact O-CD 3.49Å; P186-V189 PolarHBondContact O-N 3.1Å; P186-I190 PolarHBondContact O-N 2.86Å; P186-H354 PolarHBondContact O-CE1 3.26Å; P186-H354 VanDerWaalsContact O-CE1 3.29Å; P186-H354 PolarHBondContact O-NE2 3.17Å
187	D	88.3	Confident	87	Confident	124 Å²	124	44.2 Å²	44.2	66%	0.663	25%	0.254	S	S	*	.	H	α-helix	trans	-66.3	-41.5	179.1	-62.6	-39	0	0	0	111	N185 V189 I190 Y191	N185-D187 PolarHBondContact O-N 3.42Å; N185-D187 PolarHBondContact OD1-N 3.44Å; N185-D187 VanDerWaalsContact OD1-N 3.13Å; D187-V189 VanDerWaalsContact C-N 3.35Å; D187-I190 PolarHBondContact O-N 2.81Å; D187-Y191 WeakPolarHBondContact O-CB 3.5Å; D187-Y191 PolarHBondContact O-N 2.83Å
188	F	86.9	Confident	87.6	Confident	8 Å²	8	44.3 Å²	44.3	4%	0.035	25%	0.249	C	C	.	.	H	α-helix	trans	-66.6	-36.7	176.6	-173	-90.8	0	0	0	112	P167 L168 F172 I183 N185 Y191 S192	P167-F188 HydrophobicContact CB-CD2 4.46Å; P167-F188 HydrophobicContact CB-CE2 3.94Å; P167-F188 HydrophobicContact CG-CE2 4.29Å; L168-F188 HydrophobicContact CD1-CE1 3.71Å; L168-F188 HydrophobicContact CD1-CZ 3.63Å; L168-F188 HydrophobicContact CD2-CD1 3.83Å; L168-F188 HydrophobicContact CD2-CE1 3.41Å; L168-F188 VanDerWaalsContact CD2-CE1 3.41Å; L168-F188 HydrophobicContact CD2-CE2 4.3Å; L168-F188 HydrophobicContact CD2-CG 4.44Å; L168-F188 HydrophobicContact CD2-CZ 3.69Å; L168-F188 HydrophobicContact CG-CD1 4.43Å; L168-F188 HydrophobicContact CG-CE1 3.59Å; L168-F188 HydrophobicContact CG-CE2 4.04Å; L168-F188 HydrophobicContact CG-CZ 3.36Å; F172-F188 HydrophobicContact CB-CD2 4.46Å; I183-F188 HydrophobicContact CD1-CE1 4.42Å; I183-F188 HydrophobicContact CG2-CD1 3.64Å; I183-F188 HydrophobicContact CG2-CE1 4.26Å; N185-F188 HydrophobicContact CB-CB 3.95Å; N185-F188 PolarHBondContact O-N 3.33Å; N185-F188 PolarHBondContact OD1-N 3.43Å; F188-Y191 HydrophobicContact CD2-CD1 4.04Å; F188-Y191 AromaticContact CE2-CD1 3.88Å; F188-Y191 HydrophobicContact CE2-CD1 3.88Å; F188-Y191 HydrophobicContact CE2-CE1 4.1Å; F188-Y191 PolarHBondContact O-N 3.14Å; F188-S192 VanDerWaalsContact O-CB 3.22Å; F188-S192 WeakPolarHBondContact O-CB 3.36Å; F188-S192 PolarHBondContact O-N 3.01Å
189	V	88.9	Confident	88	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.012	25%	0.249	C	C	.	.	H	α-helix	trans	-62.2	-44.5	177.4	170.8	0	0	0	0	111.1	I183 N185 P186 D187 S193 T353	I183-V189 HydrophobicContact CB-CG2 4.38Å; I183-V189 HydrophobicContact CG2-CG2 3.59Å; N185-V189 VanDerWaalsContact O-CG2 3.26Å; N185-V189 WeakPolarHBondContact O-CG2 3.41Å; N185-V189 PolarHBondContact O-N 3.13Å; P186-V189 PolarHBondContact O-N 3.1Å; D187-V189 VanDerWaalsContact C-N 3.35Å; V189-S193 WeakPolarHBondContact O-CB 3.25Å; V189-S193 PolarHBondContact O-N 3.39Å; V189-S193 PolarHBondContact O-OG 3.48Å; V189-T353 HydrophobicContact CG1-CG2 4.2Å; V189-T353 WeakPolarHBondContact CG1-OG1 3.32Å; V189-T353 HydrophobicContact CG2-CG2 4.02Å
190	I	91	Very high	88.1	Confident	82 Å²	82	42.7 Å²	42.7	42%	0.421	23%	0.234	S	C	.	.	H	α-helix	trans	-62.4	-51.9	174.1	-61.4	179.3	0	0	0	110.2	P186 D187 S192 S193 V194 H354	P186-I190 PolarHBondContact O-N 2.86Å; D187-I190 PolarHBondContact O-N 2.81Å; I190-S192 PolarHBondContact O-N 3.21Å; I190-S193 PolarHBondContact O-N 3.23Å; I190-V194 HydrophobicContact CG2-CG2 4.21Å; I190-V194 WeakPolarHBondContact O-CB 3.18Å; I190-V194 VanDerWaalsContact O-CG2 3.31Å; I190-V194 WeakPolarHBondContact O-CG2 3.23Å; I190-V194 PolarHBondContact O-N 2.86Å; I190-H354 WeakPolarHBondContact CD1-CE1 3.46Å; I190-H354 VanDerWaalsContact CG1-CE1 3.43Å; I190-H354 WeakPolarHBondContact CG1-CE1 3.5Å; I190-H354 WeakPolarHBondContact CG1-NE2 3.38Å
191	Y	91.3	Very high	88.1	Confident	93 Å²	93	42.2 Å²	42.2	37%	0.365	23%	0.227	S	C	.	.	H	α-helix	trans	-54.3	-52.6	-179	165.1	-98.7	0	0	0	111.5	D187 F188 V194 V195	D187-Y191 WeakPolarHBondContact O-CB 3.5Å; D187-Y191 PolarHBondContact O-N 2.83Å; F188-Y191 HydrophobicContact CD2-CD1 4.04Å; F188-Y191 AromaticContact CE2-CD1 3.88Å; F188-Y191 HydrophobicContact CE2-CD1 3.88Å; F188-Y191 HydrophobicContact CE2-CE1 4.1Å; F188-Y191 PolarHBondContact O-N 3.14Å; Y191-V194 PolarHBondContact O-N 3.38Å; Y191-V195 HydrophobicContact CD2-CG2 4Å; Y191-V195 HydrophobicContact CE2-CG2 3.79Å; Y191-V195 WeakPolarHBondContact O-CB 3.39Å; Y191-V195 WeakPolarHBondContact O-CG2 3.31Å; Y191-V195 PolarHBondContact O-N 3.44Å
192	S	88.2	Confident	88.2	Confident	10 Å²	10	43 Å²	43	7%	0.07	24%	0.237	C	C	.	.	H	α-helix	trans	-63.8	-45.2	-180	-176.7	0	0	0	0	111.2	F188 I190 V194 V195 S196	F188-S192 VanDerWaalsContact O-CB 3.22Å; F188-S192 WeakPolarHBondContact O-CB 3.36Å; F188-S192 PolarHBondContact O-N 3.01Å; I190-S192 PolarHBondContact O-N 3.21Å; S192-V194 VanDerWaalsContact C-N 3.32Å; S192-V194 PolarHBondContact O-N 2.96Å; S192-V195 PolarHBondContact O-N 3.05Å; S192-S196 WeakPolarHBondContact O-CA 3.44Å; S192-S196 WeakPolarHBondContact O-CB 3.13Å; S192-S196 PolarHBondContact O-N 3.19Å; S192-S196 PolarHBondContact O-OG 2.9Å
193	S	91.2	Very high	88.4	Confident	4 Å²	4	43.8 Å²	43.8	3%	0.028	24%	0.239	C	C	.	.	H	α-helix	trans	-61.6	-40.1	178.8	-58.1	0	0	0	0	112.2	V189 I190 F197 Y198	V189-S193 WeakPolarHBondContact O-CB 3.25Å; V189-S193 PolarHBondContact O-N 3.39Å; V189-S193 PolarHBondContact O-OG 3.48Å; I190-S193 PolarHBondContact O-N 3.23Å; S193-F197 WeakPolarHBondContact O-CB 3.47Å; S193-F197 PolarHBondContact O-N 2.91Å; S193-Y198 VanDerWaalsContact O-CD2 3.23Å; S193-Y198 WeakPolarHBondContact O-CD2 3.21Å; S193-Y198 PolarHBondContact O-N 3.01Å
194	V	91.9	Very high	88.4	Confident	63 Å²	63	42.7 Å²	42.7	38%	0.382	23%	0.234	S	C	.	.	I	π-helix	trans	-69.5	-52	178.9	172.2	0	0	0	0	111.4	I190 Y191 S192 Y198 L199	I190-V194 HydrophobicContact CG2-CG2 4.21Å; I190-V194 WeakPolarHBondContact O-CB 3.18Å; I190-V194 VanDerWaalsContact O-CG2 3.31Å; I190-V194 WeakPolarHBondContact O-CG2 3.23Å; I190-V194 PolarHBondContact O-N 2.86Å; Y191-V194 PolarHBondContact O-N 3.38Å; S192-V194 VanDerWaalsContact C-N 3.32Å; S192-V194 PolarHBondContact O-N 2.96Å; V194-Y198 HydrophobicContact CG2-CD2 4.37Å; V194-Y198 PolarHBondContact O-N 3.33Å; V194-L199 VanDerWaalsContact O-CB 3.27Å; V194-L199 WeakPolarHBondContact O-CB 3.31Å; V194-L199 PolarHBondContact O-N 3.49Å
195	V	90	Very high	88.7	Confident	44 Å²	44	42.9 Å²	42.9	27%	0.267	23%	0.233	S	C	.	.	I	π-helix	trans	-77.4	-36.8	-172.1	-179.2	0	0	0	0	111.9	V164 Y191 S192 P200	V164-V195 HydrophobicContact CB-CG1 4.38Å; V164-V195 HydrophobicContact CG1-CB 4.27Å; V164-V195 HydrophobicContact CG1-CG1 3.91Å; V164-V195 HydrophobicContact CG2-CG1 3.47Å; V164-V195 VanDerWaalsContact CG2-CG1 3.47Å; Y191-V195 HydrophobicContact CD2-CG2 4Å; Y191-V195 HydrophobicContact CE2-CG2 3.79Å; Y191-V195 WeakPolarHBondContact O-CB 3.39Å; Y191-V195 WeakPolarHBondContact O-CG2 3.31Å; Y191-V195 PolarHBondContact O-N 3.44Å; S192-V195 PolarHBondContact O-N 3.05Å; V195-P200 WeakPolarHBondContact O-CD 3.49Å; V195-P200 WeakPolarHBondContact O-CG 3.18Å
196	S	88.4	Confident	88.9	Confident	2 Å²	2	47.2 Å²	47.2	1%	0.014	26%	0.255	C	S	.	.	I	π-helix	trans	-86.7	-18.3	-177.6	-49.1	0	0	0	0	113.4	T115 I118 V164 S192	T115-S196 VanDerWaalsContact OG1-CB 3.26Å; T115-S196 WeakPolarHBondContact OG1-CB 3.4Å; T115-S196 PolarHBondContact OG1-OG 3.22Å; I118-S196 WeakPolarHBondContact CG2-O 3.36Å; V164-S196 VanDerWaalsContact CG1-OG 3.23Å; V164-S196 WeakPolarHBondContact CG1-OG 3.36Å; S192-S196 WeakPolarHBondContact O-CA 3.44Å; S192-S196 WeakPolarHBondContact O-CB 3.13Å; S192-S196 PolarHBondContact O-N 3.19Å; S192-S196 PolarHBondContact O-OG 2.9Å
197	F	89.4	Confident	88.8	Confident	1 Å²	1	45.7 Å²	45.7	0%	0.004	25%	0.245	C	C	.	.	I	π-helix	trans	-133.8	-66.9	-178.4	-178.9	-101.6	0	0	0	113.7	I118 S193 L199 P200 F201 F338 W342 L343 F346	I118-F197 HydrophobicContact CD1-CD2 3.98Å; I118-F197 WeakPolarHBondContact CD1-O 3.42Å; S193-F197 WeakPolarHBondContact O-CB 3.47Å; S193-F197 PolarHBondContact O-N 2.91Å; F197-L199 PolarHBondContact O-N 3.35Å; F197-P200 WeakPolarHBondContact O-CD 3.37Å; F197-F201 WeakPolarHBondContact O-CA 3.31Å; F197-F201 WeakPolarHBondContact O-CB 3.38Å; F197-F201 PolarHBondContact O-N 2.8Å; F197-F338 AromaticContact CD2-CE1 3.83Å; F197-F338 HydrophobicContact CD2-CE1 3.83Å; F197-F338 HydrophobicContact CD2-CZ 4.38Å; F197-F338 HydrophobicContact CE2-CD1 4.28Å; F197-F338 AromaticContact CE2-CE1 3.6Å; F197-F338 HydrophobicContact CE2-CE1 3.6Å; F197-F338 HydrophobicContact CE2-CZ 4.45Å; F197-W342 HydrophobicContact CD2-CB 4.29Å; F197-W342 HydrophobicContact CE2-CB 3.64Å; F197-W342 HydrophobicContact CZ-CB 4.39Å; F197-L343 HydrophobicContact CE1-CD1 3.88Å; F197-L343 HydrophobicContact CZ-CB 4.14Å; F197-L343 HydrophobicContact CZ-CD1 4.14Å; F197-F346 HydrophobicContact CB-CD1 3.85Å; F197-F346 HydrophobicContact CB-CD2 3.79Å; F197-F346 HydrophobicContact CB-CE1 3.58Å; F197-F346 HydrophobicContact CB-CE2 3.53Å; F197-F346 HydrophobicContact CB-CG 3.96Å; F197-F346 HydrophobicContact CB-CZ 3.43Å; F197-F346 VanDerWaalsContact CB-CZ 3.43Å; F197-F346 HydrophobicContact CD1-CB 4.01Å; F197-F346 HydrophobicContact CD1-CD1 4.31Å; F197-F346 AromaticContact CD1-CD2 3.62Å; F197-F346 HydrophobicContact CD1-CD2 3.62Å; F197-F346 HydrophobicContact CD1-CE2 4.21Å; F197-F346 AromaticContact CD1-CG 3.7Å; F197-F346 HydrophobicContact CD1-CG 3.7Å; F197-F346 AromaticContact CD2-CD2 3.37Å; F197-F346 HydrophobicContact CD2-CD2 3.37Å; F197-F346 AromaticContact CD2-CE2 3.26Å; F197-F346 HydrophobicContact CD2-CE2 3.26Å; F197-F346 HydrophobicContact CD2-CG 4.25Å; F197-F346 HydrophobicContact CD2-CZ 4.07Å; F197-F346 HydrophobicContact CE1-CB 4.2Å; F197-F346 AromaticContact CE1-CD2 3.98Å; F197-F346 HydrophobicContact CE1-CD2 3.98Å; F197-F346 HydrophobicContact CE1-CG 4.22Å; F197-F346 AromaticContact CE2-CD2 3.73Å; F197-F346 HydrophobicContact CE2-CD2 3.73Å; F197-F346 AromaticContact CE2-CE2 3.97Å; F197-F346 HydrophobicContact CE2-CE2 3.97Å; F197-F346 HydrophobicContact CG-CD1 4.14Å; F197-F346 AromaticContact CG-CD2 3.3Å; F197-F346 HydrophobicContact CG-CD2 3.3Å; F197-F346 HydrophobicContact CG-CE1 4.22Å; F197-F346 AromaticContact CG-CE2 3.41Å; F197-F346 HydrophobicContact CG-CE2 3.41Å; F197-F346 VanDerWaalsContact CG-CE2 3.41Å; F197-F346 AromaticContact CG-CG 3.72Å; F197-F346 HydrophobicContact CG-CG 3.72Å; F197-F346 AromaticContact CG-CZ 3.89Å; F197-F346 HydrophobicContact CG-CZ 3.89Å; F197-F346 HydrophobicContact CZ-CD2 4.03Å
198	Y	91.6	Very high	88.4	Confident	76 Å²	76	41 Å²	41	30%	0.298	22%	0.218	S	C	.	.	I	π-helix	trans	-63	-40	-167.6	-64.5	-64.4	0	0	0	113.8	S193 V194 G202 L343	S193-Y198 VanDerWaalsContact O-CD2 3.23Å; S193-Y198 WeakPolarHBondContact O-CD2 3.21Å; S193-Y198 PolarHBondContact O-N 3.01Å; V194-Y198 HydrophobicContact CG2-CD2 4.37Å; V194-Y198 PolarHBondContact O-N 3.33Å; Y198-G202 PolarHBondContact O-N 2.91Å; Y198-L343 HydrophobicContact CE1-CD1 4.48Å
199	L	91	Very high	88.3	Confident	105 Å²	105	42.9 Å²	42.9	55%	0.55	24%	0.235	S	C	.	.	H	α-helix	trans	-70.6	-54.8	179.2	179.7	162.4	0	0	0	111.7	V194 F197 F201 G202 V203	V194-L199 VanDerWaalsContact O-CB 3.27Å; V194-L199 WeakPolarHBondContact O-CB 3.31Å; V194-L199 PolarHBondContact O-N 3.49Å; F197-L199 PolarHBondContact O-N 3.35Å; L199-F201 VanDerWaalsContact C-N 3.25Å; L199-F201 PolarHBondContact O-N 3.2Å; L199-G202 PolarHBondContact O-N 3.18Å; L199-V203 HydrophobicContact CD2-CG2 4.35Å; L199-V203 WeakPolarHBondContact O-CG2 3.44Å; L199-V203 PolarHBondContact O-N 3.06Å
200	P	88.3	Confident	88.1	Confident	4 Å²	4	51 Å²	51	3%	0.026	27%	0.265	C	S	.	.	H	α-helix	trans	-59.6	-38.4	176	-20.8	29.9	0	0	0	111.9	I118 L119 C122 V195 F197 V203 T204	I118-P200 HydrophobicContact CD1-CB 3.98Å; I118-P200 HydrophobicContact CG1-CB 4.04Å; I118-P200 HydrophobicContact CG2-CB 3.93Å; I118-P200 HydrophobicContact CG2-CG 4.14Å; L119-P200 HydrophobicContact CD2-CB 4.23Å; L119-P200 HydrophobicContact CD2-CG 4.14Å; C122-P200 PolarHBondContact SG-O 2.79Å; V195-P200 WeakPolarHBondContact O-CD 3.49Å; V195-P200 WeakPolarHBondContact O-CG 3.18Å; F197-P200 WeakPolarHBondContact O-CD 3.37Å; P200-V203 PolarHBondContact O-N 3.26Å; P200-T204 WeakPolarHBondContact O-CG2 3.01Å; P200-T204 PolarHBondContact O-N 3.27Å
201	F	87.3	Confident	87.7	Confident	47 Å²	47	47.2 Å²	47.2	21%	0.206	25%	0.246	C	C	.	.	H	α-helix	trans	-57	-52.9	173.3	173.3	-115	0	0	0	111.8	I118 F197 L199 V203 T204 V205 I339	I118-F201 HydrophobicContact CD1-CB 4.15Å; F197-F201 WeakPolarHBondContact O-CA 3.31Å; F197-F201 WeakPolarHBondContact O-CB 3.38Å; F197-F201 PolarHBondContact O-N 2.8Å; L199-F201 VanDerWaalsContact C-N 3.25Å; L199-F201 PolarHBondContact O-N 3.2Å; F201-V203 VanDerWaalsContact C-N 3.29Å; F201-V203 PolarHBondContact O-N 3Å; F201-T204 PolarHBondContact O-N 3.38Å; F201-T204 VanDerWaalsContact O-N 3.11Å; F201-T204 PolarHBondContact O-OG1 3.3Å; F201-V205 HydrophobicContact CD2-CG2 3.96Å; F201-V205 HydrophobicContact CE1-CG2 4.15Å; F201-V205 HydrophobicContact CE2-CG2 3.37Å; F201-V205 HydrophobicContact CZ-CG2 3.51Å; F201-V205 WeakPolarHBondContact O-CG2 3.17Å; F201-V205 PolarHBondContact O-N 2.87Å; F201-I339 HydrophobicContact CD2-CG1 4.15Å; F201-I339 HydrophobicContact CE2-CD1 3.46Å; F201-I339 VanDerWaalsContact CE2-CD1 3.46Å; F201-I339 HydrophobicContact CE2-CG1 3.35Å; F201-I339 HydrophobicContact CZ-CD1 3.91Å; F201-I339 HydrophobicContact CZ-CG1 3.99Å
202	G	89.4	Confident	87.3	Confident	27 Å²	27	49.8 Å²	49.8	28%	0.278	26%	0.256	S	S	.	.	H	α-helix	trans	-56	-43.6	176.9	0	0	0	0	0	112.3	Y198 L199 V205 L206	Y198-G202 PolarHBondContact O-N 2.91Å; L199-G202 PolarHBondContact O-N 3.18Å; G202-V205 PolarHBondContact O-N 3.42Å; G202-L206 WeakPolarHBondContact O-CB 3.43Å; G202-L206 VanDerWaalsContact O-CG 3.26Å; G202-L206 WeakPolarHBondContact O-CG 3.31Å; G202-L206 PolarHBondContact O-N 3.49Å
203	V	87.9	Confident	87.1	Confident	61 Å²	61	52.2 Å²	52.2	37%	0.37	27%	0.27	S	S	.	.	H	α-helix	trans	-60	-47.8	175.3	173	0	0	0	0	111.2	L199 P200 F201 V205 L206 V207	L199-V203 HydrophobicContact CD2-CG2 4.35Å; L199-V203 WeakPolarHBondContact O-CG2 3.44Å; L199-V203 PolarHBondContact O-N 3.06Å; P200-V203 PolarHBondContact O-N 3.26Å; F201-V203 VanDerWaalsContact C-N 3.29Å; F201-V203 PolarHBondContact O-N 3Å; V203-V205 PolarHBondContact O-N 3.43Å; V203-L206 PolarHBondContact O-N 2.93Å; V203-V207 HydrophobicContact CG1-CG2 4.36Å; V203-V207 VanDerWaalsContact O-CG2 3.31Å; V203-V207 WeakPolarHBondContact O-CG2 3.39Å; V203-V207 PolarHBondContact O-N 3Å
204	T	84.8	Confident	86.7	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.012	28%	0.277	C	S	.	.	H	α-helix	trans	-59.1	-48.7	178.2	63.1	0	0	0	0	111.7	C122 P200 F201 L206 V207 Y208 L335	C122-T204 HydrophobicContact CB-CG2 4.01Å; C122-T204 WeakPolarHBondContact SG-CG2 3.02Å; P200-T204 WeakPolarHBondContact O-CG2 3.01Å; P200-T204 PolarHBondContact O-N 3.27Å; F201-T204 PolarHBondContact O-N 3.38Å; F201-T204 VanDerWaalsContact O-N 3.11Å; F201-T204 PolarHBondContact O-OG1 3.3Å; T204-L206 VanDerWaalsContact C-N 3.32Å; T204-L206 PolarHBondContact O-N 3.46Å; T204-V207 PolarHBondContact O-N 3.43Å; T204-Y208 WeakPolarHBondContact O-CD2 3.44Å; T204-Y208 PolarHBondContact O-N 3.44Å; T204-L335 WeakPolarHBondContact OG1-CD1 3.32Å
205	V	86.3	Confident	86.1	Confident	58 Å²	58	52 Å²	52	35%	0.352	27%	0.268	S	S	.	.	H	α-helix	trans	-58.9	-45	-179.3	172.4	0	0	0	0	110.7	F201 G202 V203 Y208 A209 L335	F201-V205 HydrophobicContact CD2-CG2 3.96Å; F201-V205 HydrophobicContact CE1-CG2 4.15Å; F201-V205 HydrophobicContact CE2-CG2 3.37Å; F201-V205 HydrophobicContact CZ-CG2 3.51Å; F201-V205 WeakPolarHBondContact O-CG2 3.17Å; F201-V205 PolarHBondContact O-N 2.87Å; G202-V205 PolarHBondContact O-N 3.42Å; V203-V205 PolarHBondContact O-N 3.43Å; V205-Y208 PolarHBondContact O-N 2.96Å; V205-A209 WeakPolarHBondContact O-CB 3.36Å; V205-A209 PolarHBondContact O-N 3.12Å; V205-L335 HydrophobicContact CG2-CD2 4.46Å
206	L	88.3	Confident	85.7	Confident	119 Å²	119	54.3 Å²	54.3	62%	0.623	27%	0.274	S	S	*	.	H	α-helix	trans	-63.2	-44.6	177.5	-70.4	174.7	0	0	0	112	G202 V203 T204 Y208 A209 R210	G202-L206 WeakPolarHBondContact O-CB 3.43Å; G202-L206 VanDerWaalsContact O-CG 3.26Å; G202-L206 WeakPolarHBondContact O-CG 3.31Å; G202-L206 PolarHBondContact O-N 3.49Å; V203-L206 PolarHBondContact O-N 2.93Å; T204-L206 VanDerWaalsContact C-N 3.32Å; T204-L206 PolarHBondContact O-N 3.46Å; L206-Y208 PolarHBondContact O-N 2.85Å; L206-A209 PolarHBondContact O-N 3.33Å; L206-R210 WeakPolarHBondContact O-CG 3.49Å; L206-R210 PolarHBondContact O-N 3.4Å
207	V	85.1	Confident	85.4	Confident	27 Å²	27	59.5 Å²	59.5	16%	0.164	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-46.3	175.9	170.7	0	0	0	0	110.2	Y129 V203 T204 R210 I211	Y129-V207 HydrophobicContact CD2-CG1 4.4Å; Y129-V207 HydrophobicContact CG-CG1 4.28Å; V203-V207 HydrophobicContact CG1-CG2 4.36Å; V203-V207 VanDerWaalsContact O-CG2 3.31Å; V203-V207 WeakPolarHBondContact O-CG2 3.39Å; V203-V207 PolarHBondContact O-N 3Å; T204-V207 PolarHBondContact O-N 3.43Å; V207-R210 WeakPolarHBondContact O-CB 3.39Å; V207-R210 PolarHBondContact O-N 3.14Å; V207-I211 HydrophobicContact CG1-CD1 4.07Å; V207-I211 HydrophobicContact CG1-CG1 4.47Å; V207-I211 WeakPolarHBondContact O-CG1 3.42Å; V207-I211 PolarHBondContact O-N 3.08Å
208	Y	79	Confident	84.8	Confident	27 Å²	27	62.7 Å²	62.7	11%	0.106	31%	0.31	C	S	.	.	H	α-helix	trans	-66.8	-39.4	177.6	-79.3	-69	0	0	0	113.7	S125 T204 V205 L206 R210 I211 Y212 V331 L335	S125-Y208 WeakPolarHBondContact CA-OH 3.35Å; S125-Y208 WeakPolarHBondContact CB-OH 3.3Å; S125-Y208 WeakPolarHBondContact OG-CE2 3.4Å; S125-Y208 PolarHBondContact OG-OH 2.96Å; T204-Y208 WeakPolarHBondContact O-CD2 3.44Å; T204-Y208 PolarHBondContact O-N 3.44Å; V205-Y208 PolarHBondContact O-N 2.96Å; L206-Y208 PolarHBondContact O-N 2.85Å; Y208-R210 PolarHBondContact O-N 2.95Å; Y208-I211 HydrophobicContact CD1-CD1 3.96Å; Y208-I211 HydrophobicContact CE1-CD1 4.02Å; Y208-I211 PolarHBondContact O-N 3.23Å; Y208-I211 VanDerWaalsContact O-N 3.17Å; Y208-Y212 WeakPolarHBondContact O-CB 3.33Å; Y208-Y212 PolarHBondContact O-N 3.1Å; Y208-V331 HydrophobicContact CE1-CB 4.24Å; Y208-V331 HydrophobicContact CE1-CG1 3.47Å; Y208-V331 VanDerWaalsContact CE1-CG1 3.47Å; Y208-V331 WeakPolarHBondContact OH-CG1 3.19Å; Y208-L335 HydrophobicContact CD2-CD2 3.49Å; Y208-L335 VanDerWaalsContact CD2-CD2 3.49Å; Y208-L335 HydrophobicContact CE2-CD2 3.94Å; Y208-L335 HydrophobicContact CG-CD2 4.27Å
209	A	84.7	Confident	84	Confident	47 Å²	47	66.4 Å²	66.4	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-56.9	-43.4	174.1	0	0	0	0	0	110	V205 L206 Y212 V213	V205-A209 WeakPolarHBondContact O-CB 3.36Å; V205-A209 PolarHBondContact O-N 3.12Å; L206-A209 PolarHBondContact O-N 3.33Å; A209-Y212 PolarHBondContact O-N 3.04Å; A209-V213 VanDerWaalsContact O-CG2 3.28Å; A209-V213 WeakPolarHBondContact O-CG2 3.33Å; A209-V213 PolarHBondContact O-N 3.29Å
210	R	86	Confident	83.4	Confident	172 Å²	172	69 Å²	69	65%	0.649	33%	0.326	S	S	*	.	H	α-helix	trans	-65.3	-44.6	174.5	-65.6	-63.7	-176.5	179.2	0.1	112.5	Y129 L206 V207 Y208 Y212 V213 V214	Y129-R210 HydrophobicContact CE2-CB 4.04Å; L206-R210 WeakPolarHBondContact O-CG 3.49Å; L206-R210 PolarHBondContact O-N 3.4Å; V207-R210 WeakPolarHBondContact O-CB 3.39Å; V207-R210 PolarHBondContact O-N 3.14Å; Y208-R210 PolarHBondContact O-N 2.95Å; R210-Y212 VanDerWaalsContact C-N 3.32Å; R210-Y212 PolarHBondContact O-N 3.47Å; R210-V213 PolarHBondContact O-N 2.91Å; R210-V214 WeakPolarHBondContact O-CG2 3.22Å; R210-V214 PolarHBondContact O-N 3.37Å
211	I	81.7	Confident	83	Confident	3 Å²	3	76 Å²	76	2%	0.015	36%	0.356	C	S	.	.	H	α-helix	trans	-55.6	-49.5	174.7	-66.5	172	0	0	0	110.2	Y129 V207 Y208 V213 V214 L215 T328	Y129-I211 HydrophobicContact CD2-CG1 3.73Å; Y129-I211 HydrophobicContact CG-CG1 4.35Å; V207-I211 HydrophobicContact CG1-CD1 4.07Å; V207-I211 HydrophobicContact CG1-CG1 4.47Å; V207-I211 WeakPolarHBondContact O-CG1 3.42Å; V207-I211 PolarHBondContact O-N 3.08Å; Y208-I211 HydrophobicContact CD1-CD1 3.96Å; Y208-I211 HydrophobicContact CE1-CD1 4.02Å; Y208-I211 PolarHBondContact O-N 3.23Å; Y208-I211 VanDerWaalsContact O-N 3.17Å; I211-V213 PolarHBondContact O-N 2.91Å; I211-V214 PolarHBondContact O-N 3.29Å; I211-L215 HydrophobicContact CG2-CD1 3.76Å; I211-L215 HydrophobicContact CG2-CG 4.28Å; I211-L215 WeakPolarHBondContact O-CB 3.27Å; I211-L215 VanDerWaalsContact O-CG 3.31Å; I211-L215 WeakPolarHBondContact O-CG 3.41Å; I211-L215 PolarHBondContact O-N 3.01Å; I211-T328 HydrophobicContact CG2-CG2 3.81Å
212	Y	82.5	Confident	82.2	Confident	147 Å²	147	78.4 Å²	78.4	58%	0.576	36%	0.364	S	S	*	.	H	α-helix	trans	-60.5	-46.6	-179.4	176.3	-95.9	0	0	0	111.8	Y208 A209 R210 V214 L215 K216	Y208-Y212 WeakPolarHBondContact O-CB 3.33Å; Y208-Y212 PolarHBondContact O-N 3.1Å; A209-Y212 PolarHBondContact O-N 3.04Å; R210-Y212 VanDerWaalsContact C-N 3.32Å; R210-Y212 PolarHBondContact O-N 3.47Å; Y212-V214 PolarHBondContact O-N 2.88Å; Y212-L215 PolarHBondContact O-N 3.48Å; Y212-K216 HydrophobicContact CE1-CD 3.96Å; Y212-K216 VanDerWaalsContact O-CB 3.32Å; Y212-K216 WeakPolarHBondContact O-CB 3.48Å; Y212-K216 PolarHBondContact O-N 3.04Å
213	V	84.9	Confident	81.5	Confident	61 Å²	61	81.2 Å²	81.2	37%	0.37	37%	0.371	S	S	.	.	H	α-helix	trans	-59.8	-47.7	177.2	169.7	0	0	0	0	110.9	A209 R210 I211 L215 K216 Q217	A209-V213 VanDerWaalsContact O-CG2 3.28Å; A209-V213 WeakPolarHBondContact O-CG2 3.33Å; A209-V213 PolarHBondContact O-N 3.29Å; R210-V213 PolarHBondContact O-N 2.91Å; I211-V213 PolarHBondContact O-N 2.91Å; V213-L215 PolarHBondContact O-N 3.5Å; V213-K216 PolarHBondContact O-N 3.41Å; V213-Q217 HydrophobicContact CG1-CG 4.35Å; V213-Q217 WeakPolarHBondContact O-CB 3.29Å; V213-Q217 VanDerWaalsContact O-CG 3.29Å; V213-Q217 WeakPolarHBondContact O-CG 3.35Å; V213-Q217 PolarHBondContact O-N 3Å
214	V	83.4	Confident	81	Confident	29 Å²	29	83.3 Å²	83.3	18%	0.176	38%	0.38	C	S	.	.	H	α-helix	trans	-62.2	-43.5	179.2	172.4	0	0	0	0	111.1	V132 V133 R210 I211 Y212 Q217 R218	V132-V214 HydrophobicContact CG1-CG1 4.49Å; V133-V214 HydrophobicContact CG2-CB 4.48Å; V133-V214 HydrophobicContact CG2-CG1 4.24Å; V133-V214 HydrophobicContact CG2-CG2 4.16Å; R210-V214 WeakPolarHBondContact O-CG2 3.22Å; R210-V214 PolarHBondContact O-N 3.37Å; I211-V214 PolarHBondContact O-N 3.29Å; Y212-V214 PolarHBondContact O-N 2.88Å; V214-Q217 PolarHBondContact O-N 3.44Å; V214-R218 HydrophobicContact CG1-CG 4.49Å; V214-R218 WeakPolarHBondContact O-CB 3.07Å; V214-R218 VanDerWaalsContact O-CG 3.31Å; V214-R218 WeakPolarHBondContact O-CG 3.41Å; V214-R218 PolarHBondContact O-N 3.08Å
215	L	78.6	Confident	80.4	Confident	34 Å²	34	87.4 Å²	87.4	18%	0.178	41%	0.405	C	S	.	.	H	α-helix	trans	-64.2	-40.8	176.6	-72.2	174.8	0	0	0	112.2	V132 I211 Y212 V213 R218 R219 T328	V132-L215 HydrophobicContact CG1-CD2 3.69Å; V132-L215 HydrophobicContact CG1-CG 4.05Å; I211-L215 HydrophobicContact CG2-CD1 3.76Å; I211-L215 HydrophobicContact CG2-CG 4.28Å; I211-L215 WeakPolarHBondContact O-CB 3.27Å; I211-L215 VanDerWaalsContact O-CG 3.31Å; I211-L215 WeakPolarHBondContact O-CG 3.41Å; I211-L215 PolarHBondContact O-N 3.01Å; Y212-L215 PolarHBondContact O-N 3.48Å; V213-L215 PolarHBondContact O-N 3.5Å; L215-R218 PolarHBondContact O-N 3.3Å; L215-R219 WeakPolarHBondContact O-CB 3.44Å; L215-R219 PolarHBondContact O-N 3.35Å; L215-T328 HydrophobicContact CD1-CG2 3.64Å
216	K	82.1	Confident	79.4	Confident	92 Å²	92	93.7 Å²	93.7	40%	0.4	42%	0.423	S	S	.	.	H	α-helix	trans	-64.5	-43.7	176.5	-173.7	173.9	-178.3	175.7	0	111.4	Y212 V213 R219 R220	Y212-K216 HydrophobicContact CE1-CD 3.96Å; Y212-K216 VanDerWaalsContact O-CB 3.32Å; Y212-K216 WeakPolarHBondContact O-CB 3.48Å; Y212-K216 PolarHBondContact O-N 3.04Å; V213-K216 PolarHBondContact O-N 3.41Å; K216-R219 PolarHBondContact O-N 3.21Å; K216-R220 PolarHBondContact O-N 3.17Å
217	Q	81.3	Confident	78.1	Confident	110 Å²	110	94.3 Å²	94.3	51%	0.514	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-45.6	175.7	-73.4	176.9	-0.8	0	0	111.7	V213 V214 R219 R220 K221	V213-Q217 HydrophobicContact CG1-CG 4.35Å; V213-Q217 WeakPolarHBondContact O-CB 3.29Å; V213-Q217 VanDerWaalsContact O-CG 3.29Å; V213-Q217 WeakPolarHBondContact O-CG 3.35Å; V213-Q217 PolarHBondContact O-N 3Å; V214-Q217 PolarHBondContact O-N 3.44Å; Q217-R219 VanDerWaalsContact C-N 3.33Å; Q217-R219 PolarHBondContact O-N 3.32Å; Q217-R220 PolarHBondContact O-N 3.04Å; Q217-K221 PolarHBondContact O-N 3.2Å
218	R	77.5	Confident	76.8	Confident	68 Å²	68	98.2 Å²	98.2	26%	0.257	44%	0.442	S	S	.	.	H	α-helix	trans	-62	-39.8	175.2	-73.9	177.8	178.9	-172.1	4.5	112.2	V132 V133 V214 L215 R222	V132-R218 PolarHBondContact O-NH1 2.98Å; V132-R218 PolarHBondContact O-NH2 2.97Å; V133-R218 PolarHBondContact O-NH2 2.99Å; V214-R218 HydrophobicContact CG1-CG 4.49Å; V214-R218 WeakPolarHBondContact O-CB 3.07Å; V214-R218 VanDerWaalsContact O-CG 3.31Å; V214-R218 WeakPolarHBondContact O-CG 3.41Å; V214-R218 PolarHBondContact O-N 3.08Å; L215-R218 PolarHBondContact O-N 3.3Å; R218-R222 WeakPolarHBondContact O-CG 3.3Å; R218-R222 PolarHBondContact O-N 3.38Å; R218-R222 VanDerWaalsContact O-N 3.1Å
219	R	74.7	Confident	75.6	Confident	155 Å²	155	100.4 Å²	100.4	59%	0.585	46%	0.461	S	S	*	.	H	α-helix	trans	-61.9	-48	174.7	-175.4	-176.8	177.3	-135.7	-1.1	111.1	L215 K216 Q217 R222 I223	L215-R219 WeakPolarHBondContact O-CB 3.44Å; L215-R219 PolarHBondContact O-N 3.35Å; K216-R219 PolarHBondContact O-N 3.21Å; Q217-R219 VanDerWaalsContact C-N 3.33Å; Q217-R219 PolarHBondContact O-N 3.32Å; R219-R222 PolarHBondContact O-N 2.03Å; R219-I223 HydrophobicContact CG-CD1 4.07Å; R219-I223 WeakPolarHBondContact O-CG1 3.49Å; R219-I223 PolarHBondContact O-N 3.05Å; R219-I223 VanDerWaalsContact O-N 3.09Å
220	R	78.3	Confident	74	Confident	160 Å²	160	103.8 Å²	103.8	60%	0.604	47%	0.469	S	S	*	.	H	α-helix	trans	-58.8	-52	177.6	-77.8	-176.9	173.2	-176.8	-3	111.3	K216 Q217 R222 I223 L224	K216-R220 PolarHBondContact O-N 3.17Å; Q217-R220 PolarHBondContact O-N 3.04Å; R220-R222 PolarHBondContact O-N 2.95Å; R220-I223 PolarHBondContact O-N 3.16Å; R220-L224 WeakPolarHBondContact O-CD1 3.32Å; R220-L224 PolarHBondContact O-N 2.94Å
221	K	78.4	Confident	71.9	Confident	149 Å²	149	100.3 Å²	100.3	65%	0.648	47%	0.47	S	S	*	.	H	α-helix	trans	-53.6	-41.7	177.6	-74.7	-173.6	178.5	-175.3	0	112.1	Q217 L224 T225	Q217-K221 PolarHBondContact O-N 3.2Å; K221-L224 PolarHBondContact O-N 2.86Å; K221-T225 PolarHBondContact O-N 3.25Å; K221-T225 PolarHBondContact O-OG1 3.41Å
222	R	70.8	Confident	70.3	Confident	98 Å²	98	106.6 Å²	106.6	37%	0.37	50%	0.504	S	S	.	.	H	α-helix	trans	-66.4	-40	177	-76.5	-177.9	-179.1	155.3	5.5	114.4	R218 R219 R220 L224 T225 R226 R318	R218-R222 WeakPolarHBondContact O-CG 3.3Å; R218-R222 PolarHBondContact O-N 3.38Å; R218-R222 VanDerWaalsContact O-N 3.1Å; R219-R222 PolarHBondContact O-N 2.03Å; R220-R222 PolarHBondContact O-N 2.95Å; R222-L224 VanDerWaalsContact C-N 3.33Å; R222-T225 PolarHBondContact O-N 2.85Å; R222-R226 WeakPolarHBondContact O-CB 3.32Å; R222-R226 PolarHBondContact O-N 2.92Å; R222-R318 PolarHBondContact NE-O 2.98Å; R222-R318 PolarHBondContact NH2-O 3.36Å
223	I	76.2	Confident	68.4	Low	86 Å²	86	104 Å²	104	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-62.5	-46.2	177.3	-67.3	166.5	0	0	0	109.3	R219 R220 R226 Q227	R219-I223 HydrophobicContact CG-CD1 4.07Å; R219-I223 WeakPolarHBondContact O-CG1 3.49Å; R219-I223 PolarHBondContact O-N 3.05Å; R219-I223 VanDerWaalsContact O-N 3.09Å; R220-I223 PolarHBondContact O-N 3.16Å; I223-R226 PolarHBondContact O-N 3.05Å; I223-Q227 WeakPolarHBondContact O-CB 3.5Å; I223-Q227 PolarHBondContact O-N 3.37Å
224	L	76.1	Confident	66.2	Low	106 Å²	106	106.3 Å²	106.3	56%	0.555	52%	0.521	S	S	*	.	H	α-helix	trans	-59.2	-46.9	174.7	-84.2	133.5	0	0	0	112.6	R220 K221 R222 R226 Q227 N228	R220-L224 WeakPolarHBondContact O-CD1 3.32Å; R220-L224 PolarHBondContact O-N 2.94Å; K221-L224 PolarHBondContact O-N 2.86Å; R222-L224 VanDerWaalsContact C-N 3.33Å; L224-R226 VanDerWaalsContact C-N 3.32Å; L224-R226 PolarHBondContact O-N 3.39Å; L224-Q227 PolarHBondContact O-N 3.08Å; L224-N228 PolarHBondContact O-N 3.11Å
225	T	72.1	Confident	63.9	Low	87 Å²	87	114 Å²	114	53%	0.534	55%	0.547	S	S	.	.	H	α-helix	trans	-65.6	-33.4	176.7	-49.7	0	0	0	0	112.7	K221 R222 S229	K221-T225 PolarHBondContact O-N 3.25Å; K221-T225 PolarHBondContact O-OG1 3.41Å; R222-T225 PolarHBondContact O-N 2.85Å; T225-S229 WeakPolarHBondContact O-CB 3.24Å; T225-S229 PolarHBondContact O-N 2.63Å; T225-S229 PolarHBondContact O-OG 3.46Å
226	R	65.5	Low	61.9	Low	191 Å²	191	117.3 Å²	117.3	72%	0.721	57%	0.57	S	S	*	*	H	α-helix	trans	-69.3	-40.8	176.5	-160.3	172.6	96	169.5	6.6	110.9	R222 I223 L224 S229 Q230	R222-R226 WeakPolarHBondContact O-CB 3.32Å; R222-R226 PolarHBondContact O-N 2.92Å; I223-R226 PolarHBondContact O-N 3.05Å; L224-R226 VanDerWaalsContact C-N 3.32Å; L224-R226 PolarHBondContact O-N 3.39Å; R226-S229 PolarHBondContact O-N 2.94Å; R226-Q230 WeakPolarHBondContact O-CB 3.5Å; R226-Q230 PolarHBondContact O-N 2.95Å
227	Q	61.9	Low	59.6	Low	131 Å²	131	116.6 Å²	116.6	61%	0.612	59%	0.589	S	S	*	*	H	α-helix	trans	-66.2	-43.2	177.2	-162.3	169.5	12.2	0	0	111.9	I223 L224 S229 Q230 C231	I223-Q227 WeakPolarHBondContact O-CB 3.5Å; I223-Q227 PolarHBondContact O-N 3.37Å; L224-Q227 PolarHBondContact O-N 3.08Å; Q227-S229 PolarHBondContact O-N 3.24Å; Q227-Q230 PolarHBondContact O-N 3.2Å; Q227-C231 PolarHBondContact O-N 3.29Å
228	N	56.4	Low	57.3	Low	110 Å²	110	120.4 Å²	120.4	59%	0.588	60%	0.604	S	S	*	*	H	α-helix	trans	-64.3	-37.7	174.1	-78.8	2.6	0	0	0	112.8	L224 Q230 N232	L224-N228 PolarHBondContact O-N 3.11Å; N228-Q230 VanDerWaalsContact C-N 3.33Å; N228-N232 PolarHBondContact O-N 2.87Å
229	S	54.7	Low	55	Low	73 Å²	73	122.6 Å²	122.6	51%	0.51	63%	0.627	S	S	.	*	H	α-helix	trans	-66.9	-34.8	175.4	-54.5	0	0	0	0	112.5	T225 R226 Q227 S233	T225-S229 WeakPolarHBondContact O-CB 3.24Å; T225-S229 PolarHBondContact O-N 2.63Å; T225-S229 PolarHBondContact O-OG 3.46Å; R226-S229 PolarHBondContact O-N 2.94Å; Q227-S229 PolarHBondContact O-N 3.24Å; S229-S233 PolarHBondContact O-N 2.91Å
230	Q	50.2	Low	52.9	Low	118 Å²	118	124.5 Å²	124.5	55%	0.551	64%	0.643	S	S	*	*	H	α-helix	trans	-77	-34.9	-178.9	-155.3	163.7	5.7	0	0	111.5	R226 Q227 N228 N232 S233 V234	R226-Q230 WeakPolarHBondContact O-CB 3.5Å; R226-Q230 PolarHBondContact O-N 2.95Å; Q227-Q230 PolarHBondContact O-N 3.2Å; N228-Q230 VanDerWaalsContact C-N 3.33Å; Q230-N232 VanDerWaalsContact C-N 3.32Å; Q230-N232 PolarHBondContact O-N 3.48Å; Q230-S233 PolarHBondContact O-N 3.26Å; Q230-V234 PolarHBondContact O-N 3.38Å
231	C	43.7	Very low	50.5	Low	98 Å²	98	125.4 Å²	125.4	66%	0.662	65%	0.654	S	S	*	*	H	α-helix	trans	-66.5	-33.2	172.4	-151.5	0	0	0	0	112.4	Q227	Q227-C231 PolarHBondContact O-N 3.29Å
232	N	46.5	Very low	48.2	Very low	136 Å²	136	124.6 Å²	124.6	73%	0.727	66%	0.661	S	S	*	*	H	α-helix	trans	-75.9	-18.7	175.1	-78.7	-6.5	0	0	0	114.2	N228 Q230	N228-N232 PolarHBondContact O-N 2.87Å; Q230-N232 VanDerWaalsContact C-N 3.32Å; Q230-N232 PolarHBondContact O-N 3.48Å
233	S	43.4	Very low	46.1	Very low	92 Å²	92	128 Å²	128	64%	0.643	69%	0.686	S	S	*	*	H	α-helix	trans	-92.4	-11.9	178.9	99.8	0	0	0	0	113.7	S229 Q230 R235	S229-S233 PolarHBondContact O-N 2.91Å; Q230-S233 PolarHBondContact O-N 3.26Å; S233-R235 VanDerWaalsContact C-N 3.29Å; S233-R235 PolarHBondContact O-N 3.33Å
234	V	39.3	Very low	43.7	Very low	110 Å²	110	129.2 Å²	129.2	67%	0.667	70%	0.702	S	S	*	*			trans	-92.6	65.6	171.2	-173.1	0	0	0	0	108.3	Q230	Q230-V234 PolarHBondContact O-N 3.38Å
235	R	35.3	Very low	41.9	Very low	191 Å²	191	130 Å²	130	72%	0.721	71%	0.713	S	S	*	*			trans	-100.4	114.2	153	-82	-174.7	174.7	-172.4	-3.4	106	S233 G237 Y255	S233-R235 VanDerWaalsContact C-N 3.29Å; S233-R235 PolarHBondContact O-N 3.33Å; R235-G237 PolarHBondContact O-N 2.94Å; R235-Y255 PolarHBondContact NH2-OH 3.09Å
236	P	36.2	Very low	39.8	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	73%	0.727	S	S	*	*			trans	-59.9	123.6	167.6	-9.8	22.8	0	0	0	107.3	F238	P236-F238 PolarHBondContact O-N 3.09Å
237	G	34.2	Very low	38.8	Very low	76 Å²	76	129.4 Å²	129.4	78%	0.784	73%	0.727	S	S	*	*			trans	-61.1	109.7	168.1	0	0	0	0	0	108	R235	R235-G237 PolarHBondContact O-N 2.94Å
238	F	31.2	Very low	37.3	Very low	191 Å²	191	127.3 Å²	127.3	84%	0.838	73%	0.733	S	S	*	*			trans	-68.1	131.6	163.7	-86.7	-86.7	0	0	0	107.8	P236 Q240	P236-F238 PolarHBondContact O-N 3.09Å; F238-Q240 PolarHBondContact O-N 2.8Å
239	P	30.7	Very low	36.3	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	75%	0.748	S	S	*	*			trans	-60.6	126.7	172.3	23.9	-30.8	0	0	0	109	Q241	P239-Q241 PolarHBondContact O-N 2.95Å
240	Q	29.8	Very low	35.4	Very low	195 Å²	195	135.8 Å²	135.8	91%	0.911	77%	0.765	S	S	*	*			trans	-70.5	89.4	-179.5	-164	171.8	14	0	0	108.8	F238	F238-Q240 PolarHBondContact O-N 2.8Å
241	Q	28.8	Very low	34.7	Very low	178 Å²	178	137 Å²	137	83%	0.832	77%	0.77	S	S	*	*			trans	-79	120.1	163.7	-92.4	177.8	-9.2	0	0	108.7	P239 L243	P239-Q241 PolarHBondContact O-N 2.95Å; Q241-L243 PolarHBondContact O-N 3.39Å
242	T	28.8	Very low	34.2	Very low	132 Å²	132	139.9 Å²	139.9	81%	0.81	78%	0.778	S	S	*	*			trans	-62.3	116.8	169.6	42	0	0	0	0	109.9
243	L	27.6	Very low	33.3	Very low	170 Å²	170	142.8 Å²	142.8	89%	0.89	78%	0.784	S	S	*	*			trans	-133.8	132.2	162.2	-131.9	85.8	0	0	0	110.1	Q241	Q241-L243 PolarHBondContact O-N 3.39Å
244	S	26.2	Very low	32.7	Very low	112 Å²	112	147.3 Å²	147.3	78%	0.783	79%	0.787	S	S	*	*			trans	-60.9	168.2	-176.9	-50.1	0	0	0	0	113.9
245	P	37.4	Very low	32.3	Very low	121 Å²	121	149.9 Å²	149.9	79%	0.786	79%	0.786	S	S	*	*			trans	-88.9	132.9	-164.4	34.6	-28.6	0	0	0	112
246	D	27.6	Very low	32.1	Very low	155 Å²	155	150.4 Å²	150.4	83%	0.829	79%	0.79	S	S	*	*				-178.4	174.8	121.2	-125.4	-12.2	0	0	0	112.4
247	P	45.3	Very low	31.7	Very low	111 Å²	111	149 Å²	149	72%	0.721	78%	0.782	S	S	*	*				-109.5	145.5	-112.2	38.5	-25.9	0	0	0	113.8
248	A	29.6	Very low	31.7	Very low	88 Å²	88	151.9 Å²	151.9	73%	0.727	78%	0.778	S	S	*	*			trans	-146.3	88.4	164.2	0	0	0	0	0	111.5	L250	A248-L250 PolarHBondContact O-N 3.43Å
249	H	36.7	Very low	31.8	Very low	197 Å²	197	148.7 Å²	148.7	91%	0.912	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	81.3	153.2	-112.5	-100	0	0	0	109.2
250	L	35.5	Very low	31.8	Very low	163 Å²	163	150.7 Å²	150.7	85%	0.853	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.2	5.6	162.4	-131.9	73.3	0	0	0	117.1	A248	A248-L250 PolarHBondContact O-N 3.43Å
251	E	33.9	Very low	31.7	Very low	144 Å²	144	148 Å²	148	67%	0.673	77%	0.769	S	S	*	*	S	Bend	trans	-104.1	-4.7	-173.9	-79.4	-95.6	134.2	0	0	114.6	K253	E251-K253 VanDerWaalsContact C-N 3.31Å; E251-K253 PolarHBondContact O-N 2.92Å
252	L	34.5	Very low	31.9	Very low	158 Å²	158	146.2 Å²	146.2	83%	0.827	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	-6.7	-176.4	-149.2	75.2	0	0	0	114.4
253	K	28.3	Very low	32.1	Very low	197 Å²	197	144 Å²	144	86%	0.857	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	-16.7	177.9	-112.4	-179.4	179.5	-179	0	113.9	E251	E251-K253 VanDerWaalsContact C-N 3.31Å; E251-K253 PolarHBondContact O-N 2.92Å
254	R	29	Very low	32.1	Very low	187 Å²	187	144 Å²	144	71%	0.706	77%	0.766	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-20.9	-179.7	-164	174.9	-82.7	177.7	-5.3	113.1
255	Y	31.6	Very low	32.2	Very low	164 Å²	164	142.7 Å²	142.7	64%	0.643	77%	0.771	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.5	-21.8	-175.7	-155.3	-98.8	0	0	0	114.5	R235	R235-Y255 PolarHBondContact NH2-OH 3.09Å
256	Y	30.7	Very low	31.6	Very low	203 Å²	203	140.4 Å²	140.4	80%	0.796	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	-9.3	177.6	-103	-86.2	0	0	0	114.4
257	S	27.6	Very low	32.1	Very low	72 Å²	72	139.8 Å²	139.8	50%	0.503	77%	0.774	S	S	.	*	S	Bend	trans	-85.2	-14	-174.2	-172.2	0	0	0	0	114.6
258	I	35.4	Very low	31	Very low	137 Å²	137	138 Å²	138	70%	0.703	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	-7.3	-168.3	-63	176.4	0	0	0	113.1
259	C	32.9	Very low	30.7	Very low	124 Å²	124	142.6 Å²	142.6	84%	0.838	78%	0.779	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	4.6	179.2	-73.6	0	0	0	0	114.7
260	Q	30.3	Very low	30.1	Very low	157 Å²	157	140.8 Å²	140.8	73%	0.734	77%	0.771	S	S	*	*	S	Bend	trans	-109.5	-12.2	-174.2	-150	156.4	1	0	0	114.8
261	D	27.3	Very low	29.7	Very low	137 Å²	137	142 Å²	142	73%	0.733	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	4.7	-171.6	-76.3	-23.9	0	0	0	116.3
262	T	34.6	Very low	29.2	Very low	141 Å²	141	147.1 Å²	147.1	87%	0.865	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.9	11.8	175.1	20.7	0	0	0	0	114.5
263	A	32.2	Very low	28.7	Very low	87 Å²	87	143.5 Å²	143.5	72%	0.719	79%	0.786	S	S	*	*	S	Bend	trans	-104.3	-2.2	-177.7	0	0	0	0	0	115.9
264	L	27.3	Very low	28.5	Very low	168 Å²	168	137.8 Å²	137.8	88%	0.88	78%	0.784	S	S	*	*			trans	-131	120.6	-178	-75.9	162.2	0	0	0	111.5
265	G	29.5	Very low	28.2	Very low	86 Å²	86	137.2 Å²	137.2	89%	0.887	79%	0.789	S	S	*	*			trans	-75.7	163.7	-175.8	0	0	0	0	0	114.8
266	G	24.2	Very low	27.8	Very low	73 Å²	73	137.8 Å²	137.8	75%	0.753	80%	0.803	S	S	*	*			trans	167.2	129.9	167.2	0	0	0	0	0	111.4
267	P	37.1	Very low	27.4	Very low	142 Å²	142	137.1 Å²	137.1	92%	0.922	80%	0.804	S	S	*	*			trans	-89.6	136	-178	34.3	-29	0	0	0	111
268	G	23.9	Very low	27.1	Very low	73 Å²	73	144 Å²	144	75%	0.753	82%	0.819	S	S	*	*			trans	-170.1	99.5	177.1	0	0	0	0	0	114.2
269	F	22.4	Very low	26.5	Very low	185 Å²	185	144.9 Å²	144.9	81%	0.811	82%	0.82	S	S	*	*			trans	48.1	115.8	134.5	-137	-113.2	0	0	0	119.6
270	Q	23.6	Very low	26.2	Very low	159 Å²	159	147.4 Å²	147.4	74%	0.743	82%	0.819	S	S	*	*				164.8	123	87.7	-161	155.9	2.1	0	0	110.8
271	E	27.2	Very low	25.9	Very low	189 Å²	189	148.8 Å²	148.8	88%	0.883	82%	0.823	S	S	*	*			trans	-65.9	135.3	168	-73.4	179.8	134.6	0	0	111.1
272	R	24.3	Very low	25.9	Very low	250 Å²	250	147.5 Å²	147.5	94%	0.943	82%	0.82	S	S	*	*			trans	-153	128.8	145.6	-137.7	171.4	-149.6	-134.2	1.5	110.9
273	G	23	Very low	25.4	Very low	82 Å²	82	151.4 Å²	151.4	85%	0.845	82%	0.819	S	S	*	*			trans	-77.7	179.3	-166.9	0	0	0	0	0	116.6
274	G	23.9	Very low	25.1	Very low	78 Å²	78	153.9 Å²	153.9	80%	0.804	82%	0.82	S	S	*	*			trans	159.3	89.2	174.6	0	0	0	0	0	110.8
275	E	22.5	Very low	25.2	Very low	175 Å²	175	151.1 Å²	151.1	82%	0.818	82%	0.815	S	S	*	*			trans	-60.2	130.3	165.9	-97.6	177.4	107.6	0	0	110.9
276	L	23.6	Very low	25	Very low	176 Å²	176	155.2 Å²	155.2	92%	0.921	82%	0.815	S	S	*	*			trans	-142.4	109.1	152.1	-124.2	114.3	0	0	0	109.3
277	K	22	Very low	24.9	Very low	188 Å²	188	156.5 Å²	156.5	82%	0.817	81%	0.813	S	S	*	*			trans	-68.4	135.4	172.3	-75.6	176.4	176.1	173.3	0	110.4
278	R	21.8	Very low	24.7	Very low	217 Å²	217	155.6 Å²	155.6	82%	0.819	81%	0.807	S	S	*	*			trans	-159.3	114.4	145.4	-153.2	165.4	178.3	165.6	2.9	114.3
279	E	22.8	Very low	24.8	Very low	155 Å²	155	158.5 Å²	158.5	72%	0.724	81%	0.81	S	S	*	*			trans	54.4	115.2	142.7	-63.4	173.4	139.5	0	0	121.2
280	E	27.5	Very low	25.4	Very low	177 Å²	177	155.6 Å²	155.6	83%	0.827	80%	0.802	S	S	*	*			trans	-52.6	125.4	159	-171.9	176.8	-167.2	0	0	112.9
281	K	22.6	Very low	25.8	Very low	186 Å²	186	152.3 Å²	152.3	81%	0.809	80%	0.802	S	S	*	*			trans	-149.2	94.3	150.9	-151.3	168.7	-169.7	168.4	0	111.7	R283	K281-R283 PolarHBondContact O-N 3.42Å; K281-R283 VanDerWaalsContact O-N 3.1Å
282	T	27.5	Very low	26.1	Very low	110 Å²	110	146.8 Å²	146.8	68%	0.675	78%	0.783	S	S	*	*			trans	-52.2	107.2	162.2	-40.5	0	0	0	0	109.5
283	R	23.9	Very low	26.6	Very low	224 Å²	224	144.2 Å²	144.2	85%	0.845	78%	0.778	S	S	*	*			trans	-126.4	89	163.4	-129.9	179.8	-165.1	178.3	3.2	108.9	K281	K281-R283 PolarHBondContact O-N 3.42Å; K281-R283 VanDerWaalsContact O-N 3.1Å
284	N	26.4	Very low	27.3	Very low	139 Å²	139	145.3 Å²	145.3	74%	0.743	76%	0.764	S	S	*	*			trans	-51.8	147.6	153.4	-77.1	-26.9	0	0	0	109.2
285	S	29.3	Very low	28.1	Very low	109 Å²	109	144.7 Å²	144.7	76%	0.762	75%	0.747	S	S	*	*			trans	95.4	81.6	171	74.7	0	0	0	0	117.9
286	L	25.7	Very low	28.7	Very low	172 Å²	172	141.6 Å²	141.6	90%	0.901	74%	0.736	S	S	*	*			trans	-137.6	111.9	141.5	-92	108.2	0	0	0	110.1
287	S	22.6	Very low	29.5	Very low	100 Å²	100	136.6 Å²	136.6	70%	0.699	71%	0.708	S	S	*	*			trans	-49.5	145.2	165.5	-13.6	0	0	0	0	110.8	T289	S287-T289 PolarHBondContact O-N 3.03Å; S287-T289 VanDerWaalsContact O-N 3.07Å
288	P	31.4	Very low	30.6	Very low	123 Å²	123	131.5 Å²	131.5	80%	0.799	69%	0.692	S	S	*	*			trans	-76.7	101.5	171.6	30.4	-28.3	0	0	0	108.7	I290	P288-I290 PolarHBondContact O-N 3.4Å
289	T	27.7	Very low	31.6	Very low	135 Å²	135	128.7 Å²	128.7	83%	0.828	68%	0.682	S	S	*	*			trans	-62.6	117.8	170.8	-46.6	0	0	0	0	109.1	S287 A291	S287-T289 PolarHBondContact O-N 3.03Å; S287-T289 VanDerWaalsContact O-N 3.07Å; T289-A291 PolarHBondContact O-N 3.29Å
290	I	35	Very low	32.4	Very low	123 Å²	123	129 Å²	129	63%	0.631	68%	0.681	S	S	*	*			trans	-76.2	112.8	178.9	-59.9	165.9	0	0	0	107.9	P288 P292 L315	P288-I290 PolarHBondContact O-N 3.4Å; I290-P292 WeakPolarHBondContact O-CD 3.22Å; I290-L315 HydrophobicContact CD1-CD2 4.32Å; I290-L315 HydrophobicContact CG2-CD2 3.77Å
291	A	32	Very low	33.5	Very low	91 Å²	91	124.4 Å²	124.4	75%	0.752	66%	0.662	S	S	*	*			trans	-74.4	122.1	167.5	0	0	0	0	0	109.2	T289	T289-A291 PolarHBondContact O-N 3.29Å
292	P	32.1	Very low	34.7	Very low	73 Å²	73	122 Å²	122	47%	0.474	67%	0.668	S	S	.	*			trans	-76.2	144.8	180	28.2	-30.1	0	0	0	111.7	I290 L294 L312	I290-P292 WeakPolarHBondContact O-CD 3.22Å; P292-L294 PolarHBondContact O-N 2.93Å; P292-L312 HydrophobicContact CB-CD1 3.38Å; P292-L312 HydrophobicContact CG-CD1 3.91Å
293	K	35.8	Very low	35.7	Very low	195 Å²	195	122.5 Å²	122.5	85%	0.848	67%	0.666	S	S	*	*			trans	-81.8	108.4	170.5	-121.2	-178	-179.5	-174.6	0	108.6
294	L	37.4	Very low	36.7	Very low	105 Å²	105	114.4 Å²	114.4	55%	0.55	65%	0.653	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-77.4	125.2	172.7	-118	57.9	0	0	0	109.4	P292 L310 L312	P292-L294 PolarHBondContact O-N 2.93Å; L294-L310 HydrophobicContact CB-CD2 3.92Å; L294-L310 HydrophobicContact CD2-CB 4.32Å; L294-L310 HydrophobicContact CD2-CD1 3.84Å; L294-L310 HydrophobicContact CD2-CD2 3.57Å; L294-L310 HydrophobicContact CD2-CG 4.1Å; L294-L310 HydrophobicContact CG-CB 4.26Å; L294-L310 HydrophobicContact CG-CD2 3.57Å; L294-L310 HydrophobicContact CG-CG 4.34Å; L294-L312 HydrophobicContact CD1-CD1 4.08Å
295	S	39.6	Very low	37.3	Very low	65 Å²	65	117.5 Å²	117.5	46%	0.455	65%	0.654	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.6	129.2	170.4	53.5	0	0	0	0	109.9	K311	S295-K311 PolarHBondContact N-O 2.87Å; S295-K311 PolarHBondContact O-N 3.33Å; S295-K311 PolarHBondContact OG-O 3.41Å
296	L	36.8	Very low	38	Very low	111 Å²	111	117.6 Å²	117.6	58%	0.581	65%	0.646	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.3	114.4	-178.9	-157.5	82	0	0	0	109.3	V298 T308 L310	L296-V298 HydrophobicContact CD2-CG2 4.34Å; L296-T308 HydrophobicContact CD1-CG2 3.41Å; L296-T308 VanDerWaalsContact CD1-CG2 3.41Å; L296-T308 HydrophobicContact CD2-CG2 3.69Å; L296-T308 HydrophobicContact CG-CG2 3.44Å; L296-T308 VanDerWaalsContact CG-CG2 3.44Å; L296-L310 HydrophobicContact CD1-CD2 3.58Å; L296-L310 HydrophobicContact CD1-CG 3.86Å
297	E	40.4	Very low	38.5	Very low	71 Å²	71	112.2 Å²	112.2	33%	0.332	62%	0.622	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.7	119.1	171.4	-162.6	-175.3	151.8	0	0	107.9	R299 S309 K311	E297-R299 IonicContact OE1-CZ 3.73Å; E297-R299 IonicContact OE1-NE 3.59Å; E297-R299 IonicContact OE1-NH2 2.99Å; E297-R299 PolarHBondContact OE1-NH2 2.63Å; E297-S309 PolarHBondContact N-O 3.49Å; E297-S309 PolarHBondContact O-N 3.07Å; E297-K311 IonicContact OE2-NZ 3.1Å; E297-K311 PolarHBondContact OE2-NZ 2.84Å
298	V	44.3	Very low	39.4	Very low	80 Å²	80	111.4 Å²	111.4	49%	0.485	61%	0.613	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-98.3	115.6	175.7	178.1	0	0	0	0	108	L296 L306 T308	L296-V298 HydrophobicContact CD2-CG2 4.34Å; V298-L306 HydrophobicContact CG1-CB 4.49Å; V298-L306 HydrophobicContact CG1-CD2 3.33Å; V298-L306 HydrophobicContact CG1-CG 3.77Å; V298-T308 HydrophobicContact CG2-CG2 4.33Å
299	R	42.7	Very low	39.8	Very low	158 Å²	158	108.3 Å²	108.3	60%	0.596	59%	0.594	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-117	129.6	180	-161.9	178.1	-80.2	-157.5	-5.3	109.9	E297 S307	E297-R299 IonicContact OE1-CZ 3.73Å; E297-R299 IonicContact OE1-NE 3.59Å; E297-R299 IonicContact OE1-NH2 2.99Å; E297-R299 PolarHBondContact OE1-NH2 2.63Å; R299-S307 PolarHBondContact N-O 2.96Å; R299-S307 PolarHBondContact O-N 3.15Å
300	K	39.3	Very low	40.3	Very low	161 Å²	161	106.7 Å²	106.7	70%	0.7	58%	0.58	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-87.4	119.7	177.7	-155.1	173.4	-170.9	-175.7	0	108.7	L306	K300-L306 HydrophobicContact CD-CD1 4.36Å; K300-L306 HydrophobicContact CG-CD1 3.94Å
301	L	51.5	Low	40.4	Very low	82 Å²	82	105.8 Å²	105.8	43%	0.429	57%	0.572	S	S	.	*			trans	-82.4	157.1	176.1	-76.3	84.7	0	0	0	110.7	N303 G304 R305	L301-N303 WeakPolarHBondContact CB-OD1 3.18Å; L301-N303 PolarHBondContact O-N 2.97Å; L301-G304 PolarHBondContact O-N 3.33Å; L301-R305 PolarHBondContact N-O 3.18Å
302	S	46.4	Very low	40.8	Very low	134 Å²	134	106.5 Å²	106.5	94%	0.937	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	-18.9	-175	58.9	0	0	0	0	114.5	G304	S302-G304 VanDerWaalsContact C-N 3.35Å
303	N	49.2	Very low	41.1	Very low	121 Å²	121	104.6 Å²	104.6	65%	0.647	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	17.8	175.5	36.8	3.4	0	0	0	113.5	L301 R305	L301-N303 WeakPolarHBondContact CB-OD1 3.18Å; L301-N303 PolarHBondContact O-N 2.97Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 2.89Å
304	G	46.1	Very low	40.8	Very low	54 Å²	54	101.3 Å²	101.3	56%	0.557	55%	0.554	S	S	*	*	S	Bend	trans	80.1	-6.4	170.4	0	0	0	0	0	115.9	L301 S302	L301-G304 PolarHBondContact O-N 3.33Å; S302-G304 VanDerWaalsContact C-N 3.35Å
305	R	38.3	Very low	40.9	Very low	204 Å²	204	101.7 Å²	101.7	77%	0.77	56%	0.556	S	S	*	*			trans	-82	138.2	174.4	-82.9	-179.5	165.4	178.8	-4.1	111.8	L301 N303	L301-R305 PolarHBondContact N-O 3.18Å; N303-R305 VanDerWaalsContact C-N 3.27Å; N303-R305 PolarHBondContact O-N 2.89Å
306	L	43.2	Very low	40.8	Very low	112 Å²	112	106.6 Å²	106.6	59%	0.586	57%	0.572	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.6	128.4	168.6	-101.2	73.3	0	0	0	109.5	V298 K300	V298-L306 HydrophobicContact CG1-CB 4.49Å; V298-L306 HydrophobicContact CG1-CD2 3.33Å; V298-L306 HydrophobicContact CG1-CG 3.77Å; K300-L306 HydrophobicContact CD-CD1 4.36Å; K300-L306 HydrophobicContact CG-CD1 3.94Å
307	S	36.3	Very low	40.8	Very low	59 Å²	59	107 Å²	107	41%	0.413	58%	0.581	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-107.6	128.1	167.5	178.7	0	0	0	0	109.5	R299	R299-S307 PolarHBondContact N-O 2.96Å; R299-S307 PolarHBondContact O-N 3.15Å
308	T	42	Very low	40.8	Very low	82 Å²	82	114.4 Å²	114.4	50%	0.503	61%	0.606	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105.7	114.1	179.3	-47.9	0	0	0	0	108.1	L296 V298	L296-T308 HydrophobicContact CD1-CG2 3.41Å; L296-T308 VanDerWaalsContact CD1-CG2 3.41Å; L296-T308 HydrophobicContact CD2-CG2 3.69Å; L296-T308 HydrophobicContact CG-CG2 3.44Å; L296-T308 VanDerWaalsContact CG-CG2 3.44Å; V298-T308 HydrophobicContact CG2-CG2 4.33Å
309	S	39.5	Very low	40.8	Very low	58 Å²	58	112.6 Å²	112.6	41%	0.406	60%	0.604	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.5	127.8	179.6	174.3	0	0	0	0	109.7	E297 K311	E297-S309 PolarHBondContact N-O 3.49Å; E297-S309 PolarHBondContact O-N 3.07Å; S309-K311 PolarHBondContact O-N 3.1Å
310	L	38.1	Very low	41	Very low	102 Å²	102	106.2 Å²	106.2	53%	0.534	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.5	105	171.3	-80.1	159.3	0	0	0	108.7	L294 L296	L294-L310 HydrophobicContact CB-CD2 3.92Å; L294-L310 HydrophobicContact CD2-CB 4.32Å; L294-L310 HydrophobicContact CD2-CD1 3.84Å; L294-L310 HydrophobicContact CD2-CD2 3.57Å; L294-L310 HydrophobicContact CD2-CG 4.1Å; L294-L310 HydrophobicContact CG-CB 4.26Å; L294-L310 HydrophobicContact CG-CD2 3.57Å; L294-L310 HydrophobicContact CG-CG 4.34Å; L296-L310 HydrophobicContact CD1-CD2 3.58Å; L296-L310 HydrophobicContact CD1-CG 3.86Å
311	K	38.3	Very low	41.6	Very low	103 Å²	103	101.7 Å²	101.7	45%	0.448	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.6	128.6	170.2	-93.1	-179.2	-173	154.5	0	110.1	S295 E297 S309 G313	S295-K311 PolarHBondContact N-O 2.87Å; S295-K311 PolarHBondContact O-N 3.33Å; S295-K311 PolarHBondContact OG-O 3.41Å; E297-K311 IonicContact OE2-NZ 3.1Å; E297-K311 PolarHBondContact OE2-NZ 2.84Å; S309-K311 PolarHBondContact O-N 3.1Å; K311-G313 PolarHBondContact O-N 3.45Å
312	L	38.9	Very low	41.6	Very low	107 Å²	107	104.3 Å²	104.3	56%	0.56	58%	0.583	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.7	102.8	163.3	-163.5	69.7	0	0	0	107.4	P292 L294	P292-L312 HydrophobicContact CB-CD1 3.38Å; P292-L312 HydrophobicContact CG-CD1 3.91Å; L294-L312 HydrophobicContact CD1-CD1 4.08Å
313	G	38.1	Very low	41.7	Very low	32 Å²	32	106.9 Å²	106.9	33%	0.33	57%	0.572	S	S	.	*			trans	-58.4	145.6	174.3	0	0	0	0	0	110.3	K311 L315	K311-G313 PolarHBondContact O-N 3.45Å; G313-L315 PolarHBondContact O-N 3.49Å; G313-L315 VanDerWaalsContact O-N 3.15Å
314	P	31	Very low	41.9	Very low	126 Å²	126	104.2 Å²	104.2	82%	0.818	56%	0.556	S	S	*	*			trans	-57.2	125.4	-179.8	21.3	-29.5	0	0	0	109.5	Q316	P314-Q316 PolarHBondContact O-N 3.43Å
315	L	38.7	Very low	42.4	Very low	113 Å²	113	107.8 Å²	107.8	59%	0.592	56%	0.556	S	S	*	*			trans	-60.7	87.2	170.4	-90.4	119.7	0	0	0	108.7	I290 G313 P317	I290-L315 HydrophobicContact CD1-CD2 4.32Å; I290-L315 HydrophobicContact CG2-CD2 3.77Å; G313-L315 PolarHBondContact O-N 3.49Å; G313-L315 VanDerWaalsContact O-N 3.15Å; L315-P317 VanDerWaalsContact O-CD 3.25Å; L315-P317 WeakPolarHBondContact O-CD 3.5Å
316	Q	37.3	Very low	43.5	Very low	169 Å²	169	103.3 Å²	103.3	79%	0.79	54%	0.542	S	S	*	.			trans	-78.9	112.1	165.9	-122	179.4	15.4	0	0	107.3	P314 R318	P314-Q316 PolarHBondContact O-N 3.43Å; Q316-R318 PolarHBondContact O-N 3.23Å
317	P	36.4	Very low	44.3	Very low	118 Å²	118	99.6 Å²	99.6	77%	0.766	53%	0.528	S	S	*	.			trans	-69.3	102.6	178.4	26	-25.8	0	0	0	107.9	L315 G319	L315-P317 VanDerWaalsContact O-CD 3.25Å; L315-P317 WeakPolarHBondContact O-CD 3.5Å; P317-G319 PolarHBondContact O-N 2.98Å
318	R	41.6	Very low	45.6	Very low	227 Å²	227	98.3 Å²	98.3	86%	0.857	52%	0.517	S	S	*	.			trans	-70.1	37.3	171.2	-78.4	-176.2	171.2	178.9	-2.3	112.6	R222 Q316	R222-R318 PolarHBondContact NE-O 2.98Å; R222-R318 PolarHBondContact NH2-O 3.36Å; Q316-R318 PolarHBondContact O-N 3.23Å
319	G	42.9	Very low	47	Very low	43 Å²	43	99.5 Å²	99.5	44%	0.443	52%	0.517	S	S	.	.	S	Bend	trans	-83.9	148.7	168.6	0	0	0	0	0	110.8	P317 P321	P317-G319 PolarHBondContact O-N 2.98Å; G319-P321 VanDerWaalsContact O-CD 3.31Å; G319-P321 WeakPolarHBondContact O-CD 3.45Å
320	V	47.7	Very low	48.4	Very low	23 Å²	23	97.7 Å²	97.7	14%	0.139	50%	0.502	C	S	.	.			trans	-76.1	109.2	149.1	152.3	0	0	0	0	98.2	L322 E324	V320-L322 PolarHBondContact O-N 2.78Å; V320-E324 WeakPolarHBondContact CA-OE2 3.19Å; V320-E324 HydrophobicContact CB-CB 4.49Å; V320-E324 WeakPolarHBondContact CB-OE2 3.47Å; V320-E324 HydrophobicContact CG1-CB 3.37Å; V320-E324 HydrophobicContact CG1-CG 4.3Å; V320-E324 WeakPolarHBondContact CG1-OE2 3.38Å; V320-E324 WeakPolarHBondContact CG2-OE2 3.46Å
321	P	52.4	Low	49.7	Very low	66 Å²	66	93.5 Å²	93.5	43%	0.429	48%	0.481	S	S	.	.			trans	-44.9	142.7	179.6	-28.4	35.5	0	0	0	109.2	G319 R323 E324	G319-P321 VanDerWaalsContact O-CD 3.31Å; G319-P321 WeakPolarHBondContact O-CD 3.45Å; P321-R323 HydrophobicContact CB-CB 4.01Å; P321-R323 PolarHBondContact O-N 3.45Å; P321-E324 VanDerWaalsContact CD-CD 3.42Å; P321-E324 WeakPolarHBondContact CD-OE1 3.48Å; P321-E324 HydrophobicContact CG-CG 4.47Å; P321-E324 WeakPolarHBondContact O-CB 3.46Å; P321-E324 PolarHBondContact O-N 2.97Å
322	L	50.5	Low	51.4	Low	137 Å²	137	91.2 Å²	91.2	72%	0.717	48%	0.481	S	S	*	.	H	α-helix	trans	-48.4	-28.2	173.9	-140.7	86.3	0	0	0	111.6	V320 K325 K326	V320-L322 PolarHBondContact O-N 2.78Å; L322-K325 PolarHBondContact O-N 3.11Å; L322-K326 PolarHBondContact O-N 3.37Å
323	R	48.7	Very low	53.5	Low	188 Å²	188	88.7 Å²	88.7	71%	0.709	47%	0.468	S	S	*	.	H	α-helix	trans	-57.2	-40	171.1	-160.8	174.3	174.6	-171.4	-1.6	114.4	P321 K326 A327	P321-R323 HydrophobicContact CB-CB 4.01Å; P321-R323 PolarHBondContact O-N 3.45Å; R323-K326 PolarHBondContact O-N 3.43Å; R323-A327 WeakPolarHBondContact O-CB 3.49Å; R323-A327 PolarHBondContact O-N 2.96Å
324	E	53.8	Low	55.4	Low	66 Å²	66	87.6 Å²	87.6	31%	0.308	46%	0.455	S	S	.	.	H	α-helix	trans	-72.8	-33.1	179.5	-78.3	179.5	-168.8	0	0	112.8	V320 P321 T328	V320-E324 WeakPolarHBondContact CA-OE2 3.19Å; V320-E324 HydrophobicContact CB-CB 4.49Å; V320-E324 WeakPolarHBondContact CB-OE2 3.47Å; V320-E324 HydrophobicContact CG1-CB 3.37Å; V320-E324 HydrophobicContact CG1-CG 4.3Å; V320-E324 WeakPolarHBondContact CG1-OE2 3.38Å; V320-E324 WeakPolarHBondContact CG2-OE2 3.46Å; P321-E324 VanDerWaalsContact CD-CD 3.42Å; P321-E324 WeakPolarHBondContact CD-OE1 3.48Å; P321-E324 HydrophobicContact CG-CG 4.47Å; P321-E324 WeakPolarHBondContact O-CB 3.46Å; P321-E324 PolarHBondContact O-N 2.97Å; E324-T328 PolarHBondContact O-N 3.12Å; E324-T328 VanDerWaalsContact O-N 3.09Å; E324-T328 PolarHBondContact O-OG1 3.19Å
325	K	56.3	Low	57.7	Low	128 Å²	128	82.6 Å²	82.6	56%	0.557	42%	0.421	S	S	*	.	H	α-helix	trans	-64.6	-46.9	171.3	-91.1	-172	174.2	-175.4	0	111.6	L322 A327 T328 Q329	L322-K325 PolarHBondContact O-N 3.11Å; K325-A327 VanDerWaalsContact C-N 3.33Å; K325-T328 PolarHBondContact O-N 3.22Å; K325-Q329 PolarHBondContact O-N 3.2Å; K325-Q329 VanDerWaalsContact O-N 3.1Å
326	K	62.2	Low	60	Low	110 Å²	110	78.7 Å²	78.7	48%	0.478	41%	0.408	S	S	.	.	H	α-helix	trans	-63.8	-39.9	178.3	-69.3	-174.3	177	-171.6	0	111.5	L322 R323 Q329 M330	L322-K326 PolarHBondContact O-N 3.37Å; R323-K326 PolarHBondContact O-N 3.43Å; K326-Q329 PolarHBondContact O-N 3.37Å; K326-M330 PolarHBondContact O-N 3.47Å
327	A	58.7	Low	62.4	Low	34 Å²	34	71.5 Å²	71.5	28%	0.281	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-41.3	176	0	0	0	0	0	112.7	R323 K325 V331	R323-A327 WeakPolarHBondContact O-CB 3.49Å; R323-A327 PolarHBondContact O-N 2.96Å; K325-A327 VanDerWaalsContact C-N 3.33Å; A327-V331 WeakPolarHBondContact O-CG2 3.38Å; A327-V331 PolarHBondContact O-N 3.04Å
328	T	64.4	Low	64.7	Low	32 Å²	32	66 Å²	66	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-69.7	-36.8	177.9	-48.4	0	0	0	0	112	I211 L215 E324 K325 V331 A332	I211-T328 HydrophobicContact CG2-CG2 3.81Å; L215-T328 HydrophobicContact CD1-CG2 3.64Å; E324-T328 PolarHBondContact O-N 3.12Å; E324-T328 VanDerWaalsContact O-N 3.09Å; E324-T328 PolarHBondContact O-OG1 3.19Å; K325-T328 PolarHBondContact O-N 3.22Å; T328-V331 PolarHBondContact O-N 3.16Å; T328-A332 PolarHBondContact O-N 2.93Å; T328-A332 VanDerWaalsContact O-N 3.1Å
329	Q	71.2	Confident	66.9	Low	108 Å²	108	57.3 Å²	57.3	51%	0.505	31%	0.312	S	S	.	.	H	α-helix	trans	-63.9	-46.8	177.2	179.2	178.3	-12.4	0	0	112	K325 K326 V331 A332 I333	K325-Q329 PolarHBondContact O-N 3.2Å; K325-Q329 VanDerWaalsContact O-N 3.1Å; K326-Q329 PolarHBondContact O-N 3.37Å; Q329-V331 PolarHBondContact O-N 3.16Å; Q329-A332 PolarHBondContact O-N 3.01Å; Q329-I333 HydrophobicContact CG-CD1 4.04Å; Q329-I333 WeakPolarHBondContact O-CG1 3.42Å; Q329-I333 PolarHBondContact O-N 3.41Å; Q329-I333 VanDerWaalsContact O-N 3.1Å
330	M	69.1	Low	69.3	Low	19 Å²	19	60 Å²	60	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-51.9	-44.5	176.1	175.5	-173.1	176.2	0	0	110.9	K326 I333 V334 Y383 F386 N387	K326-M330 PolarHBondContact O-N 3.47Å; M330-I333 WeakPolarHBondContact O-CB 3.37Å; M330-I333 PolarHBondContact O-N 3.38Å; M330-V334 WeakPolarHBondContact O-CG2 3.37Å; M330-V334 PolarHBondContact O-N 3.3Å; M330-Y383 HydrophobicContact CE-CD1 3.13Å; M330-Y383 HydrophobicContact CE-CE1 3.69Å; M330-Y383 HydrophobicContact CE-CG 3.95Å; M330-F386 HydrophobicContact CB-CB 4.02Å; M330-F386 HydrophobicContact CG-CB 4.05Å; M330-N387 HydrophobicContact CE-CB 4.33Å; M330-N387 HydrophobicContact SD-CB 4.23Å
331	V	66.4	Low	71.5	Confident	15 Å²	15	59.1 Å²	59.1	9%	0.091	31%	0.314	C	S	.	.	H	α-helix	trans	-75.8	-33.5	-174.1	-177.8	0	0	0	0	112.5	I124 R128 Y208 A327 T328 Q329 I333 V334 L335	I124-V331 HydrophobicContact CG2-CG1 4.43Å; R128-V331 HydrophobicContact CG-CG2 4.4Å; Y208-V331 HydrophobicContact CE1-CB 4.24Å; Y208-V331 HydrophobicContact CE1-CG1 3.47Å; Y208-V331 VanDerWaalsContact CE1-CG1 3.47Å; Y208-V331 WeakPolarHBondContact OH-CG1 3.19Å; A327-V331 WeakPolarHBondContact O-CG2 3.38Å; A327-V331 PolarHBondContact O-N 3.04Å; T328-V331 PolarHBondContact O-N 3.16Å; Q329-V331 PolarHBondContact O-N 3.16Å; V331-I333 VanDerWaalsContact C-N 3.28Å; V331-I333 PolarHBondContact O-N 3.16Å; V331-V334 PolarHBondContact O-N 3.49Å; V331-L335 PolarHBondContact O-N 3.07Å
332	A	74.1	Confident	73.4	Confident	54 Å²	54	57 Å²	57	45%	0.446	30%	0.298	S	S	.	.	H	α-helix	trans	-64.4	-34.3	170.7	0	0	0	0	0	112.3	T328 Q329 G336	T328-A332 PolarHBondContact O-N 2.93Å; T328-A332 VanDerWaalsContact O-N 3.1Å; Q329-A332 PolarHBondContact O-N 3.01Å; A332-G336 PolarHBondContact O-N 2.64Å
333	I	82.4	Confident	75.4	Confident	55 Å²	55	53.2 Å²	53.2	28%	0.282	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-43.5	175.5	-66.1	169.3	0	0	0	110.6	Q329 M330 V331 L335 G336 A337 I382 F386	Q329-I333 HydrophobicContact CG-CD1 4.04Å; Q329-I333 WeakPolarHBondContact O-CG1 3.42Å; Q329-I333 PolarHBondContact O-N 3.41Å; Q329-I333 VanDerWaalsContact O-N 3.1Å; M330-I333 WeakPolarHBondContact O-CB 3.37Å; M330-I333 PolarHBondContact O-N 3.38Å; V331-I333 VanDerWaalsContact C-N 3.28Å; V331-I333 PolarHBondContact O-N 3.16Å; I333-L335 VanDerWaalsContact C-N 3.32Å; I333-L335 PolarHBondContact O-N 2.92Å; I333-G336 PolarHBondContact O-N 3.32Å; I333-A337 WeakPolarHBondContact O-CB 3.49Å; I333-A337 PolarHBondContact O-N 3.17Å; I333-I382 HydrophobicContact CG2-CG2 4.19Å; I333-F386 HydrophobicContact CD1-CD1 4.02Å; I333-F386 HydrophobicContact CD1-CD2 4.14Å; I333-F386 HydrophobicContact CD1-CE1 3.52Å; I333-F386 HydrophobicContact CD1-CE2 3.66Å; I333-F386 HydrophobicContact CD1-CG 4.32Å; I333-F386 HydrophobicContact CD1-CZ 3.34Å; I333-F386 HydrophobicContact CG2-CE2 4.11Å
334	V	78.2	Confident	77.7	Confident	9 Å²	9	46.2 Å²	46.2	6%	0.055	26%	0.257	C	S	.	.	H	α-helix	trans	-57.9	-45.4	174.9	175.4	0	0	0	0	110.9	L121 M330 V331 A337 F338 I382 Y383	L121-V334 HydrophobicContact CD2-CG1 3.39Å; M330-V334 WeakPolarHBondContact O-CG2 3.37Å; M330-V334 PolarHBondContact O-N 3.3Å; V331-V334 PolarHBondContact O-N 3.49Å; V334-A337 PolarHBondContact O-N 2.87Å; V334-F338 PolarHBondContact O-N 3.26Å; V334-I382 HydrophobicContact CG2-CD1 4.34Å; V334-I382 HydrophobicContact CG2-CG2 3.68Å; V334-Y383 HydrophobicContact CG2-CE1 4.15Å
335	L	79.6	Confident	79.5	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.11	25%	0.248	C	C	.	.	H	α-helix	trans	-63.5	-43.9	176.2	-179.4	66.1	0	0	0	112.1	T204 V205 Y208 V331 I333 A337 F338 I339	T204-L335 WeakPolarHBondContact OG1-CD1 3.32Å; V205-L335 HydrophobicContact CG2-CD2 4.46Å; Y208-L335 HydrophobicContact CD2-CD2 3.49Å; Y208-L335 VanDerWaalsContact CD2-CD2 3.49Å; Y208-L335 HydrophobicContact CE2-CD2 3.94Å; Y208-L335 HydrophobicContact CG-CD2 4.27Å; V331-L335 PolarHBondContact O-N 3.07Å; I333-L335 VanDerWaalsContact C-N 3.32Å; I333-L335 PolarHBondContact O-N 2.92Å; L335-A337 VanDerWaalsContact C-N 3.34Å; L335-A337 PolarHBondContact O-N 3.44Å; L335-F338 PolarHBondContact O-N 3.34Å; L335-I339 HydrophobicContact CG-CD1 4.18Å; L335-I339 WeakPolarHBondContact O-CG1 3.47Å; L335-I339 PolarHBondContact O-N 2.96Å
336	G	85.6	Confident	81.2	Confident	31 Å²	31	38.8 Å²	38.8	32%	0.32	22%	0.223	S	C	.	.	H	α-helix	trans	-59.8	-43.6	177.8	0	0	0	0	0	112.6	A332 I333 I339 V340	A332-G336 PolarHBondContact O-N 2.64Å; I333-G336 PolarHBondContact O-N 3.32Å; G336-I339 PolarHBondContact O-N 3.43Å; G336-V340 WeakPolarHBondContact O-CG2 3.3Å; G336-V340 PolarHBondContact O-N 3.39Å; G336-V340 VanDerWaalsContact O-N 3.08Å
337	A	88.1	Confident	82.6	Confident	18 Å²	18	37.4 Å²	37.4	15%	0.149	22%	0.221	C	C	.	.	H	α-helix	trans	-59.9	-45.8	175	0	0	0	0	0	111.3	I333 V334 L335 I339 V340 C341 L378 I382	I333-A337 WeakPolarHBondContact O-CB 3.49Å; I333-A337 PolarHBondContact O-N 3.17Å; V334-A337 PolarHBondContact O-N 2.87Å; L335-A337 VanDerWaalsContact C-N 3.34Å; L335-A337 PolarHBondContact O-N 3.44Å; A337-I339 PolarHBondContact O-N 2.88Å; A337-V340 PolarHBondContact O-N 3.05Å; A337-C341 WeakPolarHBondContact O-CB 3.43Å; A337-C341 PolarHBondContact O-N 3.36Å; A337-C341 PolarHBondContact O-SG 2.78Å; A337-C341 VanDerWaalsContact O-SG 3.37Å; A337-L378 HydrophobicContact CB-CD1 4.49Å; A337-I382 HydrophobicContact CB-CD1 3.99Å
338	F	85.8	Confident	84.3	Confident	1 Å²	1	36.4 Å²	36.4	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-58.7	-44.4	177.9	-171.6	-89	0	0	0	112.5	I118 L121 F197 V334 L335 C341 W342 N375	I118-F338 HydrophobicContact CB-CE1 4.18Å; I118-F338 HydrophobicContact CB-CE2 4.33Å; I118-F338 HydrophobicContact CB-CZ 3.69Å; I118-F338 HydrophobicContact CD1-CD1 4.45Å; I118-F338 HydrophobicContact CD1-CE1 3.47Å; I118-F338 VanDerWaalsContact CD1-CE1 3.47Å; I118-F338 HydrophobicContact CD1-CZ 3.84Å; I118-F338 HydrophobicContact CG1-CE1 3.73Å; I118-F338 HydrophobicContact CG1-CZ 3.79Å; L121-F338 HydrophobicContact CD1-CB 3.93Å; L121-F338 HydrophobicContact CD1-CD1 4.45Å; L121-F338 HydrophobicContact CD1-CD2 3.47Å; L121-F338 VanDerWaalsContact CD1-CD2 3.47Å; L121-F338 HydrophobicContact CD1-CE2 4.1Å; L121-F338 HydrophobicContact CD1-CG 3.69Å; F197-F338 AromaticContact CD2-CE1 3.83Å; F197-F338 HydrophobicContact CD2-CE1 3.83Å; F197-F338 HydrophobicContact CD2-CZ 4.38Å; F197-F338 HydrophobicContact CE2-CD1 4.28Å; F197-F338 AromaticContact CE2-CE1 3.6Å; F197-F338 HydrophobicContact CE2-CE1 3.6Å; F197-F338 HydrophobicContact CE2-CZ 4.45Å; V334-F338 PolarHBondContact O-N 3.26Å; L335-F338 PolarHBondContact O-N 3.34Å; F338-C341 PolarHBondContact O-N 3.46Å; F338-W342 AromaticContact CD2-CD1 3.49Å; F338-W342 VanDerWaalsContact CD2-CD1 3.49Å; F338-W342 HydrophobicContact CD2-CG 4.49Å; F338-W342 AromaticContact CD2-NE1 3.89Å; F338-W342 HydrophobicContact CE1-CB 4.17Å; F338-W342 HydrophobicContact CE1-CG 4.23Å; F338-W342 AromaticContact CE2-CD1 3.3Å; F338-W342 HydrophobicContact CE2-CG 4.07Å; F338-W342 AromaticContact CE2-NE1 3.5Å; F338-W342 AromaticContact CG-CD1 3.94Å; F338-W342 HydrophobicContact CZ-CB 4.31Å; F338-W342 AromaticContact CZ-CD1 3.59Å; F338-W342 AromaticContact CZ-CG 3.9Å; F338-W342 HydrophobicContact CZ-CG 3.9Å; F338-W342 WeakPolarHBondContact O-CB 3.39Å; F338-W342 PolarHBondContact O-N 2.95Å; F338-N375 WeakPolarHBondContact CA-OD1 3.29Å
339	I	87.6	Confident	85.5	Confident	45 Å²	45	35.7 Å²	35.7	23%	0.231	21%	0.206	C	C	.	.	H	α-helix	trans	-61.3	-50.6	177.8	-63.6	164.9	0	0	0	110.7	F201 L335 G336 A337 C341 W342 L343	F201-I339 HydrophobicContact CD2-CG1 4.15Å; F201-I339 HydrophobicContact CE2-CD1 3.46Å; F201-I339 VanDerWaalsContact CE2-CD1 3.46Å; F201-I339 HydrophobicContact CE2-CG1 3.35Å; F201-I339 HydrophobicContact CZ-CD1 3.91Å; F201-I339 HydrophobicContact CZ-CG1 3.99Å; L335-I339 HydrophobicContact CG-CD1 4.18Å; L335-I339 WeakPolarHBondContact O-CG1 3.47Å; L335-I339 PolarHBondContact O-N 2.96Å; G336-I339 PolarHBondContact O-N 3.43Å; A337-I339 PolarHBondContact O-N 2.88Å; I339-C341 PolarHBondContact O-N 2.98Å; I339-W342 PolarHBondContact O-N 2.98Å; I339-L343 HydrophobicContact CG2-CB 4.23Å; I339-L343 HydrophobicContact CG2-CD2 4.13Å; I339-L343 WeakPolarHBondContact O-CB 3.31Å; I339-L343 PolarHBondContact O-N 3.14Å
340	V	92.8	Very high	86.4	Confident	101 Å²	101	32.5 Å²	32.5	61%	0.612	19%	0.194	S	C	*	.	H	α-helix	trans	-61.4	-36.1	-177.7	171.3	0	0	0	0	110.7	G336 A337 P344	G336-V340 WeakPolarHBondContact O-CG2 3.3Å; G336-V340 PolarHBondContact O-N 3.39Å; G336-V340 VanDerWaalsContact O-N 3.08Å; A337-V340 PolarHBondContact O-N 3.05Å; V340-P344 VanDerWaalsContact O-CD 3.31Å; V340-P344 WeakPolarHBondContact O-CD 3.47Å; V340-P344 WeakPolarHBondContact O-CG 3.01Å
341	C	93.9	Very high	87.5	Confident	4 Å²	4	35.3 Å²	35.3	3%	0.027	21%	0.208	C	C	.	.	H	α-helix	trans	-77.5	-43.2	-179.5	-72.7	0	0	0	0	114	A337 F338 I339 L371 N375	A337-C341 WeakPolarHBondContact O-CB 3.43Å; A337-C341 PolarHBondContact O-N 3.36Å; A337-C341 PolarHBondContact O-SG 2.78Å; A337-C341 VanDerWaalsContact O-SG 3.37Å; F338-C341 PolarHBondContact O-N 3.46Å; I339-C341 PolarHBondContact O-N 2.98Å; C341-L371 WeakPolarHBondContact CB-O 3.02Å; C341-N375 HydrophobicContact CB-CB 3.72Å
342	W	92.6	Very high	88.5	Confident	21 Å²	21	38.8 Å²	38.8	8%	0.08	23%	0.226	C	C	.	.	H	α-helix	trans	-100	-31.1	-168.9	-76.1	99.1	0	0	0	114.7	C114 F197 F338 I339 P344 F345 F346	C114-W342 HydrophobicContact CB-CH2 4.08Å; C114-W342 HydrophobicContact CB-CZ3 4.45Å; C114-W342 VanDerWaalsContact SG-CH2 3.53Å; C114-W342 VanDerWaalsContact SG-CZ3 3.5Å; F197-W342 HydrophobicContact CD2-CB 4.29Å; F197-W342 HydrophobicContact CE2-CB 3.64Å; F197-W342 HydrophobicContact CZ-CB 4.39Å; F338-W342 AromaticContact CD2-CD1 3.49Å; F338-W342 VanDerWaalsContact CD2-CD1 3.49Å; F338-W342 HydrophobicContact CD2-CG 4.49Å; F338-W342 AromaticContact CD2-NE1 3.89Å; F338-W342 HydrophobicContact CE1-CB 4.17Å; F338-W342 HydrophobicContact CE1-CG 4.23Å; F338-W342 AromaticContact CE2-CD1 3.3Å; F338-W342 HydrophobicContact CE2-CG 4.07Å; F338-W342 AromaticContact CE2-NE1 3.5Å; F338-W342 AromaticContact CG-CD1 3.94Å; F338-W342 HydrophobicContact CZ-CB 4.31Å; F338-W342 AromaticContact CZ-CD1 3.59Å; F338-W342 AromaticContact CZ-CG 3.9Å; F338-W342 HydrophobicContact CZ-CG 3.9Å; F338-W342 WeakPolarHBondContact O-CB 3.39Å; F338-W342 PolarHBondContact O-N 2.95Å; I339-W342 PolarHBondContact O-N 2.98Å; W342-P344 VanDerWaalsContact C-CD 3.45Å; W342-P344 VanDerWaalsContact C-N 3.34Å; W342-F345 HydrophobicContact CE3-CD1 4.08Å; W342-F345 HydrophobicContact CZ3-CD1 4.1Å; W342-F345 HydrophobicContact CZ3-CE1 4.42Å; W342-F345 PolarHBondContact O-N 3.12Å; W342-F345 VanDerWaalsContact O-N 3.14Å; W342-F346 HydrophobicContact CB-CD2 4.23Å; W342-F346 HydrophobicContact CB-CE2 4.2Å; W342-F346 HydrophobicContact CD2-CE2 4.36Å; W342-F346 HydrophobicContact CE3-CD2 4.39Å; W342-F346 AromaticContact CE3-CE2 3.71Å; W342-F346 HydrophobicContact CE3-CE2 3.71Å; W342-F346 HydrophobicContact CE3-CZ 4.46Å; W342-F346 HydrophobicContact CZ3-CE2 4.49Å; W342-F346 VanDerWaalsContact O-CD2 3.31Å; W342-F346 WeakPolarHBondContact O-CD2 3.31Å; W342-F346 PolarHBondContact O-N 2.96Å; W342-F346 VanDerWaalsContact O-N 3.1Å
343	L	92.6	Very high	89	Confident	57 Å²	57	38.2 Å²	38.2	30%	0.298	22%	0.218	S	C	.	.	H	α-helix	trans	-56.6	-42.1	-179.5	-177.4	64.7	0	0	0	112.7	F197 Y198 I339 F345 F346 L347	F197-L343 HydrophobicContact CE1-CD1 3.88Å; F197-L343 HydrophobicContact CZ-CB 4.14Å; F197-L343 HydrophobicContact CZ-CD1 4.14Å; Y198-L343 HydrophobicContact CE1-CD1 4.48Å; I339-L343 HydrophobicContact CG2-CB 4.23Å; I339-L343 HydrophobicContact CG2-CD2 4.13Å; I339-L343 WeakPolarHBondContact O-CB 3.31Å; I339-L343 PolarHBondContact O-N 3.14Å; L343-F345 VanDerWaalsContact C-N 3.33Å; L343-F345 PolarHBondContact O-N 2.99Å; L343-F346 PolarHBondContact O-N 3.13Å; L343-L347 HydrophobicContact CD1-CD1 4.15Å; L343-L347 HydrophobicContact CD1-CG 4.13Å; L343-L347 HydrophobicContact CG-CD1 3.92Å; L343-L347 HydrophobicContact CG-CG 4.34Å; L343-L347 WeakPolarHBondContact O-CB 3.34Å; L343-L347 VanDerWaalsContact O-CG 3.27Å; L343-L347 WeakPolarHBondContact O-CG 3.41Å; L343-L347 PolarHBondContact O-N 2.85Å; L343-L347 VanDerWaalsContact O-N 3.08Å
344	P	95.5	Very high	89.3	Confident	41 Å²	41	39.5 Å²	39.5	27%	0.266	22%	0.222	S	C	.	.	H	α-helix	trans	-58.6	-43.4	177	-25.5	36.8	0	0	0	112.8	V340 W342 L347 T348 T368 L371	V340-P344 VanDerWaalsContact O-CD 3.31Å; V340-P344 WeakPolarHBondContact O-CD 3.47Å; V340-P344 WeakPolarHBondContact O-CG 3.01Å; W342-P344 VanDerWaalsContact C-CD 3.45Å; W342-P344 VanDerWaalsContact C-N 3.34Å; P344-L347 PolarHBondContact O-N 3.45Å; P344-T348 WeakPolarHBondContact O-CG2 3.49Å; P344-T348 PolarHBondContact O-N 3.29Å; P344-T348 PolarHBondContact O-OG1 3.21Å; P344-T348 VanDerWaalsContact O-OG1 3.05Å; P344-T368 HydrophobicContact CB-CG2 3.65Å; P344-L371 HydrophobicContact CG-CD2 4.19Å
345	F	93	Very high	89.7	Confident	27 Å²	27	40.6 Å²	40.6	12%	0.118	23%	0.23	C	C	.	.	H	α-helix	trans	-63.8	-48.7	179.1	172.6	-98.1	0	0	0	112.3	W342 L343 L347 T348 H349 Y365	W342-F345 HydrophobicContact CE3-CD1 4.08Å; W342-F345 HydrophobicContact CZ3-CD1 4.1Å; W342-F345 HydrophobicContact CZ3-CE1 4.42Å; W342-F345 PolarHBondContact O-N 3.12Å; W342-F345 VanDerWaalsContact O-N 3.14Å; L343-F345 VanDerWaalsContact C-N 3.33Å; L343-F345 PolarHBondContact O-N 2.99Å; F345-L347 VanDerWaalsContact C-N 3.27Å; F345-L347 PolarHBondContact O-N 2.7Å; F345-T348 WeakPolarHBondContact CA-OG1 3.3Å; F345-T348 PolarHBondContact O-N 2.03Å; F345-T348 PolarHBondContact O-OG1 3.18Å; F345-H349 HydrophobicContact CZ-CB 4.43Å; F345-H349 WeakPolarHBondContact O-CB 3.45Å; F345-H349 PolarHBondContact O-N 3.27Å; F345-Y365 HydrophobicContact CE2-CE2 4.46Å
346	F	91.2	Very high	89.8	Confident	11 Å²	11	49.3 Å²	49.3	5%	0.048	27%	0.27	C	S	.	.	H	α-helix	trans	-63.1	-36.2	179.5	-79.1	-76.8	0	0	0	111.9	F197 W342 L343 V350	F197-F346 HydrophobicContact CB-CD1 3.85Å; F197-F346 HydrophobicContact CB-CD2 3.79Å; F197-F346 HydrophobicContact CB-CE1 3.58Å; F197-F346 HydrophobicContact CB-CE2 3.53Å; F197-F346 HydrophobicContact CB-CG 3.96Å; F197-F346 HydrophobicContact CB-CZ 3.43Å; F197-F346 VanDerWaalsContact CB-CZ 3.43Å; F197-F346 HydrophobicContact CD1-CB 4.01Å; F197-F346 HydrophobicContact CD1-CD1 4.31Å; F197-F346 AromaticContact CD1-CD2 3.62Å; F197-F346 HydrophobicContact CD1-CD2 3.62Å; F197-F346 HydrophobicContact CD1-CE2 4.21Å; F197-F346 AromaticContact CD1-CG 3.7Å; F197-F346 HydrophobicContact CD1-CG 3.7Å; F197-F346 AromaticContact CD2-CD2 3.37Å; F197-F346 HydrophobicContact CD2-CD2 3.37Å; F197-F346 AromaticContact CD2-CE2 3.26Å; F197-F346 HydrophobicContact CD2-CE2 3.26Å; F197-F346 HydrophobicContact CD2-CG 4.25Å; F197-F346 HydrophobicContact CD2-CZ 4.07Å; F197-F346 HydrophobicContact CE1-CB 4.2Å; F197-F346 AromaticContact CE1-CD2 3.98Å; F197-F346 HydrophobicContact CE1-CD2 3.98Å; F197-F346 HydrophobicContact CE1-CG 4.22Å; F197-F346 AromaticContact CE2-CD2 3.73Å; F197-F346 HydrophobicContact CE2-CD2 3.73Å; F197-F346 AromaticContact CE2-CE2 3.97Å; F197-F346 HydrophobicContact CE2-CE2 3.97Å; F197-F346 HydrophobicContact CG-CD1 4.14Å; F197-F346 AromaticContact CG-CD2 3.3Å; F197-F346 HydrophobicContact CG-CD2 3.3Å; F197-F346 HydrophobicContact CG-CE1 4.22Å; F197-F346 AromaticContact CG-CE2 3.41Å; F197-F346 HydrophobicContact CG-CE2 3.41Å; F197-F346 VanDerWaalsContact CG-CE2 3.41Å; F197-F346 AromaticContact CG-CG 3.72Å; F197-F346 HydrophobicContact CG-CG 3.72Å; F197-F346 AromaticContact CG-CZ 3.89Å; F197-F346 HydrophobicContact CG-CZ 3.89Å; F197-F346 HydrophobicContact CZ-CD2 4.03Å; W342-F346 HydrophobicContact CB-CD2 4.23Å; W342-F346 HydrophobicContact CB-CE2 4.2Å; W342-F346 HydrophobicContact CD2-CE2 4.36Å; W342-F346 HydrophobicContact CE3-CD2 4.39Å; W342-F346 AromaticContact CE3-CE2 3.71Å; W342-F346 HydrophobicContact CE3-CE2 3.71Å; W342-F346 HydrophobicContact CE3-CZ 4.46Å; W342-F346 HydrophobicContact CZ3-CE2 4.49Å; W342-F346 VanDerWaalsContact O-CD2 3.31Å; W342-F346 WeakPolarHBondContact O-CD2 3.31Å; W342-F346 PolarHBondContact O-N 2.96Å; W342-F346 VanDerWaalsContact O-N 3.1Å; L343-F346 PolarHBondContact O-N 3.13Å; F346-V350 WeakPolarHBondContact O-CB 3.35Å; F346-V350 VanDerWaalsContact O-CG2 3.24Å; F346-V350 WeakPolarHBondContact O-CG2 3.49Å; F346-V350 PolarHBondContact O-N 3.05Å; F346-V350 VanDerWaalsContact O-N 3.12Å
347	L	92.8	Very high	90	Very high	82 Å²	82	54.3 Å²	54.3	43%	0.429	30%	0.295	S	S	.	.	H	α-helix	trans	-66.1	-50	174.4	-69.2	173.7	0	0	0	111.8	L343 P344 F345 H349 V350 L351	L343-L347 HydrophobicContact CD1-CD1 4.15Å; L343-L347 HydrophobicContact CD1-CG 4.13Å; L343-L347 HydrophobicContact CG-CD1 3.92Å; L343-L347 HydrophobicContact CG-CG 4.34Å; L343-L347 WeakPolarHBondContact O-CB 3.34Å; L343-L347 VanDerWaalsContact O-CG 3.27Å; L343-L347 WeakPolarHBondContact O-CG 3.41Å; L343-L347 PolarHBondContact O-N 2.85Å; L343-L347 VanDerWaalsContact O-N 3.08Å; P344-L347 PolarHBondContact O-N 3.45Å; F345-L347 VanDerWaalsContact C-N 3.27Å; F345-L347 PolarHBondContact O-N 2.7Å; L347-H349 VanDerWaalsContact C-N 3.34Å; L347-H349 PolarHBondContact O-N 3.01Å; L347-V350 PolarHBondContact O-N 3.33Å; L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 WeakPolarHBondContact O-CG 3.3Å; L347-L351 PolarHBondContact O-N 3.01Å
348	T	92.7	Very high	90	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.08	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-38.4	-179.7	51.8	0	0	0	0	111.9	P344 F345 L351 N352 V360 L364 T368	P344-T348 WeakPolarHBondContact O-CG2 3.49Å; P344-T348 PolarHBondContact O-N 3.29Å; P344-T348 PolarHBondContact O-OG1 3.21Å; P344-T348 VanDerWaalsContact O-OG1 3.05Å; F345-T348 WeakPolarHBondContact CA-OG1 3.3Å; F345-T348 PolarHBondContact O-N 2.03Å; F345-T348 PolarHBondContact O-OG1 3.18Å; T348-L351 PolarHBondContact O-N 3.37Å; T348-N352 VanDerWaalsContact O-CB 3.23Å; T348-N352 WeakPolarHBondContact O-CB 3.29Å; T348-N352 PolarHBondContact O-N 2.93Å; T348-V360 HydrophobicContact CG2-CG1 4.3Å; T348-L364 HydrophobicContact CG2-CD2 4.31Å; T348-L364 HydrophobicContact CG2-CG 4.3Å; T348-T368 HydrophobicContact CG2-CG2 4.03Å; T348-T368 PolarHBondContact OG1-OG1 2.91Å
349	H	89.4	Confident	90.1	Very high	17 Å²	17	64.1 Å²	64.1	8%	0.079	34%	0.342	C	S	.	.	H	α-helix	trans	-66.9	-43.1	179.3	-167.4	72	0	0	0	112.5	F345 L347 T353 Y365	F345-H349 HydrophobicContact CZ-CB 4.43Å; F345-H349 WeakPolarHBondContact O-CB 3.45Å; F345-H349 PolarHBondContact O-N 3.27Å; L347-H349 VanDerWaalsContact C-N 3.34Å; L347-H349 PolarHBondContact O-N 3.01Å; H349-T353 WeakPolarHBondContact O-CG2 3.49Å; H349-T353 PolarHBondContact O-N 3.48Å; H349-T353 PolarHBondContact O-OG1 3.12Å; H349-Y365 HydrophobicContact CB-CE2 4.38Å; H349-Y365 AromaticContact ND1-CE2 3.8Å; H349-Y365 AromaticContact ND1-CZ 3.83Å; H349-Y365 PolarHBondContact ND1-OH 3.06Å
350	V	91.1	Very high	90.2	Very high	41 Å²	41	63 Å²	63	25%	0.248	34%	0.337	C	S	.	.	H	α-helix	trans	-66.8	-41.6	174.1	171.5	0	0	0	0	111.3	F346 L347 T353 H354	F346-V350 WeakPolarHBondContact O-CB 3.35Å; F346-V350 VanDerWaalsContact O-CG2 3.24Å; F346-V350 WeakPolarHBondContact O-CG2 3.49Å; F346-V350 PolarHBondContact O-N 3.05Å; F346-V350 VanDerWaalsContact O-N 3.12Å; L347-V350 PolarHBondContact O-N 3.33Å; V350-T353 PolarHBondContact O-N 3Å; V350-T353 PolarHBondContact O-OG1 3.22Å; V350-T353 VanDerWaalsContact O-OG1 3.06Å; V350-H354 WeakPolarHBondContact O-CB 3.26Å; V350-H354 PolarHBondContact O-CD2 2.87Å; V350-H354 PolarHBondContact O-N 2.91Å
351	L	91.5	Very high	90.1	Very high	77 Å²	77	59.7 Å²	59.7	40%	0.403	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-43.6	177.6	-72	171.5	0	0	0	111.8	L347 T348 T353 C355 V360	L347-L351 WeakPolarHBondContact O-CB 3.49Å; L347-L351 WeakPolarHBondContact O-CG 3.3Å; L347-L351 PolarHBondContact O-N 3.01Å; T348-L351 PolarHBondContact O-N 3.37Å; L351-T353 PolarHBondContact O-N 3.3Å; L351-C355 HydrophobicContact CD2-CB 4.41Å; L351-C355 WeakPolarHBondContact O-CA 3.42Å; L351-C355 VanDerWaalsContact O-CB 3.25Å; L351-C355 WeakPolarHBondContact O-CB 3.44Å; L351-C355 PolarHBondContact O-N 3.41Å; L351-V360 HydrophobicContact CB-CG2 4.22Å
352	N	87.1	Confident	89.7	Confident	88 Å²	88	63.7 Å²	63.7	47%	0.471	35%	0.345	S	S	.	.	H	α-helix	trans	-63.7	-27.8	-179.5	-169.2	52.3	0	0	0	113	T348 V360	T348-N352 VanDerWaalsContact O-CB 3.23Å; T348-N352 WeakPolarHBondContact O-CB 3.29Å; T348-N352 PolarHBondContact O-N 2.93Å; N352-V360 HydrophobicContact CB-CG2 4.41Å
353	T	85.8	Confident	89.5	Confident	43 Å²	43	68.1 Å²	68.1	26%	0.264	37%	0.366	S	S	.	.	H	α-helix	trans	-94.8	-32	-176.4	47.9	0	0	0	0	113.2	V189 H349 V350 L351	V189-T353 HydrophobicContact CG1-CG2 4.2Å; V189-T353 WeakPolarHBondContact CG1-OG1 3.32Å; V189-T353 HydrophobicContact CG2-CG2 4.02Å; H349-T353 WeakPolarHBondContact O-CG2 3.49Å; H349-T353 PolarHBondContact O-N 3.48Å; H349-T353 PolarHBondContact O-OG1 3.12Å; V350-T353 PolarHBondContact O-N 3Å; V350-T353 PolarHBondContact O-OG1 3.22Å; V350-T353 VanDerWaalsContact O-OG1 3.06Å; L351-T353 PolarHBondContact O-N 3.3Å
354	H	88.1	Confident	89.4	Confident	81 Å²	81	69.5 Å²	69.5	38%	0.375	37%	0.373	S	S	.	.	H	α-helix	trans	-111.1	-14.2	-174.1	-66.7	-78.1	0	0	0	115.3	P186 I190 V350	P186-H354 PolarHBondContact O-CE1 3.26Å; P186-H354 VanDerWaalsContact O-CE1 3.29Å; P186-H354 PolarHBondContact O-NE2 3.17Å; I190-H354 WeakPolarHBondContact CD1-CE1 3.46Å; I190-H354 VanDerWaalsContact CG1-CE1 3.43Å; I190-H354 WeakPolarHBondContact CG1-CE1 3.5Å; I190-H354 WeakPolarHBondContact CG1-NE2 3.38Å; V350-H354 WeakPolarHBondContact O-CB 3.26Å; V350-H354 PolarHBondContact O-CD2 2.87Å; V350-H354 PolarHBondContact O-N 2.91Å
355	C	87.5	Confident	89.1	Confident	32 Å²	32	70.6 Å²	70.6	22%	0.216	37%	0.373	C	S	.	.			trans	-114.2	96.5	-178.5	-175.5	0	0	0	0	110.9	L351 T357 C358	L351-C355 HydrophobicContact CD2-CB 4.41Å; L351-C355 WeakPolarHBondContact O-CA 3.42Å; L351-C355 VanDerWaalsContact O-CB 3.25Å; L351-C355 WeakPolarHBondContact O-CB 3.44Å; L351-C355 PolarHBondContact O-N 3.41Å; C355-T357 PolarHBondContact O-N 2.9Å; C355-T357 PolarHBondContact SG-OG1 2.95Å; C355-T357 VanDerWaalsContact SG-OG1 3.38Å; C355-C358 HydrophobicContact CB-CB 3.52Å; C355-C358 WeakPolarHBondContact CB-SG 3.46Å; C355-C358 PolarHBondContact O-N 2.93Å; C355-C358 WeakPolarHBondContact SG-CB 3.35Å; C355-C358 PolarHBondContact SG-N 3.17Å; C355-C358 CovalentContact SG-SG 2.03Å; C355-C358 PolarHBondContact SG-SG 2.9Å
356	Q	81.8	Confident	88.9	Confident	205 Å²	205	70.5 Å²	70.5	96%	0.958	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-22.4	178.2	-65.5	-165.6	-14.3	0	0	113.6
357	T	88.9	Confident	89	Confident	135 Å²	135	71.7 Å²	71.7	83%	0.828	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.2	-11.7	177.7	53.8	0	0	0	0	113.3	C355	C355-T357 PolarHBondContact O-N 2.9Å; C355-T357 PolarHBondContact SG-OG1 2.95Å; C355-T357 VanDerWaalsContact SG-OG1 3.38Å
358	C	89.3	Confident	89.1	Confident	51 Å²	51	68.3 Å²	68.3	35%	0.345	37%	0.37	S	S	.	.			trans	-87.5	115	-177.9	-62.6	0	0	0	0	109.2	C355 V360	C355-C358 HydrophobicContact CB-CB 3.52Å; C355-C358 WeakPolarHBondContact CB-SG 3.46Å; C355-C358 PolarHBondContact O-N 2.93Å; C355-C358 WeakPolarHBondContact SG-CB 3.35Å; C355-C358 PolarHBondContact SG-N 3.17Å; C355-C358 CovalentContact SG-SG 2.03Å; C355-C358 PolarHBondContact SG-SG 2.9Å; C358-V360 PolarHBondContact O-N 3.37Å
359	H	87.3	Confident	89	Confident	175 Å²	175	68.8 Å²	68.8	81%	0.81	37%	0.373	S	S	*	.			trans	-86.1	100.4	175.2	-169	62.8	0	0	0	110.4
360	V	89.3	Confident	89.3	Confident	20 Å²	20	71.9 Å²	71.9	12%	0.121	38%	0.384	C	S	.	.			trans	-92.6	112	168.8	-177.8	0	0	0	0	107.4	T348 L351 N352 C358 L364	T348-V360 HydrophobicContact CG2-CG1 4.3Å; L351-V360 HydrophobicContact CB-CG2 4.22Å; N352-V360 HydrophobicContact CB-CG2 4.41Å; C358-V360 PolarHBondContact O-N 3.37Å; V360-L364 HydrophobicContact CG1-CD2 4.38Å
361	S	90.4	Very high	89.5	Confident	33 Å²	33	72.5 Å²	72.5	23%	0.231	39%	0.386	C	S	.	.			trans	-68.3	146.4	-179.9	93	0	0	0	0	110.7	E363 L364 Y365	S361-E363 WeakPolarHBondContact CB-OE2 3.21Å; S361-E363 PolarHBondContact O-N 3.36Å; S361-E363 PolarHBondContact OG-OE2 3.47Å; S361-L364 WeakPolarHBondContact O-CB 3.35Å; S361-L364 PolarHBondContact O-N 2.9Å; S361-L364 VanDerWaalsContact O-N 3.09Å; S361-L364 PolarHBondContact OG-N 2.98Å; S361-Y365 PolarHBondContact O-N 3.36Å
362	P	86.1	Confident	89.6	Confident	88 Å²	88	68.9 Å²	68.9	57%	0.571	37%	0.366	S	S	*	.	H	α-helix	trans	-56.1	-34.9	177.4	-26	35.4	0	0	0	112.9	Y365 S366	P362-Y365 PolarHBondContact O-N 3.41Å; P362-S366 PolarHBondContact O-N 3.42Å; P362-S366 PolarHBondContact O-OG 3.26Å
363	E	88.1	Confident	90	Very high	114 Å²	114	65 Å²	65	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-40.2	178.4	-53.3	73.1	-157.8	0	0	111.3	S361 Y365 A367	S361-E363 WeakPolarHBondContact CB-OE2 3.21Å; S361-E363 PolarHBondContact O-N 3.36Å; S361-E363 PolarHBondContact OG-OE2 3.47Å; E363-Y365 VanDerWaalsContact C-N 3.34Å; E363-A367 WeakPolarHBondContact O-CB 3.42Å; E363-A367 PolarHBondContact O-N 3.25Å
364	L	90.9	Very high	90.5	Very high	85 Å²	85	64.1 Å²	64.1	45%	0.445	34%	0.34	S	S	.	.	H	α-helix	trans	-66.4	-39.1	174.6	-179.7	62	0	0	0	111.1	T348 V360 S361 A367 T368	T348-L364 HydrophobicContact CG2-CD2 4.31Å; T348-L364 HydrophobicContact CG2-CG 4.3Å; V360-L364 HydrophobicContact CG1-CD2 4.38Å; S361-L364 WeakPolarHBondContact O-CB 3.35Å; S361-L364 PolarHBondContact O-N 2.9Å; S361-L364 VanDerWaalsContact O-N 3.09Å; S361-L364 PolarHBondContact OG-N 2.98Å; L364-A367 PolarHBondContact O-N 3.04Å; L364-T368 HydrophobicContact CD1-CG2 4.16Å; L364-T368 WeakPolarHBondContact O-CB 3.44Å; L364-T368 WeakPolarHBondContact O-CG2 3.21Å; L364-T368 PolarHBondContact O-N 3.03Å; L364-T368 PolarHBondContact O-OG1 3.09Å
365	Y	89.6	Confident	90.8	Very high	65 Å²	65	60.3 Å²	60.3	26%	0.255	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-47.8	176.5	-169.5	-95.3	0	0	0	111.7	F345 H349 S361 P362 E363 A367 T368 T369	F345-Y365 HydrophobicContact CE2-CE2 4.46Å; H349-Y365 HydrophobicContact CB-CE2 4.38Å; H349-Y365 AromaticContact ND1-CE2 3.8Å; H349-Y365 AromaticContact ND1-CZ 3.83Å; H349-Y365 PolarHBondContact ND1-OH 3.06Å; S361-Y365 PolarHBondContact O-N 3.36Å; P362-Y365 PolarHBondContact O-N 3.41Å; E363-Y365 VanDerWaalsContact C-N 3.34Å; Y365-A367 PolarHBondContact O-N 2.86Å; Y365-T368 PolarHBondContact O-N 2.86Å; Y365-T368 PolarHBondContact O-OG1 3.46Å; Y365-T368 VanDerWaalsContact O-OG1 3.06Å; Y365-T369 WeakPolarHBondContact O-CB 3.17Å; Y365-T369 PolarHBondContact O-N 3.25Å; Y365-T369 PolarHBondContact O-OG1 2.74Å
366	S	89	Confident	91.1	Very high	24 Å²	24	59 Å²	59	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-61.6	-41.3	174.1	-71.3	0	0	0	0	112	E90 P362 T369 W370	E90-S366 PolarHBondContact OE1-OG 3.48Å; P362-S366 PolarHBondContact O-N 3.42Å; P362-S366 PolarHBondContact O-OG 3.26Å; S366-T369 PolarHBondContact O-N 3.22Å; S366-W370 VanDerWaalsContact O-CB 3.3Å; S366-W370 WeakPolarHBondContact O-CB 3.3Å; S366-W370 PolarHBondContact O-N 3.43Å
367	A	91.7	Very high	91.8	Very high	36 Å²	36	50 Å²	50	30%	0.298	27%	0.274	S	S	.	.	H	α-helix	trans	-65.5	-42.9	178.4	0	0	0	0	0	112.9	E363 L364 Y365 W370 L371	E363-A367 WeakPolarHBondContact O-CB 3.42Å; E363-A367 PolarHBondContact O-N 3.25Å; L364-A367 PolarHBondContact O-N 3.04Å; Y365-A367 PolarHBondContact O-N 2.86Å; A367-W370 PolarHBondContact O-N 3.05Å; A367-L371 VanDerWaalsContact O-CB 3.32Å; A367-L371 WeakPolarHBondContact O-CB 3.37Å; A367-L371 PolarHBondContact O-N 2.98Å
368	T	94.4	Very high	92.1	Very high	11 Å²	11	46.4 Å²	46.4	7%	0.067	25%	0.249	C	C	.	.	H	α-helix	trans	-69	-36.1	177.2	50.5	0	0	0	0	112.2	P344 T348 L364 Y365 L371 G372	P344-T368 HydrophobicContact CB-CG2 3.65Å; T348-T368 HydrophobicContact CG2-CG2 4.03Å; T348-T368 PolarHBondContact OG1-OG1 2.91Å; L364-T368 HydrophobicContact CD1-CG2 4.16Å; L364-T368 WeakPolarHBondContact O-CB 3.44Å; L364-T368 WeakPolarHBondContact O-CG2 3.21Å; L364-T368 PolarHBondContact O-N 3.03Å; L364-T368 PolarHBondContact O-OG1 3.09Å; Y365-T368 PolarHBondContact O-N 2.86Å; Y365-T368 PolarHBondContact O-OG1 3.46Å; Y365-T368 VanDerWaalsContact O-OG1 3.06Å; T368-L371 PolarHBondContact O-N 3.26Å; T368-G372 PolarHBondContact O-N 2.82Å; T368-G372 VanDerWaalsContact O-N 3.11Å
369	T	92.4	Very high	92.2	Very high	23 Å²	23	44 Å²	44	14%	0.141	23%	0.233	C	C	.	.	H	α-helix	trans	-63.5	-49.2	172.3	-57.4	0	0	0	0	111.4	Y365 S366 L371 G372 Y373	Y365-T369 WeakPolarHBondContact O-CB 3.17Å; Y365-T369 PolarHBondContact O-N 3.25Å; Y365-T369 PolarHBondContact O-OG1 2.74Å; S366-T369 PolarHBondContact O-N 3.22Å; T369-L371 VanDerWaalsContact C-N 3.31Å; T369-L371 PolarHBondContact O-N 2.67Å; T369-G372 PolarHBondContact O-N 2.75Å; T369-G372 VanDerWaalsContact O-N 3.12Å; T369-Y373 HydrophobicContact CG2-CD2 4.13Å; T369-Y373 HydrophobicContact CG2-CE2 3.64Å; T369-Y373 WeakPolarHBondContact O-CD2 3.4Å; T369-Y373 PolarHBondContact O-N 2.87Å
370	W	94.4	Very high	92.5	Very high	83 Å²	83	36 Å²	36	31%	0.314	20%	0.197	S	C	.	.	H	α-helix	trans	-57.6	-44.2	176.5	-179.4	90.9	0	0	0	111.8	S35 Y36 S366 A367 G372 Y373 V374	S35-W370 PolarHBondContact OG-NE1 3.27Å; Y36-W370 AromaticContact CD1-CD1 3.95Å; Y36-W370 HydrophobicContact CE1-CB 4.28Å; Y36-W370 AromaticContact CE1-CD1 3.61Å; Y36-W370 HydrophobicContact CE1-CG 4.29Å; Y36-W370 AromaticContact CZ-CD1 3.71Å; Y36-W370 WeakPolarHBondContact OH-CA 3.48Å; Y36-W370 PolarHBondContact OH-N 3.22Å; S366-W370 VanDerWaalsContact O-CB 3.3Å; S366-W370 WeakPolarHBondContact O-CB 3.3Å; S366-W370 PolarHBondContact O-N 3.43Å; A367-W370 PolarHBondContact O-N 3.05Å; W370-G372 VanDerWaalsContact C-N 3.29Å; W370-G372 PolarHBondContact O-N 3.29Å; W370-Y373 PolarHBondContact O-N 2.9Å; W370-Y373 VanDerWaalsContact O-N 3.16Å; W370-V374 HydrophobicContact CD2-CG2 3.93Å; W370-V374 HydrophobicContact CE3-CG2 3.78Å; W370-V374 HydrophobicContact CH2-CG2 3.59Å; W370-V374 HydrophobicContact CZ2-CG2 3.72Å; W370-V374 HydrophobicContact CZ3-CG2 3.62Å; W370-V374 WeakPolarHBondContact O-CG2 3.49Å; W370-V374 PolarHBondContact O-N 3.15Å
371	L	95.4	Very high	92.8	Very high	54 Å²	54	39 Å²	39	28%	0.283	22%	0.215	S	C	.	.	H	α-helix	trans	-62	-35.6	177.9	-176.9	65.3	0	0	0	112.5	C341 P344 A367 T368 T369 V374	C341-L371 WeakPolarHBondContact CB-O 3.02Å; P344-L371 HydrophobicContact CG-CD2 4.19Å; A367-L371 VanDerWaalsContact O-CB 3.32Å; A367-L371 WeakPolarHBondContact O-CB 3.37Å; A367-L371 PolarHBondContact O-N 2.98Å; T368-L371 PolarHBondContact O-N 3.26Å; T369-L371 VanDerWaalsContact C-N 3.31Å; T369-L371 PolarHBondContact O-N 2.67Å; L371-V374 PolarHBondContact O-N 3.36Å
372	G	94.2	Very high	92.8	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-59.2	-48.1	172.1	0	0	0	0	0	112	T368 T369 W370 V374 N375	T368-G372 PolarHBondContact O-N 2.82Å; T368-G372 VanDerWaalsContact O-N 3.11Å; T369-G372 PolarHBondContact O-N 2.75Å; T369-G372 VanDerWaalsContact O-N 3.12Å; W370-G372 VanDerWaalsContact C-N 3.29Å; W370-G372 PolarHBondContact O-N 3.29Å; G372-V374 VanDerWaalsContact C-N 3.33Å; G372-V374 PolarHBondContact O-N 3.49Å; G372-N375 WeakPolarHBondContact O-CB 3.38Å; G372-N375 PolarHBondContact O-N 3Å
373	Y	95.4	Very high	93	Very high	8 Å²	8	34.1 Å²	34.1	3%	0.031	18%	0.181	C	C	.	.	H	α-helix	trans	-66.9	-30.2	178.1	-69.3	-58.7	0	0	0	113.7	Y36 V78 V82 M83 V86 D110 T369 W370 N375 S376	Y36-Y373 AromaticContact CE1-CD2 3.82Å; Y36-Y373 HydrophobicContact CE1-CD2 3.82Å; Y36-Y373 HydrophobicContact CE1-CE2 4.48Å; V78-Y373 HydrophobicContact CG1-CD1 3.65Å; V78-Y373 HydrophobicContact CG1-CE1 3.72Å; V82-Y373 HydrophobicContact CG1-CE1 4.35Å; M83-Y373 HydrophobicContact CE-CG 4.42Å; M83-Y373 HydrophobicContact CG-CD1 4.15Å; M83-Y373 HydrophobicContact CG-CE1 4.34Å; M83-Y373 HydrophobicContact SD-CD1 4.44Å; V86-Y373 HydrophobicContact CG1-CE2 4.17Å; V86-Y373 HydrophobicContact CG2-CE2 4.01Å; V86-Y373 WeakPolarHBondContact CG2-OH 3.45Å; D110-Y373 PolarHBondContact OD1-OH 3.4Å; T369-Y373 HydrophobicContact CG2-CD2 4.13Å; T369-Y373 HydrophobicContact CG2-CE2 3.64Å; T369-Y373 WeakPolarHBondContact O-CD2 3.4Å; T369-Y373 PolarHBondContact O-N 2.87Å; W370-Y373 PolarHBondContact O-N 2.9Å; W370-Y373 VanDerWaalsContact O-N 3.16Å; Y373-N375 PolarHBondContact O-N 2.88Å; Y373-S376 PolarHBondContact O-N 2.92Å; Y373-S376 VanDerWaalsContact O-N 3.15Å
374	V	95.9	Very high	93.1	Very high	23 Å²	23	30.3 Å²	30.3	14%	0.139	17%	0.166	C	C	.	.	H	α-helix	trans	-58.3	-30.2	174.6	169.7	0	0	0	0	112	L39 W370 L371 G372 S376 A377 L378	L39-V374 HydrophobicContact CD1-CG2 4.15Å; L39-V374 HydrophobicContact CD2-CG2 3.9Å; W370-V374 HydrophobicContact CD2-CG2 3.93Å; W370-V374 HydrophobicContact CE3-CG2 3.78Å; W370-V374 HydrophobicContact CH2-CG2 3.59Å; W370-V374 HydrophobicContact CZ2-CG2 3.72Å; W370-V374 HydrophobicContact CZ3-CG2 3.62Å; W370-V374 WeakPolarHBondContact O-CG2 3.49Å; W370-V374 PolarHBondContact O-N 3.15Å; L371-V374 PolarHBondContact O-N 3.36Å; G372-V374 VanDerWaalsContact C-N 3.33Å; G372-V374 PolarHBondContact O-N 3.49Å; V374-S376 PolarHBondContact O-N 3.31Å; V374-A377 WeakPolarHBondContact O-CB 3.44Å; V374-A377 PolarHBondContact O-N 3.13Å; V374-L378 HydrophobicContact CG1-CD1 4.16Å; V374-L378 HydrophobicContact CG1-CD2 4.44Å; V374-L378 HydrophobicContact CG1-CG 4.05Å; V374-L378 WeakPolarHBondContact O-CG 3.33Å; V374-L378 PolarHBondContact O-N 3.21Å; V374-L378 VanDerWaalsContact O-N 3.16Å
375	N	93.8	Very high	93	Very high	2 Å²	2	29.8 Å²	29.8	1%	0.011	17%	0.166	C	C	.	.	H	α-helix	trans	-51	-41.9	176	-177.7	72.3	0	0	0	112.8	F338 C341 G372 Y373 A377 L378 N379	F338-N375 WeakPolarHBondContact CA-OD1 3.29Å; C341-N375 HydrophobicContact CB-CB 3.72Å; G372-N375 WeakPolarHBondContact O-CB 3.38Å; G372-N375 PolarHBondContact O-N 3Å; Y373-N375 PolarHBondContact O-N 2.88Å; N375-A377 VanDerWaalsContact C-N 3.26Å; N375-A377 PolarHBondContact O-N 3.16Å; N375-L378 PolarHBondContact O-N 3.49Å; N375-L378 VanDerWaalsContact O-N 3.16Å; N375-N379 PolarHBondContact O-N 2.79Å
376	S	95.1	Very high	92.8	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.028	17%	0.171	C	C	.	.	H	α-helix	trans	-65.3	-27.6	-179.6	-65.2	0	0	0	0	113	N47 D75 Y373 V374	N47-S376 PolarHBondContact ND2-O 3.43Å; D75-S376 WeakPolarHBondContact OD1-CA 3.41Å; D75-S376 WeakPolarHBondContact OD1-CB 3.48Å; D75-S376 PolarHBondContact OD1-OG 3.49Å; Y373-S376 PolarHBondContact O-N 2.92Å; Y373-S376 VanDerWaalsContact O-N 3.15Å; V374-S376 PolarHBondContact O-N 3.31Å
377	A	96.1	Very high	92.7	Very high	17 Å²	17	31.1 Å²	31.1	14%	0.14	17%	0.172	C	C	.	.	H	α-helix	trans	-82.9	-26.1	175.2	0	0	0	0	0	112.9	L39 I43 V374 N375	L39-A377 HydrophobicContact CD1-CB 3.68Å; I43-A377 HydrophobicContact CG1-CB 3.79Å; V374-A377 WeakPolarHBondContact O-CB 3.44Å; V374-A377 PolarHBondContact O-N 3.13Å; N375-A377 VanDerWaalsContact C-N 3.26Å; N375-A377 PolarHBondContact O-N 3.16Å
378	L	95	Very high	92.6	Very high	58 Å²	58	33.1 Å²	33.1	30%	0.304	18%	0.177	S	C	.	.	H	α-helix	trans	-71.8	-30.6	-178.8	-68	176.5	0	0	0	112.7	A337 V374 N375 V381 I382	A337-L378 HydrophobicContact CB-CD1 4.49Å; V374-L378 HydrophobicContact CG1-CD1 4.16Å; V374-L378 HydrophobicContact CG1-CD2 4.44Å; V374-L378 HydrophobicContact CG1-CG 4.05Å; V374-L378 WeakPolarHBondContact O-CG 3.33Å; V374-L378 PolarHBondContact O-N 3.21Å; V374-L378 VanDerWaalsContact O-N 3.16Å; N375-L378 PolarHBondContact O-N 3.49Å; N375-L378 VanDerWaalsContact O-N 3.16Å; L378-V381 WeakPolarHBondContact O-CB 3.4Å; L378-V381 PolarHBondContact O-N 3.16Å; L378-I382 HydrophobicContact CB-CD1 4.25Å; L378-I382 VanDerWaalsContact O-CG1 3.31Å; L378-I382 WeakPolarHBondContact O-CG1 3.48Å; L378-I382 PolarHBondContact O-N 3.42Å
379	N	91.3	Very high	92.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.011	19%	0.189	C	C	.	.	H	α-helix	trans	-53	-56	-175.6	-73.4	-29	0	0	0	113.1	D75 N375 V381 I382 Y383	D75-N379 PolarHBondContact OD2-ND2 3.47Å; N375-N379 PolarHBondContact O-N 2.79Å; N379-V381 VanDerWaalsContact C-N 3.29Å; N379-V381 PolarHBondContact O-N 3.29Å; N379-I382 PolarHBondContact O-N 3.03Å; N379-Y383 HydrophobicContact CB-CE2 4.16Å; N379-Y383 WeakPolarHBondContact O-CD1 3.17Å; N379-Y383 VanDerWaalsContact O-CD2 3.31Å; N379-Y383 WeakPolarHBondContact O-CD2 3.49Å; N379-Y383 PolarHBondContact O-N 3.06Å
380	P	94.3	Very high	92.3	Very high	6 Å²	6	34.7 Å²	34.7	4%	0.039	18%	0.182	C	C	.	.	H	α-helix	trans	-57.3	-36.8	174.9	-25.3	33.1	0	0	0	114.4	G46 V50 Y383 T384 F394	G46-P380 WeakPolarHBondContact O-CG 3.5Å; V50-P380 HydrophobicContact CG2-CB 3.94Å; V50-P380 HydrophobicContact CG2-CG 3.91Å; P380-Y383 PolarHBondContact O-N 3.38Å; P380-T384 WeakPolarHBondContact O-CG2 3.46Å; P380-T384 PolarHBondContact O-N 3.11Å; P380-T384 PolarHBondContact O-OG1 3.3Å; P380-F394 HydrophobicContact CB-CE2 4.49Å
381	V	94.3	Very high	92.2	Very high	83 Å²	83	36 Å²	36	50%	0.503	19%	0.186	S	C	.	.	H	α-helix	trans	-65.7	-44.7	178.8	-179.4	0	0	0	0	110.4	L378 N379 Y383 T384 T385	L378-V381 WeakPolarHBondContact O-CB 3.4Å; L378-V381 PolarHBondContact O-N 3.16Å; N379-V381 VanDerWaalsContact C-N 3.29Å; N379-V381 PolarHBondContact O-N 3.29Å; V381-Y383 VanDerWaalsContact C-N 3.3Å; V381-Y383 PolarHBondContact O-N 3.44Å; V381-T384 PolarHBondContact O-N 2.87Å; V381-T384 PolarHBondContact O-OG1 3.4Å; V381-T385 PolarHBondContact O-N 2.92Å; V381-T385 PolarHBondContact O-OG1 2.82Å
382	I	91.5	Very high	92.1	Very high	14 Å²	14	39.1 Å²	39.1	7%	0.072	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-41.9	175.8	-63.4	165.3	0	0	0	110	I333 V334 A337 L378 N379 T384 T385 F386	I333-I382 HydrophobicContact CG2-CG2 4.19Å; V334-I382 HydrophobicContact CG2-CD1 4.34Å; V334-I382 HydrophobicContact CG2-CG2 3.68Å; A337-I382 HydrophobicContact CB-CD1 3.99Å; L378-I382 HydrophobicContact CB-CD1 4.25Å; L378-I382 VanDerWaalsContact O-CG1 3.31Å; L378-I382 WeakPolarHBondContact O-CG1 3.48Å; L378-I382 PolarHBondContact O-N 3.42Å; N379-I382 PolarHBondContact O-N 3.03Å; I382-T384 PolarHBondContact O-N 2.69Å; I382-T385 WeakPolarHBondContact CA-OG1 3.4Å; I382-T385 PolarHBondContact O-N 3.14Å; I382-T385 PolarHBondContact O-OG1 3.18Å; I382-F386 HydrophobicContact CG2-CD2 3.87Å; I382-F386 HydrophobicContact CG2-CE2 4.4Å; I382-F386 VanDerWaalsContact O-CD2 3.31Å; I382-F386 WeakPolarHBondContact O-CD2 3.29Å; I382-F386 PolarHBondContact O-N 3.41Å
383	Y	90	Very high	92.1	Very high	5 Å²	5	39.3 Å²	39.3	2%	0.02	20%	0.199	C	C	.	.	H	α-helix	trans	-64.7	-43.8	-179.6	-58.2	-20.1	0	0	0	112.4	V50 V68 M330 V334 N379 P380 V381 N387	V50-Y383 HydrophobicContact CG1-CD2 4.31Å; V50-Y383 HydrophobicContact CG1-CE2 4.34Å; V50-Y383 HydrophobicContact CG2-CD2 3.82Å; V50-Y383 HydrophobicContact CG2-CE2 4.29Å; V68-Y383 HydrophobicContact CG1-CD2 3.98Å; V68-Y383 HydrophobicContact CG1-CE1 4.48Å; V68-Y383 HydrophobicContact CG1-CE2 3.29Å; M330-Y383 HydrophobicContact CE-CD1 3.13Å; M330-Y383 HydrophobicContact CE-CE1 3.69Å; M330-Y383 HydrophobicContact CE-CG 3.95Å; V334-Y383 HydrophobicContact CG2-CE1 4.15Å; N379-Y383 HydrophobicContact CB-CE2 4.16Å; N379-Y383 WeakPolarHBondContact O-CD1 3.17Å; N379-Y383 VanDerWaalsContact O-CD2 3.31Å; N379-Y383 WeakPolarHBondContact O-CD2 3.49Å; N379-Y383 PolarHBondContact O-N 3.06Å; P380-Y383 PolarHBondContact O-N 3.38Å; V381-Y383 VanDerWaalsContact C-N 3.3Å; V381-Y383 PolarHBondContact O-N 3.44Å; Y383-N387 WeakPolarHBondContact O-CA 3.45Å; Y383-N387 WeakPolarHBondContact O-CB 3.15Å; Y383-N387 PolarHBondContact O-N 3.4Å
384	T	90.6	Very high	92	Very high	34 Å²	34	39.7 Å²	39.7	21%	0.209	20%	0.201	C	C	.	.	H	α-helix	trans	-70.2	-34.7	179.5	51.8	0	0	0	0	113.2	P380 V381 I382 R391 F394	P380-T384 WeakPolarHBondContact O-CG2 3.46Å; P380-T384 PolarHBondContact O-N 3.11Å; P380-T384 PolarHBondContact O-OG1 3.3Å; V381-T384 PolarHBondContact O-N 2.87Å; V381-T384 PolarHBondContact O-OG1 3.4Å; I382-T384 PolarHBondContact O-N 2.69Å; T384-R391 PolarHBondContact O-NE 3.48Å; T384-F394 HydrophobicContact CG2-CB 4.47Å; T384-F394 HydrophobicContact CG2-CD1 4.44Å; T384-F394 HydrophobicContact CG2-CD2 3.33Å; T384-F394 HydrophobicContact CG2-CE2 3.51Å; T384-F394 HydrophobicContact CG2-CG 3.85Å; T384-F394 HydrophobicContact CG2-CZ 4.15Å
385	T	89.3	Confident	91.8	Very high	74 Å²	74	44 Å²	44	45%	0.454	22%	0.223	S	C	.	.	H	α-helix	trans	-69.6	-49.1	175.8	26	0	0	0	0	111.9	V381 I382 R391	V381-T385 PolarHBondContact O-N 2.92Å; V381-T385 PolarHBondContact O-OG1 2.82Å; I382-T385 WeakPolarHBondContact CA-OG1 3.4Å; I382-T385 PolarHBondContact O-N 3.14Å; I382-T385 PolarHBondContact O-OG1 3.18Å; T385-R391 PolarHBondContact O-NH2 3.15Å
386	F	85.2	Confident	91.8	Very high	80 Å²	80	50 Å²	50	35%	0.351	25%	0.249	S	C	.	.	H	α-helix	trans	-96.4	-15.2	-170	-63.1	-75.4	0	0	0	114.8	M330 I333 I382	M330-F386 HydrophobicContact CB-CB 4.02Å; M330-F386 HydrophobicContact CG-CB 4.05Å; I333-F386 HydrophobicContact CD1-CD1 4.02Å; I333-F386 HydrophobicContact CD1-CD2 4.14Å; I333-F386 HydrophobicContact CD1-CE1 3.52Å; I333-F386 HydrophobicContact CD1-CE2 3.66Å; I333-F386 HydrophobicContact CD1-CG 4.32Å; I333-F386 HydrophobicContact CD1-CZ 3.34Å; I333-F386 HydrophobicContact CG2-CE2 4.11Å; I382-F386 HydrophobicContact CG2-CD2 3.87Å; I382-F386 HydrophobicContact CG2-CE2 4.4Å; I382-F386 VanDerWaalsContact O-CD2 3.31Å; I382-F386 WeakPolarHBondContact O-CD2 3.29Å; I382-F386 PolarHBondContact O-N 3.41Å
387	N	87	Confident	91.7	Very high	37 Å²	37	51.7 Å²	51.7	20%	0.198	26%	0.257	C	S	.	.			trans	-118	107.1	177.8	-168.1	-29	0	0	0	112	M330 Y383 E389 F390 R391	M330-N387 HydrophobicContact CE-CB 4.33Å; M330-N387 HydrophobicContact SD-CB 4.23Å; Y383-N387 WeakPolarHBondContact O-CA 3.45Å; Y383-N387 WeakPolarHBondContact O-CB 3.15Å; Y383-N387 PolarHBondContact O-N 3.4Å; N387-E389 VanDerWaalsContact C-N 3.26Å; N387-E389 PolarHBondContact O-N 3.4Å; N387-E389 WeakPolarHBondContact OD1-CB 3.34Å; N387-E389 PolarHBondContact OD1-N 3.41Å; N387-F390 HydrophobicContact CB-CB 4.21Å; N387-F390 HydrophobicContact CB-CD2 3.88Å; N387-F390 WeakPolarHBondContact ND2-CD2 3.35Å; N387-F390 PolarHBondContact O-N 2.91Å; N387-F390 PolarHBondContact OD1-N 3.43Å; N387-R391 PolarHBondContact O-N 3.05Å; N387-R391 VanDerWaalsContact O-N 3.08Å
388	I	88	Confident	91.5	Very high	78 Å²	78	55.6 Å²	55.6	40%	0.4	28%	0.275	S	S	.	.	H	α-helix	trans	-61.6	-34.2	-177.7	-60.6	168.8	0	0	0	111.6	R391 K392	I388-R391 PolarHBondContact O-N 2.81Å; I388-K392 HydrophobicContact CG2-CD 4.37Å; I388-K392 WeakPolarHBondContact O-CG 3.41Å; I388-K392 PolarHBondContact O-N 3.01Å
389	E	89.8	Confident	91.3	Very high	67 Å²	67	57.4 Å²	57.4	31%	0.313	29%	0.293	S	S	.	.	H	α-helix	trans	-70.5	-39.9	-179.4	-59.6	-54.4	133.7	0	0	111.1	L60 N387 K392 A393	L60-E389 HydrophobicContact CD2-CB 3.61Å; L60-E389 HydrophobicContact CG-CB 4.47Å; N387-E389 VanDerWaalsContact C-N 3.26Å; N387-E389 PolarHBondContact O-N 3.4Å; N387-E389 WeakPolarHBondContact OD1-CB 3.34Å; N387-E389 PolarHBondContact OD1-N 3.41Å; E389-K392 PolarHBondContact O-N 3.32Å; E389-K392 IonicContact OE1-NZ 3.45Å; E389-K392 PolarHBondContact OE1-NZ 3.33Å; E389-A393 WeakPolarHBondContact O-CB 3.33Å; E389-A393 PolarHBondContact O-N 2.96Å
390	F	91.4	Very high	90.3	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-44.2	170.8	-90.7	-68	0	0	0	111.6	V50 A53 V54 L60 V68 N387 K392 A393 F394	V50-F390 HydrophobicContact CG1-CE1 4.27Å; A53-F390 HydrophobicContact CB-CD1 4.13Å; A53-F390 HydrophobicContact CB-CE1 4.23Å; V54-F390 HydrophobicContact CG2-CE1 3.73Å; V54-F390 HydrophobicContact CG2-CZ 3.71Å; L60-F390 HydrophobicContact CD1-CD1 3.91Å; L60-F390 HydrophobicContact CD1-CE1 4.07Å; L60-F390 HydrophobicContact CD1-CG 4.35Å; L60-F390 HydrophobicContact CD2-CD2 4.25Å; L60-F390 HydrophobicContact CD2-CE2 4.34Å; L60-F390 HydrophobicContact CD2-CG 4.39Å; V68-F390 HydrophobicContact CG1-CZ 4.43Å; N387-F390 HydrophobicContact CB-CB 4.21Å; N387-F390 HydrophobicContact CB-CD2 3.88Å; N387-F390 WeakPolarHBondContact ND2-CD2 3.35Å; N387-F390 PolarHBondContact O-N 2.91Å; N387-F390 PolarHBondContact OD1-N 3.43Å; F390-K392 PolarHBondContact O-N 3.32Å; F390-A393 PolarHBondContact O-N 3.48Å; F390-F394 HydrophobicContact CD1-CD1 4.47Å; F390-F394 AromaticContact CD1-CE1 3.92Å; F390-F394 HydrophobicContact CD1-CE1 3.92Å; F390-F394 WeakPolarHBondContact O-CB 3.3Å; F390-F394 WeakPolarHBondContact O-CD1 3.37Å; F390-F394 PolarHBondContact O-N 3.01Å
391	R	93.3	Very high	90.1	Very high	109 Å²	109	68.1 Å²	68.1	41%	0.411	36%	0.36	S	S	.	.	H	α-helix	trans	-59.1	-45.4	178.3	-164	-172.3	-44.6	173.3	7.6	112.6	T384 T385 N387 I388 F394 L395	T384-R391 PolarHBondContact O-NE 3.48Å; T385-R391 PolarHBondContact O-NH2 3.15Å; N387-R391 PolarHBondContact O-N 3.05Å; N387-R391 VanDerWaalsContact O-N 3.08Å; I388-R391 PolarHBondContact O-N 2.81Å; R391-F394 PolarHBondContact O-N 2.99Å; R391-L395 WeakPolarHBondContact O-CG 3.5Å; R391-L395 PolarHBondContact O-N 2.74Å
392	K	93.4	Very high	89.9	Confident	120 Å²	120	67.3 Å²	67.3	52%	0.522	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-45.1	175.8	-72.8	173.7	-178.6	170.3	0	111.6	I388 E389 F390 F394 L395 K396	I388-K392 HydrophobicContact CG2-CD 4.37Å; I388-K392 WeakPolarHBondContact O-CG 3.41Å; I388-K392 PolarHBondContact O-N 3.01Å; E389-K392 PolarHBondContact O-N 3.32Å; E389-K392 IonicContact OE1-NZ 3.45Å; E389-K392 PolarHBondContact OE1-NZ 3.33Å; F390-K392 PolarHBondContact O-N 3.32Å; K392-F394 VanDerWaalsContact C-N 3.35Å; K392-F394 PolarHBondContact O-N 2.95Å; K392-L395 PolarHBondContact O-N 3.18Å; K392-K396 WeakPolarHBondContact O-CB 3.45Å; K392-K396 PolarHBondContact O-N 3.44Å
393	A	93.1	Very high	89.8	Confident	4 Å²	4	70.2 Å²	70.2	3%	0.033	37%	0.368	C	S	.	.	H	α-helix	trans	-62.8	-41.4	178.8	0	0	0	0	0	112	A53 E57 L60 E389 F390 K396 I397	A53-A393 HydrophobicContact CB-CB 3.87Å; E57-A393 HydrophobicContact CB-CB 4.38Å; E57-A393 HydrophobicContact CG-CB 4.48Å; L60-A393 HydrophobicContact CD1-CB 3.71Å; E389-A393 WeakPolarHBondContact O-CB 3.33Å; E389-A393 PolarHBondContact O-N 2.96Å; F390-A393 PolarHBondContact O-N 3.48Å; A393-K396 PolarHBondContact O-N 3.46Å; A393-I397 VanDerWaalsContact O-CG1 3.3Å; A393-I397 WeakPolarHBondContact O-CG1 2.78Å; A393-I397 PolarHBondContact O-N 2.9Å
394	F	93.6	Very high	89.8	Confident	17 Å²	17	74.1 Å²	74.1	8%	0.075	39%	0.389	C	S	.	.	H	α-helix	trans	-63.6	-48.6	177.3	-85.1	40.7	0	0	0	111.4	L49 V50 A53 P380 T384 F390 R391 K392 K396 I397 L398	L49-F394 HydrophobicContact CB-CD1 4.45Å; L49-F394 HydrophobicContact CB-CD2 4.07Å; L49-F394 HydrophobicContact CB-CE1 4Å; L49-F394 HydrophobicContact CB-CE2 3.58Å; L49-F394 HydrophobicContact CB-CG 4.49Å; L49-F394 HydrophobicContact CB-CZ 3.54Å; L49-F394 HydrophobicContact CD1-CD2 3.87Å; L49-F394 HydrophobicContact CD1-CE2 3.94Å; L49-F394 HydrophobicContact CG-CE2 4.44Å; L49-F394 WeakPolarHBondContact O-CE1 3.35Å; V50-F394 HydrophobicContact CB-CZ 4.48Å; V50-F394 HydrophobicContact CG2-CE1 4.46Å; V50-F394 HydrophobicContact CG2-CZ 3.77Å; A53-F394 HydrophobicContact CB-CD1 3.92Å; A53-F394 HydrophobicContact CB-CE1 3.75Å; P380-F394 HydrophobicContact CB-CE2 4.49Å; T384-F394 HydrophobicContact CG2-CB 4.47Å; T384-F394 HydrophobicContact CG2-CD1 4.44Å; T384-F394 HydrophobicContact CG2-CD2 3.33Å; T384-F394 HydrophobicContact CG2-CE2 3.51Å; T384-F394 HydrophobicContact CG2-CG 3.85Å; T384-F394 HydrophobicContact CG2-CZ 4.15Å; F390-F394 HydrophobicContact CD1-CD1 4.47Å; F390-F394 AromaticContact CD1-CE1 3.92Å; F390-F394 HydrophobicContact CD1-CE1 3.92Å; F390-F394 WeakPolarHBondContact O-CB 3.3Å; F390-F394 WeakPolarHBondContact O-CD1 3.37Å; F390-F394 PolarHBondContact O-N 3.01Å; R391-F394 PolarHBondContact O-N 2.99Å; K392-F394 VanDerWaalsContact C-N 3.35Å; K392-F394 PolarHBondContact O-N 2.95Å; F394-K396 VanDerWaalsContact C-N 3.28Å; F394-K396 PolarHBondContact O-N 2.75Å; F394-I397 PolarHBondContact O-N 2.82Å; F394-I397 VanDerWaalsContact O-N 3.17Å; F394-L398 WeakPolarHBondContact O-CB 3.49Å; F394-L398 WeakPolarHBondContact O-CG 3.44Å; F394-L398 PolarHBondContact O-N 2.92Å
395	L	92.9	Very high	89.7	Confident	114 Å²	114	76.6 Å²	76.6	60%	0.597	40%	0.4	S	S	*	.	H	α-helix	trans	-58.4	-42.9	176.7	-73	171.6	0	0	0	111.3	R391 K392 I397 L398 S399	R391-L395 WeakPolarHBondContact O-CG 3.5Å; R391-L395 PolarHBondContact O-N 2.74Å; K392-L395 PolarHBondContact O-N 3.18Å; L395-I397 PolarHBondContact O-N 2.94Å; L395-L398 PolarHBondContact O-N 3.35Å; L395-S399 WeakPolarHBondContact O-CB 2.83Å; L395-S399 PolarHBondContact O-N 2.89Å; L395-S399 PolarHBondContact O-OG 3.41Å
396	K	93.6	Very high	89.7	Confident	126 Å²	126	76.7 Å²	76.7	55%	0.548	40%	0.397	S	S	.	.	H	α-helix	trans	-62.5	-39	176.9	-176.4	179	175.1	-175.4	0	112.7	E57 K392 A393 F394 S399 C400	E57-K396 IonicContact OE2-NZ 3.53Å; K392-K396 WeakPolarHBondContact O-CB 3.45Å; K392-K396 PolarHBondContact O-N 3.44Å; A393-K396 PolarHBondContact O-N 3.46Å; F394-K396 VanDerWaalsContact C-N 3.28Å; F394-K396 PolarHBondContact O-N 2.75Å; K396-S399 PolarHBondContact O-OG 2.82Å; K396-C400 PolarHBondContact O-SG 2.93Å
397	I	92.6	Very high	90.1	Very high	40 Å²	40	76.5 Å²	76.5	21%	0.205	40%	0.4	C	S	.	.	H	α-helix	trans	-71.4	-39.7	178.1	-69.5	165.2	0	0	0	111	L49 M52 A53 A393 F394 L395	L49-I397 HydrophobicContact CD2-CB 4.46Å; L49-I397 HydrophobicContact CD2-CG2 3.73Å; M52-I397 HydrophobicContact CB-CD1 4.02Å; A53-I397 HydrophobicContact CB-CD1 4.14Å; A393-I397 VanDerWaalsContact O-CG1 3.3Å; A393-I397 WeakPolarHBondContact O-CG1 2.78Å; A393-I397 PolarHBondContact O-N 2.9Å; F394-I397 PolarHBondContact O-N 2.82Å; F394-I397 VanDerWaalsContact O-N 3.17Å; L395-I397 PolarHBondContact O-N 2.94Å
398	L	92.4	Very high	90.3	Very high	99 Å²	99	79.5 Å²	79.5	52%	0.518	42%	0.415	S	S	.	.	H	α-helix	trans	-78.6	-21	-178.4	-67.7	172.8	0	0	0	113.6	F45 L49 F394 L395 C400	F45-L398 HydrophobicContact CE2-CD2 4.14Å; F45-L398 HydrophobicContact CZ-CD2 3.8Å; L49-L398 HydrophobicContact CD1-CD1 4.35Å; L49-L398 HydrophobicContact CD1-CD2 4.28Å; L49-L398 HydrophobicContact CD2-CD2 4.23Å; F394-L398 WeakPolarHBondContact O-CB 3.49Å; F394-L398 WeakPolarHBondContact O-CG 3.44Å; F394-L398 PolarHBondContact O-N 2.92Å; L395-L398 PolarHBondContact O-N 3.35Å; L398-C400 VanDerWaalsContact C-N 3.33Å
399	S	90.9	Very high	90.5	Very high	96 Å²	96	79.7 Å²	79.7	67%	0.671	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	1.2	177	67.2	0	0	0	0	113.9	L395 K396	L395-S399 WeakPolarHBondContact O-CB 2.83Å; L395-S399 PolarHBondContact O-N 2.89Å; L395-S399 PolarHBondContact O-OG 3.41Å; K396-S399 PolarHBondContact O-OG 2.82Å
400	C	69	Low	90.5	Very high	164 Å²	164	80.8 Å²	80.8	100%	1.108	43%	0.426	S	S	*	.			trans	-86.4	0	-178	-81.9	0	0	0	0	112.2	K396 L398	K396-C400 PolarHBondContact O-SG 2.93Å; L398-C400 VanDerWaalsContact C-N 3.33Å

Retrieved 400 of 400 residues in 136.6 ms (Link to these results)

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