A0A096NM34_PAPAN Loading...

Aromatase

AlphaFold DB , UniProt , Accession A0A096NM34, Species PAPAN (Papio anubis, Olive baboon), Gene CYP19A1, Length 503 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	34.3	Very low	35.5	Very low	231 Å²	231	168.8 Å²	168.8	100%	1.138	85%	0.846	S	S	*	*				0	86.9	0	-78.1	167.3	56.6	0	0	106.3
2	V	32.3	Very low	35.3	Very low	132 Å²	132	165.4 Å²	165.4	80%	0.8	83%	0.833	S	S	*	*				68.3	110.2	75	-177.9	0	0	0	0	112.4
3	L	30.5	Very low	35.7	Very low	141 Å²	141	165.2 Å²	165.2	74%	0.738	83%	0.832	S	S	*	*			trans	69.7	140.5	152.4	-100.8	81.4	0	0	0	123.2
4	E	33.5	Very low	36.1	Very low	168 Å²	168	161 Å²	161	79%	0.785	82%	0.82	S	S	*	*			trans	77.2	125.4	154.6	-69.6	172.2	177.8	0	0	117
5	M	32.8	Very low	36.5	Very low	180 Å²	180	157.7 Å²	157.7	89%	0.887	82%	0.817	S	S	*	*			cis	-147.3	147.5	43.5	-68.1	-179.7	71.5	0	0	114
6	L	37.1	Very low	36.7	Very low	166 Å²	166	159.4 Å²	159.4	87%	0.869	82%	0.823	S	S	*	*			trans	-62.2	134.5	165.6	-70.4	135.1	0	0	0	112.7
7	N	34	Very low	36.9	Very low	153 Å²	153	157 Å²	157	82%	0.818	82%	0.817	S	S	*	*				-170.7	145.8	118.9	-127.7	-1.7	0	0	0	111.4
8	P	41.9	Very low	37.3	Very low	106 Å²	106	155.4 Å²	155.4	69%	0.688	82%	0.818	S	S	*	*			trans	-82.3	121.9	-174.5	30.5	-24.6	0	0	0	110.6	H10	P8-H10 PolarHBondContact O-N 2.71Å
9	M	37	Very low	38.2	Very low	179 Å²	179	157.1 Å²	157.1	88%	0.882	82%	0.821	S	S	*	*			trans	-67.7	120.8	168.8	-76.2	-157.2	-66.2	0	0	109.7	Y11	M9-Y11 PolarHBondContact O-N 3.11Å
10	H	38	Very low	39.1	Very low	181 Å²	181	153.4 Å²	153.4	84%	0.838	81%	0.814	S	S	*	*			trans	-40.7	118.7	166.8	-83.7	-82.7	0	0	0	111.9	P8 N12	P8-H10 PolarHBondContact O-N 2.71Å; H10-N12 PolarHBondContact O-N 2.76Å; H10-N12 VanDerWaalsContact O-N 3.08Å
11	Y	38.8	Very low	39.9	Very low	220 Å²	220	151.7 Å²	151.7	86%	0.863	80%	0.803	S	S	*	*			trans	-69.2	100.6	157.3	-99.1	-92.5	0	0	0	107.8	M9 I13	M9-Y11 PolarHBondContact O-N 3.11Å; Y11-I13 PolarHBondContact O-N 3.03Å
12	N	33.8	Very low	41.3	Very low	128 Å²	128	144.6 Å²	144.6	68%	0.684	77%	0.774	S	S	*	*			trans	-78.4	97.8	173.2	-147.1	5.1	0	0	0	108	H10 T14	H10-N12 PolarHBondContact O-N 2.76Å; H10-N12 VanDerWaalsContact O-N 3.08Å; N12-T14 PolarHBondContact O-N 3.5Å; N12-T14 PolarHBondContact OD1-OG1 3.31Å
13	I	39.9	Very low	42.8	Very low	162 Å²	162	143 Å²	143	83%	0.831	78%	0.775	S	S	*	*			trans	-79.9	61	175.5	-50.9	176.1	0	0	0	109.1	Y11	Y11-I13 PolarHBondContact O-N 3.03Å
14	T	41.7	Very low	44.2	Very low	107 Å²	107	139 Å²	139	66%	0.656	76%	0.763	S	S	*	*			trans	-131.4	15.4	-178.7	26.9	0	0	0	0	114.1	N12	N12-T14 PolarHBondContact O-N 3.5Å; N12-T14 PolarHBondContact OD1-OG1 3.31Å
15	S	41.8	Very low	45.9	Very low	112 Å²	112	132.8 Å²	132.8	78%	0.783	74%	0.736	S	S	*	*			trans	-114.2	17.9	-178.6	63.3	0	0	0	0	116.2
16	M	40.2	Very low	47.6	Very low	184 Å²	184	129.6 Å²	129.6	91%	0.906	72%	0.72	S	S	*	*			trans	-124.4	60.1	173.1	-75.3	-161.1	130.8	0	0	113.1
17	V	40.1	Very low	49.5	Very low	119 Å²	119	124.6 Å²	124.6	72%	0.721	70%	0.698	S	S	*	*			trans	-140.3	115.9	154	-174.8	0	0	0	0	107.3	E19	V17-E19 PolarHBondContact O-N 3.47Å
18	P	44.6	Very low	51.6	Low	128 Å²	128	122.1 Å²	122.1	83%	0.831	68%	0.683	S	S	*	*			trans	-70.9	99.2	161.1	-3.3	20	0	0	0	107.3	A20	P18-A20 PolarHBondContact O-N 3.29Å; P18-A20 VanDerWaalsContact O-N 3.16Å
19	E	54.4	Low	53.3	Low	187 Å²	187	121.8 Å²	121.8	87%	0.874	68%	0.675	S	S	*	*			trans	-66.3	101.3	160.1	-78.2	-176.2	161.5	0	0	108.6	V17	V17-E19 PolarHBondContact O-N 3.47Å
20	A	55.4	Low	55.2	Low	83 Å²	83	119.3 Å²	119.3	69%	0.686	67%	0.665	S	S	*	*			trans	169.1	111.3	138	0	0	0	0	0	106.9	P18	P18-A20 PolarHBondContact O-N 3.29Å; P18-A20 VanDerWaalsContact O-N 3.16Å
21	M	55.1	Low	57.2	Low	118 Å²	118	116.1 Å²	116.1	58%	0.581	65%	0.653	S	S	*	*			trans	-49.6	127.9	154.9	-79.5	-134.8	86.8	0	0	107.6	A23 T25	M21-A23 PolarHBondContact O-N 2.92Å; M21-T25 WeakPolarHBondContact CB-OG1 3.42Å; M21-T25 HydrophobicContact CE-CG2 4.17Å
22	P	65.6	Low	59	Low	82 Å²	82	108.8 Å²	108.8	53%	0.532	63%	0.632	S	S	.	*			trans	-50.1	138.8	-177.9	-22.9	27.6	0	0	0	110	A24 T25	P22-A24 PolarHBondContact O-N 3.34Å; P22-T25 HydrophobicContact CB-CG2 4.06Å; P22-T25 HydrophobicContact CG-CG2 3.86Å; P22-T25 PolarHBondContact O-N 3.22Å; P22-T25 PolarHBondContact O-OG1 3.23Å
23	A	62	Low	60.9	Low	99 Å²	99	104 Å²	104	82%	0.818	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-15.8	-177.3	0	0	0	0	0	114.1	M21 P27	M21-A23 PolarHBondContact O-N 2.92Å; A23-P27 WeakPolarHBondContact O-CD 3.38Å; A23-P27 WeakPolarHBondContact O-CG 3.32Å
24	A	60.8	Low	62.5	Low	58 Å²	58	101.4 Å²	101.4	48%	0.479	60%	0.6	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.4	-23.4	173.1	0	0	0	0	0	115.1	P22 P27 I28	P22-A24 PolarHBondContact O-N 3.34Å; A24-P27 WeakPolarHBondContact O-CD 3.38Å; A24-I28 HydrophobicContact CB-CD1 4.29Å; A24-I28 WeakPolarHBondContact O-CB 3.48Å; A24-I28 VanDerWaalsContact O-CD1 3.24Å; A24-I28 WeakPolarHBondContact O-CD1 3.44Å; A24-I28 WeakPolarHBondContact O-CG1 3.39Å; A24-I28 PolarHBondContact O-N 3.11Å
25	T	68.4	Low	63.8	Low	37 Å²	37	103.1 Å²	103.1	23%	0.227	60%	0.599	C	S	.	*	H	α-helix	trans	-73.7	-36.3	-175.3	56.5	0	0	0	0	112.9	M21 P22 I28 L29	M21-T25 WeakPolarHBondContact CB-OG1 3.42Å; M21-T25 HydrophobicContact CE-CG2 4.17Å; P22-T25 HydrophobicContact CB-CG2 4.06Å; P22-T25 HydrophobicContact CG-CG2 3.86Å; P22-T25 PolarHBondContact O-N 3.22Å; P22-T25 PolarHBondContact O-OG1 3.23Å; T25-I28 PolarHBondContact O-N 3.14Å; T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.25Å; T25-L29 PolarHBondContact O-N 3.16Å
26	M	69.8	Low	64.8	Low	112 Å²	112	100.9 Å²	100.9	55%	0.552	58%	0.578	S	S	*	*	H	α-helix	trans	-66.5	-47.7	175.6	-82.4	-63.3	-163.9	0	0	112.6	I28 L29 L30	M26-I28 VanDerWaalsContact C-N 3.31Å; M26-I28 PolarHBondContact O-N 3.11Å; M26-L29 PolarHBondContact O-N 2.75Å; M26-L30 WeakPolarHBondContact O-CB 3.45Å; M26-L30 VanDerWaalsContact O-CG 3.3Å; M26-L30 WeakPolarHBondContact O-CG 3.45Å; M26-L30 PolarHBondContact O-N 2.76Å
27	P	76.4	Confident	65.9	Low	61 Å²	61	98.1 Å²	98.1	40%	0.396	57%	0.566	S	S	.	*	H	α-helix	trans	-58.4	-39.9	170.9	-24.9	32.5	0	0	0	112.9	A23 A24 L30 L31	A23-P27 WeakPolarHBondContact O-CD 3.38Å; A23-P27 WeakPolarHBondContact O-CG 3.32Å; A24-P27 WeakPolarHBondContact O-CD 3.38Å; P27-L30 PolarHBondContact O-N 2.88Å; P27-L31 VanDerWaalsContact O-CB 3.23Å; P27-L31 WeakPolarHBondContact O-CB 3.41Å; P27-L31 PolarHBondContact O-N 2.93Å
28	I	78.7	Confident	66.9	Low	102 Å²	102	95.6 Å²	95.6	52%	0.523	55%	0.551	S	S	.	*	H	α-helix	trans	-67.5	-41.2	177.8	-70.3	165.5	0	0	0	111.3	A24 T25 M26 L31 T32	A24-I28 HydrophobicContact CB-CD1 4.29Å; A24-I28 WeakPolarHBondContact O-CB 3.48Å; A24-I28 VanDerWaalsContact O-CD1 3.24Å; A24-I28 WeakPolarHBondContact O-CD1 3.44Å; A24-I28 WeakPolarHBondContact O-CG1 3.39Å; A24-I28 PolarHBondContact O-N 3.11Å; T25-I28 PolarHBondContact O-N 3.14Å; M26-I28 VanDerWaalsContact C-N 3.31Å; M26-I28 PolarHBondContact O-N 3.11Å; I28-L31 PolarHBondContact O-N 3.2Å; I28-T32 WeakPolarHBondContact O-CB 3.39Å; I28-T32 PolarHBondContact O-N 3.24Å; I28-T32 PolarHBondContact O-OG1 3.4Å
29	L	76.3	Confident	67.6	Low	98 Å²	98	98.3 Å²	98.3	51%	0.513	54%	0.544	S	S	.	.	H	α-helix	trans	-66.6	-36.1	174.9	-76.6	168.4	0	0	0	112.2	T25 M26 T32 G33	T25-L29 WeakPolarHBondContact O-CB 3.41Å; T25-L29 VanDerWaalsContact O-CG 3.27Å; T25-L29 WeakPolarHBondContact O-CG 3.25Å; T25-L29 PolarHBondContact O-N 3.16Å; M26-L29 PolarHBondContact O-N 2.75Å; L29-T32 VanDerWaalsContact CA-OG1 3.27Å; L29-T32 WeakPolarHBondContact CA-OG1 3.31Å; L29-T32 PolarHBondContact O-OG1 3.14Å; L29-G33 WeakPolarHBondContact O-CA 3.47Å; L29-G33 PolarHBondContact O-N 3.2Å
30	L	78.5	Confident	67.7	Low	128 Å²	128	91.3 Å²	91.3	67%	0.67	51%	0.513	S	S	*	.	H	α-helix	trans	-73.1	-40.3	174.8	-72.7	171.1	0	0	0	111.9	M26 P27 G33 L34	M26-L30 WeakPolarHBondContact O-CB 3.45Å; M26-L30 VanDerWaalsContact O-CG 3.3Å; M26-L30 WeakPolarHBondContact O-CG 3.45Å; M26-L30 PolarHBondContact O-N 2.76Å; P27-L30 PolarHBondContact O-N 2.88Å; L30-G33 CarbonylContact O-C 3.48Å; L30-G33 PolarHBondContact O-N 2.9Å; L30-L34 VanDerWaalsContact O-CB 3.24Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 PolarHBondContact O-N 2.97Å
31	L	78.9	Confident	67.7	Low	113 Å²	113	96.8 Å²	96.8	59%	0.592	52%	0.517	S	S	*	.	H	α-helix	trans	-68.5	-42.9	175.3	-96.8	147.6	0	0	0	111.3	P27 I28 L34 F35	P27-L31 VanDerWaalsContact O-CB 3.23Å; P27-L31 WeakPolarHBondContact O-CB 3.41Å; P27-L31 PolarHBondContact O-N 2.93Å; I28-L31 PolarHBondContact O-N 3.2Å; L31-L34 PolarHBondContact O-N 3.07Å; L31-F35 WeakPolarHBondContact O-CB 3.4Å; L31-F35 PolarHBondContact O-N 3.26Å
32	T	75.9	Confident	67.4	Low	66 Å²	66	98.3 Å²	98.3	41%	0.405	52%	0.523	S	S	.	.	H	α-helix	trans	-62.5	-49	169.6	41.1	0	0	0	0	109.4	I28 L29 L34 F35 L36	I28-T32 WeakPolarHBondContact O-CB 3.39Å; I28-T32 PolarHBondContact O-N 3.24Å; I28-T32 PolarHBondContact O-OG1 3.4Å; L29-T32 VanDerWaalsContact CA-OG1 3.27Å; L29-T32 WeakPolarHBondContact CA-OG1 3.31Å; L29-T32 PolarHBondContact O-OG1 3.14Å; T32-L34 VanDerWaalsContact C-N 3.29Å; T32-L34 PolarHBondContact O-N 2.88Å; T32-F35 CarbonylContact O-C 3.58Å; T32-F35 PolarHBondContact O-N 3.24Å; T32-L36 WeakPolarHBondContact O-CB 3.29Å; T32-L36 VanDerWaalsContact O-CD1 3.31Å; T32-L36 WeakPolarHBondContact O-CD1 3.46Å; T32-L36 WeakPolarHBondContact O-CG 3.47Å; T32-L36 PolarHBondContact O-N 3.46Å
33	G	74.8	Confident	66.6	Low	28 Å²	28	97.1 Å²	97.1	29%	0.289	53%	0.525	S	S	.	.	H	α-helix	trans	-51.6	-42.5	173.8	0	0	0	0	0	114.4	L29 L30 L36 L37	L29-G33 WeakPolarHBondContact O-CA 3.47Å; L29-G33 PolarHBondContact O-N 3.2Å; L30-G33 CarbonylContact O-C 3.48Å; L30-G33 PolarHBondContact O-N 2.9Å; G33-L36 WeakPolarHBondContact O-CB 3.41Å; G33-L36 PolarHBondContact O-N 3.2Å; G33-L37 WeakPolarHBondContact O-CG 3.45Å; G33-L37 PolarHBondContact O-N 3.46Å
34	L	73.6	Confident	66	Low	108 Å²	108	95.3 Å²	95.3	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-72.4	-46	178.2	-165.7	85.4	0	0	0	111.6	L30 L31 T32 L36 L37 V38	L30-L34 VanDerWaalsContact O-CB 3.24Å; L30-L34 WeakPolarHBondContact O-CB 3.45Å; L30-L34 PolarHBondContact O-N 2.97Å; L31-L34 PolarHBondContact O-N 3.07Å; T32-L34 VanDerWaalsContact C-N 3.29Å; T32-L34 PolarHBondContact O-N 2.88Å; L34-L36 PolarHBondContact O-N 3.46Å; L34-L37 PolarHBondContact O-N 3.32Å; L34-V38 WeakPolarHBondContact O-CB 3.33Å; L34-V38 VanDerWaalsContact O-CG2 3.3Å; L34-V38 WeakPolarHBondContact O-CG2 3.5Å; L34-V38 PolarHBondContact O-N 2.97Å
35	F	68.6	Low	65.4	Low	143 Å²	143	97.2 Å²	97.2	63%	0.627	51%	0.514	S	S	*	.	H	α-helix	trans	-62.5	-32.1	175	-146.3	-89.3	0	0	0	110.9	L31 T32 W39	L31-F35 WeakPolarHBondContact O-CB 3.4Å; L31-F35 PolarHBondContact O-N 3.26Å; T32-F35 CarbonylContact O-C 3.58Å; T32-F35 PolarHBondContact O-N 3.24Å; F35-W39 HydrophobicContact CE1-CE3 4.14Å; F35-W39 WeakPolarHBondContact O-CB 3.46Å; F35-W39 PolarHBondContact O-N 3.42Å
36	L	61.7	Low	65.7	Low	65 Å²	65	99.6 Å²	99.6	34%	0.34	53%	0.532	S	S	.	.	H	α-helix	trans	-71	-41.8	174.4	-70.4	167.4	0	0	0	112.1	T32 G33 L34 N40 M54	T32-L36 WeakPolarHBondContact O-CB 3.29Å; T32-L36 VanDerWaalsContact O-CD1 3.31Å; T32-L36 WeakPolarHBondContact O-CD1 3.46Å; T32-L36 WeakPolarHBondContact O-CG 3.47Å; T32-L36 PolarHBondContact O-N 3.46Å; G33-L36 WeakPolarHBondContact O-CB 3.41Å; G33-L36 PolarHBondContact O-N 3.2Å; L34-L36 PolarHBondContact O-N 3.46Å; L36-N40 VanDerWaalsContact O-CB 3.3Å; L36-N40 WeakPolarHBondContact O-CB 3.46Å; L36-N40 PolarHBondContact O-N 3.15Å; L36-M54 HydrophobicContact CD1-CE 3.32Å; L36-M54 HydrophobicContact CD2-CE 3.22Å; L36-M54 HydrophobicContact CD2-CG 3.63Å; L36-M54 HydrophobicContact CD2-SD 3.29Å; L36-M54 WeakPolarHBondContact CD2-SD 3.45Å; L36-M54 HydrophobicContact CG-CE 3.86Å; L36-M54 HydrophobicContact CG-SD 4.47Å
37	L	63.9	Low	66.7	Low	126 Å²	126	95.8 Å²	95.8	66%	0.66	51%	0.514	S	S	*	.	H	α-helix	trans	-63.2	-45.5	173	-78.6	164.6	0	0	0	111	G33 L34 Y41	G33-L37 WeakPolarHBondContact O-CG 3.45Å; G33-L37 PolarHBondContact O-N 3.46Å; L34-L37 PolarHBondContact O-N 3.32Å; L37-Y41 WeakPolarHBondContact O-CB 3.14Å; L37-Y41 PolarHBondContact O-N 2.9Å
38	V	62.3	Low	67.6	Low	66 Å²	66	94.9 Å²	94.9	40%	0.4	51%	0.507	S	S	.	.	H	α-helix	trans	-67.8	-43.3	179.4	174.8	0	0	0	0	111.6	L34 Y41 E42	L34-V38 WeakPolarHBondContact O-CB 3.33Å; L34-V38 VanDerWaalsContact O-CG2 3.3Å; L34-V38 WeakPolarHBondContact O-CG2 3.5Å; L34-V38 PolarHBondContact O-N 2.97Å; V38-Y41 CarbonylContact O-C 3.59Å; V38-Y41 WeakPolarHBondContact O-CB 3.34Å; V38-Y41 PolarHBondContact O-N 3.36Å; V38-Y41 VanDerWaalsContact O-N 3.1Å; V38-E42 HydrophobicContact CG1-CG 4.41Å; V38-E42 PolarHBondContact O-N 3.31Å
39	W	59	Low	68.4	Low	184 Å²	184	91.1 Å²	91.1	70%	0.697	49%	0.494	S	S	*	.	H	α-helix	trans	-66.8	-38.5	176.6	-172.2	-76.5	0	0	0	112.7	F35 Y41 G43	F35-W39 HydrophobicContact CE1-CE3 4.14Å; F35-W39 WeakPolarHBondContact O-CB 3.46Å; F35-W39 PolarHBondContact O-N 3.42Å; W39-Y41 VanDerWaalsContact C-N 3.27Å; W39-Y41 PolarHBondContact O-N 2.94Å; W39-G43 PolarHBondContact O-N 2.97Å
40	N	57	Low	69.2	Low	40 Å²	40	87.3 Å²	87.3	21%	0.214	48%	0.475	C	S	.	.	H	α-helix	trans	-65.6	-33.8	171.4	-121.1	2.6	0	0	0	110.9	L36 T44	L36-N40 VanDerWaalsContact O-CB 3.3Å; L36-N40 WeakPolarHBondContact O-CB 3.46Å; L36-N40 PolarHBondContact O-N 3.15Å; N40-T44 WeakPolarHBondContact O-CB 3.4Å; N40-T44 WeakPolarHBondContact O-CG2 3.45Å; N40-T44 PolarHBondContact O-N 3.47Å; N40-T44 PolarHBondContact O-OG1 2.87Å
41	Y	54.8	Low	69.8	Low	198 Å²	198	82.9 Å²	82.9	78%	0.776	46%	0.46	S	S	*	.	H	α-helix	trans	-74.8	-40.7	-179.1	-166.6	-99.2	0	0	0	112.5	L37 V38 W39	L37-Y41 WeakPolarHBondContact O-CB 3.14Å; L37-Y41 PolarHBondContact O-N 2.9Å; V38-Y41 CarbonylContact O-C 3.59Å; V38-Y41 WeakPolarHBondContact O-CB 3.34Å; V38-Y41 PolarHBondContact O-N 3.36Å; V38-Y41 VanDerWaalsContact O-N 3.1Å; W39-Y41 VanDerWaalsContact C-N 3.27Å; W39-Y41 PolarHBondContact O-N 2.94Å
42	E	49.4	Very low	70.2	Confident	151 Å²	151	82.7 Å²	82.7	71%	0.706	45%	0.453	S	S	*	.	H	α-helix	trans	-85	-26.2	-179.1	-70.3	-176.5	164.1	0	0	113.4	V38	V38-E42 HydrophobicContact CG1-CG 4.41Å; V38-E42 PolarHBondContact O-N 3.31Å
43	G	47.2	Very low	70.9	Confident	56 Å²	56	82.9 Å²	82.9	58%	0.577	46%	0.456	S	S	*	.	H	α-helix	trans	-92.1	-10.4	-179.6	0	0	0	0	0	115.7	W39 S45	W39-G43 PolarHBondContact O-N 2.97Å; G43-S45 PolarHBondContact O-N 2.86Å
44	T	49.6	Very low	71.3	Confident	62 Å²	62	87.8 Å²	87.8	38%	0.38	47%	0.473	S	S	.	.			trans	-92.9	68.8	176.2	54.3	0	0	0	0	111.3	N40 S46	N40-T44 WeakPolarHBondContact O-CB 3.4Å; N40-T44 WeakPolarHBondContact O-CG2 3.45Å; N40-T44 PolarHBondContact O-N 3.47Å; N40-T44 PolarHBondContact O-OG1 2.87Å; T44-S46 PolarHBondContact O-N 3.08Å
45	S	48.2	Very low	72	Confident	97 Å²	97	83.6 Å²	83.6	68%	0.678	46%	0.456	S	S	*	.			trans	-59.1	110.8	171.5	-54.6	0	0	0	0	111.1	G43 I47	G43-S45 PolarHBondContact O-N 2.86Å; S45-I47 PolarHBondContact O-N 3.02Å
46	S	75.9	Confident	73.1	Confident	87 Å²	87	81.3 Å²	81.3	61%	0.608	45%	0.449	S	S	*	.	S	Bend	trans	69.4	-36.8	155.3	-165.6	0	0	0	0	120.1	T44 P48 Y386	T44-S46 PolarHBondContact O-N 3.08Å; S46-P48 WeakPolarHBondContact O-CD 3.43Å; S46-Y386 WeakPolarHBondContact O-CE1 3.44Å
47	I	89.9	Confident	74.6	Confident	33 Å²	33	78.5 Å²	78.5	17%	0.169	44%	0.436	C	S	.	.			trans	-83.3	122.2	-170.4	-57.5	171.7	0	0	0	112.2	S45 F84 R86 L95 Y386	S45-I47 PolarHBondContact O-N 3.02Å; I47-F84 HydrophobicContact CG2-CD1 4.45Å; I47-F84 HydrophobicContact CG2-CE1 4.27Å; I47-R86 HydrophobicContact CG2-CB 3.75Å; I47-L95 HydrophobicContact CG2-CD2 4.2Å; I47-Y386 HydrophobicContact CB-CD1 4.39Å; I47-Y386 HydrophobicContact CG1-CD1 3.68Å; I47-Y386 HydrophobicContact CG1-CE1 4.46Å; I47-Y386 HydrophobicContact CG1-CG 4.36Å
48	P	95.1	Very high	76.1	Confident	41 Å²	41	73.2 Å²	73.2	27%	0.266	41%	0.409	S	S	.	.			trans	-61	146.3	178.9	-22.9	33.5	0	0	0	113.5	S46 Y81 M85 R86	S46-P48 WeakPolarHBondContact O-CD 3.43Å; P48-Y81 WeakPolarHBondContact CB-O 3.46Å; P48-M85 HydrophobicContact CB-CB 4.28Å; P48-M85 CarbonylContact O-C 3.35Å; P48-M85 WeakPolarHBondContact O-CA 3.38Å; P48-M85 WeakPolarHBondContact O-CB 3.4Å; P48-R86 PolarHBondContact O-N 3.01Å
49	G	95.1	Very high	77.7	Confident	24 Å²	24	76 Å²	76	25%	0.247	42%	0.421	C	S	.	.	S	Bend	trans	157.8	177.1	173.6	0	0	0	0	0	113.9	Y81	G49-Y81 VanDerWaalsContact C-CD1 3.44Å; G49-Y81 VanDerWaalsContact C-CE1 3.43Å
50	P	94.3	Very high	79.5	Confident	18 Å²	18	71.9 Å²	71.9	12%	0.117	41%	0.412	C	S	.	.			trans	-57.8	148.3	171.3	23.9	-34.6	0	0	0	111.9	Y77 R86 W88	P50-Y77 HydrophobicContact CG-CE1 4.09Å; P50-R86 WeakPolarHBondContact CD-O 3.35Å; P50-W88 HydrophobicContact CB-CZ3 4.47Å; P50-W88 HydrophobicContact CG-CZ3 3.99Å; P50-W88 VanDerWaalsContact O-CH2 3.24Å; P50-W88 WeakPolarHBondContact O-CH2 3.41Å
51	G	89.9	Confident	81.4	Confident	34 Å²	34	70 Å²	70	35%	0.351	40%	0.402	S	S	.	.			trans	-66	147.8	174.5	0	0	0	0	0	112.2	G57	G51-G57 WeakPolarHBondContact O-CA 3.36Å
52	Y	88.6	Confident	83.5	Confident	110 Å²	110	61.4 Å²	61.4	43%	0.431	37%	0.369	S	S	.	.			trans	-70.2	-37.8	-177.6	176.6	-107.6	0	0	0	112.8	M54 G55 G57 P58 W88	Y52-M54 PolarHBondContact O-N 3.06Å; Y52-G55 PolarHBondContact O-N 3.2Å; Y52-G57 WeakPolarHBondContact O-CA 3.3Å; Y52-G57 PolarHBondContact O-N 3.37Å; Y52-P58 HydrophobicContact CD2-CG 3.71Å; Y52-P58 HydrophobicContact CE2-CG 3.52Å; Y52-P58 WeakPolarHBondContact O-CD 3.43Å; Y52-W88 AromaticContact CD2-CE2 3.92Å; Y52-W88 HydrophobicContact CD2-CH2 4.28Å; Y52-W88 AromaticContact CD2-CZ2 3.64Å; Y52-W88 HydrophobicContact CD2-CZ2 3.64Å; Y52-W88 HydrophobicContact CG-CZ2 4.25Å
53	C	89.3	Confident	85.8	Confident	70 Å²	70	56 Å²	56	47%	0.473	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	47.8	52	173.6	-59.8	0	0	0	0	113.3	G55 I56	C53-G55 VanDerWaalsContact C-N 3.29Å; C53-G55 PolarHBondContact O-N 3.08Å; C53-I56 HydrophobicContact CB-CB 4.22Å; C53-I56 WeakPolarHBondContact O-CB 3.47Å; C53-I56 WeakPolarHBondContact O-CG1 3.23Å; C53-I56 PolarHBondContact O-N 2.88Å
54	M	84.9	Confident	88.2	Confident	131 Å²	131	56.8 Å²	56.8	65%	0.645	34%	0.339	S	S	*	.	G	3₁₀ helix	trans	47.1	44.1	-179.8	-68.6	-166.6	-68.5	0	0	114.8	L36 Y52	L36-M54 HydrophobicContact CD1-CE 3.32Å; L36-M54 HydrophobicContact CD2-CE 3.22Å; L36-M54 HydrophobicContact CD2-CG 3.63Å; L36-M54 HydrophobicContact CD2-SD 3.29Å; L36-M54 WeakPolarHBondContact CD2-SD 3.45Å; L36-M54 HydrophobicContact CG-CE 3.86Å; L36-M54 HydrophobicContact CG-SD 4.47Å; Y52-M54 PolarHBondContact O-N 3.06Å
55	G	87.3	Confident	90.5	Very high	20 Å²	20	53.9 Å²	53.9	21%	0.206	32%	0.321	C	S	.	.	G	3₁₀ helix	trans	92.3	-11.5	177.1	0	0	0	0	0	114.8	Y52 C53 P58 L59	Y52-G55 PolarHBondContact O-N 3.2Å; C53-G55 VanDerWaalsContact C-N 3.29Å; C53-G55 PolarHBondContact O-N 3.08Å; G55-P58 WeakPolarHBondContact O-CD 3.22Å; G55-L59 WeakPolarHBondContact O-CG 3.42Å; G55-L59 PolarHBondContact O-N 2.72Å
56	I	92.3	Very high	92.9	Very high	94 Å²	94	52.2 Å²	52.2	48%	0.482	30%	0.304	S	S	.	.	H	α-helix	trans	-69.1	-37.9	172.5	-58.6	-59.2	0	0	0	111.2	C53 L59 I60	C53-I56 HydrophobicContact CB-CB 4.22Å; C53-I56 WeakPolarHBondContact O-CB 3.47Å; C53-I56 WeakPolarHBondContact O-CG1 3.23Å; C53-I56 PolarHBondContact O-N 2.88Å; I56-L59 HydrophobicContact CD1-CD1 4.46Å; I56-L59 PolarHBondContact O-N 2.96Å; I56-I60 HydrophobicContact CG2-CD1 3.58Å; I56-I60 HydrophobicContact CG2-CG1 4.12Å; I56-I60 WeakPolarHBondContact O-CG1 3.28Å; I56-I60 PolarHBondContact O-N 2.64Å
57	G	93.1	Very high	94	Very high	7 Å²	7	58.9 Å²	58.9	7%	0.072	32%	0.316	C	S	.	.	H	α-helix	trans	-54.3	-54	175.5	0	0	0	0	0	112.2	G51 Y52 L59 I60 S61	G51-G57 WeakPolarHBondContact O-CA 3.36Å; Y52-G57 WeakPolarHBondContact O-CA 3.3Å; Y52-G57 PolarHBondContact O-N 3.37Å; G57-L59 PolarHBondContact O-N 2.9Å; G57-I60 PolarHBondContact O-N 3.15Å; G57-S61 PolarHBondContact O-N 2.91Å; G57-S61 PolarHBondContact O-OG 3.33Å
58	P	95.6	Very high	94.4	Very high	15 Å²	15	60.5 Å²	60.5	10%	0.097	32%	0.324	C	S	.	.	H	α-helix	trans	-55.9	-40.6	174.2	-27.6	30.4	0	0	0	115.7	Y52 G55 S61 H62 W88	Y52-P58 HydrophobicContact CD2-CG 3.71Å; Y52-P58 HydrophobicContact CE2-CG 3.52Å; Y52-P58 WeakPolarHBondContact O-CD 3.43Å; G55-P58 WeakPolarHBondContact O-CD 3.22Å; P58-S61 PolarHBondContact O-N 3.1Å; P58-S61 PolarHBondContact O-OG 2.95Å; P58-S61 VanDerWaalsContact O-OG 3.12Å; P58-H62 VanDerWaalsContact O-CB 3.29Å; P58-H62 WeakPolarHBondContact O-CB 3.42Å; P58-H62 PolarHBondContact O-N 3.19Å; P58-W88 HydrophobicContact CB-CB 3.75Å; P58-W88 HydrophobicContact CB-CD2 4.24Å; P58-W88 HydrophobicContact CB-CG 3.92Å; P58-W88 HydrophobicContact CG-CB 4.15Å; P58-W88 HydrophobicContact CG-CD2 3.72Å; P58-W88 HydrophobicContact CG-CE3 4.08Å; P58-W88 HydrophobicContact CG-CG 3.74Å
59	L	95.6	Very high	94.5	Very high	125 Å²	125	59 Å²	59	65%	0.654	32%	0.315	S	S	*	.	H	α-helix	trans	-65.9	-45.2	178.7	-70	173.7	0	0	0	111.7	G55 I56 G57 G63	G55-L59 WeakPolarHBondContact O-CG 3.42Å; G55-L59 PolarHBondContact O-N 2.72Å; I56-L59 HydrophobicContact CD1-CD1 4.46Å; I56-L59 PolarHBondContact O-N 2.96Å; G57-L59 PolarHBondContact O-N 2.9Å; L59-G63 PolarHBondContact O-N 2.84Å
60	I	96.1	Very high	94.7	Very high	96 Å²	96	57.9 Å²	57.9	49%	0.492	30%	0.303	S	S	.	.	H	α-helix	trans	-66.1	-42.5	177.7	-64.8	171.2	0	0	0	110.2	I56 G57 R64	I56-I60 HydrophobicContact CG2-CD1 3.58Å; I56-I60 HydrophobicContact CG2-CG1 4.12Å; I56-I60 WeakPolarHBondContact O-CG1 3.28Å; I56-I60 PolarHBondContact O-N 2.64Å; G57-I60 PolarHBondContact O-N 3.15Å; I60-R64 WeakPolarHBondContact O-CB 3.17Å; I60-R64 PolarHBondContact O-N 3.36Å
61	S	97.4	Very high	94.9	Very high	1 Å²	1	57 Å²	57	1%	0.007	30%	0.298	C	S	.	.	H	α-helix	trans	-64.2	-50.7	-179.9	67.2	0	0	0	0	111.3	G57 P58 G63 R64 F65 Y77 W88	G57-S61 PolarHBondContact O-N 2.91Å; G57-S61 PolarHBondContact O-OG 3.33Å; P58-S61 PolarHBondContact O-N 3.1Å; P58-S61 PolarHBondContact O-OG 2.95Å; P58-S61 VanDerWaalsContact O-OG 3.12Å; S61-G63 PolarHBondContact O-N 2.96Å; S61-R64 WeakPolarHBondContact O-CB 3.39Å; S61-R64 PolarHBondContact O-N 3.28Å; S61-F65 VanDerWaalsContact O-CD2 3.29Å; S61-F65 WeakPolarHBondContact O-CD2 3.49Å; S61-F65 PolarHBondContact O-N 3.14Å; S61-F65 VanDerWaalsContact O-N 3.13Å; S61-Y77 WeakPolarHBondContact CA-OH 3.38Å; S61-W88 PolarHBondContact OG-N 3.28Å; S61-W88 PolarHBondContact OG-O 3.01Å
62	H	98.3	Very high	95.3	Very high	18 Å²	18	57.1 Å²	57.1	8%	0.083	29%	0.293	C	S	.	.	H	α-helix	trans	-63.7	-43.3	179.1	-167.3	179	0	0	0	111.7	P58 R64 F65 L66 S90 I229	P58-H62 VanDerWaalsContact O-CB 3.29Å; P58-H62 WeakPolarHBondContact O-CB 3.42Å; P58-H62 PolarHBondContact O-N 3.19Å; H62-R64 VanDerWaalsContact C-N 3.27Å; H62-R64 PolarHBondContact O-N 3.21Å; H62-F65 WeakPolarHBondContact O-CB 3.21Å; H62-F65 PolarHBondContact O-N 2.97Å; H62-F65 VanDerWaalsContact O-N 3.12Å; H62-L66 WeakPolarHBondContact O-CG 3.33Å; H62-L66 PolarHBondContact O-N 3.48Å; H62-S90 PolarHBondContact CE1-N 2.91Å; H62-S90 VanDerWaalsContact CE1-N 3.27Å; H62-S90 PolarHBondContact CE1-OG 3.19Å; H62-S90 PolarHBondContact ND1-N 2.87Å; H62-I229 PolarHBondContact NE2-O 3.19Å
63	G	97.9	Very high	95.7	Very high	36 Å²	36	51.9 Å²	51.9	37%	0.371	27%	0.273	S	S	.	.	H	α-helix	trans	-57.2	-39.3	174.2	0	0	0	0	0	112.7	L59 S61 L66 W67	L59-G63 PolarHBondContact O-N 2.84Å; S61-G63 PolarHBondContact O-N 2.96Å; G63-L66 PolarHBondContact O-N 2.75Å; G63-W67 WeakPolarHBondContact O-CB 3.49Å; G63-W67 PolarHBondContact O-N 3.37Å
64	R	98.4	Very high	96.2	Very high	73 Å²	73	48.6 Å²	48.6	28%	0.275	25%	0.25	S	S	.	.	H	α-helix	trans	-64.9	-40.3	175.5	-175.6	169.7	-74.3	154.4	-11.9	112.7	I60 S61 H62 L66 W67 M68 Y76 Y77	I60-R64 WeakPolarHBondContact O-CB 3.17Å; I60-R64 PolarHBondContact O-N 3.36Å; S61-R64 WeakPolarHBondContact O-CB 3.39Å; S61-R64 PolarHBondContact O-N 3.28Å; H62-R64 VanDerWaalsContact C-N 3.27Å; H62-R64 PolarHBondContact O-N 3.21Å; R64-L66 VanDerWaalsContact C-N 3.33Å; R64-W67 PolarHBondContact O-N 2.89Å; R64-M68 HydrophobicContact CG-CG 4.04Å; R64-M68 HydrophobicContact CG-SD 3.37Å; R64-M68 WeakPolarHBondContact CG-SD 3.44Å; R64-M68 WeakPolarHBondContact O-CB 3.18Å; R64-M68 WeakPolarHBondContact O-CG 3.36Å; R64-M68 PolarHBondContact O-N 2.87Å; R64-Y76 VanDerWaalsContact NH1-CZ 3.34Å; R64-Y76 PolarHBondContact NH1-OH 3.07Å; R64-Y76 VanDerWaalsContact NH1-OH 3.17Å; R64-Y76 PolarHBondContact NH2-OH 2.64Å; R64-Y77 HydrophobicContact CG-CE2 4.42Å; R64-Y77 PolarHBondContact NH1-OH 3.41Å
65	F	98.4	Very high	96.9	Very high	1 Å²	1	43.8 Å²	43.8	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-43.4	173	-87.2	-89.3	0	0	0	111.8	S61 H62 W67 G69 I70 A73 Y77 V87 I89 I96 I229 I395	S61-F65 VanDerWaalsContact O-CD2 3.29Å; S61-F65 WeakPolarHBondContact O-CD2 3.49Å; S61-F65 PolarHBondContact O-N 3.14Å; S61-F65 VanDerWaalsContact O-N 3.13Å; H62-F65 WeakPolarHBondContact O-CB 3.21Å; H62-F65 PolarHBondContact O-N 2.97Å; H62-F65 VanDerWaalsContact O-N 3.12Å; F65-W67 VanDerWaalsContact C-N 3.32Å; F65-W67 PolarHBondContact O-N 3.39Å; F65-G69 CarbonylContact O-C 3.6Å; F65-G69 WeakPolarHBondContact O-CA 3.31Å; F65-G69 PolarHBondContact O-N 3.45Å; F65-I70 HydrophobicContact CD1-CB 4.35Å; F65-I70 HydrophobicContact CD1-CG1 4.29Å; F65-I70 HydrophobicContact CD1-CG2 4.29Å; F65-I70 HydrophobicContact CE1-CG2 4.12Å; F65-A73 HydrophobicContact CD1-CB 3.75Å; F65-A73 HydrophobicContact CD2-CB 4.27Å; F65-A73 HydrophobicContact CE1-CB 3.86Å; F65-A73 HydrophobicContact CE2-CB 4.35Å; F65-A73 HydrophobicContact CG-CB 3.95Å; F65-A73 HydrophobicContact CZ-CB 4.16Å; F65-Y77 HydrophobicContact CD2-CE2 4.33Å; F65-Y77 HydrophobicContact CE2-CD2 4.04Å; F65-Y77 AromaticContact CE2-CE2 3.82Å; F65-Y77 HydrophobicContact CE2-CE2 3.82Å; F65-Y77 HydrophobicContact CZ-CD2 4.39Å; F65-V87 HydrophobicContact CE2-CB 4.26Å; F65-V87 HydrophobicContact CE2-CG1 4.41Å; F65-V87 HydrophobicContact CE2-CG2 3.76Å; F65-V87 HydrophobicContact CZ-CG2 4.07Å; F65-I89 HydrophobicContact CD1-CD1 4.11Å; F65-I89 HydrophobicContact CD2-CD1 4.31Å; F65-I89 HydrophobicContact CD2-CG1 4.15Å; F65-I89 HydrophobicContact CE1-CD1 4.04Å; F65-I89 HydrophobicContact CE2-CD1 4.25Å; F65-I89 HydrophobicContact CE2-CG1 4.28Å; F65-I89 HydrophobicContact CG-CD1 4.27Å; F65-I89 HydrophobicContact CG-CG1 4.42Å; F65-I89 HydrophobicContact CZ-CD1 4.11Å; F65-I96 HydrophobicContact CE2-CD1 4.3Å; F65-I96 HydrophobicContact CZ-CD1 3.65Å; F65-I96 HydrophobicContact CZ-CG1 4.49Å; F65-I229 HydrophobicContact CB-CD1 3.87Å; F65-I229 HydrophobicContact CD1-CD1 4.43Å; F65-I395 HydrophobicContact CE1-CD1 4.02Å; F65-I395 HydrophobicContact CZ-CD1 4.38Å
66	L	97.9	Very high	97.4	Very high	62 Å²	62	45.5 Å²	45.5	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-69.6	-28.4	179.2	-63	177.2	0	0	0	113.4	H62 G63 R64 I229 K230 P231	H62-L66 WeakPolarHBondContact O-CG 3.33Å; H62-L66 PolarHBondContact O-N 3.48Å; G63-L66 PolarHBondContact O-N 2.75Å; R64-L66 VanDerWaalsContact C-N 3.33Å; L66-I229 HydrophobicContact CD2-CD1 4.21Å; L66-I229 HydrophobicContact CD2-CG1 4.2Å; L66-K230 HydrophobicContact CD2-CD 3.94Å; L66-P231 HydrophobicContact CD1-CG 4.46Å
67	W	98.1	Very high	97.7	Very high	228 Å²	228	41.1 Å²	41.1	86%	0.864	21%	0.206	S	C	*	.	H	α-helix	trans	-84	-45.7	180	176.3	-107.9	0	0	0	113	G63 R64 F65	G63-W67 WeakPolarHBondContact O-CB 3.49Å; G63-W67 PolarHBondContact O-N 3.37Å; R64-W67 PolarHBondContact O-N 2.89Å; F65-W67 VanDerWaalsContact C-N 3.32Å; F65-W67 PolarHBondContact O-N 3.39Å
68	M	98.2	Very high	98	Very high	67 Å²	67	40.9 Å²	40.9	33%	0.33	20%	0.202	S	C	.	.	H	α-helix	trans	-89.3	-23.2	-174	-62.7	-179.4	62.9	0	0	113.4	R64 S72 A73 Y76	R64-M68 HydrophobicContact CG-CG 4.04Å; R64-M68 HydrophobicContact CG-SD 3.37Å; R64-M68 WeakPolarHBondContact CG-SD 3.44Å; R64-M68 WeakPolarHBondContact O-CB 3.18Å; R64-M68 WeakPolarHBondContact O-CG 3.36Å; R64-M68 PolarHBondContact O-N 2.87Å; M68-S72 WeakPolarHBondContact O-CB 3.29Å; M68-A73 HydrophobicContact CB-CB 4.37Å; M68-Y76 HydrophobicContact CE-CG 4.37Å
69	G	98.1	Very high	98.1	Very high	8 Å²	8	47.9 Å²	47.9	8%	0.082	23%	0.227	C	C	.	.			trans	86.5	153	-162	0	0	0	0	0	112.2	F65 A73 D476	F65-G69 CarbonylContact O-C 3.6Å; F65-G69 WeakPolarHBondContact O-CA 3.31Å; F65-G69 PolarHBondContact O-N 3.45Å; G69-A73 WeakPolarHBondContact O-CB 3.49Å; G69-A73 PolarHBondContact O-N 2.73Å; G69-D476 VanDerWaalsContact CA-OD1 3.24Å; G69-D476 WeakPolarHBondContact CA-OD1 3.48Å
70	I	98.6	Very high	98.2	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-58	-53.3	-172.9	-59.3	162.6	0	0	0	111.4	F65 A73 C74 L228 I229 L372 I395 D476 L477	F65-I70 HydrophobicContact CD1-CB 4.35Å; F65-I70 HydrophobicContact CD1-CG1 4.29Å; F65-I70 HydrophobicContact CD1-CG2 4.29Å; F65-I70 HydrophobicContact CE1-CG2 4.12Å; I70-A73 PolarHBondContact O-N 3.31Å; I70-C74 WeakPolarHBondContact O-CB 3.35Å; I70-C74 PolarHBondContact O-N 3.4Å; I70-C74 PolarHBondContact O-SG 3.48Å; I70-L228 HydrophobicContact CD1-CD2 4.47Å; I70-I229 HydrophobicContact CD1-CD1 4.09Å; I70-I229 HydrophobicContact CD1-CG1 4.25Å; I70-I229 HydrophobicContact CD1-CG2 4.25Å; I70-I229 HydrophobicContact CG1-CD1 3.65Å; I70-I229 HydrophobicContact CG1-CG1 4.35Å; I70-L372 HydrophobicContact CB-CD2 4.28Å; I70-L372 HydrophobicContact CG2-CD1 4.18Å; I70-L372 HydrophobicContact CG2-CD2 3.73Å; I70-I395 HydrophobicContact CG2-CD1 4.04Å; I70-D476 WeakPolarHBondContact CB-O 3.18Å; I70-D476 VanDerWaalsContact CG1-OD1 3.3Å; I70-D476 WeakPolarHBondContact CG1-OD1 3.22Å; I70-D476 PolarHBondContact N-OD1 3.35Å; I70-L477 HydrophobicContact CD1-CD1 4.39Å
71	G	98.2	Very high	98.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.8	-45.6	-177.6	0	0	0	0	0	113.7	A73 C74 N75 L372 H475 D476	G71-A73 PolarHBondContact O-N 3.29Å; G71-C74 PolarHBondContact O-N 3.4Å; G71-N75 PolarHBondContact O-N 2.89Å; G71-N75 PolarHBondContact O-ND2 2.75Å; G71-N75 VanDerWaalsContact O-ND2 3.07Å; G71-L372 VanDerWaalsContact CA-CD2 3.44Å; G71-H475 PolarHBondContact N-O 3.45Å; G71-D476 PolarHBondContact N-O 2.85Å
72	S	98.5	Very high	98.2	Very high	37 Å²	37	45.9 Å²	45.9	26%	0.259	22%	0.222	S	C	.	.	H	α-helix	trans	-63.2	-42.6	175.4	-69.8	0	0	0	0	112.6	M68 N75 Y76 H475	M68-S72 WeakPolarHBondContact O-CB 3.29Å; S72-N75 PolarHBondContact O-N 3.49Å; S72-Y76 WeakPolarHBondContact O-CB 3.47Å; S72-Y76 PolarHBondContact O-N 2.95Å; S72-H475 PolarHBondContact N-O 2.91Å; S72-H475 WeakPolarHBondContact OG-CB 3.3Å; S72-H475 PolarHBondContact OG-O 2.86Å
73	A	98.7	Very high	98.2	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-41.2	176.8	0	0	0	0	0	111.7	F65 M68 G69 I70 G71 Y76 Y77	F65-A73 HydrophobicContact CD1-CB 3.75Å; F65-A73 HydrophobicContact CD2-CB 4.27Å; F65-A73 HydrophobicContact CE1-CB 3.86Å; F65-A73 HydrophobicContact CE2-CB 4.35Å; F65-A73 HydrophobicContact CG-CB 3.95Å; F65-A73 HydrophobicContact CZ-CB 4.16Å; M68-A73 HydrophobicContact CB-CB 4.37Å; G69-A73 WeakPolarHBondContact O-CB 3.49Å; G69-A73 PolarHBondContact O-N 2.73Å; I70-A73 PolarHBondContact O-N 3.31Å; G71-A73 PolarHBondContact O-N 3.29Å; A73-Y76 WeakPolarHBondContact O-CB 3.49Å; A73-Y76 PolarHBondContact O-N 3.49Å; A73-Y77 WeakPolarHBondContact O-CD2 3.45Å; A73-Y77 PolarHBondContact O-N 3.12Å
74	C	98.8	Very high	98.2	Very high	0 Å²	0	46 Å²	46	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60	-47.4	175.5	-69.2	0	0	0	0	111.8	I70 G71 Y76 Y77 N78 I96	I70-C74 WeakPolarHBondContact O-CB 3.35Å; I70-C74 PolarHBondContact O-N 3.4Å; I70-C74 PolarHBondContact O-SG 3.48Å; G71-C74 PolarHBondContact O-N 3.4Å; C74-Y76 VanDerWaalsContact C-N 3.33Å; C74-Y76 PolarHBondContact O-N 3.27Å; C74-Y77 PolarHBondContact O-N 2.76Å; C74-N78 PolarHBondContact O-N 3.04Å; C74-N78 PolarHBondContact O-OD1 3.2Å; C74-I96 HydrophobicContact CB-CG2 3.77Å
75	N	98.6	Very high	98.2	Very high	31 Å²	31	42.5 Å²	42.5	17%	0.166	20%	0.2	C	C	.	.	H	α-helix	trans	-63.6	-37.7	176.9	-78.1	-52.6	0	0	0	113	G71 S72 R79 N397 H475	G71-N75 PolarHBondContact O-N 2.89Å; G71-N75 PolarHBondContact O-ND2 2.75Å; G71-N75 VanDerWaalsContact O-ND2 3.07Å; S72-N75 PolarHBondContact O-N 3.49Å; N75-R79 VanDerWaalsContact O-CB 3.26Å; N75-R79 WeakPolarHBondContact O-CB 3.42Å; N75-R79 PolarHBondContact O-N 2.93Å; N75-R79 VanDerWaalsContact O-N 3.11Å; N75-N397 PolarHBondContact OD1-ND2 2.96Å; N75-H475 PolarHBondContact ND2-CE1 3.21Å
76	Y	98.7	Very high	98.2	Very high	56 Å²	56	43.8 Å²	43.8	22%	0.22	20%	0.204	C	C	.	.	H	α-helix	trans	-59.8	-52.5	172.8	170.1	-86.4	0	0	0	111.1	R64 M68 S72 A73 C74 R79 V80	R64-Y76 VanDerWaalsContact NH1-CZ 3.34Å; R64-Y76 PolarHBondContact NH1-OH 3.07Å; R64-Y76 VanDerWaalsContact NH1-OH 3.17Å; R64-Y76 PolarHBondContact NH2-OH 2.64Å; M68-Y76 HydrophobicContact CE-CG 4.37Å; S72-Y76 WeakPolarHBondContact O-CB 3.47Å; S72-Y76 PolarHBondContact O-N 2.95Å; A73-Y76 WeakPolarHBondContact O-CB 3.49Å; A73-Y76 PolarHBondContact O-N 3.49Å; C74-Y76 VanDerWaalsContact C-N 3.33Å; C74-Y76 PolarHBondContact O-N 3.27Å; Y76-R79 PolarHBondContact O-N 3.48Å; Y76-V80 HydrophobicContact CD2-CG2 4.42Å; Y76-V80 HydrophobicContact CE1-CG2 4.14Å; Y76-V80 HydrophobicContact CE2-CG2 4.06Å; Y76-V80 VanDerWaalsContact O-CG2 3.3Å; Y76-V80 WeakPolarHBondContact O-CG2 3.31Å; Y76-V80 PolarHBondContact O-N 3.07Å; Y76-V80 VanDerWaalsContact O-N 3.09Å
77	Y	98.6	Very high	98.2	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.008	19%	0.189	C	C	.	.	H	α-helix	trans	-67.4	-40.8	-175.7	-81.8	-63.8	0	0	0	112.7	P50 S61 R64 F65 A73 C74 R79 V80 Y81 M85 V87 I96	P50-Y77 HydrophobicContact CG-CE1 4.09Å; S61-Y77 WeakPolarHBondContact CA-OH 3.38Å; R64-Y77 HydrophobicContact CG-CE2 4.42Å; R64-Y77 PolarHBondContact NH1-OH 3.41Å; F65-Y77 HydrophobicContact CD2-CE2 4.33Å; F65-Y77 HydrophobicContact CE2-CD2 4.04Å; F65-Y77 AromaticContact CE2-CE2 3.82Å; F65-Y77 HydrophobicContact CE2-CE2 3.82Å; F65-Y77 HydrophobicContact CZ-CD2 4.39Å; A73-Y77 WeakPolarHBondContact O-CD2 3.45Å; A73-Y77 PolarHBondContact O-N 3.12Å; C74-Y77 PolarHBondContact O-N 2.76Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 2.91Å; Y77-V80 PolarHBondContact O-N 2.87Å; Y77-Y81 AromaticContact CD1-CD2 3.78Å; Y77-Y81 HydrophobicContact CD1-CD2 3.78Å; Y77-Y81 AromaticContact CD1-CE2 3.65Å; Y77-Y81 HydrophobicContact CD1-CE2 3.65Å; Y77-Y81 AromaticContact CE1-CE2 3.98Å; Y77-Y81 HydrophobicContact CE1-CE2 3.98Å; Y77-Y81 PolarHBondContact O-N 3.3Å; Y77-M85 HydrophobicContact CD1-CE 3.6Å; Y77-M85 HydrophobicContact CG-CE 3.9Å; Y77-M85 HydrophobicContact CG-SD 4.37Å; Y77-V87 HydrophobicContact CD1-CG1 3.83Å; Y77-V87 HydrophobicContact CD2-CG1 3.78Å; Y77-V87 HydrophobicContact CE1-CG1 4.01Å; Y77-V87 HydrophobicContact CE2-CG1 3.96Å; Y77-V87 HydrophobicContact CG-CG1 3.74Å; Y77-I96 HydrophobicContact CD2-CD1 3.99Å; Y77-I96 HydrophobicContact CG-CD1 4.17Å
78	N	98.6	Very high	98.2	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-63.1	-38.9	175	-72	137.3	0	0	0	112.3	C74 V80 G82 I96 N397	C74-N78 PolarHBondContact O-N 3.04Å; C74-N78 PolarHBondContact O-OD1 3.2Å; N78-V80 VanDerWaalsContact C-N 3.32Å; N78-V80 PolarHBondContact O-N 3.37Å; N78-G82 VanDerWaalsContact CA-O 3.32Å; N78-G82 WeakPolarHBondContact CA-O 3.24Å; N78-G82 PolarHBondContact ND2-O 3.32Å; N78-G82 VanDerWaalsContact ND2-O 3.15Å; N78-G82 CarbonylContact O-C 3.6Å; N78-G82 WeakPolarHBondContact O-CA 2.76Å; N78-G82 PolarHBondContact O-N 3.13Å; N78-I96 PolarHBondContact ND2-O 2.8Å; N78-I96 WeakPolarHBondContact OD1-CG2 3.4Å; N78-N397 PolarHBondContact OD1-ND2 3.49Å
79	R	98.2	Very high	98.2	Very high	162 Å²	162	27.2 Å²	27.2	61%	0.611	13%	0.134	S	C	*	.	H	α-helix	trans	-67.1	-31.2	177.6	-175.4	172.1	62	-119.4	0.5	113.2	N75 Y76 Y77	N75-R79 VanDerWaalsContact O-CB 3.26Å; N75-R79 WeakPolarHBondContact O-CB 3.42Å; N75-R79 PolarHBondContact O-N 2.93Å; N75-R79 VanDerWaalsContact O-N 3.11Å; Y76-R79 PolarHBondContact O-N 3.48Å; Y77-R79 VanDerWaalsContact C-N 3.32Å; Y77-R79 PolarHBondContact O-N 2.91Å
80	V	97.9	Very high	97.8	Very high	73 Å²	73	29.8 Å²	29.8	44%	0.442	15%	0.151	S	C	.	.	H	α-helix	trans	-88.1	-41.7	-176.5	176.2	0	0	0	0	112.5	Y76 Y77 N78	Y76-V80 HydrophobicContact CD2-CG2 4.42Å; Y76-V80 HydrophobicContact CE1-CG2 4.14Å; Y76-V80 HydrophobicContact CE2-CG2 4.06Å; Y76-V80 VanDerWaalsContact O-CG2 3.3Å; Y76-V80 WeakPolarHBondContact O-CG2 3.31Å; Y76-V80 PolarHBondContact O-N 3.07Å; Y76-V80 VanDerWaalsContact O-N 3.09Å; Y77-V80 PolarHBondContact O-N 2.87Å; N78-V80 VanDerWaalsContact C-N 3.32Å; N78-V80 PolarHBondContact O-N 3.37Å
81	Y	96.8	Very high	97.2	Very high	79 Å²	79	32.4 Å²	32.4	31%	0.31	18%	0.178	S	C	.	.	H	α-helix	trans	-113.2	-8.6	-169.1	-61.2	-85.6	0	0	0	114.2	P48 G49 Y77 M85	P48-Y81 WeakPolarHBondContact CB-O 3.46Å; G49-Y81 VanDerWaalsContact C-CD1 3.44Å; G49-Y81 VanDerWaalsContact C-CE1 3.43Å; Y77-Y81 AromaticContact CD1-CD2 3.78Å; Y77-Y81 HydrophobicContact CD1-CD2 3.78Å; Y77-Y81 AromaticContact CD1-CE2 3.65Å; Y77-Y81 HydrophobicContact CD1-CE2 3.65Å; Y77-Y81 AromaticContact CE1-CE2 3.98Å; Y77-Y81 HydrophobicContact CE1-CE2 3.98Å; Y77-Y81 PolarHBondContact O-N 3.3Å; Y81-M85 HydrophobicContact CD2-CE 3.76Å; Y81-M85 HydrophobicContact CG-CE 4.01Å
82	G	96.7	Very high	97	Very high	29 Å²	29	36.9 Å²	36.9	30%	0.299	20%	0.199	S	C	.	.			trans	110.1	172.5	-179	0	0	0	0	0	114.4	N78 F84	N78-G82 VanDerWaalsContact CA-O 3.32Å; N78-G82 WeakPolarHBondContact CA-O 3.24Å; N78-G82 PolarHBondContact ND2-O 3.32Å; N78-G82 VanDerWaalsContact ND2-O 3.15Å; N78-G82 CarbonylContact O-C 3.6Å; N78-G82 WeakPolarHBondContact O-CA 2.76Å; N78-G82 PolarHBondContact O-N 3.13Å; G82-F84 PolarHBondContact O-N 2.81Å
83	E	98.3	Very high	96.9	Very high	49 Å²	49	38.9 Å²	38.9	23%	0.229	20%	0.204	C	C	.	.	S	Bend	trans	-78.6	-3.1	-170.6	-51.3	-51.4	139.4	0	0	114.5	I97 S98 K99 R400 L404	E83-I97 CarbonylContact O-C 3.5Å; E83-I97 WeakPolarHBondContact O-CA 3.22Å; E83-S98 WeakPolarHBondContact CA-OG 3.43Å; E83-S98 WeakPolarHBondContact CB-OG 3.37Å; E83-S98 PolarHBondContact O-N 3.11Å; E83-S98 PolarHBondContact O-OG 3.12Å; E83-S98 WeakPolarHBondContact OE2-CB 3.49Å; E83-S98 PolarHBondContact OE2-OG 2.91Å; E83-K99 HydrophobicContact CB-CG 3.82Å; E83-R400 IonicContact OE1-CZ 3.01Å; E83-R400 IonicContact OE1-NE 3.69Å; E83-R400 PolarHBondContact OE1-NE 2.99Å; E83-R400 IonicContact OE1-NH2 2.72Å; E83-R400 PolarHBondContact OE1-NH2 3.01Å; E83-R400 WeakPolarHBondContact OE2-CD 3.46Å; E83-R400 IonicContact OE2-CZ 2.78Å; E83-R400 IonicContact OE2-NE 2.86Å; E83-R400 PolarHBondContact OE2-NE 3.14Å; E83-R400 IonicContact OE2-NH2 3.3Å; E83-L404 HydrophobicContact CG-CD1 4.01Å; E83-L404 WeakPolarHBondContact OE2-CD1 3.46Å
84	F	98.4	Very high	96.9	Very high	7 Å²	7	38.9 Å²	38.9	3%	0.031	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	111.5	168.2	-171.4	-61.1	0	0	0	106.8	I47 G82 L95 I97 K99 I383 Y386 V388	I47-F84 HydrophobicContact CG2-CD1 4.45Å; I47-F84 HydrophobicContact CG2-CE1 4.27Å; G82-F84 PolarHBondContact O-N 2.81Å; F84-L95 HydrophobicContact CE1-CD1 4.06Å; F84-L95 HydrophobicContact CE1-CD2 4.18Å; F84-L95 HydrophobicContact CZ-CD1 3.88Å; F84-I97 HydrophobicContact CD2-CD1 3.94Å; F84-I97 HydrophobicContact CD2-CG1 3.95Å; F84-I97 HydrophobicContact CD2-CG2 3.97Å; F84-I97 HydrophobicContact CE2-CD1 3.61Å; F84-I97 HydrophobicContact CE2-CG1 4.13Å; F84-I97 HydrophobicContact CG-CG1 4.23Å; F84-I97 HydrophobicContact CZ-CD1 3.99Å; F84-K99 HydrophobicContact CB-CD 4.06Å; F84-I383 HydrophobicContact CE2-CB 4.38Å; F84-I383 HydrophobicContact CE2-CG2 4.36Å; F84-Y386 HydrophobicContact CB-CE2 4.31Å; F84-Y386 AromaticContact CD1-CD2 3.73Å; F84-Y386 HydrophobicContact CD1-CD2 3.73Å; F84-Y386 HydrophobicContact CD1-CE2 4.02Å; F84-Y386 HydrophobicContact CD1-CG 4.03Å; F84-Y386 AromaticContact CD2-CD2 3.97Å; F84-Y386 HydrophobicContact CD2-CD2 3.97Å; F84-Y386 HydrophobicContact CD2-CE2 4.39Å; F84-Y386 HydrophobicContact CE1-CD1 4.42Å; F84-Y386 AromaticContact CE1-CD2 3.74Å; F84-Y386 HydrophobicContact CE1-CD2 3.74Å; F84-Y386 HydrophobicContact CE1-CE2 4.47Å; F84-Y386 AromaticContact CE1-CG 3.69Å; F84-Y386 HydrophobicContact CE1-CG 3.69Å; F84-Y386 AromaticContact CE2-CD2 3.95Å; F84-Y386 HydrophobicContact CE2-CD2 3.95Å; F84-Y386 HydrophobicContact CE2-CG 4.5Å; F84-Y386 AromaticContact CG-CD2 3.87Å; F84-Y386 HydrophobicContact CG-CD2 3.87Å; F84-Y386 AromaticContact CG-CE2 4Å; F84-Y386 HydrophobicContact CG-CE2 4Å; F84-Y386 AromaticContact CZ-CD2 3.84Å; F84-Y386 HydrophobicContact CZ-CD2 3.84Å; F84-Y386 AromaticContact CZ-CG 3.95Å; F84-Y386 HydrophobicContact CZ-CG 3.95Å; F84-V388 HydrophobicContact CZ-CG2 4.37Å
85	M	98.2	Very high	96.9	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	164.7	-174.7	67.2	77.8	62.8	0	0	112.1	P48 Y77 Y81 V87 L95 I96	P48-M85 HydrophobicContact CB-CB 4.28Å; P48-M85 CarbonylContact O-C 3.35Å; P48-M85 WeakPolarHBondContact O-CA 3.38Å; P48-M85 WeakPolarHBondContact O-CB 3.4Å; Y77-M85 HydrophobicContact CD1-CE 3.6Å; Y77-M85 HydrophobicContact CG-CE 3.9Å; Y77-M85 HydrophobicContact CG-SD 4.37Å; Y81-M85 HydrophobicContact CD2-CE 3.76Å; Y81-M85 HydrophobicContact CG-CE 4.01Å; M85-V87 HydrophobicContact CE-CG1 3.54Å; M85-V87 HydrophobicContact SD-CG1 3.71Å; M85-L95 CarbonylContact O-C 3.49Å; M85-L95 VanDerWaalsContact O-CA 3.29Å; M85-L95 WeakPolarHBondContact O-CA 3.41Å; M85-I96 HydrophobicContact CG-CB 4.38Å; M85-I96 PolarHBondContact N-O 3.36Å; M85-I96 PolarHBondContact O-N 2.83Å; M85-I96 HydrophobicContact SD-CB 3.83Å; M85-I96 HydrophobicContact SD-CD1 3.76Å; M85-I96 HydrophobicContact SD-CG1 3.9Å
86	R	98.3	Very high	96.9	Very high	27 Å²	27	37.6 Å²	37.6	10%	0.102	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	138.8	-178.1	-179.1	-84.3	-55	-90.4	-0.4	112	I47 P48 P50 W88 E93 L95	I47-R86 HydrophobicContact CG2-CB 3.75Å; P48-R86 PolarHBondContact O-N 3.01Å; P50-R86 WeakPolarHBondContact CD-O 3.35Å; R86-W88 VanDerWaalsContact NH1-CZ2 3.27Å; R86-E93 IonicContact NH1-OE1 3.51Å; R86-E93 PolarHBondContact NH1-OE1 3.15Å; R86-L95 HydrophobicContact CB-CD2 3.89Å; R86-L95 HydrophobicContact CG-CD2 4.27Å
87	V	98.3	Very high	96.9	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	-176.4	165.9	-61.7	0	0	0	0	110	F65 Y77 M85 T94 I96	F65-V87 HydrophobicContact CE2-CB 4.26Å; F65-V87 HydrophobicContact CE2-CG1 4.41Å; F65-V87 HydrophobicContact CE2-CG2 3.76Å; F65-V87 HydrophobicContact CZ-CG2 4.07Å; Y77-V87 HydrophobicContact CD1-CG1 3.83Å; Y77-V87 HydrophobicContact CD2-CG1 3.78Å; Y77-V87 HydrophobicContact CE1-CG1 4.01Å; Y77-V87 HydrophobicContact CE2-CG1 3.96Å; Y77-V87 HydrophobicContact CG-CG1 3.74Å; M85-V87 HydrophobicContact CE-CG1 3.54Å; M85-V87 HydrophobicContact SD-CG1 3.71Å; V87-T94 HydrophobicContact CG2-CG2 4.36Å; V87-T94 WeakPolarHBondContact CG2-O 3.43Å; V87-T94 PolarHBondContact N-O 3.09Å; V87-T94 PolarHBondContact O-N 3.3Å; V87-I96 HydrophobicContact CB-CD1 4.47Å; V87-I96 HydrophobicContact CG1-CD1 3.78Å; V87-I96 HydrophobicContact CG1-CG1 4.46Å; V87-I96 HydrophobicContact CG2-CD1 3.82Å; V87-I96 HydrophobicContact CG2-CG1 3.93Å
88	W	98.3	Very high	96.9	Very high	5 Å²	5	34.9 Å²	34.9	2%	0.019	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	140.5	168.6	-52.8	-97.1	0	0	0	111.6	P50 Y52 P58 S61 R86 E92	P50-W88 HydrophobicContact CB-CZ3 4.47Å; P50-W88 HydrophobicContact CG-CZ3 3.99Å; P50-W88 VanDerWaalsContact O-CH2 3.24Å; P50-W88 WeakPolarHBondContact O-CH2 3.41Å; Y52-W88 AromaticContact CD2-CE2 3.92Å; Y52-W88 HydrophobicContact CD2-CH2 4.28Å; Y52-W88 AromaticContact CD2-CZ2 3.64Å; Y52-W88 HydrophobicContact CD2-CZ2 3.64Å; Y52-W88 HydrophobicContact CG-CZ2 4.25Å; P58-W88 HydrophobicContact CB-CB 3.75Å; P58-W88 HydrophobicContact CB-CD2 4.24Å; P58-W88 HydrophobicContact CB-CG 3.92Å; P58-W88 HydrophobicContact CG-CB 4.15Å; P58-W88 HydrophobicContact CG-CD2 3.72Å; P58-W88 HydrophobicContact CG-CE3 4.08Å; P58-W88 HydrophobicContact CG-CG 3.74Å; S61-W88 PolarHBondContact OG-N 3.28Å; S61-W88 PolarHBondContact OG-O 3.01Å; R86-W88 VanDerWaalsContact NH1-CZ2 3.27Å; W88-E92 WeakPolarHBondContact CA-O 3.3Å
89	I	97.3	Very high	96.9	Very high	5 Å²	5	38.8 Å²	38.8	3%	0.026	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	122.6	171.8	-61.1	176.6	0	0	0	106.5	F65 G91 E92 T94 F116 I229 I395	F65-I89 HydrophobicContact CD1-CD1 4.11Å; F65-I89 HydrophobicContact CD2-CD1 4.31Å; F65-I89 HydrophobicContact CD2-CG1 4.15Å; F65-I89 HydrophobicContact CE1-CD1 4.04Å; F65-I89 HydrophobicContact CE2-CD1 4.25Å; F65-I89 HydrophobicContact CE2-CG1 4.28Å; F65-I89 HydrophobicContact CG-CD1 4.27Å; F65-I89 HydrophobicContact CG-CG1 4.42Å; F65-I89 HydrophobicContact CZ-CD1 4.11Å; I89-G91 PolarHBondContact O-N 3.42Å; I89-E92 PolarHBondContact N-O 3.23Å; I89-E92 VanDerWaalsContact N-O 3.11Å; I89-E92 PolarHBondContact O-N 2.81Å; I89-T94 HydrophobicContact CD1-CG2 4.14Å; I89-F116 HydrophobicContact CD1-CE2 4.17Å; I89-F116 HydrophobicContact CD1-CZ 4.38Å; I89-I229 HydrophobicContact CG2-CB 4.12Å; I89-I229 HydrophobicContact CG2-CG2 4.3Å; I89-I395 HydrophobicContact CD1-CD1 4.12Å
90	S	89.4	Confident	96.9	Very high	62 Å²	62	31.2 Å²	31.2	43%	0.434	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	32.5	-175.4	-58.1	0	0	0	0	114.1	H62 E92	H62-S90 PolarHBondContact CE1-N 2.91Å; H62-S90 VanDerWaalsContact CE1-N 3.27Å; H62-S90 PolarHBondContact CE1-OG 3.19Å; H62-S90 PolarHBondContact ND1-N 2.87Å; S90-E92 PolarHBondContact O-N 2.89Å
91	G	86.5	Confident	96.9	Very high	56 Å²	56	29.6 Å²	29.6	58%	0.577	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	80.4	-13.9	-177.7	0	0	0	0	0	115.1	I89	I89-G91 PolarHBondContact O-N 3.42Å
92	E	93.6	Very high	97	Very high	93 Å²	93	25.9 Å²	25.9	44%	0.435	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	135.8	175.2	-61.2	-167.9	154.1	0	0	111	W88 I89 S90 T94 K376 N393	W88-E92 WeakPolarHBondContact CA-O 3.3Å; I89-E92 PolarHBondContact N-O 3.23Å; I89-E92 VanDerWaalsContact N-O 3.11Å; I89-E92 PolarHBondContact O-N 2.81Å; S90-E92 PolarHBondContact O-N 2.89Å; E92-T94 PolarHBondContact O-N 3.21Å; E92-T94 PolarHBondContact O-OG1 2.78Å; E92-K376 IonicContact OE1-NZ 2.6Å; E92-K376 IonicContact OE2-NZ 3.63Å; E92-K376 PolarHBondContact OE2-NZ 2.92Å; E92-N393 PolarHBondContact OE2-ND2 2.99Å; E92-N393 PolarHBondContact OE2-OD1 3.16Å
93	E	96.6	Very high	97.1	Very high	80 Å²	80	24.5 Å²	24.5	37%	0.374	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	130.1	171.9	-64	-162.7	152.4	0	0	110.6	R86 N393	R86-E93 IonicContact NH1-OE1 3.51Å; R86-E93 PolarHBondContact NH1-OE1 3.15Å; E93-N393 PolarHBondContact O-N 3.01Å
94	T	98.6	Very high	97.1	Very high	0 Å²	0	24 Å²	24	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	125.6	-178.9	-54.4	0	0	0	0	109.3	V87 I89 E92 F116 N393 I395	V87-T94 HydrophobicContact CG2-CG2 4.36Å; V87-T94 WeakPolarHBondContact CG2-O 3.43Å; V87-T94 PolarHBondContact N-O 3.09Å; V87-T94 PolarHBondContact O-N 3.3Å; I89-T94 HydrophobicContact CD1-CG2 4.14Å; E92-T94 PolarHBondContact O-N 3.21Å; E92-T94 PolarHBondContact O-OG1 2.78Å; T94-F116 HydrophobicContact CG2-CE2 4.46Å; T94-F116 HydrophobicContact CG2-CZ 3.88Å; T94-N393 CarbonylContact C-O 3.59Å; T94-N393 VanDerWaalsContact CA-O 3.28Å; T94-N393 WeakPolarHBondContact CA-O 2.99Å; T94-N393 HydrophobicContact CG2-CB 3.75Å; T94-N393 WeakPolarHBondContact OG1-CB 3.03Å; T94-I395 HydrophobicContact CG2-CD1 4.18Å; T94-I395 HydrophobicContact CG2-CG1 4.02Å
95	L	98.8	Very high	97.2	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.016	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	133.7	175.1	-58.1	177	0	0	0	110.1	I47 F84 M85 R86 I97 V388 T392 N393 I394 I395	I47-L95 HydrophobicContact CG2-CD2 4.2Å; F84-L95 HydrophobicContact CE1-CD1 4.06Å; F84-L95 HydrophobicContact CE1-CD2 4.18Å; F84-L95 HydrophobicContact CZ-CD1 3.88Å; M85-L95 CarbonylContact O-C 3.49Å; M85-L95 VanDerWaalsContact O-CA 3.29Å; M85-L95 WeakPolarHBondContact O-CA 3.41Å; R86-L95 HydrophobicContact CB-CD2 3.89Å; R86-L95 HydrophobicContact CG-CD2 4.27Å; L95-I97 HydrophobicContact CB-CD1 3.93Å; L95-I97 HydrophobicContact CB-CG1 4.03Å; L95-I97 HydrophobicContact CD1-CD1 4.36Å; L95-V388 HydrophobicContact CD1-CB 4.5Å; L95-V388 HydrophobicContact CD1-CG1 4.08Å; L95-V388 HydrophobicContact CD1-CG2 3.72Å; L95-T392 HydrophobicContact CD1-CG2 3.88Å; L95-T392 HydrophobicContact CG-CG2 3.71Å; L95-N393 PolarHBondContact N-O 2.84Å; L95-I394 CarbonylContact O-C 3.6Å; L95-I394 WeakPolarHBondContact O-CA 3.39Å; L95-I395 PolarHBondContact O-N 2.71Å
96	I	98.8	Very high	97.2	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	117.6	171.6	-47.2	175.6	0	0	0	107.6	F65 C74 Y77 N78 M85 V87 I395	F65-I96 HydrophobicContact CE2-CD1 4.3Å; F65-I96 HydrophobicContact CZ-CD1 3.65Å; F65-I96 HydrophobicContact CZ-CG1 4.49Å; C74-I96 HydrophobicContact CB-CG2 3.77Å; Y77-I96 HydrophobicContact CD2-CD1 3.99Å; Y77-I96 HydrophobicContact CG-CD1 4.17Å; N78-I96 PolarHBondContact ND2-O 2.8Å; N78-I96 WeakPolarHBondContact OD1-CG2 3.4Å; M85-I96 HydrophobicContact CG-CB 4.38Å; M85-I96 PolarHBondContact N-O 3.36Å; M85-I96 PolarHBondContact O-N 2.83Å; M85-I96 HydrophobicContact SD-CB 3.83Å; M85-I96 HydrophobicContact SD-CD1 3.76Å; M85-I96 HydrophobicContact SD-CG1 3.9Å; V87-I96 HydrophobicContact CB-CD1 4.47Å; V87-I96 HydrophobicContact CG1-CD1 3.78Å; V87-I96 HydrophobicContact CG1-CG1 4.46Å; V87-I96 HydrophobicContact CG2-CD1 3.82Å; V87-I96 HydrophobicContact CG2-CG1 3.93Å; I96-I395 WeakPolarHBondContact CA-O 3.29Å
97	I	98.8	Very high	97.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	127.5	-167.3	-52.3	170.8	0	0	0	110.7	E83 F84 L95 K99 S102 I106 I394 I395 L396 N397	E83-I97 CarbonylContact O-C 3.5Å; E83-I97 WeakPolarHBondContact O-CA 3.22Å; F84-I97 HydrophobicContact CD2-CD1 3.94Å; F84-I97 HydrophobicContact CD2-CG1 3.95Å; F84-I97 HydrophobicContact CD2-CG2 3.97Å; F84-I97 HydrophobicContact CE2-CD1 3.61Å; F84-I97 HydrophobicContact CE2-CG1 4.13Å; F84-I97 HydrophobicContact CG-CG1 4.23Å; F84-I97 HydrophobicContact CZ-CD1 3.99Å; L95-I97 HydrophobicContact CB-CD1 3.93Å; L95-I97 HydrophobicContact CB-CG1 4.03Å; L95-I97 HydrophobicContact CD1-CD1 4.36Å; I97-K99 HydrophobicContact CG2-CB 4.35Å; I97-S102 VanDerWaalsContact CG2-CB 3.48Å; I97-I106 HydrophobicContact CD1-CD1 3.8Å; I97-I394 HydrophobicContact CD1-CG2 4.15Å; I97-I395 PolarHBondContact N-O 3.12Å; I97-L396 HydrophobicContact CB-CD2 4.23Å; I97-L396 CarbonylContact O-C 3.36Å; I97-L396 VanDerWaalsContact O-CA 3.3Å; I97-L396 WeakPolarHBondContact O-CA 3.34Å; I97-N397 PolarHBondContact O-N 3.45Å
98	S	98.7	Very high	97.2	Very high	2 Å²	2	29.9 Å²	29.9	1%	0.014	16%	0.163	C	C	.	.			trans	-121.4	1.5	176.2	36.1	0	0	0	0	112.9	E83 M401	E83-S98 WeakPolarHBondContact CA-OG 3.43Å; E83-S98 WeakPolarHBondContact CB-OG 3.37Å; E83-S98 PolarHBondContact O-N 3.11Å; E83-S98 PolarHBondContact O-OG 3.12Å; E83-S98 WeakPolarHBondContact OE2-CB 3.49Å; E83-S98 PolarHBondContact OE2-OG 2.91Å; S98-M401 VanDerWaalsContact O-CB 3.22Å; S98-M401 WeakPolarHBondContact O-CB 3.36Å; S98-M401 VanDerWaalsContact O-CG 3.26Å; S98-M401 WeakPolarHBondContact O-CG 3.33Å
99	K	98.5	Very high	97.2	Very high	82 Å²	82	32.8 Å²	32.8	36%	0.357	18%	0.177	S	C	.	.			trans	-69.7	129	172.2	-61.2	-175.9	80.4	88.1	0	111.3	E83 F84 I97 S101 S102 M103 E405	E83-K99 HydrophobicContact CB-CG 3.82Å; F84-K99 HydrophobicContact CB-CD 4.06Å; I97-K99 HydrophobicContact CG2-CB 4.35Å; K99-S101 VanDerWaalsContact C-N 3.34Å; K99-S101 PolarHBondContact O-N 3Å; K99-S102 PolarHBondContact O-N 3.43Å; K99-M103 WeakPolarHBondContact O-CB 3.33Å; K99-M103 PolarHBondContact O-N 3.21Å; K99-E405 WeakPolarHBondContact CA-OE1 3.37Å
100	S	98.5	Very high	97.3	Very high	4 Å²	4	38 Å²	38	3%	0.028	21%	0.205	C	C	.	.	H	α-helix	trans	-66.3	-33.5	-179.3	76.7	0	0	0	0	113.6	M103 F104 E405 Y426	S100-M103 PolarHBondContact O-N 3.1Å; S100-F104 VanDerWaalsContact O-CB 3.26Å; S100-F104 WeakPolarHBondContact O-CB 3.23Å; S100-F104 PolarHBondContact O-N 2.9Å; S100-E405 WeakPolarHBondContact CB-OE2 3.49Å; S100-E405 PolarHBondContact N-OE1 3.24Å; S100-E405 PolarHBondContact OG-OE2 2.85Å; S100-Y426 WeakPolarHBondContact OG-CD1 3.36Å; S100-Y426 WeakPolarHBondContact OG-CE1 3.31Å
101	S	98.5	Very high	97.7	Very high	39 Å²	39	36.3 Å²	36.3	27%	0.273	19%	0.19	S	C	.	.	H	α-helix	trans	-59.4	-52.3	175.5	45.3	0	0	0	0	111.5	K99 F104 H105 D384	K99-S101 VanDerWaalsContact C-N 3.34Å; K99-S101 PolarHBondContact O-N 3Å; S101-F104 PolarHBondContact O-N 3.28Å; S101-H105 PolarHBondContact O-N 3.43Å; S101-D384 WeakPolarHBondContact CB-OD2 3.41Å; S101-D384 PolarHBondContact OG-OD2 2.71Å
102	S	98.6	Very high	98.3	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.8	-47.3	175.9	-68.8	0	0	0	0	111.7	I97 K99 F104 H105 I106 D384	I97-S102 VanDerWaalsContact CG2-CB 3.48Å; K99-S102 PolarHBondContact O-N 3.43Å; S102-F104 VanDerWaalsContact C-N 3.3Å; S102-F104 PolarHBondContact O-N 3.35Å; S102-H105 WeakPolarHBondContact O-CB 3.15Å; S102-H105 PolarHBondContact O-N 2.97Å; S102-I106 WeakPolarHBondContact O-CB 3.36Å; S102-I106 WeakPolarHBondContact O-CD1 3.44Å; S102-I106 VanDerWaalsContact O-CG1 3.24Å; S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.31Å; S102-D384 WeakPolarHBondContact CB-OD2 3.29Å; S102-D384 PolarHBondContact N-OD2 3.1Å; S102-D384 VanDerWaalsContact OG-CG 3.3Å; S102-D384 PolarHBondContact OG-OD2 2.89Å
103	M	98.7	Very high	98.5	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	14%	0.144	C	C	.	.	H	α-helix	trans	-54.7	-47.8	177.1	178	-71.4	-63	0	0	110.9	K99 S100 H105 I106 M107 L396 I398 M401 R425 Q428 F432	K99-M103 WeakPolarHBondContact O-CB 3.33Å; K99-M103 PolarHBondContact O-N 3.21Å; S100-M103 PolarHBondContact O-N 3.1Å; M103-H105 PolarHBondContact O-N 2.97Å; M103-I106 PolarHBondContact O-N 3.35Å; M103-M107 HydrophobicContact CG-CE 3.97Å; M103-M107 WeakPolarHBondContact O-CB 3.27Å; M103-M107 WeakPolarHBondContact O-CG 3.3Å; M103-M107 PolarHBondContact O-N 3.42Å; M103-M107 HydrophobicContact SD-CE 3.8Å; M103-M107 HydrophobicContact SD-CG 4.07Å; M103-M107 HydrophobicContact SD-SD 3.74Å; M103-L396 HydrophobicContact CB-CD2 4.26Å; M103-L396 HydrophobicContact CG-CD1 4.25Å; M103-I398 HydrophobicContact CG-CG2 4.19Å; M103-M401 HydrophobicContact CB-SD 3.91Å; M103-M401 HydrophobicContact CE-CE 3.79Å; M103-M401 HydrophobicContact CE-SD 3.67Å; M103-M401 HydrophobicContact CG-CE 4.4Å; M103-M401 HydrophobicContact CG-SD 3.81Å; M103-R425 VanDerWaalsContact CE-O 3.26Å; M103-R425 WeakPolarHBondContact CE-O 3.4Å; M103-Q428 HydrophobicContact CE-CB 4.05Å; M103-Q428 HydrophobicContact CE-CG 3.5Å; M103-Q428 HydrophobicContact SD-CB 3.99Å; M103-Q428 HydrophobicContact SD-CG 3.69Å; M103-F432 HydrophobicContact SD-CE1 4.42Å
104	F	98.7	Very high	98.6	Very high	38 Å²	38	26 Å²	26	17%	0.167	13%	0.128	C	C	.	.	H	α-helix	trans	-62.7	-44.6	179.7	-173.9	-93.6	0	0	0	111.9	S100 S101 S102 K108 Y424 R425 F432	S100-F104 VanDerWaalsContact O-CB 3.26Å; S100-F104 WeakPolarHBondContact O-CB 3.23Å; S100-F104 PolarHBondContact O-N 2.9Å; S101-F104 PolarHBondContact O-N 3.28Å; S102-F104 VanDerWaalsContact C-N 3.3Å; S102-F104 PolarHBondContact O-N 3.35Å; F104-K108 HydrophobicContact CE1-CD 4.05Å; F104-K108 WeakPolarHBondContact O-CB 3.37Å; F104-K108 PolarHBondContact O-N 3.47Å; F104-Y424 HydrophobicContact CD2-CE2 4.38Å; F104-Y424 HydrophobicContact CE2-CD2 4.41Å; F104-Y424 AromaticContact CE2-CE2 3.53Å; F104-Y424 HydrophobicContact CE2-CE2 3.53Å; F104-Y424 AromaticContact CE2-CZ 3.77Å; F104-Y424 HydrophobicContact CZ-CE2 4.38Å; F104-R425 HydrophobicContact CD2-CB 3.45Å; F104-R425 VanDerWaalsContact CD2-CB 3.45Å; F104-R425 HydrophobicContact CE2-CB 3.61Å; F104-R425 HydrophobicContact CG-CB 4.26Å; F104-F432 HydrophobicContact CD1-CZ 4.37Å; F104-F432 AromaticContact CD2-CE1 3.62Å; F104-F432 HydrophobicContact CD2-CE1 3.62Å; F104-F432 HydrophobicContact CD2-CE2 4.26Å; F104-F432 AromaticContact CD2-CZ 3.3Å; F104-F432 HydrophobicContact CD2-CZ 3.3Å; F104-F432 HydrophobicContact CE1-CZ 4.47Å; F104-F432 HydrophobicContact CE2-CE1 4.08Å; F104-F432 AromaticContact CE2-CE2 3.96Å; F104-F432 HydrophobicContact CE2-CE2 3.96Å; F104-F432 AromaticContact CE2-CZ 3.45Å; F104-F432 HydrophobicContact CE2-CZ 3.45Å; F104-F432 VanDerWaalsContact CE2-CZ 3.45Å; F104-F432 HydrophobicContact CG-CE1 4.26Å; F104-F432 AromaticContact CG-CZ 3.83Å; F104-F432 HydrophobicContact CG-CZ 3.83Å; F104-F432 HydrophobicContact CZ-CE2 4.33Å; F104-F432 HydrophobicContact CZ-CZ 4.05Å; F104-F432 WeakPolarHBondContact O-CZ 3.23Å
105	H	98.8	Very high	98.6	Very high	45 Å²	45	28.2 Å²	28.2	21%	0.208	14%	0.136	C	C	.	.	H	α-helix	trans	-57.4	-53.4	175	-179.2	-93.8	0	0	0	111.5	S101 S102 M103 M107 K108 H109 Y112 D381	S101-H105 PolarHBondContact O-N 3.43Å; S102-H105 WeakPolarHBondContact O-CB 3.15Å; S102-H105 PolarHBondContact O-N 2.97Å; M103-H105 PolarHBondContact O-N 2.97Å; H105-M107 VanDerWaalsContact C-N 3.33Å; H105-M107 PolarHBondContact O-N 3.38Å; H105-K108 PolarHBondContact O-N 3.32Å; H105-K108 VanDerWaalsContact O-N 3.15Å; H105-H109 AromaticContact CD2-CD2 3.49Å; H105-H109 PolarHBondContact CD2-CD2 3.25Å; H105-H109 VanDerWaalsContact CD2-CD2 3.49Å; H105-H109 AromaticContact CD2-NE2 3.61Å; H105-H109 AromaticContact CE1-CD2 3.97Å; H105-H109 AromaticContact CG-CD2 3.97Å; H105-H109 AromaticContact NE2-CD2 3.48Å; H105-H109 PolarHBondContact NE2-CD2 2.9Å; H105-H109 AromaticContact NE2-NE2 3.69Å; H105-H109 PolarHBondContact O-CD2 2.71Å; H105-H109 VanDerWaalsContact O-CD2 3.24Å; H105-H109 PolarHBondContact O-N 3.46Å; H105-Y112 AromaticContact CE1-CE2 3.83Å; H105-Y112 AromaticContact ND1-CE2 3.82Å; H105-D381 IonicContact CE1-OD2 3.78Å; H105-D381 PolarHBondContact CE1-OD2 2.99Å; H105-D381 IonicContact NE2-OD2 2.81Å
106	I	98.8	Very high	98.6	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-63	-38.6	-176.2	-67.4	158.9	0	0	0	111.7	I97 S102 M103 Y112 R375 I383 I394 L396	I97-I106 HydrophobicContact CD1-CD1 3.8Å; S102-I106 WeakPolarHBondContact O-CB 3.36Å; S102-I106 WeakPolarHBondContact O-CD1 3.44Å; S102-I106 VanDerWaalsContact O-CG1 3.24Å; S102-I106 WeakPolarHBondContact O-CG1 3.24Å; S102-I106 PolarHBondContact O-N 3.31Å; M103-I106 PolarHBondContact O-N 3.35Å; I106-Y112 HydrophobicContact CB-CD2 4.32Å; I106-Y112 HydrophobicContact CB-CG 4.37Å; I106-Y112 HydrophobicContact CG1-CD2 4.48Å; I106-Y112 HydrophobicContact CG1-CE2 4.37Å; I106-Y112 HydrophobicContact CG2-CD1 4.16Å; I106-Y112 HydrophobicContact CG2-CD2 4.29Å; I106-Y112 HydrophobicContact CG2-CG 3.86Å; I106-Y112 VanDerWaalsContact O-CB 3.24Å; I106-Y112 WeakPolarHBondContact O-CB 3.21Å; I106-Y112 WeakPolarHBondContact O-CD2 3.32Å; I106-R375 HydrophobicContact CG2-CB 4.22Å; I106-R375 HydrophobicContact CG2-CG 4.08Å; I106-R375 PolarHBondContact O-NH1 2.9Å; I106-I383 HydrophobicContact CD1-CD1 3.88Å; I106-I383 HydrophobicContact CG1-CD1 3.65Å; I106-I394 HydrophobicContact CD1-CD1 4.21Å; I106-I394 HydrophobicContact CD1-CG2 4.1Å; I106-I394 HydrophobicContact CG1-CD1 4.4Å; I106-I394 HydrophobicContact CG2-CD1 4.36Å; I106-L396 HydrophobicContact CB-CD1 4.43Å; I106-L396 HydrophobicContact CD1-CD2 3.76Å; I106-L396 HydrophobicContact CG2-CD1 4.01Å; I106-L396 HydrophobicContact CG2-CD2 4.48Å
107	M	98.5	Very high	98.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-76.8	-27.3	178.8	-67.6	-158.5	-171.2	0	0	113.2	M103 H105 V373 L396 I398 G431 F432 P434	M103-M107 HydrophobicContact CG-CE 3.97Å; M103-M107 WeakPolarHBondContact O-CB 3.27Å; M103-M107 WeakPolarHBondContact O-CG 3.3Å; M103-M107 PolarHBondContact O-N 3.42Å; M103-M107 HydrophobicContact SD-CE 3.8Å; M103-M107 HydrophobicContact SD-CG 4.07Å; M103-M107 HydrophobicContact SD-SD 3.74Å; H105-M107 VanDerWaalsContact C-N 3.33Å; H105-M107 PolarHBondContact O-N 3.38Å; M107-V373 HydrophobicContact CE-CB 4.34Å; M107-V373 HydrophobicContact CE-CG1 4.45Å; M107-V373 HydrophobicContact CE-CG2 4.14Å; M107-L396 HydrophobicContact CE-CD1 3.53Å; M107-L396 HydrophobicContact CG-CD1 3.92Å; M107-I398 HydrophobicContact CE-CG2 4.15Å; M107-G431 WeakPolarHBondContact SD-CA 2.94Å; M107-F432 HydrophobicContact CB-CD1 3.7Å; M107-F432 HydrophobicContact CB-CE1 3.47Å; M107-F432 VanDerWaalsContact CB-CE1 3.47Å; M107-F432 HydrophobicContact CB-CG 4.46Å; M107-F432 HydrophobicContact CB-CZ 4.02Å; M107-F432 HydrophobicContact CG-CD1 4.49Å; M107-F432 HydrophobicContact CG-CE1 4.41Å; M107-F432 HydrophobicContact SD-CD1 4.05Å; M107-F432 HydrophobicContact SD-CE1 4.42Å; M107-P434 WeakPolarHBondContact O-CD 3.43Å
108	K	98.6	Very high	98.5	Very high	113 Å²	113	30.1 Å²	30.1	49%	0.491	15%	0.153	S	C	.	.	H	α-helix	trans	-73.2	-43.8	-179.3	175.9	178.2	173.8	-179.2	0	112.7	F104 H105 F432	F104-K108 HydrophobicContact CE1-CD 4.05Å; F104-K108 WeakPolarHBondContact O-CB 3.37Å; F104-K108 PolarHBondContact O-N 3.47Å; H105-K108 PolarHBondContact O-N 3.32Å; H105-K108 VanDerWaalsContact O-N 3.15Å; K108-F432 HydrophobicContact CB-CE2 4.01Å; K108-F432 HydrophobicContact CB-CZ 4.02Å
109	H	98.6	Very high	98.5	Very high	66 Å²	66	35.8 Å²	35.8	31%	0.306	18%	0.178	S	C	.	.	S	Bend	trans	-89	142.8	-168.8	-67.9	-83	0	0	0	113.9	H105 H111 Y112	H105-H109 AromaticContact CD2-CD2 3.49Å; H105-H109 PolarHBondContact CD2-CD2 3.25Å; H105-H109 VanDerWaalsContact CD2-CD2 3.49Å; H105-H109 AromaticContact CD2-NE2 3.61Å; H105-H109 AromaticContact CE1-CD2 3.97Å; H105-H109 AromaticContact CG-CD2 3.97Å; H105-H109 AromaticContact NE2-CD2 3.48Å; H105-H109 PolarHBondContact NE2-CD2 2.9Å; H105-H109 AromaticContact NE2-NE2 3.69Å; H105-H109 PolarHBondContact O-CD2 2.71Å; H105-H109 VanDerWaalsContact O-CD2 3.24Å; H105-H109 PolarHBondContact O-N 3.46Å; H109-H111 VanDerWaalsContact C-N 3.34Å; H109-H111 WeakPolarHBondContact CB-CE1 3.43Å; H109-H111 WeakPolarHBondContact CB-ND1 3.34Å; H109-H111 AromaticContact CG-CE1 3.85Å; H109-H111 PolarHBondContact O-N 3.1Å; H109-Y112 HydrophobicContact CB-CD2 4.08Å; H109-Y112 HydrophobicContact CB-CE2 4.28Å; H109-Y112 PolarHBondContact O-N 3.48Å
110	N	98	Very high	98.4	Very high	115 Å²	115	35 Å²	35	62%	0.615	18%	0.177	S	C	*	.	G	3₁₀ helix	trans	-67	-31.4	-173.4	-78.4	-47.1	0	0	0	113.3	Y112 S113 P434	N110-Y112 PolarHBondContact O-N 2.86Å; N110-S113 WeakPolarHBondContact O-CB 3.27Å; N110-S113 PolarHBondContact O-N 3.45Å; N110-S113 PolarHBondContact O-OG 2.87Å; N110-P434 WeakPolarHBondContact OD1-CB 3.32Å; N110-P434 WeakPolarHBondContact OD1-CG 3.24Å
111	H	98.1	Very high	98.4	Very high	25 Å²	25	34.8 Å²	34.8	12%	0.116	18%	0.176	C	C	.	.	G	3₁₀ helix	trans	-71.6	4.8	-179.9	62.8	-70.5	0	0	0	113.7	H109 L378 E379 D381	H109-H111 VanDerWaalsContact C-N 3.34Å; H109-H111 WeakPolarHBondContact CB-CE1 3.43Å; H109-H111 WeakPolarHBondContact CB-ND1 3.34Å; H109-H111 AromaticContact CG-CE1 3.85Å; H109-H111 PolarHBondContact O-N 3.1Å; H111-L378 HydrophobicContact CB-CB 4.33Å; H111-L378 WeakPolarHBondContact O-CB 3.24Å; H111-L378 WeakPolarHBondContact O-CG 3.47Å; H111-L378 PolarHBondContact O-N 3.48Å; H111-E379 HydrophobicContact CB-CB 3.99Å; H111-E379 HydrophobicContact CB-CG 3.99Å; H111-D381 IonicContact CD2-OD2 2.66Å; H111-D381 IonicContact CE1-OD2 2.88Å; H111-D381 PolarHBondContact CE1-OD2 3.23Å; H111-D381 IonicContact NE2-OD2 2.63Å; H111-D381 PolarHBondContact NE2-OD2 3.46Å
112	Y	98.7	Very high	98.4	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	G	3₁₀ helix	trans	-112.4	16.1	165.2	-56.7	-73.2	0	0	0	112.8	H105 I106 H109 N110 S114 R375 A377 D381 I383 I394	H105-Y112 AromaticContact CE1-CE2 3.83Å; H105-Y112 AromaticContact ND1-CE2 3.82Å; I106-Y112 HydrophobicContact CB-CD2 4.32Å; I106-Y112 HydrophobicContact CB-CG 4.37Å; I106-Y112 HydrophobicContact CG1-CD2 4.48Å; I106-Y112 HydrophobicContact CG1-CE2 4.37Å; I106-Y112 HydrophobicContact CG2-CD1 4.16Å; I106-Y112 HydrophobicContact CG2-CD2 4.29Å; I106-Y112 HydrophobicContact CG2-CG 3.86Å; I106-Y112 VanDerWaalsContact O-CB 3.24Å; I106-Y112 WeakPolarHBondContact O-CB 3.21Å; I106-Y112 WeakPolarHBondContact O-CD2 3.32Å; H109-Y112 HydrophobicContact CB-CD2 4.08Å; H109-Y112 HydrophobicContact CB-CE2 4.28Å; H109-Y112 PolarHBondContact O-N 3.48Å; N110-Y112 PolarHBondContact O-N 2.86Å; Y112-S114 PolarHBondContact O-N 2.82Å; Y112-R375 WeakPolarHBondContact O-CD 3.47Å; Y112-R375 PolarHBondContact O-NH1 3.06Å; Y112-A377 HydrophobicContact CD1-CB 4.12Å; Y112-A377 HydrophobicContact CE1-CB 3.84Å; Y112-D381 VanDerWaalsContact OH-CB 3.26Å; Y112-D381 WeakPolarHBondContact OH-CB 3.35Å; Y112-D381 PolarHBondContact OH-OD2 2.94Å; Y112-I383 HydrophobicContact CE1-CD1 4.04Å; Y112-I383 HydrophobicContact CE2-CD1 4.48Å; Y112-I383 WeakPolarHBondContact OH-CD1 3.43Å; Y112-I383 WeakPolarHBondContact OH-CG1 3.44Å; Y112-I394 HydrophobicContact CD1-CD1 3.81Å; Y112-I394 HydrophobicContact CE1-CD1 3.86Å
113	S	98.4	Very high	98.4	Very high	8 Å²	8	37.4 Å²	37.4	6%	0.056	18%	0.183	C	C	.	.			trans	-79.9	43.9	178.5	-56.3	0	0	0	0	112.4	N110 R435	N110-S113 WeakPolarHBondContact O-CB 3.27Å; N110-S113 PolarHBondContact O-N 3.45Å; N110-S113 PolarHBondContact O-OG 2.87Å; S113-R435 WeakPolarHBondContact O-CD 3.41Å; S113-R435 PolarHBondContact O-NH1 3.32Å
114	S	98.6	Very high	98.4	Very high	4 Å²	4	38.7 Å²	38.7	3%	0.028	19%	0.192	C	C	.	.			trans	-137.1	161.7	173.8	-169.5	0	0	0	0	110.6	Y112 R375 K376	Y112-S114 PolarHBondContact O-N 2.82Å; S114-R375 CarbonylContact O-C 3.55Å; S114-R375 WeakPolarHBondContact O-CA 3.3Å; S114-K376 PolarHBondContact O-N 3.08Å
115	R	98.7	Very high	98.4	Very high	47 Å²	47	37 Å²	37	18%	0.177	19%	0.185	C	C	.	.			trans	-120.6	-173	168.8	-51.2	-165.4	-177.2	-95.6	11.1	109.2	I133 F134 N136 M374	R115-I133 WeakPolarHBondContact CD-O 3.49Å; R115-I133 PolarHBondContact NE-O 3.48Å; R115-F134 HydrophobicContact CB-CD1 3.94Å; R115-F134 HydrophobicContact CB-CE1 3.97Å; R115-N136 VanDerWaalsContact C-OD1 3.24Å; R115-N136 VanDerWaalsContact CA-OD1 3.32Å; R115-N136 WeakPolarHBondContact CA-OD1 3.42Å; R115-N136 VanDerWaalsContact CB-OD1 3.32Å; R115-N136 WeakPolarHBondContact CB-OD1 3.44Å; R115-N136 PolarHBondContact N-OD1 3.15Å; R115-N136 PolarHBondContact O-ND2 2.74Å; R115-N136 PolarHBondContact O-OD1 2.92Å; R115-N136 VanDerWaalsContact O-OD1 3.14Å; R115-M374 WeakPolarHBondContact CG-O 3.3Å; R115-M374 PolarHBondContact NH1-O 3.47Å
116	F	98.6	Very high	98.3	Very high	8 Å²	8	35.1 Å²	35.1	4%	0.035	18%	0.178	C	C	.	.			trans	-144.4	162.3	178.3	73.5	-82.4	0	0	0	111	I89 T94 F134 M374 R375 K376 N393 I394 I395	I89-F116 HydrophobicContact CD1-CE2 4.17Å; I89-F116 HydrophobicContact CD1-CZ 4.38Å; T94-F116 HydrophobicContact CG2-CE2 4.46Å; T94-F116 HydrophobicContact CG2-CZ 3.88Å; F116-F134 VanDerWaalsContact O-CE1 3.26Å; F116-F134 WeakPolarHBondContact O-CE1 3.26Å; F116-M374 HydrophobicContact CD1-CB 4.11Å; F116-M374 HydrophobicContact CD1-CE 3.95Å; F116-M374 HydrophobicContact CD2-CE 3.89Å; F116-M374 HydrophobicContact CE1-CB 3.8Å; F116-M374 HydrophobicContact CE1-CE 3.58Å; F116-M374 HydrophobicContact CE1-CG 4Å; F116-M374 HydrophobicContact CE2-CE 3.51Å; F116-M374 HydrophobicContact CG-CE 4.1Å; F116-M374 HydrophobicContact CZ-CE 3.35Å; F116-M374 HydrophobicContact CZ-CG 4.38Å; F116-M374 VanDerWaalsContact O-CE 3.26Å; F116-M374 WeakPolarHBondContact O-CE 3.42Å; F116-R375 VanDerWaalsContact CD1-O 3.3Å; F116-R375 WeakPolarHBondContact CD1-O 3.44Å; F116-K376 HydrophobicContact CB-CD 4.26Å; F116-N393 HydrophobicContact CB-CB 4.44Å; F116-N393 WeakPolarHBondContact CB-OD1 3.11Å; F116-N393 HydrophobicContact CD1-CB 3.7Å; F116-N393 HydrophobicContact CD2-CB 3.87Å; F116-N393 VanDerWaalsContact CD2-CG 3.42Å; F116-N393 WeakPolarHBondContact CD2-ND2 3.45Å; F116-N393 HydrophobicContact CE1-CB 3.77Å; F116-N393 HydrophobicContact CE2-CB 3.94Å; F116-N393 HydrophobicContact CG-CB 3.74Å; F116-N393 VanDerWaalsContact CG-OD1 3.3Å; F116-N393 WeakPolarHBondContact CG-OD1 3.19Å; F116-N393 HydrophobicContact CZ-CB 3.88Å; F116-I394 WeakPolarHBondContact CE1-O 3.26Å; F116-I395 HydrophobicContact CE1-CG1 4.02Å; F116-I395 HydrophobicContact CZ-CD1 4.08Å; F116-I395 HydrophobicContact CZ-CG1 3.78Å
117	G	97.7	Very high	98.3	Very high	28 Å²	28	35.1 Å²	35.1	29%	0.289	18%	0.178	S	C	.	.			trans	169.4	169.6	179.6	0	0	0	0	0	110.1	K119 L228	G117-K119 PolarHBondContact O-N 2.73Å; G117-L228 CarbonylContact C-O 3.52Å; G117-L228 VanDerWaalsContact CA-O 3.3Å; G117-L228 WeakPolarHBondContact CA-O 3.46Å
118	S	98.1	Very high	98.3	Very high	8 Å²	8	37.3 Å²	37.3	6%	0.056	19%	0.188	C	C	.	.			trans	-56	121	173.6	176.8	0	0	0	0	109.9	L120 G121 L122 L228 K230 F235	S118-L120 VanDerWaalsContact C-N 3.29Å; S118-L120 PolarHBondContact O-N 2.97Å; S118-G121 PolarHBondContact O-N 2.88Å; S118-G121 PolarHBondContact OG-N 2.75Å; S118-L122 WeakPolarHBondContact O-CB 3.25Å; S118-L122 VanDerWaalsContact O-CG 3.28Å; S118-L122 WeakPolarHBondContact O-CG 3.46Å; S118-L122 PolarHBondContact O-N 3.32Å; S118-L228 PolarHBondContact N-O 2.92Å; S118-K230 WeakPolarHBondContact CB-O 3.32Å; S118-K230 PolarHBondContact OG-O 3.19Å; S118-F235 WeakPolarHBondContact OG-CE2 3.49Å
119	K	98.1	Very high	98.3	Very high	121 Å²	121	35.8 Å²	35.8	53%	0.526	18%	0.183	S	C	.	.	H	α-helix	trans	-56.9	-45.8	176	-179.9	175.7	179.7	176.3	0	110.8	G117 L122 Q123 H128	G117-K119 PolarHBondContact O-N 2.73Å; K119-L122 PolarHBondContact O-N 3.08Å; K119-Q123 HydrophobicContact CG-CG 4.46Å; K119-Q123 WeakPolarHBondContact O-CB 3.27Å; K119-Q123 VanDerWaalsContact O-CG 3.22Å; K119-Q123 WeakPolarHBondContact O-CG 3.35Å; K119-Q123 PolarHBondContact O-N 3.41Å; K119-H128 WeakPolarHBondContact CE-NE2 3.43Å
120	L	98	Very high	98.3	Very high	65 Å²	65	35.5 Å²	35.5	34%	0.34	18%	0.181	S	C	.	.	H	α-helix	trans	-64.7	-41.6	178.9	-65.6	173.4	0	0	0	111.7	S118 Q123 C124 D232 F235	S118-L120 VanDerWaalsContact C-N 3.29Å; S118-L120 PolarHBondContact O-N 2.97Å; L120-Q123 PolarHBondContact O-N 3.27Å; L120-C124 WeakPolarHBondContact O-CB 3.44Å; L120-C124 PolarHBondContact O-N 2.85Å; L120-D232 HydrophobicContact CD1-CB 4.02Å; L120-F235 HydrophobicContact CB-CB 4.42Å; L120-F235 HydrophobicContact CB-CD1 4.06Å; L120-F235 HydrophobicContact CB-CD2 3.75Å; L120-F235 HydrophobicContact CB-CE1 4.24Å; L120-F235 HydrophobicContact CB-CE2 3.95Å; L120-F235 HydrophobicContact CB-CG 3.81Å; L120-F235 HydrophobicContact CB-CZ 4.19Å; L120-F235 HydrophobicContact CD1-CB 3.84Å; L120-F235 HydrophobicContact CD1-CD2 3.95Å; L120-F235 HydrophobicContact CD1-CG 4.02Å
121	G	98.3	Very high	98.3	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-61.9	-48.1	174.5	0	0	0	0	0	112.5	S118 Q123 C124 I125 F235	S118-G121 PolarHBondContact O-N 2.88Å; S118-G121 PolarHBondContact OG-N 2.75Å; G121-Q123 VanDerWaalsContact C-N 3.33Å; G121-Q123 PolarHBondContact O-N 3.34Å; G121-C124 WeakPolarHBondContact O-CB 3.43Å; G121-C124 PolarHBondContact O-N 2.69Å; G121-I125 PolarHBondContact O-N 3.22Å; G121-I125 VanDerWaalsContact O-N 3.09Å; G121-F235 VanDerWaalsContact CA-CZ 3.46Å
122	L	98.6	Very high	98.3	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	15%	0.15	C	C	.	.	H	α-helix	trans	-64.4	-36	177.6	-68.2	178	0	0	0	112.2	S118 K119 I125 G126 M127 H128 F134 L228	S118-L122 WeakPolarHBondContact O-CB 3.25Å; S118-L122 VanDerWaalsContact O-CG 3.28Å; S118-L122 WeakPolarHBondContact O-CG 3.46Å; S118-L122 PolarHBondContact O-N 3.32Å; K119-L122 PolarHBondContact O-N 3.08Å; L122-I125 HydrophobicContact CD2-CD1 4.1Å; L122-G126 CarbonylContact O-C 3.43Å; L122-G126 PolarHBondContact O-N 3.48Å; L122-M127 HydrophobicContact CD2-CB 4.09Å; L122-M127 PolarHBondContact O-N 2.94Å; L122-H128 HydrophobicContact CB-CB 3.81Å; L122-H128 PolarHBondContact O-N 3.09Å; L122-F134 HydrophobicContact CD2-CB 3.71Å; L122-F134 HydrophobicContact CD2-CD1 4.21Å; L122-F134 HydrophobicContact CD2-CG 4.07Å; L122-L228 HydrophobicContact CD2-CD1 3.74Å
123	Q	98.4	Very high	98.3	Very high	91 Å²	91	31.3 Å²	31.3	43%	0.425	16%	0.159	S	C	.	.	H	α-helix	trans	-65.2	-44.6	173.6	-77.9	175.1	-25.7	0	0	111.2	K119 L120 G121 I125 G126 H128	K119-Q123 HydrophobicContact CG-CG 4.46Å; K119-Q123 WeakPolarHBondContact O-CB 3.27Å; K119-Q123 VanDerWaalsContact O-CG 3.22Å; K119-Q123 WeakPolarHBondContact O-CG 3.35Å; K119-Q123 PolarHBondContact O-N 3.41Å; L120-Q123 PolarHBondContact O-N 3.27Å; G121-Q123 VanDerWaalsContact C-N 3.33Å; G121-Q123 PolarHBondContact O-N 3.34Å; Q123-I125 PolarHBondContact O-N 2.68Å; Q123-G126 PolarHBondContact O-N 3.05Å; Q123-G126 VanDerWaalsContact O-N 3.17Å; Q123-H128 HydrophobicContact CB-CB 4.34Å; Q123-H128 HydrophobicContact CG-CB 3.61Å
124	C	98.1	Very high	98.3	Very high	29 Å²	29	31.4 Å²	31.4	20%	0.196	16%	0.158	C	C	.	.	H	α-helix	trans	-56.4	-52.8	177.5	-176.6	0	0	0	0	111.1	L120 G121 G126 L227 V248	L120-C124 WeakPolarHBondContact O-CB 3.44Å; L120-C124 PolarHBondContact O-N 2.85Å; G121-C124 WeakPolarHBondContact O-CB 3.43Å; G121-C124 PolarHBondContact O-N 2.69Å; C124-G126 VanDerWaalsContact C-N 3.26Å; C124-G126 PolarHBondContact O-N 3.04Å; C124-L227 HydrophobicContact CB-CD1 4.08Å; C124-V248 WeakPolarHBondContact O-CG1 3.38Å
125	I	98.2	Very high	98.3	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	16%	0.157	C	C	.	.	H	α-helix	trans	-75.2	-13.1	-179.9	69.2	178	0	0	0	113.6	G121 L122 Q123 M127 Y220 W224 L227 V248 K252	G121-I125 PolarHBondContact O-N 3.22Å; G121-I125 VanDerWaalsContact O-N 3.09Å; L122-I125 HydrophobicContact CD2-CD1 4.1Å; Q123-I125 PolarHBondContact O-N 2.68Å; I125-M127 HydrophobicContact CD1-CB 4.07Å; I125-M127 HydrophobicContact CD1-CE 4.34Å; I125-M127 HydrophobicContact CD1-CG 3.86Å; I125-M127 HydrophobicContact CD1-SD 3.7Å; I125-M127 HydrophobicContact CG1-CB 4.04Å; I125-M127 HydrophobicContact CG1-CG 3.96Å; I125-M127 HydrophobicContact CG1-SD 4.45Å; I125-Y220 HydrophobicContact CB-CE2 4.3Å; I125-Y220 WeakPolarHBondContact O-CE2 3.21Å; I125-Y220 PolarHBondContact O-OH 3.3Å; I125-W224 HydrophobicContact CD1-CB 4.01Å; I125-W224 HydrophobicContact CD1-CG 3.84Å; I125-L227 HydrophobicContact CG2-CD1 4.25Å; I125-V248 HydrophobicContact CB-CG2 4.33Å; I125-V248 HydrophobicContact CG2-CG2 3.88Å; I125-K252 VanDerWaalsContact C-NZ 3.31Å; I125-K252 WeakPolarHBondContact O-CE 3.38Å; I125-K252 PolarHBondContact O-NZ 3.19Å; I125-K252 VanDerWaalsContact O-NZ 3.08Å
126	G	97.8	Very high	98.3	Very high	7 Å²	7	30.8 Å²	30.8	7%	0.072	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.3	12.8	179.4	0	0	0	0	0	115.8	L122 Q123 C124 K130 Q298	L122-G126 CarbonylContact O-C 3.43Å; L122-G126 PolarHBondContact O-N 3.48Å; Q123-G126 PolarHBondContact O-N 3.05Å; Q123-G126 VanDerWaalsContact O-N 3.17Å; C124-G126 VanDerWaalsContact C-N 3.26Å; C124-G126 PolarHBondContact O-N 3.04Å; G126-K130 WeakPolarHBondContact O-CB 3.42Å; G126-Q298 VanDerWaalsContact O-CD 3.24Å; G126-Q298 WeakPolarHBondContact O-CG 3.34Å; G126-Q298 PolarHBondContact O-OE1 2.96Å
127	M	98.7	Very high	98.2	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.			trans	-93.6	-4.3	177.9	-67.3	-171.9	-175.6	0	0	113.6	L122 I125 E129 I133 F134 Y220 W224 E302 I305	L122-M127 HydrophobicContact CD2-CB 4.09Å; L122-M127 PolarHBondContact O-N 2.94Å; I125-M127 HydrophobicContact CD1-CB 4.07Å; I125-M127 HydrophobicContact CD1-CE 4.34Å; I125-M127 HydrophobicContact CD1-CG 3.86Å; I125-M127 HydrophobicContact CD1-SD 3.7Å; I125-M127 HydrophobicContact CG1-CB 4.04Å; I125-M127 HydrophobicContact CG1-CG 3.96Å; I125-M127 HydrophobicContact CG1-SD 4.45Å; M127-E129 PolarHBondContact O-N 2.81Å; M127-E129 VanDerWaalsContact O-N 3.13Å; M127-I133 HydrophobicContact CE-CD1 4.5Å; M127-F134 HydrophobicContact CB-CB 4.06Å; M127-F134 CarbonylContact O-C 3.6Å; M127-F134 HydrophobicContact SD-CB 4.04Å; M127-F134 HydrophobicContact SD-CD2 4.27Å; M127-Y220 HydrophobicContact CE-CE1 3.74Å; M127-Y220 WeakPolarHBondContact CE-OH 3.26Å; M127-W224 HydrophobicContact CE-CD2 4.06Å; M127-W224 HydrophobicContact CE-CE3 4.3Å; M127-W224 HydrophobicContact CE-CG 4.41Å; M127-W224 HydrophobicContact CE-CZ2 4.38Å; M127-W224 HydrophobicContact SD-CD2 4.49Å; M127-W224 HydrophobicContact SD-CZ2 4.42Å; M127-E302 HydrophobicContact CE-CG 4.49Å; M127-I305 HydrophobicContact CE-CD1 4.34Å
128	H	98.6	Very high	98.2	Very high	45 Å²	45	33.8 Å²	33.8	21%	0.208	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69	110.8	174.8	-178.1	62.1	0	0	0	110.2	K119 L122 Q123 K130	K119-H128 WeakPolarHBondContact CE-NE2 3.43Å; L122-H128 HydrophobicContact CB-CB 3.81Å; L122-H128 PolarHBondContact O-N 3.09Å; Q123-H128 HydrophobicContact CB-CB 4.34Å; Q123-H128 HydrophobicContact CG-CB 3.61Å; H128-K130 PolarHBondContact O-N 3.31Å; H128-K130 VanDerWaalsContact O-N 3.16Å
129	E	98.2	Very high	98.2	Very high	82 Å²	82	39.2 Å²	39.2	38%	0.383	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	53	32.4	-179	-52.5	-165.4	128.7	0	0	113.5	M127 N135 N137 L140	M127-E129 PolarHBondContact O-N 2.81Å; M127-E129 VanDerWaalsContact O-N 3.13Å; E129-N135 WeakPolarHBondContact CA-OD1 3.41Å; E129-N137 HydrophobicContact CB-CB 4.14Å; E129-N137 HydrophobicContact CG-CB 3.92Å; E129-N137 WeakPolarHBondContact OE1-CB 3.46Å; E129-N137 PolarHBondContact OE1-ND2 3.41Å; E129-L140 WeakPolarHBondContact O-CD2 3.5Å
130	K	98.4	Very high	98.2	Very high	60 Å²	60	35.9 Å²	35.9	26%	0.261	19%	0.187	S	C	.	.	S	Bend	trans	-143.2	156.5	175	-62.4	177.2	-159.9	178.9	0	109.2	G126 H128 N135 E294 N295 Q298	G126-K130 WeakPolarHBondContact O-CB 3.42Å; H128-K130 PolarHBondContact O-N 3.31Å; H128-K130 VanDerWaalsContact O-N 3.16Å; K130-N135 WeakPolarHBondContact O-CB 3.22Å; K130-E294 HydrophobicContact CD-CB 4.24Å; K130-E294 WeakPolarHBondContact CE-OE2 3.45Å; K130-E294 IonicContact NZ-OE2 2.91Å; K130-E294 PolarHBondContact NZ-OE2 2.9Å; K130-N295 WeakPolarHBondContact CA-OD1 3.01Å; K130-Q298 HydrophobicContact CB-CB 4.08Å; K130-Q298 HydrophobicContact CB-CG 3.91Å
131	G	98.1	Very high	98.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	S	Bend	trans	66.4	-152.4	-173.3	0	0	0	0	0	112	N135 N295 E302	G131-N135 WeakPolarHBondContact O-CB 3.11Å; G131-N135 PolarHBondContact O-ND2 2.84Å; G131-N295 PolarHBondContact N-OD1 3.11Å; G131-E302 WeakPolarHBondContact CA-OE2 3.5Å
132	I	98.6	Very high	98.2	Very high	14 Å²	14	41 Å²	41	7%	0.072	21%	0.206	C	C	.	.	S	Bend	trans	-134	-21.8	-179.8	64.3	158.9	0	0	0	114.1	T144 R145 F148 E302 R435 A438	I132-T144 HydrophobicContact CG2-CG2 3.6Å; I132-R145 HydrophobicContact CG2-CB 4.34Å; I132-F148 HydrophobicContact CB-CE2 4.36Å; I132-F148 HydrophobicContact CD1-CB 3.85Å; I132-F148 HydrophobicContact CD1-CD1 3.58Å; I132-F148 HydrophobicContact CD1-CD2 3.6Å; I132-F148 HydrophobicContact CD1-CE1 3.95Å; I132-F148 HydrophobicContact CD1-CE2 3.96Å; I132-F148 HydrophobicContact CD1-CG 3.4Å; I132-F148 HydrophobicContact CD1-CZ 4.12Å; I132-F148 HydrophobicContact CG1-CD1 4.2Å; I132-F148 HydrophobicContact CG1-CD2 3.95Å; I132-F148 HydrophobicContact CG1-CE1 4.06Å; I132-F148 HydrophobicContact CG1-CE2 3.78Å; I132-F148 HydrophobicContact CG1-CG 4.16Å; I132-F148 HydrophobicContact CG1-CZ 3.83Å; I132-F148 HydrophobicContact CG2-CD2 3.8Å; I132-F148 HydrophobicContact CG2-CE2 3.69Å; I132-E302 PolarHBondContact N-OE2 3Å; I132-R435 PolarHBondContact O-NH2 3.4Å; I132-A438 HydrophobicContact CD1-CB 4.41Å
133	I	98.4	Very high	98.1	Very high	38 Å²	38	44.5 Å²	44.5	20%	0.195	23%	0.228	C	C	.	.	S	Bend	trans	-65.1	-58.9	-172.7	-60	171.7	0	0	0	109.4	R115 M127 W224 E302	R115-I133 WeakPolarHBondContact CD-O 3.49Å; R115-I133 PolarHBondContact NE-O 3.48Å; M127-I133 HydrophobicContact CE-CD1 4.5Å; I133-W224 HydrophobicContact CG2-CH2 3.94Å; I133-W224 HydrophobicContact CG2-CZ2 3.74Å; I133-E302 HydrophobicContact CD1-CB 3.96Å; I133-E302 HydrophobicContact CD1-CG 3.84Å; I133-E302 HydrophobicContact CG1-CB 4.45Å; I133-E302 HydrophobicContact CG1-CG 4.3Å; I133-E302 WeakPolarHBondContact CG1-OE2 3.48Å; I133-E302 PolarHBondContact N-OE2 3.41Å
134	F	98.6	Very high	98.1	Very high	9 Å²	9	40.2 Å²	40.2	4%	0.039	21%	0.208	C	C	.	.	S	Bend	trans	-114.2	17.9	177.8	-87.4	-88.3	0	0	0	114	R115 F116 L122 M127 N136 W224 L228 M374	R115-F134 HydrophobicContact CB-CD1 3.94Å; R115-F134 HydrophobicContact CB-CE1 3.97Å; F116-F134 VanDerWaalsContact O-CE1 3.26Å; F116-F134 WeakPolarHBondContact O-CE1 3.26Å; L122-F134 HydrophobicContact CD2-CB 3.71Å; L122-F134 HydrophobicContact CD2-CD1 4.21Å; L122-F134 HydrophobicContact CD2-CG 4.07Å; M127-F134 HydrophobicContact CB-CB 4.06Å; M127-F134 CarbonylContact O-C 3.6Å; M127-F134 HydrophobicContact SD-CB 4.04Å; M127-F134 HydrophobicContact SD-CD2 4.27Å; F134-N136 VanDerWaalsContact O-CG 3.27Å; F134-N136 PolarHBondContact O-N 3.07Å; F134-N136 PolarHBondContact O-ND2 2.79Å; F134-N136 PolarHBondContact O-OD1 2.96Å; F134-W224 AromaticContact CD2-CE2 3.87Å; F134-W224 AromaticContact CD2-CZ2 3.61Å; F134-W224 HydrophobicContact CD2-CZ2 3.61Å; F134-W224 AromaticContact CD2-NE1 3.57Å; F134-W224 AromaticContact CE2-CE2 3.85Å; F134-W224 AromaticContact CE2-CZ2 3.48Å; F134-W224 HydrophobicContact CE2-CZ2 3.48Å; F134-W224 VanDerWaalsContact CE2-CZ2 3.48Å; F134-W224 AromaticContact CE2-NE1 3.62Å; F134-L228 HydrophobicContact CD1-CD1 3.89Å; F134-L228 HydrophobicContact CE1-CD1 3.7Å; F134-L228 HydrophobicContact CE1-CD2 4.11Å; F134-L228 HydrophobicContact CE1-CG 4.43Å; F134-L228 HydrophobicContact CE2-CD1 4.41Å; F134-L228 HydrophobicContact CE2-CD2 4.35Å; F134-L228 HydrophobicContact CG-CD1 4.34Å; F134-L228 HydrophobicContact CZ-CD1 3.98Å; F134-L228 HydrophobicContact CZ-CD2 3.73Å; F134-L228 HydrophobicContact CZ-CG 4.48Å; F134-M374 HydrophobicContact CE1-CE 4.3Å; F134-M374 HydrophobicContact CE1-SD 3.93Å; F134-M374 HydrophobicContact CZ-SD 3.7Å
135	N	98.6	Very high	98.2	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.203	C	C	.	.			trans	-67.6	105.3	170.6	-171.5	-16.7	0	0	0	110.8	E129 K130 G131 N137 W141 R435	E129-N135 WeakPolarHBondContact CA-OD1 3.41Å; K130-N135 WeakPolarHBondContact O-CB 3.22Å; G131-N135 WeakPolarHBondContact O-CB 3.11Å; G131-N135 PolarHBondContact O-ND2 2.84Å; N135-N137 WeakPolarHBondContact OD1-CB 3.38Å; N135-N137 PolarHBondContact OD1-N 3.09Å; N135-N137 VanDerWaalsContact OD1-N 3.09Å; N135-W141 HydrophobicContact CB-CB 4.46Å; N135-R435 PolarHBondContact O-NH1 2.76Å; N135-R435 PolarHBondContact O-NH2 2.87Å
136	N	97.5	Very high	98.2	Very high	39 Å²	39	43.5 Å²	43.5	21%	0.209	23%	0.225	C	C	.	.			trans	-96.4	2	-175.3	-60.6	-32.1	0	0	0	113.2	R115 F134 P138	R115-N136 VanDerWaalsContact C-OD1 3.24Å; R115-N136 VanDerWaalsContact CA-OD1 3.32Å; R115-N136 WeakPolarHBondContact CA-OD1 3.42Å; R115-N136 VanDerWaalsContact CB-OD1 3.32Å; R115-N136 WeakPolarHBondContact CB-OD1 3.44Å; R115-N136 PolarHBondContact N-OD1 3.15Å; R115-N136 PolarHBondContact O-ND2 2.74Å; R115-N136 PolarHBondContact O-OD1 2.92Å; R115-N136 VanDerWaalsContact O-OD1 3.14Å; F134-N136 VanDerWaalsContact O-CG 3.27Å; F134-N136 PolarHBondContact O-N 3.07Å; F134-N136 PolarHBondContact O-ND2 2.79Å; F134-N136 PolarHBondContact O-OD1 2.96Å; N136-P138 VanDerWaalsContact O-CD 3.28Å; N136-P138 WeakPolarHBondContact O-CD 3.38Å
137	N	98.3	Very high	98.2	Very high	43 Å²	43	44.8 Å²	44.8	23%	0.23	23%	0.229	C	C	.	.			trans	-79.2	111.1	170.4	-172.8	-61.7	0	0	0	108.8	E129 N135 D139 L140 W141	E129-N137 HydrophobicContact CB-CB 4.14Å; E129-N137 HydrophobicContact CG-CB 3.92Å; E129-N137 WeakPolarHBondContact OE1-CB 3.46Å; E129-N137 PolarHBondContact OE1-ND2 3.41Å; N135-N137 WeakPolarHBondContact OD1-CB 3.38Å; N135-N137 PolarHBondContact OD1-N 3.09Å; N135-N137 VanDerWaalsContact OD1-N 3.09Å; N137-D139 VanDerWaalsContact C-N 3.33Å; N137-D139 PolarHBondContact O-N 3.07Å; N137-D139 PolarHBondContact OD1-N 2.69Å; N137-L140 HydrophobicContact CB-CB 4.13Å; N137-L140 PolarHBondContact OD1-N 2.5Å; N137-L140 VanDerWaalsContact OD1-N 3.11Å; N137-W141 WeakPolarHBondContact O-CB 3.38Å; N137-W141 PolarHBondContact O-N 2.82Å
138	P	96.9	Very high	98.2	Very high	56 Å²	56	45.2 Å²	45.2	36%	0.364	23%	0.23	S	C	.	.	H	α-helix	trans	-61.3	-39.7	-171.4	-25.1	36.2	0	0	0	113.4	N136 K142 L378	N136-P138 VanDerWaalsContact O-CD 3.28Å; N136-P138 WeakPolarHBondContact O-CD 3.38Å; P138-K142 WeakPolarHBondContact O-CB 3.26Å; P138-K142 PolarHBondContact O-N 3.29Å; P138-L378 HydrophobicContact CG-CD1 4.31Å; P138-L378 HydrophobicContact CG-CD2 4.47Å
139	D	97.4	Very high	98.2	Very high	122 Å²	122	46.7 Å²	46.7	65%	0.652	24%	0.238	S	C	*	.	H	α-helix	trans	-70.4	-48.8	-176.6	-62.5	-42.6	0	0	0	110.8	N137 W141 K142 T143	N137-D139 VanDerWaalsContact C-N 3.33Å; N137-D139 PolarHBondContact O-N 3.07Å; N137-D139 PolarHBondContact OD1-N 2.69Å; D139-W141 PolarHBondContact O-N 3.07Å; D139-K142 WeakPolarHBondContact O-CB 3.42Å; D139-K142 PolarHBondContact O-N 3.29Å; D139-T143 PolarHBondContact O-N 2.74Å; D139-T143 VanDerWaalsContact O-N 3.08Å; D139-T143 PolarHBondContact O-OG1 3.33Å
140	L	97.7	Very high	98.1	Very high	51 Å²	51	49 Å²	49	27%	0.267	25%	0.247	S	C	.	.	H	α-helix	trans	-67.9	-37.1	179.6	-173.3	61.2	0	0	0	112.3	E129 N137 K142 T143 T144	E129-L140 WeakPolarHBondContact O-CD2 3.5Å; N137-L140 HydrophobicContact CB-CB 4.13Å; N137-L140 PolarHBondContact OD1-N 2.5Å; N137-L140 VanDerWaalsContact OD1-N 3.11Å; L140-K142 VanDerWaalsContact C-N 3.31Å; L140-K142 PolarHBondContact O-N 2.48Å; L140-T143 PolarHBondContact O-N 2.96Å; L140-T143 PolarHBondContact O-OG1 3.31Å; L140-T143 VanDerWaalsContact O-OG1 3.06Å; L140-T144 VanDerWaalsContact O-CB 3.25Å; L140-T144 WeakPolarHBondContact O-CB 3.37Å; L140-T144 PolarHBondContact O-N 3.07Å; L140-T144 PolarHBondContact O-OG1 3.2Å
141	W	98.5	Very high	98.1	Very high	20 Å²	20	46.9 Å²	46.9	8%	0.076	24%	0.241	C	C	.	.	H	α-helix	trans	-61.7	-41.8	173.1	172.5	85.8	0	0	0	111.2	N135 N137 D139 T143 T144 R145 P434 R435	N135-W141 HydrophobicContact CB-CB 4.46Å; N137-W141 WeakPolarHBondContact O-CB 3.38Å; N137-W141 PolarHBondContact O-N 2.82Å; D139-W141 PolarHBondContact O-N 3.07Å; W141-T143 VanDerWaalsContact C-N 3.34Å; W141-T143 PolarHBondContact O-N 3.26Å; W141-T144 PolarHBondContact O-N 3.42Å; W141-R145 HydrophobicContact CZ2-CG 4.47Å; W141-R145 VanDerWaalsContact O-CB 3.23Å; W141-R145 WeakPolarHBondContact O-CB 3.43Å; W141-R145 PolarHBondContact O-N 3.4Å; W141-P434 HydrophobicContact CH2-CB 4.41Å; W141-P434 WeakPolarHBondContact CH2-O 3.29Å; W141-R435 HydrophobicContact CH2-CB 3.97Å; W141-R435 HydrophobicContact CH2-CG 4.29Å; W141-R435 HydrophobicContact CZ2-CB 3.6Å; W141-R435 HydrophobicContact CZ2-CG 3.48Å; W141-R435 VanDerWaalsContact CZ2-CG 3.48Å
142	K	97.9	Very high	98	Very high	151 Å²	151	47.7 Å²	47.7	66%	0.657	25%	0.246	S	C	*	.	H	α-helix	trans	-66.2	-34	-179.4	-173.4	177.9	-179.9	-175.2	0	112.4	P138 D139 L140 P146	P138-K142 WeakPolarHBondContact O-CB 3.26Å; P138-K142 PolarHBondContact O-N 3.29Å; D139-K142 WeakPolarHBondContact O-CB 3.42Å; D139-K142 PolarHBondContact O-N 3.29Å; L140-K142 VanDerWaalsContact C-N 3.31Å; L140-K142 PolarHBondContact O-N 2.48Å; K142-P146 WeakPolarHBondContact O-CD 3.36Å; K142-P146 WeakPolarHBondContact O-CG 3.37Å
143	T	97.9	Very high	97.8	Very high	77 Å²	77	49.4 Å²	49.4	47%	0.472	26%	0.258	S	S	.	.	H	α-helix	trans	-81.9	-29.5	175.6	60.1	0	0	0	0	113.4	D139 L140 W141 P146	D139-T143 PolarHBondContact O-N 2.74Å; D139-T143 VanDerWaalsContact O-N 3.08Å; D139-T143 PolarHBondContact O-OG1 3.33Å; L140-T143 PolarHBondContact O-N 2.96Å; L140-T143 PolarHBondContact O-OG1 3.31Å; L140-T143 VanDerWaalsContact O-OG1 3.06Å; W141-T143 VanDerWaalsContact C-N 3.34Å; W141-T143 PolarHBondContact O-N 3.26Å; T143-P146 WeakPolarHBondContact O-CD 3.36Å
144	T	98.6	Very high	97.6	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-82.8	-39	-178	-54	0	0	0	0	112.7	I132 L140 W141 P146 F147 F148 N295 C299	I132-T144 HydrophobicContact CG2-CG2 3.6Å; L140-T144 VanDerWaalsContact O-CB 3.25Å; L140-T144 WeakPolarHBondContact O-CB 3.37Å; L140-T144 PolarHBondContact O-N 3.07Å; L140-T144 PolarHBondContact O-OG1 3.2Å; W141-T144 PolarHBondContact O-N 3.42Å; T144-P146 VanDerWaalsContact C-CD 3.42Å; T144-F147 WeakPolarHBondContact O-CD2 3.43Å; T144-F147 PolarHBondContact O-N 3.4Å; T144-F148 HydrophobicContact CG2-CE2 4.26Å; T144-N295 PolarHBondContact OG1-ND2 2.91Å; T144-N295 VanDerWaalsContact OG1-ND2 3.1Å; T144-C299 WeakPolarHBondContact CG2-SG 3.36Å
145	R	98.5	Very high	97.3	Very high	29 Å²	29	53.8 Å²	53.8	11%	0.109	30%	0.299	C	S	.	.	H	α-helix	trans	-56.3	-37.6	-177.7	177.8	170.6	178.3	84.6	-5.1	115.6	I132 W141 F147 F148 M149 P434 G436	I132-R145 HydrophobicContact CG2-CB 4.34Å; W141-R145 HydrophobicContact CZ2-CG 4.47Å; W141-R145 VanDerWaalsContact O-CB 3.23Å; W141-R145 WeakPolarHBondContact O-CB 3.43Å; W141-R145 PolarHBondContact O-N 3.4Å; R145-F147 PolarHBondContact O-N 3.19Å; R145-F148 WeakPolarHBondContact O-CB 3.4Å; R145-F148 PolarHBondContact O-N 3.46Å; R145-F148 VanDerWaalsContact O-N 3.11Å; R145-M149 HydrophobicContact CG-CG 3.94Å; R145-M149 WeakPolarHBondContact O-CG 3.26Å; R145-M149 PolarHBondContact O-N 3.23Å; R145-P434 VanDerWaalsContact CZ-O 3.24Å; R145-P434 PolarHBondContact NE-O 2.66Å; R145-P434 PolarHBondContact NH2-O 3.47Å; R145-P434 VanDerWaalsContact NH2-O 3.09Å; R145-G436 PolarHBondContact NH1-O 3.3Å; R145-G436 PolarHBondContact NH2-O 3.32Å
146	P	98.6	Very high	97	Very high	71 Å²	71	54.1 Å²	54.1	46%	0.461	30%	0.302	S	S	.	.	H	α-helix	trans	-53.3	-36.3	177.6	-30.4	36.8	0	0	0	114.5	K142 T143 T144 F148 M149 K150	K142-P146 WeakPolarHBondContact O-CD 3.36Å; K142-P146 WeakPolarHBondContact O-CG 3.37Å; T143-P146 WeakPolarHBondContact O-CD 3.36Å; T144-P146 VanDerWaalsContact C-CD 3.42Å; P146-F148 PolarHBondContact O-N 2.86Å; P146-M149 PolarHBondContact O-N 3.15Å; P146-K150 WeakPolarHBondContact O-CB 3.45Å; P146-K150 PolarHBondContact O-N 2.94Å
147	F	98.4	Very high	96.8	Very high	34 Å²	34	53.8 Å²	53.8	15%	0.149	30%	0.3	C	S	.	.	H	α-helix	trans	-61	-44.5	177	-67.1	-83.3	0	0	0	111.9	T144 R145 A151 F278 E281 L282 A285 L291	T144-F147 WeakPolarHBondContact O-CD2 3.43Å; T144-F147 PolarHBondContact O-N 3.4Å; R145-F147 PolarHBondContact O-N 3.19Å; F147-A151 WeakPolarHBondContact O-CB 3.45Å; F147-A151 PolarHBondContact O-N 3.27Å; F147-A151 VanDerWaalsContact O-N 3.11Å; F147-F278 HydrophobicContact CB-CE2 4.03Å; F147-E281 HydrophobicContact CD1-CB 4.12Å; F147-E281 HydrophobicContact CE1-CB 4.47Å; F147-L282 HydrophobicContact CB-CD2 3.8Å; F147-L282 HydrophobicContact CD1-CD2 3.93Å; F147-L282 HydrophobicContact CD2-CD2 4.01Å; F147-L282 HydrophobicContact CG-CD2 3.64Å; F147-A285 HydrophobicContact CE1-CB 3.75Å; F147-A285 HydrophobicContact CE2-CB 4.45Å; F147-A285 HydrophobicContact CZ-CB 3.46Å; F147-A285 VanDerWaalsContact CZ-CB 3.46Å; F147-L291 HydrophobicContact CD2-CD1 4.12Å; F147-L291 HydrophobicContact CE2-CD1 3.7Å; F147-L291 HydrophobicContact CE2-CG 4.28Å; F147-L291 HydrophobicContact CZ-CD1 4.01Å
148	F	98.6	Very high	96.6	Very high	8 Å²	8	55 Å²	55	4%	0.035	31%	0.309	C	S	.	.	H	α-helix	trans	-65	-45.8	175.3	-73.7	-100.7	0	0	0	111.3	I132 T144 R145 P146 K150 A151 L152 F278 C299 E302 M303 A438	I132-F148 HydrophobicContact CB-CE2 4.36Å; I132-F148 HydrophobicContact CD1-CB 3.85Å; I132-F148 HydrophobicContact CD1-CD1 3.58Å; I132-F148 HydrophobicContact CD1-CD2 3.6Å; I132-F148 HydrophobicContact CD1-CE1 3.95Å; I132-F148 HydrophobicContact CD1-CE2 3.96Å; I132-F148 HydrophobicContact CD1-CG 3.4Å; I132-F148 HydrophobicContact CD1-CZ 4.12Å; I132-F148 HydrophobicContact CG1-CD1 4.2Å; I132-F148 HydrophobicContact CG1-CD2 3.95Å; I132-F148 HydrophobicContact CG1-CE1 4.06Å; I132-F148 HydrophobicContact CG1-CE2 3.78Å; I132-F148 HydrophobicContact CG1-CG 4.16Å; I132-F148 HydrophobicContact CG1-CZ 3.83Å; I132-F148 HydrophobicContact CG2-CD2 3.8Å; I132-F148 HydrophobicContact CG2-CE2 3.69Å; T144-F148 HydrophobicContact CG2-CE2 4.26Å; R145-F148 WeakPolarHBondContact O-CB 3.4Å; R145-F148 PolarHBondContact O-N 3.46Å; R145-F148 VanDerWaalsContact O-N 3.11Å; P146-F148 PolarHBondContact O-N 2.86Å; F148-K150 VanDerWaalsContact C-N 3.3Å; F148-K150 PolarHBondContact O-N 3.41Å; F148-A151 PolarHBondContact O-N 3.22Å; F148-L152 HydrophobicContact CB-CD1 4.24Å; F148-L152 VanDerWaalsContact O-CB 3.3Å; F148-L152 WeakPolarHBondContact O-CB 3.43Å; F148-L152 WeakPolarHBondContact O-CD1 3.31Å; F148-L152 WeakPolarHBondContact O-CG 3.33Å; F148-L152 PolarHBondContact O-N 2.97Å; F148-F278 HydrophobicContact CD1-CE2 4.18Å; F148-F278 AromaticContact CD1-CZ 3.98Å; F148-F278 HydrophobicContact CD1-CZ 3.98Å; F148-F278 AromaticContact CD2-CE2 3.94Å; F148-F278 HydrophobicContact CD2-CE2 3.94Å; F148-F278 AromaticContact CD2-CZ 3.96Å; F148-F278 HydrophobicContact CD2-CZ 3.96Å; F148-F278 HydrophobicContact CE1-CE1 4.47Å; F148-F278 HydrophobicContact CE1-CE2 4.39Å; F148-F278 AromaticContact CE1-CZ 3.73Å; F148-F278 HydrophobicContact CE1-CZ 3.73Å; F148-F278 HydrophobicContact CE2-CE2 4.17Å; F148-F278 AromaticContact CE2-CZ 3.71Å; F148-F278 HydrophobicContact CE2-CZ 3.71Å; F148-F278 AromaticContact CG-CE2 3.95Å; F148-F278 HydrophobicContact CG-CE2 3.95Å; F148-F278 HydrophobicContact CG-CZ 4.09Å; F148-F278 HydrophobicContact CZ-CE1 4.46Å; F148-F278 HydrophobicContact CZ-CE2 4.39Å; F148-F278 AromaticContact CZ-CZ 3.6Å; F148-F278 HydrophobicContact CZ-CZ 3.6Å; F148-C299 HydrophobicContact CE2-CB 3.9Å; F148-C299 HydrophobicContact CZ-CB 3.9Å; F148-C299 WeakPolarHBondContact CZ-O 3.2Å; F148-E302 HydrophobicContact CZ-CB 4.33Å; F148-M303 HydrophobicContact CB-CE 4.44Å; F148-M303 HydrophobicContact CD1-CE 3.3Å; F148-M303 HydrophobicContact CD1-SD 4.25Å; F148-M303 HydrophobicContact CE1-CB 4.18Å; F148-M303 HydrophobicContact CE1-CE 3.76Å; F148-M303 HydrophobicContact CE1-SD 4.41Å; F148-M303 HydrophobicContact CG-CE 4.06Å; F148-A438 HydrophobicContact CB-CB 4.36Å
149	M	98.2	Very high	96.4	Very high	76 Å²	76	57.4 Å²	57.4	37%	0.374	31%	0.311	S	S	.	.	H	α-helix	trans	-61.3	-39.7	-179.5	-65	-58.1	-58.3	0	0	112	R145 P146 S153 A438	R145-M149 HydrophobicContact CG-CG 3.94Å; R145-M149 WeakPolarHBondContact O-CG 3.26Å; R145-M149 PolarHBondContact O-N 3.23Å; P146-M149 PolarHBondContact O-N 3.15Å; M149-S153 WeakPolarHBondContact O-CB 3.45Å; M149-S153 PolarHBondContact O-OG 3.23Å; M149-A438 HydrophobicContact SD-CB 3.88Å
150	K	97.4	Very high	96.3	Very high	130 Å²	130	51.6 Å²	51.6	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-64.6	-48	176.1	-173.3	-177.9	-177.9	-175.2	0	111.3	P146 F148 L152 E281	P146-K150 WeakPolarHBondContact O-CB 3.45Å; P146-K150 PolarHBondContact O-N 2.94Å; F148-K150 VanDerWaalsContact C-N 3.3Å; F148-K150 PolarHBondContact O-N 3.41Å; K150-L152 PolarHBondContact O-N 3.22Å; K150-E281 WeakPolarHBondContact CE-OE1 3.33Å; K150-E281 IonicContact NZ-OE1 3.27Å; K150-E281 PolarHBondContact NZ-OE1 2.7Å; K150-E281 IonicContact NZ-OE2 3.4Å
151	A	97.1	Very high	96.1	Very high	17 Å²	17	49.2 Å²	49.2	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-68.1	-33.2	-177.6	0	0	0	0	0	113.7	F147 F148 S153 F203 F278 M303	F147-A151 WeakPolarHBondContact O-CB 3.45Å; F147-A151 PolarHBondContact O-N 3.27Å; F147-A151 VanDerWaalsContact O-N 3.11Å; F148-A151 PolarHBondContact O-N 3.22Å; A151-S153 VanDerWaalsContact C-N 3.32Å; A151-S153 PolarHBondContact O-N 3.49Å; A151-F203 HydrophobicContact CB-CD1 4.23Å; A151-F203 HydrophobicContact CB-CE1 4.14Å; A151-F278 HydrophobicContact CB-CB 3.79Å; A151-F278 HydrophobicContact CB-CD2 3.63Å; A151-F278 HydrophobicContact CB-CG 4.06Å; A151-M303 HydrophobicContact CB-CE 4.39Å
152	L	97.4	Very high	95.9	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	8.7	-175.7	-62.6	166.3	0	0	0	113.5	F148 K150 F203 M303 A438 I442	F148-L152 HydrophobicContact CB-CD1 4.24Å; F148-L152 VanDerWaalsContact O-CB 3.3Å; F148-L152 WeakPolarHBondContact O-CB 3.43Å; F148-L152 WeakPolarHBondContact O-CD1 3.31Å; F148-L152 WeakPolarHBondContact O-CG 3.33Å; F148-L152 PolarHBondContact O-N 2.97Å; K150-L152 PolarHBondContact O-N 3.22Å; L152-F203 HydrophobicContact CD2-CE1 4.03Å; L152-F203 HydrophobicContact CD2-CE2 4.29Å; L152-F203 HydrophobicContact CD2-CZ 3.49Å; L152-F203 VanDerWaalsContact CD2-CZ 3.49Å; L152-M303 HydrophobicContact CD1-CE 4.18Å; L152-M303 HydrophobicContact CD1-SD 4.47Å; L152-M303 HydrophobicContact CD2-CE 4.23Å; L152-M303 HydrophobicContact CD2-SD 3.92Å; L152-M303 HydrophobicContact CG-CE 4.1Å; L152-M303 HydrophobicContact CG-SD 4.4Å; L152-A438 HydrophobicContact CD1-CB 3.7Å; L152-I442 HydrophobicContact CB-CG2 4.2Å; L152-I442 HydrophobicContact CD2-CD1 4.36Å; L152-I442 HydrophobicContact CD2-CG2 3.81Å
153	S	94.2	Very high	95.8	Very high	49 Å²	49	46.3 Å²	46.3	34%	0.343	27%	0.265	S	S	.	.	S	Bend	trans	-138.3	179.9	-179.7	68.3	0	0	0	0	112	M149 A151 G156	M149-S153 WeakPolarHBondContact O-CB 3.45Å; M149-S153 PolarHBondContact O-OG 3.23Å; A151-S153 VanDerWaalsContact C-N 3.32Å; A151-S153 PolarHBondContact O-N 3.49Å; S153-G156 PolarHBondContact O-N 2.96Å
154	G	94.3	Very high	95.7	Very high	46 Å²	46	42.7 Å²	42.7	47%	0.474	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.9	-132.6	176.1	0	0	0	0	0	113.2	G156 L157 V158	G154-G156 VanDerWaalsContact C-N 3.27Å; G154-G156 PolarHBondContact O-N 2.8Å; G154-L157 PolarHBondContact O-N 3.01Å; G154-V158 PolarHBondContact O-N 3.38Å
155	P	92.1	Very high	95.6	Very high	94 Å²	94	42.8 Å²	42.8	61%	0.61	24%	0.244	S	C	*	.	H	α-helix	trans	-59.8	-32.2	-177.6	-24.1	33.8	0	0	0	114.4	L157 V158 R159	P155-L157 VanDerWaalsContact C-N 3.33Å; P155-L157 PolarHBondContact O-N 3.48Å; P155-V158 PolarHBondContact O-N 2.89Å; P155-R159 PolarHBondContact O-N 3.43Å; P155-R159 VanDerWaalsContact O-N 3.08Å
156	G	90.9	Very high	95.6	Very high	7 Å²	7	45.2 Å²	45.2	7%	0.072	26%	0.256	C	S	.	.	H	α-helix	trans	-62.3	-42.1	177.7	0	0	0	0	0	111.8	S153 G154 R159 M160 L202	S153-G156 PolarHBondContact O-N 2.96Å; G154-G156 VanDerWaalsContact C-N 3.27Å; G154-G156 PolarHBondContact O-N 2.8Å; G156-R159 PolarHBondContact O-N 3.34Å; G156-M160 WeakPolarHBondContact O-CB 3.23Å; G156-M160 PolarHBondContact O-N 3.27Å; G156-L202 WeakPolarHBondContact O-CD2 3.18Å
157	L	93.1	Very high	95.6	Very high	31 Å²	31	42.1 Å²	42.1	16%	0.162	24%	0.236	C	C	.	.	H	α-helix	trans	-65.5	-38.4	177.2	-179	152.4	0	0	0	112.3	G154 P155 M160 I347 I442 V445	G154-L157 PolarHBondContact O-N 3.01Å; P155-L157 VanDerWaalsContact C-N 3.33Å; P155-L157 PolarHBondContact O-N 3.48Å; L157-M160 WeakPolarHBondContact O-CB 3.49Å; L157-M160 PolarHBondContact O-N 3.42Å; L157-I347 HydrophobicContact CD2-CD1 3.73Å; L157-I442 HydrophobicContact CD1-CB 4.31Å; L157-V445 HydrophobicContact CD1-CG2 4.48Å; L157-V445 HydrophobicContact CD2-CG2 4.05Å; L157-V445 HydrophobicContact CG-CG2 4.24Å
158	V	94.8	Very high	95.5	Very high	70 Å²	70	40.5 Å²	40.5	42%	0.424	23%	0.229	S	C	.	.	H	α-helix	trans	-64.7	-48.5	176.6	177.6	0	0	0	0	110.9	G154 P155 M160 V161 I347	G154-V158 PolarHBondContact O-N 3.38Å; P155-V158 PolarHBondContact O-N 2.89Å; V158-M160 PolarHBondContact O-N 2.87Å; V158-V161 PolarHBondContact O-N 3.38Å; V158-I347 HydrophobicContact CG1-CB 4.28Å; V158-I347 HydrophobicContact CG1-CG2 4.03Å; V158-I347 HydrophobicContact CG2-CG1 4.33Å
159	R	93.8	Very high	95.5	Very high	105 Å²	105	42.1 Å²	42.1	40%	0.396	24%	0.236	S	C	.	.	H	α-helix	trans	-62.1	-32.3	177.6	-70.1	-166.5	-58.1	-104.8	5.2	112.5	P155 G156 V161 T162 V163 L202	P155-R159 PolarHBondContact O-N 3.43Å; P155-R159 VanDerWaalsContact O-N 3.08Å; G156-R159 PolarHBondContact O-N 3.34Å; R159-V161 PolarHBondContact O-N 2.87Å; R159-T162 PolarHBondContact O-N 3.13Å; R159-V163 WeakPolarHBondContact O-CG2 3.44Å; R159-V163 PolarHBondContact O-N 3.03Å; R159-L202 HydrophobicContact CB-CD1 4.03Å
160	M	94.2	Very high	95.5	Very high	1 Å²	1	41.7 Å²	41.7	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-56.8	-36.4	-177.1	-172.4	57.6	100.7	0	0	113.1	G156 L157 V158 T162 V163 C164 T198 L202 F203 I442 M446	G156-M160 WeakPolarHBondContact O-CB 3.23Å; G156-M160 PolarHBondContact O-N 3.27Å; L157-M160 WeakPolarHBondContact O-CB 3.49Å; L157-M160 PolarHBondContact O-N 3.42Å; V158-M160 PolarHBondContact O-N 2.87Å; M160-T162 VanDerWaalsContact C-N 3.35Å; M160-T162 PolarHBondContact O-N 3.38Å; M160-V163 PolarHBondContact O-N 3.49Å; M160-C164 WeakPolarHBondContact O-CB 3.25Å; M160-C164 PolarHBondContact O-N 3.1Å; M160-C164 PolarHBondContact O-SG 3.43Å; M160-C164 VanDerWaalsContact O-SG 3.33Å; M160-C164 VanDerWaalsContact SD-SG 3.63Å; M160-T198 HydrophobicContact CE-CG2 3.78Å; M160-T198 HydrophobicContact SD-CG2 3.22Å; M160-T198 WeakPolarHBondContact SD-CG2 3.39Å; M160-L202 HydrophobicContact CB-CD2 4.13Å; M160-L202 HydrophobicContact CE-CB 4.12Å; M160-L202 HydrophobicContact CE-CD2 3.23Å; M160-L202 HydrophobicContact CE-CG 4.29Å; M160-L202 HydrophobicContact CG-CD2 4.45Å; M160-L202 HydrophobicContact SD-CD2 3.86Å; M160-F203 HydrophobicContact CE-CE2 4.06Å; M160-F203 HydrophobicContact CE-CZ 3.98Å; M160-I442 HydrophobicContact CB-CD1 3.9Å; M160-I442 HydrophobicContact CB-CG1 3.97Å; M160-I442 HydrophobicContact CE-CD1 3.7Å; M160-I442 HydrophobicContact CE-CG1 4.21Å; M160-I442 HydrophobicContact CG-CD1 3.87Å; M160-I442 HydrophobicContact CG-CG1 3.69Å; M160-M446 HydrophobicContact CE-CG 4.33Å; M160-M446 HydrophobicContact CE-SD 3.6Å; M160-M446 VanDerWaalsContact CE-SD 3.6Å; M160-M446 HydrophobicContact CG-CG 3.45Å; M160-M446 VanDerWaalsContact CG-CG 3.45Å; M160-M446 HydrophobicContact CG-SD 4.04Å; M160-M446 HydrophobicContact SD-CG 4.03Å; M160-M446 HydrophobicContact SD-SD 3.92Å
161	V	94.1	Very high	95.5	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.4	-52.3	179.1	179.6	0	0	0	0	111	V158 R159 A165 V345 I347 M350 V445	V158-V161 PolarHBondContact O-N 3.38Å; R159-V161 PolarHBondContact O-N 2.87Å; V161-A165 WeakPolarHBondContact O-CB 3.33Å; V161-A165 PolarHBondContact O-N 2.82Å; V161-A165 VanDerWaalsContact O-N 3.15Å; V161-V345 HydrophobicContact CG1-CG1 4.1Å; V161-V345 HydrophobicContact CG1-CG2 4.21Å; V161-I347 HydrophobicContact CG2-CB 4.13Å; V161-I347 HydrophobicContact CG2-CD1 3.67Å; V161-I347 HydrophobicContact CG2-CG1 4.49Å; V161-M350 HydrophobicContact CG1-CE 4.04Å; V161-M350 HydrophobicContact CG2-CG 4.16Å; V161-V445 HydrophobicContact CB-CG1 4.4Å; V161-V445 HydrophobicContact CG2-CG1 3.3Å
162	T	94.2	Very high	95.5	Very high	74 Å²	74	35.2 Å²	35.2	45%	0.454	21%	0.207	S	C	.	.	H	α-helix	trans	-71.6	-41.7	-177.7	-52	0	0	0	0	110.8	R159 M160 C164 A165 E166	R159-T162 PolarHBondContact O-N 3.13Å; M160-T162 VanDerWaalsContact C-N 3.35Å; M160-T162 PolarHBondContact O-N 3.38Å; T162-C164 VanDerWaalsContact C-N 3.35Å; T162-C164 PolarHBondContact O-N 3.25Å; T162-A165 PolarHBondContact O-N 3.15Å; T162-E166 HydrophobicContact CG2-CG 4.19Å; T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.38Å
163	V	96.6	Very high	95.5	Very high	37 Å²	37	39 Å²	39	22%	0.224	23%	0.227	C	C	.	.	H	α-helix	trans	-59	-45.7	177.4	174.4	0	0	0	0	111.3	R159 M160 A165 S167 T198 M201	R159-V163 WeakPolarHBondContact O-CG2 3.44Å; R159-V163 PolarHBondContact O-N 3.03Å; M160-V163 PolarHBondContact O-N 3.49Å; V163-A165 PolarHBondContact O-N 2.94Å; V163-S167 WeakPolarHBondContact O-CB 3.46Å; V163-S167 PolarHBondContact O-N 2.89Å; V163-T198 HydrophobicContact CG1-CG2 4.33Å; V163-M201 HydrophobicContact CG1-CB 3.79Å
164	C	95.9	Very high	95.6	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.1	-44.7	176.1	-75.7	0	0	0	0	112.8	M160 T162 L168 T198 M446 A449 I450	M160-C164 WeakPolarHBondContact O-CB 3.25Å; M160-C164 PolarHBondContact O-N 3.1Å; M160-C164 PolarHBondContact O-SG 3.43Å; M160-C164 VanDerWaalsContact O-SG 3.33Å; M160-C164 VanDerWaalsContact SD-SG 3.63Å; T162-C164 VanDerWaalsContact C-N 3.35Å; T162-C164 PolarHBondContact O-N 3.25Å; C164-L168 WeakPolarHBondContact O-CB 3.45Å; C164-L168 PolarHBondContact O-N 3.25Å; C164-T198 WeakPolarHBondContact SG-CG2 3.32Å; C164-M446 VanDerWaalsContact SG-CG 3.5Å; C164-A449 HydrophobicContact CB-CB 4.06Å; C164-I450 HydrophobicContact CB-CD1 4.45Å; C164-I450 HydrophobicContact CB-CG1 4.17Å
165	A	96.3	Very high	95.7	Very high	3 Å²	3	39.4 Å²	39.4	3%	0.025	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-46.8	-178.4	0	0	0	0	0	111.3	V161 T162 V163 L168 K169 V345	V161-A165 WeakPolarHBondContact O-CB 3.33Å; V161-A165 PolarHBondContact O-N 2.82Å; V161-A165 VanDerWaalsContact O-N 3.15Å; T162-A165 PolarHBondContact O-N 3.15Å; V163-A165 PolarHBondContact O-N 2.94Å; A165-L168 PolarHBondContact O-N 3.16Å; A165-K169 WeakPolarHBondContact O-CB 3.33Å; A165-K169 VanDerWaalsContact O-CG 3.24Å; A165-K169 WeakPolarHBondContact O-CG 3.48Å; A165-K169 PolarHBondContact O-N 3.48Å; A165-V345 HydrophobicContact CB-CG1 3.67Å
166	E	97.4	Very high	95.8	Very high	80 Å²	80	41.4 Å²	41.4	37%	0.374	21%	0.209	S	C	.	.	H	α-helix	trans	-68.8	-41.2	179.7	-64.2	-48.3	124.8	0	0	112.4	T162 L168 K169 T170	T162-E166 HydrophobicContact CG2-CG 4.19Å; T162-E166 WeakPolarHBondContact O-CG 3.42Å; T162-E166 PolarHBondContact O-N 3.38Å; E166-L168 PolarHBondContact O-N 3.33Å; E166-K169 PolarHBondContact O-N 3.07Å; E166-K169 IonicContact OE1-NZ 3.75Å; E166-K169 PolarHBondContact OE1-NZ 3.23Å; E166-K169 IonicContact OE2-NZ 2.88Å; E166-T170 WeakPolarHBondContact O-CB 3.26Å; E166-T170 PolarHBondContact O-N 3.44Å; E166-T170 PolarHBondContact O-OG1 2.87Å
167	S	98	Very high	96	Very high	5 Å²	5	45.4 Å²	45.4	4%	0.035	23%	0.226	C	C	.	.	H	α-helix	trans	-57	-50.6	173.1	-179.5	0	0	0	0	110.5	V163 T170 H171 V194 D197	V163-S167 WeakPolarHBondContact O-CB 3.46Å; V163-S167 PolarHBondContact O-N 2.89Å; S167-T170 PolarHBondContact O-N 3.06Å; S167-H171 PolarHBondContact O-N 3.12Å; S167-H171 VanDerWaalsContact O-N 3.15Å; S167-H171 PolarHBondContact O-ND1 2.57Å; S167-V194 PolarHBondContact OG-O 3.15Å; S167-D197 VanDerWaalsContact CB-OD2 3.23Å; S167-D197 WeakPolarHBondContact CB-OD2 3.39Å; S167-D197 PolarHBondContact OG-OD2 2.99Å
168	L	98.3	Very high	96.1	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-64.5	-44.1	179	-176.6	64.2	0	0	0	112.5	C164 A165 E166 T170 H171 L172 V194 I450 T453 L454	C164-L168 WeakPolarHBondContact O-CB 3.45Å; C164-L168 PolarHBondContact O-N 3.25Å; A165-L168 PolarHBondContact O-N 3.16Å; E166-L168 PolarHBondContact O-N 3.33Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.85Å; L168-H171 PolarHBondContact O-N 2.66Å; L168-H171 VanDerWaalsContact O-N 3.13Å; L168-L172 HydrophobicContact CD1-CD1 4.26Å; L168-L172 HydrophobicContact CD1-CD2 4.3Å; L168-L172 HydrophobicContact CD1-CG 3.99Å; L168-L172 HydrophobicContact CD2-CD1 4.2Å; L168-L172 HydrophobicContact CG-CD1 3.83Å; L168-L172 HydrophobicContact CG-CG 4Å; L168-L172 WeakPolarHBondContact O-CB 3.38Å; L168-L172 VanDerWaalsContact O-CG 3.3Å; L168-L172 WeakPolarHBondContact O-CG 3.34Å; L168-L172 PolarHBondContact O-N 3.12Å; L168-V194 HydrophobicContact CB-CG1 4.15Å; L168-V194 HydrophobicContact CD1-CG1 4.32Å; L168-V194 HydrophobicContact CD1-CG2 3.88Å; L168-I450 HydrophobicContact CD2-CB 4.22Å; L168-I450 HydrophobicContact CD2-CG1 4.41Å; L168-I450 HydrophobicContact CD2-CG2 3.76Å; L168-I450 WeakPolarHBondContact CD2-O 3.15Å; L168-T453 HydrophobicContact CD2-CG2 4Å; L168-T453 HydrophobicContact CG-CG2 4.48Å; L168-L454 HydrophobicContact CD2-CB 4.02Å
169	K	97.4	Very high	96.2	Very high	42 Å²	42	43.4 Å²	43.4	18%	0.183	22%	0.216	C	C	.	.	H	α-helix	trans	-54.1	-49.6	176.9	-77.6	171.1	-177.4	176.4	0	111.1	A165 E166 H171 L172 D173 D344 T453	A165-K169 WeakPolarHBondContact O-CB 3.33Å; A165-K169 VanDerWaalsContact O-CG 3.24Å; A165-K169 WeakPolarHBondContact O-CG 3.48Å; A165-K169 PolarHBondContact O-N 3.48Å; E166-K169 PolarHBondContact O-N 3.07Å; E166-K169 IonicContact OE1-NZ 3.75Å; E166-K169 PolarHBondContact OE1-NZ 3.23Å; E166-K169 IonicContact OE2-NZ 2.88Å; K169-H171 PolarHBondContact O-N 2.89Å; K169-L172 PolarHBondContact O-N 3.28Å; K169-L172 VanDerWaalsContact O-N 3.1Å; K169-D173 PolarHBondContact O-N 3.07Å; K169-D344 IonicContact NZ-OD1 3.49Å; K169-D344 PolarHBondContact NZ-OD1 2.93Å; K169-D344 IonicContact NZ-OD2 3.29Å; K169-T453 HydrophobicContact CG-CG2 3.96Å
170	T	97.8	Very high	96.1	Very high	68 Å²	68	41.6 Å²	41.6	42%	0.417	21%	0.214	S	C	.	.	H	α-helix	trans	-60.6	-33.2	-179.7	-54.1	0	0	0	0	112.3	E166 S167 L168 R174	E166-T170 WeakPolarHBondContact O-CB 3.26Å; E166-T170 PolarHBondContact O-N 3.44Å; E166-T170 PolarHBondContact O-OG1 2.87Å; S167-T170 PolarHBondContact O-N 3.06Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.85Å; T170-R174 PolarHBondContact O-NE 3.15Å; T170-R174 VanDerWaalsContact O-NE 3.07Å
171	H	98.3	Very high	95.9	Very high	6 Å²	6	51.4 Å²	51.4	3%	0.028	26%	0.26	C	S	.	.	H	α-helix	trans	-79.7	-35.5	175.6	-75.7	82.7	0	0	0	113.1	S167 L168 K169 D173 R174 L175 L190 V194 D197 E210	S167-H171 PolarHBondContact O-N 3.12Å; S167-H171 VanDerWaalsContact O-N 3.15Å; S167-H171 PolarHBondContact O-ND1 2.57Å; L168-H171 PolarHBondContact O-N 2.66Å; L168-H171 VanDerWaalsContact O-N 3.13Å; K169-H171 PolarHBondContact O-N 2.89Å; H171-D173 VanDerWaalsContact C-N 3.27Å; H171-D173 PolarHBondContact O-N 3.02Å; H171-R174 CarbonylContact O-C 3.59Å; H171-R174 VanDerWaalsContact O-C 3.27Å; H171-R174 PolarHBondContact O-N 3.36Å; H171-R174 VanDerWaalsContact O-N 3.16Å; H171-L175 PolarHBondContact O-N 3.05Å; H171-L190 HydrophobicContact CB-CD1 3.8Å; H171-V194 HydrophobicContact CB-CG2 3.68Å; H171-D197 IonicContact CE1-OD2 2.78Å; H171-E210 IonicContact CE1-OE2 3.52Å; H171-E210 PolarHBondContact CE1-OE2 2.56Å; H171-E210 IonicContact NE2-OE2 3.88Å; H171-E210 PolarHBondContact NE2-OE2 3.42Å
172	L	97.5	Very high	95.8	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	29%	0.288	C	S	.	.	H	α-helix	trans	-70.1	-25.3	174.5	-68.6	179.1	0	0	0	112.4	L168 K169 R174 L175 L190 F458 F492	L168-L172 HydrophobicContact CD1-CD1 4.26Å; L168-L172 HydrophobicContact CD1-CD2 4.3Å; L168-L172 HydrophobicContact CD1-CG 3.99Å; L168-L172 HydrophobicContact CD2-CD1 4.2Å; L168-L172 HydrophobicContact CG-CD1 3.83Å; L168-L172 HydrophobicContact CG-CG 4Å; L168-L172 WeakPolarHBondContact O-CB 3.38Å; L168-L172 VanDerWaalsContact O-CG 3.3Å; L168-L172 WeakPolarHBondContact O-CG 3.34Å; L168-L172 PolarHBondContact O-N 3.12Å; K169-L172 PolarHBondContact O-N 3.28Å; K169-L172 VanDerWaalsContact O-N 3.1Å; L172-R174 VanDerWaalsContact C-N 3.29Å; L172-L175 HydrophobicContact CD2-CD1 4.06Å; L172-L190 HydrophobicContact CD2-CD2 4.28Å; L172-F458 HydrophobicContact CB-CE2 4.28Å; L172-F458 HydrophobicContact CD1-CD2 4.39Å; L172-F458 HydrophobicContact CD1-CE2 4.18Å; L172-F458 HydrophobicContact CD2-CD2 4.33Å; L172-F458 HydrophobicContact CD2-CE2 3.96Å; L172-F458 HydrophobicContact CG-CE2 4.36Å; L172-F492 HydrophobicContact CD2-CE2 4.3Å
173	D	97.1	Very high	95.7	Very high	95 Å²	95	53.5 Å²	53.5	51%	0.508	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-18.3	171.1	-68.7	-26.5	0	0	0	113	K169 H171 R457	K169-D173 PolarHBondContact O-N 3.07Å; H171-D173 VanDerWaalsContact C-N 3.27Å; H171-D173 PolarHBondContact O-N 3.02Å; D173-R457 IonicContact OD1-CZ 3.89Å; D173-R457 IonicContact OD1-NH1 3.9Å; D173-R457 PolarHBondContact OD1-NH1 3.27Å; D173-R457 IonicContact OD1-NH2 2.64Å; D173-R457 PolarHBondContact OD1-NH2 3.24Å
174	R	96.3	Very high	95.7	Very high	79 Å²	79	55.5 Å²	55.5	30%	0.298	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	36.4	177.1	-63	-179.1	-66.9	154.1	-5.1	111.7	T170 H171 L172 E176 E177	T170-R174 PolarHBondContact O-NE 3.15Å; T170-R174 VanDerWaalsContact O-NE 3.07Å; H171-R174 CarbonylContact O-C 3.59Å; H171-R174 VanDerWaalsContact O-C 3.27Å; H171-R174 PolarHBondContact O-N 3.36Å; H171-R174 VanDerWaalsContact O-N 3.16Å; L172-R174 VanDerWaalsContact C-N 3.29Å; R174-E176 VanDerWaalsContact CA-OE2 3.26Å; R174-E176 WeakPolarHBondContact CA-OE2 3.39Å; R174-E176 PolarHBondContact O-N 2.86Å; R174-E176 VanDerWaalsContact O-N 3.15Å; R174-E177 HydrophobicContact CB-CG 4.27Å; R174-E177 WeakPolarHBondContact CD-OE1 3.39Å; R174-E177 IonicContact CZ-OE1 2.75Å; R174-E177 IonicContact NE-OE1 2.68Å; R174-E177 IonicContact NH1-OE1 3.91Å; R174-E177 PolarHBondContact NH1-OE1 3.23Å; R174-E177 VanDerWaalsContact NH1-OE1 3.1Å; R174-E177 WeakPolarHBondContact O-CB 3.26Å; R174-E177 PolarHBondContact O-N 3.37Å
175	L	95.3	Very high	95.8	Very high	26 Å²	26	55.6 Å²	55.6	14%	0.136	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-62.9	-23.1	-173.5	-157.3	68.1	0	0	0	112	H171 L172 E177 V178 T179 V185 L190 F458 F492	H171-L175 PolarHBondContact O-N 3.05Å; L172-L175 HydrophobicContact CD2-CD1 4.06Å; L175-E177 PolarHBondContact O-N 3.5Å; L175-V178 HydrophobicContact CD1-CG2 4.08Å; L175-V178 WeakPolarHBondContact O-CG2 3.15Å; L175-V178 PolarHBondContact O-N 3.45Å; L175-V178 VanDerWaalsContact O-N 3.12Å; L175-T179 WeakPolarHBondContact O-CB 3.38Å; L175-T179 PolarHBondContact O-N 3.04Å; L175-T179 VanDerWaalsContact O-N 3.07Å; L175-T179 PolarHBondContact O-OG1 3.34Å; L175-V185 HydrophobicContact CD1-CG1 4.11Å; L175-V185 HydrophobicContact CD2-CG2 4.2Å; L175-V185 HydrophobicContact CG-CG2 4.39Å; L175-L190 HydrophobicContact CD1-CD2 4.07Å; L175-F458 HydrophobicContact CD2-CZ 4.27Å; L175-F492 HydrophobicContact CD1-CD2 4.26Å; L175-F492 HydrophobicContact CD1-CE2 4.49Å; L175-F492 HydrophobicContact CD2-CB 4.43Å; L175-F492 HydrophobicContact CD2-CD2 4.21Å
176	E	94.9	Very high	95.9	Very high	135 Å²	135	58.4 Å²	58.4	63%	0.631	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-58	-25.8	173.1	69	-80.2	-173.6	0	0	113.6	R174 V178	R174-E176 VanDerWaalsContact CA-OE2 3.26Å; R174-E176 WeakPolarHBondContact CA-OE2 3.39Å; R174-E176 PolarHBondContact O-N 2.86Å; R174-E176 VanDerWaalsContact O-N 3.15Å; E176-V178 PolarHBondContact O-N 3.08Å
177	E	95	Very high	95.9	Very high	91 Å²	91	54.7 Å²	54.7	43%	0.425	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-69.4	-18	177.5	-65.4	-175.9	-165.1	0	0	113.3	R174 L175 R193	R174-E177 HydrophobicContact CB-CG 4.27Å; R174-E177 WeakPolarHBondContact CD-OE1 3.39Å; R174-E177 IonicContact CZ-OE1 2.75Å; R174-E177 IonicContact NE-OE1 2.68Å; R174-E177 IonicContact NH1-OE1 3.91Å; R174-E177 PolarHBondContact NH1-OE1 3.23Å; R174-E177 VanDerWaalsContact NH1-OE1 3.1Å; R174-E177 WeakPolarHBondContact O-CB 3.26Å; R174-E177 PolarHBondContact O-N 3.37Å; L175-E177 PolarHBondContact O-N 3.5Å; E177-R193 IonicContact OE2-NH1 3.21Å; E177-R193 PolarHBondContact OE2-NH1 3.37Å
178	V	95.9	Very high	95.9	Very high	16 Å²	16	54.6 Å²	54.6	10%	0.097	28%	0.284	C	S	.	.	S	Bend	trans	-130.8	8	-173.7	-65.8	0	0	0	0	112.7	L175 E176 V185 D186 T189 L190	L175-V178 HydrophobicContact CD1-CG2 4.08Å; L175-V178 WeakPolarHBondContact O-CG2 3.15Å; L175-V178 PolarHBondContact O-N 3.45Å; L175-V178 VanDerWaalsContact O-N 3.12Å; E176-V178 PolarHBondContact O-N 3.08Å; V178-V185 HydrophobicContact CG2-CG1 4.09Å; V178-V185 WeakPolarHBondContact O-CA 3.34Å; V178-D186 PolarHBondContact O-N 2.92Å; V178-T189 HydrophobicContact CG1-CG2 4.21Å; V178-L190 HydrophobicContact CG1-CB 4.5Å; V178-L190 HydrophobicContact CG2-CB 4.2Å; V178-L190 HydrophobicContact CG2-CD1 4.28Å
179	T	95.7	Very high	95.9	Very high	43 Å²	43	56 Å²	56	26%	0.264	29%	0.292	S	S	.	.	B	Isolated β-bridge	trans	-110.9	129.5	-179.7	-55.3	0	0	0	0	110.1	L175 Y184 V185	L175-T179 WeakPolarHBondContact O-CB 3.38Å; L175-T179 PolarHBondContact O-N 3.04Å; L175-T179 VanDerWaalsContact O-N 3.07Å; L175-T179 PolarHBondContact O-OG1 3.34Å; T179-Y184 WeakPolarHBondContact CA-O 3.45Å; T179-V185 HydrophobicContact CG2-CG2 4.37Å
180	N	92.4	Very high	96	Very high	67 Å²	67	54.1 Å²	54.1	36%	0.358	28%	0.284	S	S	.	.			trans	-78.8	172.3	175.9	76.1	13.3	0	0	0	112.3	S182 G183 Y184	N180-S182 PolarHBondContact O-N 3.49Å; N180-S182 VanDerWaalsContact O-N 3.09Å; N180-S182 WeakPolarHBondContact OD1-CA 3.32Å; N180-S182 WeakPolarHBondContact OD1-CB 3.16Å; N180-S182 PolarHBondContact OD1-N 3.26Å; N180-G183 PolarHBondContact O-N 3.35Å; N180-G183 PolarHBondContact OD1-N 3.18Å; N180-G183 VanDerWaalsContact OD1-N 3.15Å; N180-Y184 PolarHBondContact N-O 3.34Å; N180-Y184 WeakPolarHBondContact ND2-CB 3.4Å; N180-Y184 VanDerWaalsContact ND2-CD2 3.35Å; N180-Y184 WeakPolarHBondContact ND2-CD2 3.34Å; N180-Y184 WeakPolarHBondContact OD1-CB 3.5Å; N180-Y184 PolarHBondContact OD1-N 2.98Å
181	E	90.6	Very high	96	Very high	208 Å²	208	50.9 Å²	50.9	97%	0.972	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-24.2	-179.9	-63.8	-178.3	175.6	0	0	114	G183	E181-G183 VanDerWaalsContact C-N 3.29Å
182	S	90.7	Very high	96.1	Very high	85 Å²	85	51.4 Å²	51.4	59%	0.594	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	3.4	176.9	-59	0	0	0	0	113.4	N180	N180-S182 PolarHBondContact O-N 3.49Å; N180-S182 VanDerWaalsContact O-N 3.09Å; N180-S182 WeakPolarHBondContact OD1-CA 3.32Å; N180-S182 WeakPolarHBondContact OD1-CB 3.16Å; N180-S182 PolarHBondContact OD1-N 3.26Å
183	G	93.2	Very high	96.1	Very high	33 Å²	33	52.7 Å²	52.7	34%	0.34	27%	0.27	S	S	.	.	S	Bend	trans	78.3	18.8	-178.1	0	0	0	0	0	114.2	N180 E181	N180-G183 PolarHBondContact O-N 3.35Å; N180-G183 PolarHBondContact OD1-N 3.18Å; N180-G183 VanDerWaalsContact OD1-N 3.15Å; E181-G183 VanDerWaalsContact C-N 3.29Å
184	Y	96.6	Very high	96.2	Very high	78 Å²	78	48.1 Å²	48.1	31%	0.306	25%	0.246	S	C	.	.			trans	-91.5	124.9	176.3	-46.9	-26.8	0	0	0	110.1	T179 N180 L463 I491	T179-Y184 WeakPolarHBondContact CA-O 3.45Å; N180-Y184 PolarHBondContact N-O 3.34Å; N180-Y184 WeakPolarHBondContact ND2-CB 3.4Å; N180-Y184 VanDerWaalsContact ND2-CD2 3.35Å; N180-Y184 WeakPolarHBondContact ND2-CD2 3.34Å; N180-Y184 WeakPolarHBondContact OD1-CB 3.5Å; N180-Y184 PolarHBondContact OD1-N 2.98Å; Y184-L463 HydrophobicContact CD1-CD2 3.63Å; Y184-L463 HydrophobicContact CD2-CD1 3.83Å; Y184-L463 HydrophobicContact CD2-CD2 4.3Å; Y184-L463 HydrophobicContact CE1-CD2 3.46Å; Y184-L463 VanDerWaalsContact CE1-CD2 3.46Å; Y184-L463 HydrophobicContact CE2-CD1 4.05Å; Y184-L463 HydrophobicContact CE2-CD2 4.18Å; Y184-L463 HydrophobicContact CG-CD1 4.09Å; Y184-L463 HydrophobicContact CG-CD2 4.06Å; Y184-I491 HydrophobicContact CD1-CD1 4.23Å; Y184-I491 HydrophobicContact CD1-CG1 3.84Å; Y184-I491 HydrophobicContact CE1-CD1 4.02Å; Y184-I491 HydrophobicContact CE1-CG1 4.16Å
185	V	97.9	Very high	96.3	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.012	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-89.6	126	-179.3	-174.6	0	0	0	0	109.1	L175 V178 T179 V187 L190 E489 M490 F492	L175-V185 HydrophobicContact CD1-CG1 4.11Å; L175-V185 HydrophobicContact CD2-CG2 4.2Å; L175-V185 HydrophobicContact CG-CG2 4.39Å; V178-V185 HydrophobicContact CG2-CG1 4.09Å; V178-V185 WeakPolarHBondContact O-CA 3.34Å; T179-V185 HydrophobicContact CG2-CG2 4.37Å; V185-V187 VanDerWaalsContact C-N 3.31Å; V185-V187 HydrophobicContact CB-CG2 4.37Å; V185-V187 HydrophobicContact CG1-CG2 4.27Å; V185-V187 PolarHBondContact O-N 3.12Å; V185-L190 HydrophobicContact CG1-CD2 4.15Å; V185-E489 WeakPolarHBondContact O-CA 3.26Å; V185-E489 WeakPolarHBondContact O-CB 3.3Å; V185-M490 PolarHBondContact N-O 2.9Å; V185-M490 PolarHBondContact O-N 3.05Å; V185-M490 VanDerWaalsContact O-N 3.07Å; V185-F492 HydrophobicContact CG1-CD2 4.46Å; V185-F492 HydrophobicContact CG1-CE2 4.22Å; V185-F492 HydrophobicContact CG1-CZ 4.43Å; V185-F492 HydrophobicContact CG2-CB 4.25Å; V185-F492 HydrophobicContact CG2-CD1 4.44Å; V185-F492 HydrophobicContact CG2-CD2 4.21Å; V185-F492 HydrophobicContact CG2-CG 4.05Å
186	D	97.9	Very high	96.5	Very high	63 Å²	63	43.1 Å²	43.1	34%	0.337	23%	0.226	S	C	.	.			trans	-73.2	88.3	165.2	-177.9	-8.8	0	0	0	109.4	V178 L188 T189 L190	V178-D186 PolarHBondContact O-N 2.92Å; D186-L188 VanDerWaalsContact C-N 3.31Å; D186-L188 PolarHBondContact O-N 3.32Å; D186-L188 PolarHBondContact OD1-N 3.39Å; D186-T189 VanDerWaalsContact CG-CB 3.45Å; D186-T189 VanDerWaalsContact CG-OG1 3.24Å; D186-T189 PolarHBondContact O-N 3.45Å; D186-T189 PolarHBondContact OD1-N 3.27Å; D186-T189 PolarHBondContact OD1-OG1 3.5Å; D186-T189 WeakPolarHBondContact OD2-CB 3.36Å; D186-T189 PolarHBondContact OD2-OG1 3.3Å; D186-L190 WeakPolarHBondContact O-CB 3.36Å; D186-L190 PolarHBondContact O-N 3.29Å
187	V	98.1	Very high	96.6	Very high	1 Å²	1	38 Å²	38	1%	0.006	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-34	-176.3	177.6	0	0	0	0	112	V185 L191 F316 L319 M490 F492	V185-V187 VanDerWaalsContact C-N 3.31Å; V185-V187 HydrophobicContact CB-CG2 4.37Å; V185-V187 HydrophobicContact CG1-CG2 4.27Å; V185-V187 PolarHBondContact O-N 3.12Å; V187-L191 HydrophobicContact CG1-CD1 3.62Å; V187-L191 HydrophobicContact CG1-CG 4.09Å; V187-L191 WeakPolarHBondContact O-CB 3.22Å; V187-L191 WeakPolarHBondContact O-CG 3.36Å; V187-L191 PolarHBondContact O-N 2.82Å; V187-F316 HydrophobicContact CB-CD2 4.22Å; V187-F316 HydrophobicContact CG1-CD2 4.09Å; V187-L319 HydrophobicContact CG1-CD1 3.66Å; V187-M490 HydrophobicContact CG1-SD 4.45Å; V187-M490 HydrophobicContact CG2-CB 3.63Å; V187-M490 HydrophobicContact CG2-CG 3.67Å; V187-M490 HydrophobicContact CG2-SD 3.9Å; V187-F492 HydrophobicContact CG2-CE1 3.83Å; V187-F492 HydrophobicContact CG2-CZ 3.82Å
188	L	98.1	Very high	96.8	Very high	4 Å²	4	33.7 Å²	33.7	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-67.3	-47.1	179.2	-80	171.2	0	0	0	110.7	D186 L191 R192 V313 F316 P481 E483 L488	D186-L188 VanDerWaalsContact C-N 3.31Å; D186-L188 PolarHBondContact O-N 3.32Å; D186-L188 PolarHBondContact OD1-N 3.39Å; L188-L191 PolarHBondContact O-N 3Å; L188-R192 WeakPolarHBondContact O-CB 3.37Å; L188-R192 VanDerWaalsContact O-CG 3.25Å; L188-R192 WeakPolarHBondContact O-CG 3.17Å; L188-R192 PolarHBondContact O-N 3.44Å; L188-V313 HydrophobicContact CD2-CG2 4.37Å; L188-F316 HydrophobicContact CD1-CD2 4.49Å; L188-F316 HydrophobicContact CD1-CE2 4.39Å; L188-F316 HydrophobicContact CD2-CB 3.78Å; L188-F316 HydrophobicContact CD2-CD1 4.3Å; L188-F316 HydrophobicContact CD2-CD2 3.93Å; L188-F316 HydrophobicContact CD2-CG 3.74Å; L188-F316 HydrophobicContact CG-CB 4.5Å; L188-F316 HydrophobicContact CG-CD2 3.73Å; L188-F316 HydrophobicContact CG-CE2 4.04Å; L188-F316 HydrophobicContact CG-CG 4.06Å; L188-P481 HydrophobicContact CD1-CG 4.36Å; L188-E483 HydrophobicContact CD1-CG 3.88Å; L188-L488 HydrophobicContact CD1-CD1 4.27Å
189	T	98.1	Very high	96.9	Very high	29 Å²	29	33 Å²	33	18%	0.178	18%	0.178	C	C	.	.	H	α-helix	trans	-63.4	-45.3	176.7	-65	0	0	0	0	111.5	V178 D186 L191 R192 R193	V178-T189 HydrophobicContact CG1-CG2 4.21Å; D186-T189 VanDerWaalsContact CG-CB 3.45Å; D186-T189 VanDerWaalsContact CG-OG1 3.24Å; D186-T189 PolarHBondContact O-N 3.45Å; D186-T189 PolarHBondContact OD1-N 3.27Å; D186-T189 PolarHBondContact OD1-OG1 3.5Å; D186-T189 WeakPolarHBondContact OD2-CB 3.36Å; D186-T189 PolarHBondContact OD2-OG1 3.3Å; T189-L191 PolarHBondContact O-N 2.85Å; T189-R192 PolarHBondContact O-N 2.82Å; T189-R193 WeakPolarHBondContact O-CG 3.27Å; T189-R193 PolarHBondContact O-N 3.33Å
190	L	98.6	Very high	97	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	17%	0.168	C	C	.	.	H	α-helix	trans	-53.8	-53.3	175.1	173.3	60.7	0	0	0	111.5	H171 L172 L175 V178 V185 D186 R192 R193 V194 F492	H171-L190 HydrophobicContact CB-CD1 3.8Å; L172-L190 HydrophobicContact CD2-CD2 4.28Å; L175-L190 HydrophobicContact CD1-CD2 4.07Å; V178-L190 HydrophobicContact CG1-CB 4.5Å; V178-L190 HydrophobicContact CG2-CB 4.2Å; V178-L190 HydrophobicContact CG2-CD1 4.28Å; V185-L190 HydrophobicContact CG1-CD2 4.15Å; D186-L190 WeakPolarHBondContact O-CB 3.36Å; D186-L190 PolarHBondContact O-N 3.29Å; L190-R192 PolarHBondContact O-N 3.09Å; L190-R193 PolarHBondContact O-N 2.88Å; L190-V194 HydrophobicContact CD1-CG2 4.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 3.04Å; L190-V194 VanDerWaalsContact O-N 3.1Å; L190-F492 HydrophobicContact CD2-CE2 3.85Å; L190-F492 HydrophobicContact CD2-CZ 4.37Å
191	L	98.8	Very high	97.2	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-65.8	-38.9	-177.4	-69.5	172.5	0	0	0	111.5	V187 L188 T189 V194 M195 S312 L315 F316 L319 I450	V187-L191 HydrophobicContact CG1-CD1 3.62Å; V187-L191 HydrophobicContact CG1-CG 4.09Å; V187-L191 WeakPolarHBondContact O-CB 3.22Å; V187-L191 WeakPolarHBondContact O-CG 3.36Å; V187-L191 PolarHBondContact O-N 2.82Å; L188-L191 PolarHBondContact O-N 3Å; T189-L191 PolarHBondContact O-N 2.85Å; L191-V194 PolarHBondContact O-N 2.94Å; L191-M195 WeakPolarHBondContact O-CB 3.32Å; L191-M195 WeakPolarHBondContact O-CG 3.34Å; L191-M195 PolarHBondContact O-N 3.04Å; L191-S312 VanDerWaalsContact CD1-O 3.31Å; L191-S312 WeakPolarHBondContact CD1-O 3.24Å; L191-L315 HydrophobicContact CD1-CB 3.74Å; L191-L315 HydrophobicContact CD2-CB 4.23Å; L191-L315 HydrophobicContact CD2-CD1 4.28Å; L191-F316 HydrophobicContact CD1-CB 4.19Å; L191-L319 HydrophobicContact CD1-CD1 4.22Å; L191-I450 HydrophobicContact CD2-CG2 4.31Å
192	R	98.8	Very high	97.5	Very high	17 Å²	17	22.7 Å²	22.7	6%	0.064	13%	0.126	C	C	.	.	H	α-helix	trans	-62.8	-42.3	176.9	-76	173.5	177.6	136.4	-1.5	112.6	L188 T189 L190 M195 L196 V214 S312 E483	L188-R192 WeakPolarHBondContact O-CB 3.37Å; L188-R192 VanDerWaalsContact O-CG 3.25Å; L188-R192 WeakPolarHBondContact O-CG 3.17Å; L188-R192 PolarHBondContact O-N 3.44Å; T189-R192 PolarHBondContact O-N 2.82Å; L190-R192 PolarHBondContact O-N 3.09Å; R192-M195 PolarHBondContact O-N 3.44Å; R192-L196 WeakPolarHBondContact O-CB 3.35Å; R192-L196 PolarHBondContact O-N 3.44Å; R192-V214 HydrophobicContact CB-CG1 3.63Å; R192-V214 HydrophobicContact CB-CG2 4.11Å; R192-V214 HydrophobicContact CG-CG1 4.38Å; R192-S312 WeakPolarHBondContact CG-OG 3.26Å; R192-E483 IonicContact CZ-OE1 2.7Å; R192-E483 IonicContact CZ-OE2 3.7Å; R192-E483 VanDerWaalsContact NH1-CD 3.31Å; R192-E483 IonicContact NH1-OE1 2.71Å; R192-E483 PolarHBondContact NH1-OE1 2.96Å; R192-E483 VanDerWaalsContact NH1-OE1 3.15Å; R192-E483 IonicContact NH1-OE2 3.43Å; R192-E483 PolarHBondContact NH1-OE2 3.43Å; R192-E483 IonicContact NH2-OE1 2.74Å; R192-E483 PolarHBondContact NH2-OE1 3.36Å; R192-E483 IonicContact NH2-OE2 3.63Å
193	R	98.7	Very high	97.8	Very high	32 Å²	32	19.1 Å²	19.1	12%	0.121	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-50.5	175.4	-71.7	-176.9	-176.5	175.3	7.7	111.2	E177 T189 L190 M195 L196 D197 S211 V214	E177-R193 IonicContact OE2-NH1 3.21Å; E177-R193 PolarHBondContact OE2-NH1 3.37Å; T189-R193 WeakPolarHBondContact O-CG 3.27Å; T189-R193 PolarHBondContact O-N 3.33Å; L190-R193 PolarHBondContact O-N 2.88Å; R193-M195 VanDerWaalsContact C-N 3.33Å; R193-M195 PolarHBondContact O-N 3.29Å; R193-L196 PolarHBondContact O-N 2.92Å; R193-L196 VanDerWaalsContact O-N 3.11Å; R193-D197 WeakPolarHBondContact O-CB 3.23Å; R193-D197 PolarHBondContact O-N 3.27Å; R193-S211 PolarHBondContact NE-OG 2.89Å; R193-S211 PolarHBondContact NH2-OG 3.39Å; R193-V214 HydrophobicContact CG-CG2 4.17Å
194	V	98.5	Very high	98	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-58.2	-42.8	176.4	174.2	0	0	0	0	111.9	S167 L168 H171 L190 L191 T198 I450	S167-V194 PolarHBondContact OG-O 3.15Å; L168-V194 HydrophobicContact CB-CG1 4.15Å; L168-V194 HydrophobicContact CD1-CG1 4.32Å; L168-V194 HydrophobicContact CD1-CG2 3.88Å; H171-V194 HydrophobicContact CB-CG2 3.68Å; L190-V194 HydrophobicContact CD1-CG2 4.29Å; L190-V194 WeakPolarHBondContact O-CG2 3.39Å; L190-V194 PolarHBondContact O-N 3.04Å; L190-V194 VanDerWaalsContact O-N 3.1Å; L191-V194 PolarHBondContact O-N 2.94Å; V194-T198 WeakPolarHBondContact O-CB 3.19Å; V194-T198 PolarHBondContact O-N 3.01Å; V194-T198 PolarHBondContact O-OG1 3.3Å; V194-I450 HydrophobicContact CG1-CD1 4.22Å
195	M	98.6	Very high	97.9	Very high	0 Å²	0	18 Å²	18	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.6	-39.6	177.3	-71.1	-50.5	132.7	0	0	112.6	L191 R192 R193 S199 A307 P308 M311 L315 I450	L191-M195 WeakPolarHBondContact O-CB 3.32Å; L191-M195 WeakPolarHBondContact O-CG 3.34Å; L191-M195 PolarHBondContact O-N 3.04Å; R192-M195 PolarHBondContact O-N 3.44Å; R193-M195 VanDerWaalsContact C-N 3.33Å; R193-M195 PolarHBondContact O-N 3.29Å; M195-S199 VanDerWaalsContact O-CB 3.31Å; M195-S199 WeakPolarHBondContact O-CB 3.23Å; M195-S199 PolarHBondContact O-N 3.11Å; M195-S199 PolarHBondContact O-OG 2.85Å; M195-A307 HydrophobicContact CB-CB 4.01Å; M195-A307 HydrophobicContact CG-CB 4.32Å; M195-A307 HydrophobicContact SD-CB 4.21Å; M195-P308 HydrophobicContact CB-CB 4.45Å; M195-P308 HydrophobicContact CB-CG 3.99Å; M195-M311 HydrophobicContact CE-CB 4.2Å; M195-M311 HydrophobicContact CG-CB 3.96Å; M195-M311 HydrophobicContact SD-CB 3.46Å; M195-M311 WeakPolarHBondContact SD-CB 3.32Å; M195-M311 HydrophobicContact SD-CE 4.46Å; M195-M311 HydrophobicContact SD-CG 4.21Å; M195-L315 HydrophobicContact CE-CD1 3.34Å; M195-I450 HydrophobicContact CE-CD1 3.15Å; M195-I450 HydrophobicContact SD-CD1 4.25Å
196	L	98.7	Very high	97.9	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-68.2	-48.9	178.5	174.5	62.7	0	0	0	110.7	R192 R193 T198 S199 N200 L208 E210 I213 V214 I217 P308	R192-L196 WeakPolarHBondContact O-CB 3.35Å; R192-L196 PolarHBondContact O-N 3.44Å; R193-L196 PolarHBondContact O-N 2.92Å; R193-L196 VanDerWaalsContact O-N 3.11Å; L196-T198 PolarHBondContact O-N 3Å; L196-S199 PolarHBondContact O-N 3.43Å; L196-N200 WeakPolarHBondContact O-CB 3.35Å; L196-N200 PolarHBondContact O-N 2.72Å; L196-L208 HydrophobicContact CD2-CD1 3.85Å; L196-L208 HydrophobicContact CG-CD1 4.24Å; L196-E210 HydrophobicContact CD2-CB 4.44Å; L196-I213 HydrophobicContact CD1-CG2 3.96Å; L196-I213 HydrophobicContact CD2-CB 3.68Å; L196-I213 HydrophobicContact CD2-CG2 3.52Å; L196-I213 HydrophobicContact CG-CG2 4.4Å; L196-V214 HydrophobicContact CB-CG2 4.23Å; L196-V214 HydrophobicContact CD2-CG2 3.81Å; L196-I217 HydrophobicContact CD1-CD1 3.92Å; L196-P308 HydrophobicContact CB-CG 4.07Å
197	D	98.6	Very high	97.8	Very high	28 Å²	28	19.8 Å²	19.8	15%	0.15	10%	0.1	C	C	.	.	H	α-helix	trans	-58.8	-49.1	178	176.1	39.6	0	0	0	110.7	S167 H171 R193 S199 N200 M201	S167-D197 VanDerWaalsContact CB-OD2 3.23Å; S167-D197 WeakPolarHBondContact CB-OD2 3.39Å; S167-D197 PolarHBondContact OG-OD2 2.99Å; H171-D197 IonicContact CE1-OD2 2.78Å; R193-D197 WeakPolarHBondContact O-CB 3.23Å; R193-D197 PolarHBondContact O-N 3.27Å; D197-S199 VanDerWaalsContact C-N 3.32Å; D197-S199 PolarHBondContact O-N 3.28Å; D197-N200 PolarHBondContact O-N 3.12Å; D197-M201 WeakPolarHBondContact O-CB 3.46Å; D197-M201 WeakPolarHBondContact O-CG 3.16Å; D197-M201 PolarHBondContact O-N 2.95Å; D197-M201 WeakPolarHBondContact OD1-CG 3.46Å
198	T	97.9	Very high	97.8	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-53.3	-47.9	173.6	-66.8	0	0	0	0	112.1	M160 V163 C164 V194 L196 M201 L202 M446	M160-T198 HydrophobicContact CE-CG2 3.78Å; M160-T198 HydrophobicContact SD-CG2 3.22Å; M160-T198 WeakPolarHBondContact SD-CG2 3.39Å; V163-T198 HydrophobicContact CG1-CG2 4.33Å; C164-T198 WeakPolarHBondContact SG-CG2 3.32Å; V194-T198 WeakPolarHBondContact O-CB 3.19Å; V194-T198 PolarHBondContact O-N 3.01Å; V194-T198 PolarHBondContact O-OG1 3.3Å; L196-T198 PolarHBondContact O-N 3Å; T198-M201 PolarHBondContact O-N 3.28Å; T198-L202 PolarHBondContact O-N 3.06Å; T198-L202 VanDerWaalsContact O-N 3.12Å; T198-M446 HydrophobicContact CG2-SD 4.24Å
199	S	98.1	Very high	97.7	Very high	2 Å²	2	25.9 Å²	25.9	1%	0.014	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-43	-179.4	-60.5	0	0	0	0	111.4	M195 L196 D197 L202 F203	M195-S199 VanDerWaalsContact O-CB 3.31Å; M195-S199 WeakPolarHBondContact O-CB 3.23Å; M195-S199 PolarHBondContact O-N 3.11Å; M195-S199 PolarHBondContact O-OG 2.85Å; L196-S199 PolarHBondContact O-N 3.43Å; D197-S199 VanDerWaalsContact C-N 3.32Å; D197-S199 PolarHBondContact O-N 3.28Å; S199-L202 PolarHBondContact O-N 3.16Å; S199-F203 VanDerWaalsContact O-CB 3.32Å; S199-F203 WeakPolarHBondContact O-CB 3.45Å; S199-F203 WeakPolarHBondContact O-CD2 3.32Å; S199-F203 PolarHBondContact O-N 3.07Å
200	N	98.3	Very high	97.7	Very high	7 Å²	7	26.5 Å²	26.5	4%	0.037	13%	0.133	C	C	.	.	H	α-helix	trans	-61	-52.4	176.1	-179.4	35.3	0	0	0	110.8	L196 D197 L202 F203 L204 R205 I206 L208 L304	L196-N200 WeakPolarHBondContact O-CB 3.35Å; L196-N200 PolarHBondContact O-N 2.72Å; D197-N200 PolarHBondContact O-N 3.12Å; N200-L202 PolarHBondContact O-N 3.27Å; N200-F203 PolarHBondContact O-N 3.03Å; N200-L204 CarbonylContact O-C 3.4Å; N200-L204 PolarHBondContact O-N 3.5Å; N200-R205 PolarHBondContact O-N 2.88Å; N200-R205 PolarHBondContact OD1-N 2.93Å; N200-I206 PolarHBondContact ND2-O 2.79Å; N200-I206 PolarHBondContact OD1-N 3.09Å; N200-I206 PolarHBondContact OD1-O 2.94Å; N200-L208 HydrophobicContact CB-CD2 3.85Å; N200-L208 WeakPolarHBondContact ND2-CD2 3.3Å; N200-L304 HydrophobicContact CB-CD2 4.46Å
201	M	96.6	Very high	97.5	Very high	90 Å²	90	28.7 Å²	28.7	44%	0.443	15%	0.149	S	C	.	.	H	α-helix	trans	-62	-28	-177.2	-72.5	-55.3	-70.7	0	0	113.6	V163 D197 T198 R205	V163-M201 HydrophobicContact CG1-CB 3.79Å; D197-M201 WeakPolarHBondContact O-CB 3.46Å; D197-M201 WeakPolarHBondContact O-CG 3.16Å; D197-M201 PolarHBondContact O-N 2.95Å; D197-M201 WeakPolarHBondContact OD1-CG 3.46Å; T198-M201 PolarHBondContact O-N 3.28Å; M201-R205 WeakPolarHBondContact O-CG 3.47Å; M201-R205 PolarHBondContact O-NE 3.4Å
202	L	95.9	Very high	97.5	Very high	4 Å²	4	30.5 Å²	30.5	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-88.4	-37.6	176	-162.6	65.8	0	0	0	113.6	G156 R159 M160 T198 S199 N200 I442	G156-L202 WeakPolarHBondContact O-CD2 3.18Å; R159-L202 HydrophobicContact CB-CD1 4.03Å; M160-L202 HydrophobicContact CB-CD2 4.13Å; M160-L202 HydrophobicContact CE-CB 4.12Å; M160-L202 HydrophobicContact CE-CD2 3.23Å; M160-L202 HydrophobicContact CE-CG 4.29Å; M160-L202 HydrophobicContact CG-CD2 4.45Å; M160-L202 HydrophobicContact SD-CD2 3.86Å; T198-L202 PolarHBondContact O-N 3.06Å; T198-L202 VanDerWaalsContact O-N 3.12Å; S199-L202 PolarHBondContact O-N 3.16Å; N200-L202 PolarHBondContact O-N 3.27Å; L202-I442 HydrophobicContact CD2-CD1 3.99Å
203	F	97.8	Very high	97.5	Very high	10 Å²	10	30.1 Å²	30.1	4%	0.044	16%	0.163	C	C	.	.	H	α-helix	trans	-112.5	-20.5	-164.4	-55.3	-55.4	0	0	0	115.7	A151 L152 M160 S199 N200 F278 A279 M303 I442	A151-F203 HydrophobicContact CB-CD1 4.23Å; A151-F203 HydrophobicContact CB-CE1 4.14Å; L152-F203 HydrophobicContact CD2-CE1 4.03Å; L152-F203 HydrophobicContact CD2-CE2 4.29Å; L152-F203 HydrophobicContact CD2-CZ 3.49Å; L152-F203 VanDerWaalsContact CD2-CZ 3.49Å; M160-F203 HydrophobicContact CE-CE2 4.06Å; M160-F203 HydrophobicContact CE-CZ 3.98Å; S199-F203 VanDerWaalsContact O-CB 3.32Å; S199-F203 WeakPolarHBondContact O-CB 3.45Å; S199-F203 WeakPolarHBondContact O-CD2 3.32Å; S199-F203 PolarHBondContact O-N 3.07Å; N200-F203 PolarHBondContact O-N 3.03Å; F203-F278 HydrophobicContact CB-CB 3.96Å; F203-F278 HydrophobicContact CB-CD1 4.32Å; F203-F278 HydrophobicContact CD1-CB 3.91Å; F203-F278 HydrophobicContact CG-CB 4.34Å; F203-A279 WeakPolarHBondContact O-CB 3.45Å; F203-A279 PolarHBondContact O-N 3.34Å; F203-M303 HydrophobicContact CB-CG 3.9Å; F203-M303 HydrophobicContact CD1-CE 4.44Å; F203-M303 HydrophobicContact CD1-CG 4.31Å; F203-M303 HydrophobicContact CD1-SD 4.35Å; F203-M303 HydrophobicContact CD2-CG 3.44Å; F203-M303 VanDerWaalsContact CD2-CG 3.44Å; F203-M303 HydrophobicContact CD2-SD 3.81Å; F203-M303 HydrophobicContact CE1-CE 4.47Å; F203-M303 HydrophobicContact CE1-SD 4.29Å; F203-M303 HydrophobicContact CE2-CG 4.02Å; F203-M303 HydrophobicContact CE2-SD 3.75Å; F203-M303 HydrophobicContact CG-CG 3.62Å; F203-M303 HydrophobicContact CG-SD 4.14Å; F203-M303 HydrophobicContact CZ-SD 4Å; F203-I442 HydrophobicContact CZ-CD1 4.43Å
204	L	97.3	Very high	97.5	Very high	1 Å²	1	28.9 Å²	28.9	1%	0.005	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-132.4	-48.4	-173.7	179	60	0	0	0	113.5	N200 I206 L258 K262 A279 I300 L304	N200-L204 CarbonylContact O-C 3.4Å; N200-L204 PolarHBondContact O-N 3.5Å; L204-I206 HydrophobicContact CD1-CG1 4.04Å; L204-I206 HydrophobicContact CG-CB 4.19Å; L204-I206 HydrophobicContact CG-CG1 3.95Å; L204-L258 HydrophobicContact CD2-CB 3.99Å; L204-L258 HydrophobicContact CD2-CD1 4.18Å; L204-K262 HydrophobicContact CD1-CB 3.95Å; L204-K262 HydrophobicContact CD1-CD 4.26Å; L204-K262 HydrophobicContact CD1-CG 3.92Å; L204-K262 WeakPolarHBondContact O-CE 3.46Å; L204-K262 PolarHBondContact O-NZ 3.13Å; L204-A279 HydrophobicContact CD1-CB 3.71Å; L204-I300 HydrophobicContact CD1-CG2 4.39Å; L204-I300 HydrophobicContact CD2-CG2 4.32Å; L204-L304 HydrophobicContact CD2-CD1 3.86Å
205	R	95.3	Very high	97.5	Very high	87 Å²	87	33.3 Å²	33.3	33%	0.328	19%	0.185	S	C	.	.			trans	60.9	41.7	176.2	-59.8	173.4	178.9	174.1	-0	114.2	N200 M201	N200-R205 PolarHBondContact O-N 2.88Å; N200-R205 PolarHBondContact OD1-N 2.93Å; M201-R205 WeakPolarHBondContact O-CG 3.47Å; M201-R205 PolarHBondContact O-NE 3.4Å
206	I	97.4	Very high	97.5	Very high	5 Å²	5	36.5 Å²	36.5	3%	0.026	20%	0.199	C	C	.	.			trans	-113	131.4	174.6	-62	-54.7	0	0	0	108.5	N200 L204 L208 L258 E261 K262	N200-I206 PolarHBondContact ND2-O 2.79Å; N200-I206 PolarHBondContact OD1-N 3.09Å; N200-I206 PolarHBondContact OD1-O 2.94Å; L204-I206 HydrophobicContact CD1-CG1 4.04Å; L204-I206 HydrophobicContact CG-CB 4.19Å; L204-I206 HydrophobicContact CG-CG1 3.95Å; I206-L208 PolarHBondContact O-N 2.64Å; I206-L258 HydrophobicContact CG2-CB 4.27Å; I206-L258 HydrophobicContact CG2-CD2 3.91Å; I206-E261 HydrophobicContact CD1-CG 3.89Å; I206-E261 HydrophobicContact CG1-CG 4.48Å; I206-E261 HydrophobicContact CG2-CB 4.11Å; I206-E261 HydrophobicContact CG2-CG 3.81Å; I206-K262 HydrophobicContact CD1-CB 4.22Å; I206-K262 HydrophobicContact CD1-CD 4.08Å; I206-K262 HydrophobicContact CG1-CB 4.02Å; I206-K262 HydrophobicContact CG1-CD 4.27Å
207	P	96.8	Very high	97.4	Very high	97 Å²	97	36.6 Å²	36.6	63%	0.63	20%	0.2	S	C	*	.			trans	-53.9	132.7	174.1	-24.7	34.1	0	0	0	110.8
208	L	97.1	Very high	97.4	Very high	34 Å²	34	37.5 Å²	37.5	18%	0.178	20%	0.203	C	C	.	.			trans	-142.4	159.4	-178.2	62.4	79.5	0	0	0	110.6	L196 N200 I206 E210 I213 L258	L196-L208 HydrophobicContact CD2-CD1 3.85Å; L196-L208 HydrophobicContact CG-CD1 4.24Å; N200-L208 HydrophobicContact CB-CD2 3.85Å; N200-L208 WeakPolarHBondContact ND2-CD2 3.3Å; I206-L208 PolarHBondContact O-N 2.64Å; L208-E210 HydrophobicContact CD1-CB 4.26Å; L208-E210 HydrophobicContact CD1-CG 3.7Å; L208-E210 PolarHBondContact O-N 2.84Å; L208-I213 HydrophobicContact CD1-CG1 4.38Å; L208-L258 HydrophobicContact CB-CD1 4.01Å; L208-L258 HydrophobicContact CB-CD2 3.88Å; L208-L258 HydrophobicContact CD2-CD1 3.94Å
209	D	97.1	Very high	97.4	Very high	99 Å²	99	38.1 Å²	38.1	53%	0.529	21%	0.209	S	C	.	.			trans	-83.5	101.7	170.2	179.5	-18.3	0	0	0	109	S211 A212 I213	D209-S211 VanDerWaalsContact C-N 3.33Å; D209-S211 PolarHBondContact O-N 3.45Å; D209-S211 PolarHBondContact OD1-N 2.56Å; D209-S211 VanDerWaalsContact OD1-N 3.13Å; D209-A212 HydrophobicContact CB-CB 4.05Å; D209-A212 VanDerWaalsContact CG-CB 3.44Å; D209-A212 PolarHBondContact O-N 3.34Å; D209-A212 PolarHBondContact OD1-N 3.33Å; D209-A212 WeakPolarHBondContact OD2-CB 3.41Å; D209-I213 WeakPolarHBondContact O-CB 3.38Å; D209-I213 WeakPolarHBondContact O-CG1 3.46Å; D209-I213 PolarHBondContact O-N 3.44Å
210	E	96.4	Very high	97.5	Very high	42 Å²	42	38 Å²	38	20%	0.196	21%	0.209	C	C	.	.	H	α-helix	trans	-61	-42.5	-175.6	-64.8	175	-147.4	0	0	112.1	H171 L196 L208 I213 V214	H171-E210 IonicContact CE1-OE2 3.52Å; H171-E210 PolarHBondContact CE1-OE2 2.56Å; H171-E210 IonicContact NE2-OE2 3.88Å; H171-E210 PolarHBondContact NE2-OE2 3.42Å; L196-E210 HydrophobicContact CD2-CB 4.44Å; L208-E210 HydrophobicContact CD1-CB 4.26Å; L208-E210 HydrophobicContact CD1-CG 3.7Å; L208-E210 PolarHBondContact O-N 2.84Å; E210-I213 PolarHBondContact O-N 3.1Å; E210-V214 WeakPolarHBondContact O-CB 3.32Å; E210-V214 WeakPolarHBondContact O-CG2 3.35Å; E210-V214 PolarHBondContact O-N 3.48Å
211	S	96.1	Very high	97.5	Very high	48 Å²	48	38.9 Å²	38.9	34%	0.336	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-47.7	-177.6	-66.3	0	0	0	0	111.1	R193 D209 V215	R193-S211 PolarHBondContact NE-OG 2.89Å; R193-S211 PolarHBondContact NH2-OG 3.39Å; D209-S211 VanDerWaalsContact C-N 3.33Å; D209-S211 PolarHBondContact O-N 3.45Å; D209-S211 PolarHBondContact OD1-N 2.56Å; D209-S211 VanDerWaalsContact OD1-N 3.13Å; S211-V215 WeakPolarHBondContact O-CG2 3.43Å; S211-V215 PolarHBondContact O-N 3.44Å
212	A	97.9	Very high	97.6	Very high	37 Å²	37	38.6 Å²	38.6	31%	0.306	21%	0.212	S	C	.	.	H	α-helix	trans	-67.5	-40.5	179.9	0	0	0	0	0	112.2	D209 K216	D209-A212 HydrophobicContact CB-CB 4.05Å; D209-A212 VanDerWaalsContact CG-CB 3.44Å; D209-A212 PolarHBondContact O-N 3.34Å; D209-A212 PolarHBondContact OD1-N 3.33Å; D209-A212 WeakPolarHBondContact OD2-CB 3.41Å; A212-K216 VanDerWaalsContact O-CG 3.31Å; A212-K216 WeakPolarHBondContact O-CG 3.41Å; A212-K216 PolarHBondContact O-N 2.58Å
213	I	98.4	Very high	97.7	Very high	10 Å²	10	38.4 Å²	38.4	5%	0.051	21%	0.211	C	C	.	.	H	α-helix	trans	-69.5	-41.4	-179.6	-64.2	-66	0	0	0	110.9	L196 L208 D209 E210 V215 K216 I217 L251 A254	L196-I213 HydrophobicContact CD1-CG2 3.96Å; L196-I213 HydrophobicContact CD2-CB 3.68Å; L196-I213 HydrophobicContact CD2-CG2 3.52Å; L196-I213 HydrophobicContact CG-CG2 4.4Å; L208-I213 HydrophobicContact CD1-CG1 4.38Å; D209-I213 WeakPolarHBondContact O-CB 3.38Å; D209-I213 WeakPolarHBondContact O-CG1 3.46Å; D209-I213 PolarHBondContact O-N 3.44Å; E210-I213 PolarHBondContact O-N 3.1Å; I213-V215 VanDerWaalsContact C-N 3.33Å; I213-V215 PolarHBondContact O-N 2.75Å; I213-K216 HydrophobicContact CD1-CD 4.5Å; I213-K216 CarbonylContact O-C 3.59Å; I213-K216 WeakPolarHBondContact O-CB 3.21Å; I213-K216 PolarHBondContact O-N 3.34Å; I213-K216 VanDerWaalsContact O-N 3.1Å; I213-I217 HydrophobicContact CG2-CD1 3.8Å; I213-I217 HydrophobicContact CG2-CG1 4.11Å; I213-I217 VanDerWaalsContact O-CG1 3.3Å; I213-I217 WeakPolarHBondContact O-CG1 3.4Å; I213-I217 PolarHBondContact O-N 2.87Å; I213-L251 HydrophobicContact CG2-CD1 4.43Å; I213-A254 HydrophobicContact CD1-CB 3.59Å
214	V	98.4	Very high	97.7	Very high	5 Å²	5	39.1 Å²	39.1	3%	0.03	21%	0.214	C	C	.	.	H	α-helix	trans	-55.9	-46.7	176.6	164.9	0	0	0	0	111.6	R192 R193 L196 E210 K216 I217 Q218	R192-V214 HydrophobicContact CB-CG1 3.63Å; R192-V214 HydrophobicContact CB-CG2 4.11Å; R192-V214 HydrophobicContact CG-CG1 4.38Å; R193-V214 HydrophobicContact CG-CG2 4.17Å; L196-V214 HydrophobicContact CB-CG2 4.23Å; L196-V214 HydrophobicContact CD2-CG2 3.81Å; E210-V214 WeakPolarHBondContact O-CB 3.32Å; E210-V214 WeakPolarHBondContact O-CG2 3.35Å; E210-V214 PolarHBondContact O-N 3.48Å; V214-K216 VanDerWaalsContact C-N 3.31Å; V214-K216 PolarHBondContact O-N 3.12Å; V214-I217 WeakPolarHBondContact O-CB 3.25Å; V214-I217 PolarHBondContact O-N 2.76Å; V214-I217 VanDerWaalsContact O-N 3.16Å; V214-Q218 WeakPolarHBondContact O-CG 3.44Å; V214-Q218 PolarHBondContact O-N 3.01Å
215	V	98.2	Very high	97.7	Very high	94 Å²	94	40 Å²	40	57%	0.57	22%	0.218	S	C	*	.	H	α-helix	trans	-61.2	-40.5	177.5	174	0	0	0	0	111.7	S211 I213 Q218 G219	S211-V215 WeakPolarHBondContact O-CG2 3.43Å; S211-V215 PolarHBondContact O-N 3.44Å; I213-V215 VanDerWaalsContact C-N 3.33Å; I213-V215 PolarHBondContact O-N 2.75Å; V215-Q218 PolarHBondContact O-N 3.45Å; V215-G219 PolarHBondContact O-N 3.43Å
216	K	98.6	Very high	97.8	Very high	66 Å²	66	36.7 Å²	36.7	29%	0.287	21%	0.209	S	C	.	.	H	α-helix	trans	-67.6	-35.3	176.7	-71	169.8	173.9	-129.1	0	112.3	A212 I213 V214 G219 Y220 D250 L251 A254	A212-K216 VanDerWaalsContact O-CG 3.31Å; A212-K216 WeakPolarHBondContact O-CG 3.41Å; A212-K216 PolarHBondContact O-N 2.58Å; I213-K216 HydrophobicContact CD1-CD 4.5Å; I213-K216 CarbonylContact O-C 3.59Å; I213-K216 WeakPolarHBondContact O-CB 3.21Å; I213-K216 PolarHBondContact O-N 3.34Å; I213-K216 VanDerWaalsContact O-N 3.1Å; V214-K216 VanDerWaalsContact C-N 3.31Å; V214-K216 PolarHBondContact O-N 3.12Å; K216-G219 PolarHBondContact O-N 3.37Å; K216-Y220 WeakPolarHBondContact O-CB 3.4Å; K216-Y220 PolarHBondContact O-N 3.46Å; K216-D250 WeakPolarHBondContact CD-O 3.4Å; K216-D250 HydrophobicContact CG-CB 4.41Å; K216-D250 PolarHBondContact NZ-O 3.35Å; K216-L251 HydrophobicContact CB-CB 4.09Å; K216-L251 HydrophobicContact CB-CD1 3.75Å; K216-A254 HydrophobicContact CD-CB 4.01Å
217	I	98.6	Very high	97.8	Very high	3 Å²	3	36.4 Å²	36.4	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-64.1	-46.5	174.2	-67.8	176.4	0	0	0	110.3	L196 I213 V214 G219 Y220 F221 L251 I305 P308 D309	L196-I217 HydrophobicContact CD1-CD1 3.92Å; I213-I217 HydrophobicContact CG2-CD1 3.8Å; I213-I217 HydrophobicContact CG2-CG1 4.11Å; I213-I217 VanDerWaalsContact O-CG1 3.3Å; I213-I217 WeakPolarHBondContact O-CG1 3.4Å; I213-I217 PolarHBondContact O-N 2.87Å; V214-I217 WeakPolarHBondContact O-CB 3.25Å; V214-I217 PolarHBondContact O-N 2.76Å; V214-I217 VanDerWaalsContact O-N 3.16Å; I217-G219 VanDerWaalsContact C-N 3.33Å; I217-G219 PolarHBondContact O-N 3.01Å; I217-Y220 WeakPolarHBondContact O-CB 3.25Å; I217-Y220 PolarHBondContact O-N 3.15Å; I217-Y220 VanDerWaalsContact O-N 3.1Å; I217-F221 PolarHBondContact O-N 3.44Å; I217-L251 HydrophobicContact CG1-CD1 3.8Å; I217-L251 HydrophobicContact CG1-CD2 4.15Å; I217-I305 HydrophobicContact CB-CG2 4.38Å; I217-I305 HydrophobicContact CD1-CG2 4.13Å; I217-I305 HydrophobicContact CG1-CG2 3.84Å; I217-I305 HydrophobicContact CG2-CB 3.94Å; I217-I305 HydrophobicContact CG2-CG2 3.84Å; I217-P308 HydrophobicContact CD1-CB 4.48Å; I217-P308 HydrophobicContact CD1-CG 4.2Å; I217-P308 HydrophobicContact CG2-CB 4.22Å; I217-D309 WeakPolarHBondContact CG2-OD1 3.36Å
218	Q	98.1	Very high	97.9	Very high	46 Å²	46	31.9 Å²	31.9	22%	0.215	18%	0.178	C	C	.	.	H	α-helix	trans	-57.4	-46.7	174.9	-68.1	168.5	-70.8	0	0	111.3	V214 V215 Y220 F221 D222 E483	V214-Q218 WeakPolarHBondContact O-CG 3.44Å; V214-Q218 PolarHBondContact O-N 3.01Å; V215-Q218 PolarHBondContact O-N 3.45Å; Q218-Y220 VanDerWaalsContact C-N 3.3Å; Q218-Y220 PolarHBondContact O-N 2.93Å; Q218-F221 PolarHBondContact O-N 3Å; Q218-D222 PolarHBondContact O-N 3.14Å; Q218-E483 PolarHBondContact NE2-OE2 3.02Å
219	G	98.4	Very high	97.9	Very high	13 Å²	13	30.7 Å²	30.7	13%	0.134	17%	0.172	C	C	.	.	H	α-helix	trans	-62.3	-34.2	176	0	0	0	0	0	113.9	V215 K216 I217 A223 S247	V215-G219 PolarHBondContact O-N 3.43Å; K216-G219 PolarHBondContact O-N 3.37Å; I217-G219 VanDerWaalsContact C-N 3.33Å; I217-G219 PolarHBondContact O-N 3.01Å; G219-A223 PolarHBondContact O-N 3.01Å; G219-A223 VanDerWaalsContact O-N 3.13Å; G219-S247 WeakPolarHBondContact O-CB 3.45Å
220	Y	98.8	Very high	98	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.1	-41.7	173.4	-177.8	-88.2	0	0	0	111.8	I125 M127 K216 I217 Q218 A223 W224 V248 L251 Q298 L301 I305	I125-Y220 HydrophobicContact CB-CE2 4.3Å; I125-Y220 WeakPolarHBondContact O-CE2 3.21Å; I125-Y220 PolarHBondContact O-OH 3.3Å; M127-Y220 HydrophobicContact CE-CE1 3.74Å; M127-Y220 WeakPolarHBondContact CE-OH 3.26Å; K216-Y220 WeakPolarHBondContact O-CB 3.4Å; K216-Y220 PolarHBondContact O-N 3.46Å; I217-Y220 WeakPolarHBondContact O-CB 3.25Å; I217-Y220 PolarHBondContact O-N 3.15Å; I217-Y220 VanDerWaalsContact O-N 3.1Å; Q218-Y220 VanDerWaalsContact C-N 3.3Å; Q218-Y220 PolarHBondContact O-N 2.93Å; Y220-A223 WeakPolarHBondContact O-CB 3.37Å; Y220-A223 PolarHBondContact O-N 3.15Å; Y220-W224 WeakPolarHBondContact O-CB 3.47Å; Y220-W224 PolarHBondContact O-N 3.39Å; Y220-V248 HydrophobicContact CD2-CB 4.42Å; Y220-V248 HydrophobicContact CD2-CG1 4.38Å; Y220-V248 HydrophobicContact CD2-CG2 4.09Å; Y220-V248 HydrophobicContact CE2-CG1 4.16Å; Y220-V248 HydrophobicContact CE2-CG2 4.26Å; Y220-L251 VanDerWaalsContact CB-CD2 3.41Å; Y220-L251 HydrophobicContact CD1-CD2 4.23Å; Y220-L251 HydrophobicContact CD2-CB 4.49Å; Y220-L251 HydrophobicContact CD2-CD2 3.87Å; Y220-L251 HydrophobicContact CG-CD2 3.59Å; Y220-Q298 PolarHBondContact OH-NE2 3.39Å; Y220-L301 HydrophobicContact CE1-CD2 3.91Å; Y220-L301 HydrophobicContact CE2-CD1 4.28Å; Y220-L301 HydrophobicContact CE2-CD2 4.23Å; Y220-I305 HydrophobicContact CD1-CD1 3.87Å; Y220-I305 HydrophobicContact CE1-CD1 3.61Å
221	F	98.4	Very high	98	Very high	25 Å²	25	27.6 Å²	27.6	11%	0.11	16%	0.157	C	C	.	.	H	α-helix	trans	-62.1	-43	175.3	-176	-96.6	0	0	0	111.4	I217 Q218 A223 W224 Q225 D309 L477 S478	I217-F221 PolarHBondContact O-N 3.44Å; Q218-F221 PolarHBondContact O-N 3Å; F221-A223 VanDerWaalsContact C-N 3.32Å; F221-A223 PolarHBondContact O-N 2.91Å; F221-W224 AromaticContact CD2-CE3 3.56Å; F221-W224 HydrophobicContact CD2-CE3 3.56Å; F221-W224 AromaticContact CD2-CZ3 3.75Å; F221-W224 HydrophobicContact CD2-CZ3 3.75Å; F221-W224 AromaticContact CE2-CE3 3.86Å; F221-W224 HydrophobicContact CE2-CE3 3.86Å; F221-W224 AromaticContact CE2-CZ3 3.8Å; F221-W224 HydrophobicContact CE2-CZ3 3.8Å; F221-W224 PolarHBondContact O-N 3.1Å; F221-Q225 WeakPolarHBondContact O-CB 3.48Å; F221-Q225 PolarHBondContact O-N 2.98Å; F221-D309 HydrophobicContact CD2-CB 4.2Å; F221-L477 HydrophobicContact CE2-CD2 4.42Å; F221-S478 WeakPolarHBondContact CZ-OG 3.22Å
222	D	98.1	Very high	98	Very high	84 Å²	84	30 Å²	30	45%	0.449	17%	0.165	S	C	.	.	H	α-helix	trans	-57.8	-44.1	173.7	-75.7	-10.7	0	0	0	111.9	Q218 A226	Q218-D222 PolarHBondContact O-N 3.14Å; D222-A226 WeakPolarHBondContact O-CB 3.24Å; D222-A226 PolarHBondContact O-N 2.62Å
223	A	98.4	Very high	97.8	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-64.8	-43.7	176.2	0	0	0	0	0	112.1	G219 Y220 F221 L227 Y244 V248	G219-A223 PolarHBondContact O-N 3.01Å; G219-A223 VanDerWaalsContact O-N 3.13Å; Y220-A223 WeakPolarHBondContact O-CB 3.37Å; Y220-A223 PolarHBondContact O-N 3.15Å; F221-A223 VanDerWaalsContact C-N 3.32Å; F221-A223 PolarHBondContact O-N 2.91Å; A223-L227 VanDerWaalsContact O-CB 3.26Å; A223-L227 WeakPolarHBondContact O-CB 3.16Å; A223-L227 WeakPolarHBondContact O-CG 3.45Å; A223-L227 PolarHBondContact O-N 3.09Å; A223-Y244 HydrophobicContact CB-CD1 3.93Å; A223-Y244 HydrophobicContact CB-CG 4.24Å; A223-V248 HydrophobicContact CB-CG2 3.74Å
224	W	98.5	Very high	97.7	Very high	25 Å²	25	35 Å²	35	10%	0.095	19%	0.185	C	C	.	.	H	α-helix	trans	-60.9	-53.7	176.7	172.6	24.9	0	0	0	111.6	I125 M127 I133 F134 Y220 F221 A226 L227 L228 L477	I125-W224 HydrophobicContact CD1-CB 4.01Å; I125-W224 HydrophobicContact CD1-CG 3.84Å; M127-W224 HydrophobicContact CE-CD2 4.06Å; M127-W224 HydrophobicContact CE-CE3 4.3Å; M127-W224 HydrophobicContact CE-CG 4.41Å; M127-W224 HydrophobicContact CE-CZ2 4.38Å; M127-W224 HydrophobicContact SD-CD2 4.49Å; M127-W224 HydrophobicContact SD-CZ2 4.42Å; I133-W224 HydrophobicContact CG2-CH2 3.94Å; I133-W224 HydrophobicContact CG2-CZ2 3.74Å; F134-W224 AromaticContact CD2-CE2 3.87Å; F134-W224 AromaticContact CD2-CZ2 3.61Å; F134-W224 HydrophobicContact CD2-CZ2 3.61Å; F134-W224 AromaticContact CD2-NE1 3.57Å; F134-W224 AromaticContact CE2-CE2 3.85Å; F134-W224 AromaticContact CE2-CZ2 3.48Å; F134-W224 HydrophobicContact CE2-CZ2 3.48Å; F134-W224 VanDerWaalsContact CE2-CZ2 3.48Å; F134-W224 AromaticContact CE2-NE1 3.62Å; Y220-W224 WeakPolarHBondContact O-CB 3.47Å; Y220-W224 PolarHBondContact O-N 3.39Å; F221-W224 AromaticContact CD2-CE3 3.56Å; F221-W224 HydrophobicContact CD2-CE3 3.56Å; F221-W224 AromaticContact CD2-CZ3 3.75Å; F221-W224 HydrophobicContact CD2-CZ3 3.75Å; F221-W224 AromaticContact CE2-CE3 3.86Å; F221-W224 HydrophobicContact CE2-CE3 3.86Å; F221-W224 AromaticContact CE2-CZ3 3.8Å; F221-W224 HydrophobicContact CE2-CZ3 3.8Å; F221-W224 PolarHBondContact O-N 3.1Å; W224-A226 PolarHBondContact O-N 2.62Å; W224-L227 PolarHBondContact O-N 3.44Å; W224-L228 VanDerWaalsContact O-CB 3.31Å; W224-L228 WeakPolarHBondContact O-CB 3.45Å; W224-L228 PolarHBondContact O-N 3.48Å; W224-L228 VanDerWaalsContact O-N 3.08Å; W224-L477 HydrophobicContact CD2-CD2 3.87Å; W224-L477 HydrophobicContact CE3-CD2 4.35Å; W224-L477 HydrophobicContact CG-CD2 4.22Å; W224-L477 HydrophobicContact CZ2-CD2 4.13Å
225	Q	97.6	Very high	97.6	Very high	19 Å²	19	35.8 Å²	35.8	9%	0.089	19%	0.188	C	C	.	.	H	α-helix	trans	-56.8	-49.7	177.3	175.8	166.9	-84.5	0	0	111.3	F221 L227 D476 L477 H480	F221-Q225 WeakPolarHBondContact O-CB 3.48Å; F221-Q225 PolarHBondContact O-N 2.98Å; Q225-L227 PolarHBondContact O-N 3.44Å; Q225-D476 HydrophobicContact CG-CB 4.19Å; Q225-D476 WeakPolarHBondContact CG-OD2 3.36Å; Q225-L477 HydrophobicContact CB-CB 4.1Å; Q225-L477 HydrophobicContact CB-CD2 4.23Å; Q225-L477 HydrophobicContact CG-CB 3.77Å; Q225-H480 PolarHBondContact OE1-CE1 2.9Å
226	A	97.2	Very high	97.4	Very high	18 Å²	18	39.9 Å²	39.9	15%	0.149	20%	0.198	C	C	.	.	H	α-helix	trans	-65.2	-37.6	-175.5	0	0	0	0	0	113.4	D222 W224 K230 Y244	D222-A226 WeakPolarHBondContact O-CB 3.24Å; D222-A226 PolarHBondContact O-N 2.62Å; W224-A226 PolarHBondContact O-N 2.62Å; A226-K230 WeakPolarHBondContact O-CE 3.48Å; A226-K230 WeakPolarHBondContact O-CG 3.46Å; A226-Y244 HydrophobicContact CB-CD1 4.12Å; A226-Y244 HydrophobicContact CB-CD2 4.44Å; A226-Y244 HydrophobicContact CB-CE1 3.48Å; A226-Y244 VanDerWaalsContact CB-CE1 3.48Å; A226-Y244 HydrophobicContact CB-CE2 3.88Å; A226-Y244 WeakPolarHBondContact CB-OH 3.24Å
227	L	98	Very high	97.2	Very high	0 Å²	0	40 Å²	40	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-92.8	-15.3	-172.6	-61.1	179.4	0	0	0	113.8	C124 I125 A223 W224 Q225 I229 K230 F234 F235 Y244	C124-L227 HydrophobicContact CB-CD1 4.08Å; I125-L227 HydrophobicContact CG2-CD1 4.25Å; A223-L227 VanDerWaalsContact O-CB 3.26Å; A223-L227 WeakPolarHBondContact O-CB 3.16Å; A223-L227 WeakPolarHBondContact O-CG 3.45Å; A223-L227 PolarHBondContact O-N 3.09Å; W224-L227 PolarHBondContact O-N 3.44Å; Q225-L227 PolarHBondContact O-N 3.44Å; L227-I229 VanDerWaalsContact C-N 3.29Å; L227-I229 PolarHBondContact O-N 3.49Å; L227-K230 PolarHBondContact O-N 3.24Å; L227-F234 HydrophobicContact CD2-CD1 4.33Å; L227-F234 HydrophobicContact CD2-CE1 3.64Å; L227-F235 HydrophobicContact CB-CZ 4.3Å; L227-F235 HydrophobicContact CD2-CE1 3.92Å; L227-F235 HydrophobicContact CD2-CZ 4.07Å; L227-Y244 HydrophobicContact CD1-CG 4.49Å; L227-Y244 HydrophobicContact CD2-CD2 3.87Å; L227-Y244 HydrophobicContact CD2-CG 4.39Å; L227-Y244 HydrophobicContact CG-CD2 4.3Å; L227-Y244 HydrophobicContact CG-CG 4.35Å
228	L	98.2	Very high	96.8	Very high	1 Å²	1	42 Å²	42	1%	0.005	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-37.7	-168.6	-174.3	63	0	0	0	114.1	I70 G117 S118 L122 F134 W224 M374 L477	I70-L228 HydrophobicContact CD1-CD2 4.47Å; G117-L228 CarbonylContact C-O 3.52Å; G117-L228 VanDerWaalsContact CA-O 3.3Å; G117-L228 WeakPolarHBondContact CA-O 3.46Å; S118-L228 PolarHBondContact N-O 2.92Å; L122-L228 HydrophobicContact CD2-CD1 3.74Å; F134-L228 HydrophobicContact CD1-CD1 3.89Å; F134-L228 HydrophobicContact CE1-CD1 3.7Å; F134-L228 HydrophobicContact CE1-CD2 4.11Å; F134-L228 HydrophobicContact CE1-CG 4.43Å; F134-L228 HydrophobicContact CE2-CD1 4.41Å; F134-L228 HydrophobicContact CE2-CD2 4.35Å; F134-L228 HydrophobicContact CG-CD1 4.34Å; F134-L228 HydrophobicContact CZ-CD1 3.98Å; F134-L228 HydrophobicContact CZ-CD2 3.73Å; F134-L228 HydrophobicContact CZ-CG 4.48Å; W224-L228 VanDerWaalsContact O-CB 3.31Å; W224-L228 WeakPolarHBondContact O-CB 3.45Å; W224-L228 PolarHBondContact O-N 3.48Å; W224-L228 VanDerWaalsContact O-N 3.08Å; L228-M374 HydrophobicContact CD2-CE 4.1Å; L228-M374 HydrophobicContact CD2-SD 3.69Å; L228-M374 HydrophobicContact CG-CE 4.47Å; L228-L477 HydrophobicContact CD2-CD1 3.48Å; L228-L477 VanDerWaalsContact CD2-CD1 3.48Å; L228-L477 HydrophobicContact CD2-CD2 4.19Å; L228-L477 HydrophobicContact CD2-CG 4.44Å
229	I	97.6	Very high	96.5	Very high	9 Å²	9	49.4 Å²	49.4	5%	0.046	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-124.7	18.5	-177	61.5	157.2	0	0	0	112.9	H62 F65 L66 I70 I89 L227 M374	H62-I229 PolarHBondContact NE2-O 3.19Å; F65-I229 HydrophobicContact CB-CD1 3.87Å; F65-I229 HydrophobicContact CD1-CD1 4.43Å; L66-I229 HydrophobicContact CD2-CD1 4.21Å; L66-I229 HydrophobicContact CD2-CG1 4.2Å; I70-I229 HydrophobicContact CD1-CD1 4.09Å; I70-I229 HydrophobicContact CD1-CG1 4.25Å; I70-I229 HydrophobicContact CD1-CG2 4.25Å; I70-I229 HydrophobicContact CG1-CD1 3.65Å; I70-I229 HydrophobicContact CG1-CG1 4.35Å; I89-I229 HydrophobicContact CG2-CB 4.12Å; I89-I229 HydrophobicContact CG2-CG2 4.3Å; L227-I229 VanDerWaalsContact C-N 3.29Å; L227-I229 PolarHBondContact O-N 3.49Å; I229-M374 HydrophobicContact CG2-CE 4.27Å
230	K	97.3	Very high	96.3	Very high	45 Å²	45	52.8 Å²	52.8	20%	0.196	26%	0.256	C	S	.	.			trans	-68.9	137.5	177.4	-69.8	-72.8	176	-173.7	0	110.3	L66 S118 A226 L227 F234 F235	L66-K230 HydrophobicContact CD2-CD 3.94Å; S118-K230 WeakPolarHBondContact CB-O 3.32Å; S118-K230 PolarHBondContact OG-O 3.19Å; A226-K230 WeakPolarHBondContact O-CE 3.48Å; A226-K230 WeakPolarHBondContact O-CG 3.46Å; L227-K230 PolarHBondContact O-N 3.24Å; K230-F234 HydrophobicContact CB-CB 4.07Å; K230-F234 HydrophobicContact CB-CD1 3.89Å; K230-F234 HydrophobicContact CB-CG 4.01Å; K230-F234 HydrophobicContact CD-CD1 4.29Å; K230-F234 HydrophobicContact CD-CD2 3.9Å; K230-F234 HydrophobicContact CD-CE1 4.41Å; K230-F234 HydrophobicContact CD-CE2 4.04Å; K230-F234 HydrophobicContact CD-CG 4.04Å; K230-F234 HydrophobicContact CD-CZ 4.31Å; K230-F234 HydrophobicContact CG-CD1 3.97Å; K230-F234 HydrophobicContact CG-CD2 4.48Å; K230-F234 HydrophobicContact CG-CE1 4.15Å; K230-F234 HydrophobicContact CG-CG 4.15Å; K230-F235 HydrophobicContact CB-CE2 3.82Å; K230-F235 HydrophobicContact CB-CZ 4.16Å
231	P	96.8	Very high	96	Very high	32 Å²	32	55 Å²	55	21%	0.208	26%	0.264	C	S	.	.			trans	-67.6	153.2	175.6	29.3	-35	0	0	0	110.5	L66 I233 F234	L66-P231 HydrophobicContact CD1-CG 4.46Å; P231-I233 HydrophobicContact CB-CG2 4.14Å; P231-I233 HydrophobicContact CG-CG2 3.93Å; P231-I233 PolarHBondContact O-N 2.92Å; P231-F234 WeakPolarHBondContact O-CB 3.46Å; P231-F234 PolarHBondContact O-N 3.08Å
232	D	96	Very high	95.8	Very high	97 Å²	97	59.3 Å²	59.3	52%	0.519	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-57.4	-28.6	-176.3	-67.4	-8.5	0	0	0	113.6	L120 F234 F235	L120-D232 HydrophobicContact CD1-CB 4.02Å; D232-F234 PolarHBondContact O-N 2.88Å; D232-F235 PolarHBondContact O-N 3.33Å
233	I	94.5	Very high	95.7	Very high	124 Å²	124	62.4 Å²	62.4	64%	0.636	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	-60.2	-29.6	175.5	-161.8	163.3	0	0	0	112.9	P231 F235 K236	P231-I233 HydrophobicContact CB-CG2 4.14Å; P231-I233 HydrophobicContact CG-CG2 3.93Å; P231-I233 PolarHBondContact O-N 2.92Å; I233-F235 VanDerWaalsContact C-N 3.27Å; I233-F235 PolarHBondContact O-N 2.95Å; I233-K236 WeakPolarHBondContact O-CB 3.43Å; I233-K236 PolarHBondContact O-N 3.35Å
234	F	95.8	Very high	95.6	Very high	28 Å²	28	65 Å²	65	12%	0.123	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-61.7	-37.7	175.4	-177.4	-96.5	0	0	0	111.5	L227 K230 P231 D232 K236 I237 L240 Y244	L227-F234 HydrophobicContact CD2-CD1 4.33Å; L227-F234 HydrophobicContact CD2-CE1 3.64Å; K230-F234 HydrophobicContact CB-CB 4.07Å; K230-F234 HydrophobicContact CB-CD1 3.89Å; K230-F234 HydrophobicContact CB-CG 4.01Å; K230-F234 HydrophobicContact CD-CD1 4.29Å; K230-F234 HydrophobicContact CD-CD2 3.9Å; K230-F234 HydrophobicContact CD-CE1 4.41Å; K230-F234 HydrophobicContact CD-CE2 4.04Å; K230-F234 HydrophobicContact CD-CG 4.04Å; K230-F234 HydrophobicContact CD-CZ 4.31Å; K230-F234 HydrophobicContact CG-CD1 3.97Å; K230-F234 HydrophobicContact CG-CD2 4.48Å; K230-F234 HydrophobicContact CG-CE1 4.15Å; K230-F234 HydrophobicContact CG-CG 4.15Å; P231-F234 WeakPolarHBondContact O-CB 3.46Å; P231-F234 PolarHBondContact O-N 3.08Å; D232-F234 PolarHBondContact O-N 2.88Å; F234-K236 VanDerWaalsContact C-N 3.28Å; F234-K236 PolarHBondContact O-N 2.91Å; F234-I237 PolarHBondContact O-N 3.37Å; F234-L240 HydrophobicContact CD2-CD2 3.42Å; F234-L240 VanDerWaalsContact CD2-CD2 3.42Å; F234-L240 HydrophobicContact CD2-CG 4.07Å; F234-L240 HydrophobicContact CE2-CB 4.38Å; F234-L240 HydrophobicContact CE2-CD1 4.5Å; F234-L240 HydrophobicContact CE2-CD2 3.26Å; F234-L240 HydrophobicContact CE2-CG 3.43Å; F234-L240 VanDerWaalsContact CE2-CG 3.43Å; F234-L240 HydrophobicContact CG-CD2 4.38Å; F234-L240 HydrophobicContact CZ-CB 4.47Å; F234-L240 HydrophobicContact CZ-CD2 4.13Å; F234-L240 HydrophobicContact CZ-CG 3.83Å; F234-Y244 HydrophobicContact CZ-CE2 4.5Å
235	F	96.1	Very high	95.5	Very high	23 Å²	23	68.2 Å²	68.2	10%	0.101	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-80.4	-6.8	-179.1	-61.1	-85.9	0	0	0	113.3	S118 L120 G121 L227 K230 D232 I233 I237 Y241	S118-F235 WeakPolarHBondContact OG-CE2 3.49Å; L120-F235 HydrophobicContact CB-CB 4.42Å; L120-F235 HydrophobicContact CB-CD1 4.06Å; L120-F235 HydrophobicContact CB-CD2 3.75Å; L120-F235 HydrophobicContact CB-CE1 4.24Å; L120-F235 HydrophobicContact CB-CE2 3.95Å; L120-F235 HydrophobicContact CB-CG 3.81Å; L120-F235 HydrophobicContact CB-CZ 4.19Å; L120-F235 HydrophobicContact CD1-CB 3.84Å; L120-F235 HydrophobicContact CD1-CD2 3.95Å; L120-F235 HydrophobicContact CD1-CG 4.02Å; G121-F235 VanDerWaalsContact CA-CZ 3.46Å; L227-F235 HydrophobicContact CB-CZ 4.3Å; L227-F235 HydrophobicContact CD2-CE1 3.92Å; L227-F235 HydrophobicContact CD2-CZ 4.07Å; K230-F235 HydrophobicContact CB-CE2 3.82Å; K230-F235 HydrophobicContact CB-CZ 4.16Å; D232-F235 PolarHBondContact O-N 3.33Å; I233-F235 VanDerWaalsContact C-N 3.27Å; I233-F235 PolarHBondContact O-N 2.95Å; F235-I237 VanDerWaalsContact C-N 3.34Å; F235-Y241 HydrophobicContact CB-CE1 4.38Å; F235-Y241 HydrophobicContact CD1-CD1 4.27Å; F235-Y241 HydrophobicContact CD1-CE1 4.44Å; F235-Y241 HydrophobicContact CD1-CG 4.33Å; F235-Y241 WeakPolarHBondContact O-CE1 3.43Å
236	K	94.3	Very high	95.5	Very high	180 Å²	180	73.9 Å²	73.9	78%	0.783	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-76.1	-25.8	170.1	-64.7	-64.7	-176.5	-179.1	0	112.1	I233 F234 S238	I233-K236 WeakPolarHBondContact O-CB 3.43Å; I233-K236 PolarHBondContact O-N 3.35Å; F234-K236 VanDerWaalsContact C-N 3.28Å; F234-K236 PolarHBondContact O-N 2.91Å; K236-S238 PolarHBondContact O-N 3.22Å
237	I	94.1	Very high	95.6	Very high	69 Å²	69	74.3 Å²	74.3	35%	0.354	35%	0.345	S	S	.	.	S	Bend	trans	-100.5	85.4	-177.4	-51.1	177.5	0	0	0	109	F234 F235 W239 L240	F234-I237 PolarHBondContact O-N 3.37Å; F235-I237 VanDerWaalsContact C-N 3.34Å; I237-W239 VanDerWaalsContact C-N 3.34Å; I237-W239 HydrophobicContact CG2-CD2 3.73Å; I237-W239 HydrophobicContact CG2-CE3 4.28Å; I237-W239 HydrophobicContact CG2-CG 4.24Å; I237-W239 HydrophobicContact CG2-CH2 4.01Å; I237-W239 HydrophobicContact CG2-CZ2 3.41Å; I237-W239 VanDerWaalsContact CG2-CZ2 3.41Å; I237-W239 HydrophobicContact CG2-CZ3 4.4Å; I237-W239 PolarHBondContact O-N 3.15Å; I237-L240 HydrophobicContact CB-CB 4.45Å; I237-L240 HydrophobicContact CG2-CB 4.31Å; I237-L240 VanDerWaalsContact O-CB 3.29Å; I237-L240 WeakPolarHBondContact O-CB 3.41Å; I237-L240 PolarHBondContact O-N 3.15Å
238	S	90.4	Very high	95.6	Very high	45 Å²	45	74.5 Å²	74.5	32%	0.315	35%	0.347	S	S	.	.	H	α-helix	trans	-57	-38.4	-167.2	66.8	0	0	0	0	115.3	K236 L240 Y241 K242	K236-S238 PolarHBondContact O-N 3.22Å; S238-L240 PolarHBondContact O-N 3.39Å; S238-L240 VanDerWaalsContact O-N 3.09Å; S238-Y241 VanDerWaalsContact CA-CE1 3.46Å; S238-Y241 PolarHBondContact O-N 2.7Å; S238-K242 VanDerWaalsContact O-CG 3.28Å; S238-K242 WeakPolarHBondContact O-CG 3.3Å; S238-K242 PolarHBondContact O-N 3.49Å; S238-K242 VanDerWaalsContact O-N 3.09Å
239	W	93.3	Very high	95.6	Very high	201 Å²	201	79.9 Å²	79.9	76%	0.761	37%	0.37	S	S	*	.	H	α-helix	trans	-62.3	-20.8	180	65.7	70.4	0	0	0	113.6	I237	I237-W239 VanDerWaalsContact C-N 3.34Å; I237-W239 HydrophobicContact CG2-CD2 3.73Å; I237-W239 HydrophobicContact CG2-CE3 4.28Å; I237-W239 HydrophobicContact CG2-CG 4.24Å; I237-W239 HydrophobicContact CG2-CH2 4.01Å; I237-W239 HydrophobicContact CG2-CZ2 3.41Å; I237-W239 VanDerWaalsContact CG2-CZ2 3.41Å; I237-W239 HydrophobicContact CG2-CZ3 4.4Å; I237-W239 PolarHBondContact O-N 3.15Å
240	L	92.4	Very high	95.7	Very high	83 Å²	83	82.2 Å²	82.2	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-77.9	-24.9	-177.3	-164.2	61.1	0	0	0	112.6	F234 I237 S238	F234-L240 HydrophobicContact CD2-CD2 3.42Å; F234-L240 VanDerWaalsContact CD2-CD2 3.42Å; F234-L240 HydrophobicContact CD2-CG 4.07Å; F234-L240 HydrophobicContact CE2-CB 4.38Å; F234-L240 HydrophobicContact CE2-CD1 4.5Å; F234-L240 HydrophobicContact CE2-CD2 3.26Å; F234-L240 HydrophobicContact CE2-CG 3.43Å; F234-L240 VanDerWaalsContact CE2-CG 3.43Å; F234-L240 HydrophobicContact CG-CD2 4.38Å; F234-L240 HydrophobicContact CZ-CB 4.47Å; F234-L240 HydrophobicContact CZ-CD2 4.13Å; F234-L240 HydrophobicContact CZ-CG 3.83Å; I237-L240 HydrophobicContact CB-CB 4.45Å; I237-L240 HydrophobicContact CG2-CB 4.31Å; I237-L240 VanDerWaalsContact O-CB 3.29Å; I237-L240 WeakPolarHBondContact O-CB 3.41Å; I237-L240 PolarHBondContact O-N 3.15Å; S238-L240 PolarHBondContact O-N 3.39Å; S238-L240 VanDerWaalsContact O-N 3.09Å
241	Y	94.1	Very high	95.7	Very high	46 Å²	46	80.1 Å²	80.1	18%	0.18	37%	0.373	C	S	.	.	H	α-helix	trans	-117.4	-9.5	-178.1	76.7	-98.1	0	0	0	114.8	F235 S238 K243 Y244 E245	F235-Y241 HydrophobicContact CB-CE1 4.38Å; F235-Y241 HydrophobicContact CD1-CD1 4.27Å; F235-Y241 HydrophobicContact CD1-CE1 4.44Å; F235-Y241 HydrophobicContact CD1-CG 4.33Å; F235-Y241 WeakPolarHBondContact O-CE1 3.43Å; S238-Y241 VanDerWaalsContact CA-CE1 3.46Å; S238-Y241 PolarHBondContact O-N 2.7Å; Y241-K243 PolarHBondContact O-N 3.47Å; Y241-K243 VanDerWaalsContact O-N 3.1Å; Y241-Y244 WeakPolarHBondContact O-CB 3.32Å; Y241-Y244 PolarHBondContact O-N 3.31Å; Y241-E245 HydrophobicContact CD2-CB 4.5Å; Y241-E245 WeakPolarHBondContact CE2-OE2 3.21Å; Y241-E245 PolarHBondContact O-N 3.32Å; Y241-E245 VanDerWaalsContact O-N 3.11Å
242	K	93.8	Very high	95.8	Very high	116 Å²	116	81.3 Å²	81.3	50%	0.504	38%	0.375	S	S	.	.	H	α-helix	trans	-51.9	-32.7	176.3	-87.2	175.7	-172	-175.7	0	114.1	S238 Y244 E245 K246	S238-K242 VanDerWaalsContact O-CG 3.28Å; S238-K242 WeakPolarHBondContact O-CG 3.3Å; S238-K242 PolarHBondContact O-N 3.49Å; S238-K242 VanDerWaalsContact O-N 3.09Å; K242-Y244 VanDerWaalsContact C-N 3.33Å; K242-Y244 PolarHBondContact O-N 3.24Å; K242-E245 PolarHBondContact O-N 2.78Å; K242-K246 PolarHBondContact O-N 3.18Å
243	K	94.8	Very high	95.9	Very high	149 Å²	149	80 Å²	80	65%	0.648	37%	0.368	S	S	*	.	H	α-helix	trans	-56.3	-49.2	174	179.3	-175.5	172.6	-173.1	0	110.9	Y241 K246 S247	Y241-K243 PolarHBondContact O-N 3.47Å; Y241-K243 VanDerWaalsContact O-N 3.1Å; K243-K246 PolarHBondContact O-N 2.89Å; K243-S247 PolarHBondContact O-N 3.22Å; K243-S247 PolarHBondContact O-OG 3.2Å
244	Y	97.3	Very high	96.1	Very high	54 Å²	54	75 Å²	75	21%	0.212	35%	0.345	C	S	.	.	H	α-helix	trans	-70.2	-38.6	-179	-58.7	-61.6	0	0	0	111.9	A223 A226 L227 F234 Y241 K242 K246 S247 V248	A223-Y244 HydrophobicContact CB-CD1 3.93Å; A223-Y244 HydrophobicContact CB-CG 4.24Å; A226-Y244 HydrophobicContact CB-CD1 4.12Å; A226-Y244 HydrophobicContact CB-CD2 4.44Å; A226-Y244 HydrophobicContact CB-CE1 3.48Å; A226-Y244 VanDerWaalsContact CB-CE1 3.48Å; A226-Y244 HydrophobicContact CB-CE2 3.88Å; A226-Y244 WeakPolarHBondContact CB-OH 3.24Å; L227-Y244 HydrophobicContact CD1-CG 4.49Å; L227-Y244 HydrophobicContact CD2-CD2 3.87Å; L227-Y244 HydrophobicContact CD2-CG 4.39Å; L227-Y244 HydrophobicContact CG-CD2 4.3Å; L227-Y244 HydrophobicContact CG-CG 4.35Å; F234-Y244 HydrophobicContact CZ-CE2 4.5Å; Y241-Y244 WeakPolarHBondContact O-CB 3.32Å; Y241-Y244 PolarHBondContact O-N 3.31Å; K242-Y244 VanDerWaalsContact C-N 3.33Å; K242-Y244 PolarHBondContact O-N 3.24Å; Y244-K246 VanDerWaalsContact C-N 3.27Å; Y244-K246 PolarHBondContact O-N 3.37Å; Y244-S247 PolarHBondContact O-N 2.96Å; Y244-V248 VanDerWaalsContact O-CG2 3.31Å; Y244-V248 WeakPolarHBondContact O-CG2 3.29Å; Y244-V248 PolarHBondContact O-N 3.48Å
245	E	96.8	Very high	96.2	Very high	94 Å²	94	73.8 Å²	73.8	44%	0.439	34%	0.34	S	S	.	.	H	α-helix	trans	-59.6	-40.1	174.9	-169.7	176.8	179.4	0	0	111.7	Y241 K242 V248 K249	Y241-E245 HydrophobicContact CD2-CB 4.5Å; Y241-E245 WeakPolarHBondContact CE2-OE2 3.21Å; Y241-E245 PolarHBondContact O-N 3.32Å; Y241-E245 VanDerWaalsContact O-N 3.11Å; K242-E245 PolarHBondContact O-N 2.78Å; E245-V248 PolarHBondContact O-N 3.12Å; E245-K249 WeakPolarHBondContact O-CB 3.16Å; E245-K249 PolarHBondContact O-N 2.87Å
246	K	97.9	Very high	96.3	Very high	137 Å²	137	75.9 Å²	75.9	60%	0.596	35%	0.35	S	S	*	.	H	α-helix	trans	-62.5	-49.8	173.6	-172.7	-177.4	176.4	-176.5	0	111.7	K242 K243 Y244 V248 K249 D250	K242-K246 PolarHBondContact O-N 3.18Å; K243-K246 PolarHBondContact O-N 2.89Å; Y244-K246 VanDerWaalsContact C-N 3.27Å; Y244-K246 PolarHBondContact O-N 3.37Å; K246-V248 VanDerWaalsContact C-N 3.27Å; K246-V248 PolarHBondContact O-N 2.87Å; K246-K249 PolarHBondContact O-N 3.11Å; K246-K249 VanDerWaalsContact O-N 3.12Å; K246-D250 WeakPolarHBondContact O-CB 3.36Å; K246-D250 VanDerWaalsContact O-CG 3.26Å; K246-D250 PolarHBondContact O-N 3.29Å
247	S	98.2	Very high	96.4	Very high	27 Å²	27	72.1 Å²	72.1	19%	0.189	34%	0.342	C	S	.	.	H	α-helix	trans	-58.2	-40.2	177.9	-60.3	0	0	0	0	112.4	G219 K243 Y244 D250 L251	G219-S247 WeakPolarHBondContact O-CB 3.45Å; K243-S247 PolarHBondContact O-N 3.22Å; K243-S247 PolarHBondContact O-OG 3.2Å; Y244-S247 PolarHBondContact O-N 2.96Å; S247-D250 PolarHBondContact O-N 2.87Å; S247-L251 PolarHBondContact O-N 2.86Å
248	V	98.4	Very high	96.7	Very high	5 Å²	5	69.5 Å²	69.5	3%	0.03	33%	0.329	C	S	.	.	H	α-helix	trans	-63.4	-46.6	175	171.2	0	0	0	0	111.4	C124 I125 Y220 A223 Y244 E245 K246 L251 K252	C124-V248 WeakPolarHBondContact O-CG1 3.38Å; I125-V248 HydrophobicContact CB-CG2 4.33Å; I125-V248 HydrophobicContact CG2-CG2 3.88Å; Y220-V248 HydrophobicContact CD2-CB 4.42Å; Y220-V248 HydrophobicContact CD2-CG1 4.38Å; Y220-V248 HydrophobicContact CD2-CG2 4.09Å; Y220-V248 HydrophobicContact CE2-CG1 4.16Å; Y220-V248 HydrophobicContact CE2-CG2 4.26Å; A223-V248 HydrophobicContact CB-CG2 3.74Å; Y244-V248 VanDerWaalsContact O-CG2 3.31Å; Y244-V248 WeakPolarHBondContact O-CG2 3.29Å; Y244-V248 PolarHBondContact O-N 3.48Å; E245-V248 PolarHBondContact O-N 3.12Å; K246-V248 VanDerWaalsContact C-N 3.27Å; K246-V248 PolarHBondContact O-N 2.87Å; V248-L251 PolarHBondContact O-N 2.72Å; V248-K252 HydrophobicContact CG1-CD 3.78Å; V248-K252 HydrophobicContact CG1-CG 4.31Å; V248-K252 WeakPolarHBondContact O-CB 3.46Å; V248-K252 WeakPolarHBondContact O-CG 3.31Å; V248-K252 PolarHBondContact O-N 3.19Å
249	K	98.3	Very high	97	Very high	114 Å²	114	67.4 Å²	67.4	50%	0.496	31%	0.314	S	S	.	.	H	α-helix	trans	-61.3	-45	177.6	179.1	170.3	173.6	52	0	111.3	E245 K246 L251 K252 D253	E245-K249 WeakPolarHBondContact O-CB 3.16Å; E245-K249 PolarHBondContact O-N 2.87Å; K246-K249 PolarHBondContact O-N 3.11Å; K246-K249 VanDerWaalsContact O-N 3.12Å; K249-L251 VanDerWaalsContact C-N 3.3Å; K249-L251 PolarHBondContact O-N 3Å; K249-K252 PolarHBondContact O-N 2.82Å; K249-D253 VanDerWaalsContact CE-OD2 3.26Å; K249-D253 WeakPolarHBondContact CE-OD2 3.1Å; K249-D253 VanDerWaalsContact CG-OD2 3.31Å; K249-D253 WeakPolarHBondContact CG-OD2 3.2Å; K249-D253 VanDerWaalsContact NZ-CG 3.33Å; K249-D253 IonicContact NZ-OD1 2.98Å; K249-D253 PolarHBondContact NZ-OD1 3.26Å; K249-D253 VanDerWaalsContact NZ-OD1 3.16Å; K249-D253 IonicContact NZ-OD2 3.89Å; K249-D253 PolarHBondContact NZ-OD2 3.35Å; K249-D253 WeakPolarHBondContact O-CB 3.42Å; K249-D253 VanDerWaalsContact O-CG 3.25Å; K249-D253 PolarHBondContact O-N 2.71Å
250	D	98.5	Very high	97.2	Very high	58 Å²	58	59.9 Å²	59.9	31%	0.31	29%	0.294	S	S	.	.	H	α-helix	trans	-58.9	-39.7	-177.6	-73.1	-22.3	0	0	0	112.3	K216 K246 S247 A254	K216-D250 WeakPolarHBondContact CD-O 3.4Å; K216-D250 HydrophobicContact CG-CB 4.41Å; K216-D250 PolarHBondContact NZ-O 3.35Å; K246-D250 WeakPolarHBondContact O-CB 3.36Å; K246-D250 VanDerWaalsContact O-CG 3.26Å; K246-D250 PolarHBondContact O-N 3.29Å; S247-D250 PolarHBondContact O-N 2.87Å; D250-A254 WeakPolarHBondContact O-CB 3.36Å; D250-A254 PolarHBondContact O-N 2.91Å
251	L	98.6	Very high	97.5	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-75.6	-46	174.9	-176.2	64	0	0	0	112.2	I213 K216 I217 Y220 S247 V248 K249 D253 A254 I255 L301 I305	I213-L251 HydrophobicContact CG2-CD1 4.43Å; K216-L251 HydrophobicContact CB-CB 4.09Å; K216-L251 HydrophobicContact CB-CD1 3.75Å; I217-L251 HydrophobicContact CG1-CD1 3.8Å; I217-L251 HydrophobicContact CG1-CD2 4.15Å; Y220-L251 VanDerWaalsContact CB-CD2 3.41Å; Y220-L251 HydrophobicContact CD1-CD2 4.23Å; Y220-L251 HydrophobicContact CD2-CB 4.49Å; Y220-L251 HydrophobicContact CD2-CD2 3.87Å; Y220-L251 HydrophobicContact CG-CD2 3.59Å; S247-L251 PolarHBondContact O-N 2.86Å; V248-L251 PolarHBondContact O-N 2.72Å; K249-L251 VanDerWaalsContact C-N 3.3Å; K249-L251 PolarHBondContact O-N 3Å; L251-D253 PolarHBondContact O-N 3.5Å; L251-A254 PolarHBondContact O-N 2.83Å; L251-I255 HydrophobicContact CD1-CD1 3.81Å; L251-I255 HydrophobicContact CD1-CG1 4.14Å; L251-I255 HydrophobicContact CD2-CD1 4.3Å; L251-I255 HydrophobicContact CG-CD1 3.81Å; L251-I255 HydrophobicContact CG-CG1 4.4Å; L251-I255 WeakPolarHBondContact O-CG1 3.4Å; L251-I255 PolarHBondContact O-N 2.89Å; L251-L301 HydrophobicContact CD2-CD1 4.22Å; L251-L301 HydrophobicContact CD2-CG 4.3Å; L251-L301 HydrophobicContact CG-CD1 4.38Å; L251-I305 HydrophobicContact CD2-CG2 3.94Å
252	K	98.4	Very high	97.6	Very high	58 Å²	58	56.8 Å²	56.8	25%	0.252	28%	0.279	S	S	.	.	H	α-helix	trans	-59.9	-46.1	-178.9	-78.1	-177.6	179.5	174.8	0	111.9	I125 V248 K249 A254 I255 E256 L301	I125-K252 VanDerWaalsContact C-NZ 3.31Å; I125-K252 WeakPolarHBondContact O-CE 3.38Å; I125-K252 PolarHBondContact O-NZ 3.19Å; I125-K252 VanDerWaalsContact O-NZ 3.08Å; V248-K252 HydrophobicContact CG1-CD 3.78Å; V248-K252 HydrophobicContact CG1-CG 4.31Å; V248-K252 WeakPolarHBondContact O-CB 3.46Å; V248-K252 WeakPolarHBondContact O-CG 3.31Å; V248-K252 PolarHBondContact O-N 3.19Å; K249-K252 PolarHBondContact O-N 2.82Å; K252-A254 VanDerWaalsContact C-N 3.31Å; K252-A254 PolarHBondContact O-N 3.3Å; K252-I255 PolarHBondContact O-N 2.93Å; K252-E256 WeakPolarHBondContact O-CB 3.41Å; K252-E256 PolarHBondContact O-N 3.36Å; K252-L301 HydrophobicContact CG-CD1 3.85Å
253	D	98.4	Very high	97.7	Very high	69 Å²	69	53.7 Å²	53.7	37%	0.369	26%	0.264	S	S	.	.	H	α-helix	trans	-61.8	-41.7	177.7	-70.2	-5.6	0	0	0	110.7	K249 L251 E256 V257	K249-D253 VanDerWaalsContact CE-OD2 3.26Å; K249-D253 WeakPolarHBondContact CE-OD2 3.1Å; K249-D253 VanDerWaalsContact CG-OD2 3.31Å; K249-D253 WeakPolarHBondContact CG-OD2 3.2Å; K249-D253 VanDerWaalsContact NZ-CG 3.33Å; K249-D253 IonicContact NZ-OD1 2.98Å; K249-D253 PolarHBondContact NZ-OD1 3.26Å; K249-D253 VanDerWaalsContact NZ-OD1 3.16Å; K249-D253 IonicContact NZ-OD2 3.89Å; K249-D253 PolarHBondContact NZ-OD2 3.35Å; K249-D253 WeakPolarHBondContact O-CB 3.42Å; K249-D253 VanDerWaalsContact O-CG 3.25Å; K249-D253 PolarHBondContact O-N 2.71Å; L251-D253 PolarHBondContact O-N 3.5Å; D253-E256 PolarHBondContact O-N 3.45Å; D253-V257 PolarHBondContact O-N 3.5Å
254	A	98.4	Very high	97.7	Very high	18 Å²	18	53.1 Å²	53.1	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-64.6	-43.1	178.5	0	0	0	0	0	112.1	I213 K216 D250 L251 K252 V257 L258	I213-A254 HydrophobicContact CD1-CB 3.59Å; K216-A254 HydrophobicContact CD-CB 4.01Å; D250-A254 WeakPolarHBondContact O-CB 3.36Å; D250-A254 PolarHBondContact O-N 2.91Å; L251-A254 PolarHBondContact O-N 2.83Å; K252-A254 VanDerWaalsContact C-N 3.31Å; K252-A254 PolarHBondContact O-N 3.3Å; A254-V257 PolarHBondContact O-N 2.74Å; A254-L258 PolarHBondContact O-N 3.41Å
255	I	97.7	Very high	97.6	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	27%	0.267	C	S	.	.	H	α-helix	trans	-69.8	-34.5	177.1	-69.3	177.3	0	0	0	111.1	L251 K252 V257 L258 I259 I300 L301 L304	L251-I255 HydrophobicContact CD1-CD1 3.81Å; L251-I255 HydrophobicContact CD1-CG1 4.14Å; L251-I255 HydrophobicContact CD2-CD1 4.3Å; L251-I255 HydrophobicContact CG-CD1 3.81Å; L251-I255 HydrophobicContact CG-CG1 4.4Å; L251-I255 WeakPolarHBondContact O-CG1 3.4Å; L251-I255 PolarHBondContact O-N 2.89Å; K252-I255 PolarHBondContact O-N 2.93Å; I255-V257 VanDerWaalsContact C-N 3.27Å; I255-V257 PolarHBondContact O-N 3.19Å; I255-L258 WeakPolarHBondContact O-CB 3.38Å; I255-L258 PolarHBondContact O-N 2.87Å; I255-I259 HydrophobicContact CG2-CD1 3.53Å; I255-I259 HydrophobicContact CG2-CG1 3.98Å; I255-I259 VanDerWaalsContact O-CG1 3.31Å; I255-I259 WeakPolarHBondContact O-CG1 3.45Å; I255-I259 PolarHBondContact O-N 3.11Å; I255-I300 HydrophobicContact CG2-CG2 4.49Å; I255-L301 HydrophobicContact CD1-CB 3.79Å; I255-L301 HydrophobicContact CD1-CD1 3.9Å; I255-L301 HydrophobicContact CD1-CG 3.56Å; I255-L301 HydrophobicContact CG2-CB 4.46Å; I255-L304 HydrophobicContact CD1-CD1 4.48Å
256	E	97.4	Very high	97.4	Very high	67 Å²	67	51.7 Å²	51.7	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-61.7	-35.5	176.8	-173.6	136	-155.4	0	0	112.1	K252 D253 I259 A260 R293	K252-E256 WeakPolarHBondContact O-CB 3.41Å; K252-E256 PolarHBondContact O-N 3.36Å; D253-E256 PolarHBondContact O-N 3.45Å; E256-I259 PolarHBondContact O-N 2.87Å; E256-A260 VanDerWaalsContact O-CB 3.25Å; E256-A260 WeakPolarHBondContact O-CB 3.16Å; E256-A260 PolarHBondContact O-N 3.17Å; E256-R293 IonicContact OE1-CZ 2.67Å; E256-R293 VanDerWaalsContact OE1-CZ 3.23Å; E256-R293 IonicContact OE1-NH1 3.78Å; E256-R293 PolarHBondContact OE1-NH1 3.49Å; E256-R293 IonicContact OE1-NH2 3.16Å; E256-R293 PolarHBondContact OE1-NH2 2.92Å
257	V	98.4	Very high	97.1	Very high	100 Å²	100	49.1 Å²	49.1	61%	0.606	25%	0.248	S	C	*	.	H	α-helix	trans	-59.9	-46.3	170.8	174.7	0	0	0	0	111.2	D253 A254 I255 A260 E261	D253-V257 PolarHBondContact O-N 3.5Å; A254-V257 PolarHBondContact O-N 2.74Å; I255-V257 VanDerWaalsContact C-N 3.27Å; I255-V257 PolarHBondContact O-N 3.19Å; V257-A260 PolarHBondContact O-N 2.91Å; V257-E261 PolarHBondContact O-N 3.02Å; V257-E261 VanDerWaalsContact O-N 3.09Å
258	L	98.4	Very high	96.7	Very high	15 Å²	15	53.2 Å²	53.2	8%	0.079	27%	0.272	C	S	.	.	H	α-helix	trans	-65.6	-41.8	179.8	-53.6	179	0	0	0	111.9	L204 I206 L208 A254 I255 E261 K262	L204-L258 HydrophobicContact CD2-CB 3.99Å; L204-L258 HydrophobicContact CD2-CD1 4.18Å; I206-L258 HydrophobicContact CG2-CB 4.27Å; I206-L258 HydrophobicContact CG2-CD2 3.91Å; L208-L258 HydrophobicContact CB-CD1 4.01Å; L208-L258 HydrophobicContact CB-CD2 3.88Å; L208-L258 HydrophobicContact CD2-CD1 3.94Å; A254-L258 PolarHBondContact O-N 3.41Å; I255-L258 WeakPolarHBondContact O-CB 3.38Å; I255-L258 PolarHBondContact O-N 2.87Å; L258-E261 PolarHBondContact O-N 2.99Å; L258-K262 PolarHBondContact O-N 2.96Å
259	I	97.8	Very high	96.2	Very high	1 Å²	1	57.3 Å²	57.3	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-69.9	-35.9	179	-59.7	170	0	0	0	110.6	I255 E256 E261 K262 R263 I283 N297 I300	I255-I259 HydrophobicContact CG2-CD1 3.53Å; I255-I259 HydrophobicContact CG2-CG1 3.98Å; I255-I259 VanDerWaalsContact O-CG1 3.31Å; I255-I259 WeakPolarHBondContact O-CG1 3.45Å; I255-I259 PolarHBondContact O-N 3.11Å; E256-I259 PolarHBondContact O-N 2.87Å; I259-E261 VanDerWaalsContact C-N 3.35Å; I259-K262 PolarHBondContact O-N 3.45Å; I259-R263 HydrophobicContact CG2-CG 4.45Å; I259-R263 VanDerWaalsContact CG2-NH1 3.27Å; I259-R263 WeakPolarHBondContact O-CG 3.45Å; I259-R263 PolarHBondContact O-N 3.01Å; I259-I283 HydrophobicContact CG2-CD1 4.49Å; I259-N297 HydrophobicContact CD1-CB 4.03Å; I259-I300 HydrophobicContact CD1-CB 3.94Å; I259-I300 HydrophobicContact CD1-CD1 3.91Å; I259-I300 HydrophobicContact CD1-CG2 4.01Å; I259-I300 HydrophobicContact CG1-CB 4.37Å; I259-I300 HydrophobicContact CG1-CD1 3.88Å; I259-I300 HydrophobicContact CG1-CG2 3.99Å; I259-I300 HydrophobicContact CG2-CD1 4.13Å
260	A	97.9	Very high	95.1	Very high	42 Å²	42	60.9 Å²	60.9	35%	0.347	31%	0.309	S	S	.	.	H	α-helix	trans	-62	-43	174.5	0	0	0	0	0	111.6	E256 V257 R263 R264	E256-A260 VanDerWaalsContact O-CB 3.25Å; E256-A260 WeakPolarHBondContact O-CB 3.16Å; E256-A260 PolarHBondContact O-N 3.17Å; V257-A260 PolarHBondContact O-N 2.91Å; A260-R263 PolarHBondContact O-N 3.3Å; A260-R264 PolarHBondContact O-N 3.32Å; A260-R264 VanDerWaalsContact O-N 3.1Å
261	E	97.3	Very high	94.3	Very high	47 Å²	47	63.9 Å²	63.9	22%	0.22	32%	0.32	C	S	.	.	H	α-helix	trans	-60.3	-47	170.6	176	65.1	-148.3	0	0	111.6	I206 V257 L258 I259 R263 R264 R265	I206-E261 HydrophobicContact CD1-CG 3.89Å; I206-E261 HydrophobicContact CG1-CG 4.48Å; I206-E261 HydrophobicContact CG2-CB 4.11Å; I206-E261 HydrophobicContact CG2-CG 3.81Å; V257-E261 PolarHBondContact O-N 3.02Å; V257-E261 VanDerWaalsContact O-N 3.09Å; L258-E261 PolarHBondContact O-N 2.99Å; I259-E261 VanDerWaalsContact C-N 3.35Å; E261-R263 VanDerWaalsContact C-N 3.33Å; E261-R263 PolarHBondContact O-N 3.18Å; E261-R264 WeakPolarHBondContact O-CB 3.21Å; E261-R264 PolarHBondContact O-N 3.48Å; E261-R264 VanDerWaalsContact O-N 3.13Å; E261-R264 IonicContact OE1-NH1 3.44Å; E261-R264 IonicContact OE2-CZ 3.1Å; E261-R264 IonicContact OE2-NH1 3.88Å; E261-R264 PolarHBondContact OE2-NH1 2.79Å; E261-R264 IonicContact OE2-NH2 2.76Å; E261-R264 PolarHBondContact OE2-NH2 3.05Å; E261-R265 PolarHBondContact O-N 3.34Å; E261-R265 IonicContact OE1-CZ 3.27Å; E261-R265 IonicContact OE1-NE 3.34Å; E261-R265 PolarHBondContact OE1-NE 3.4Å; E261-R265 IonicContact OE1-NH2 2.64Å; E261-R265 PolarHBondContact OE1-NH2 3.09Å
262	K	97	Very high	93.3	Very high	17 Å²	17	65.7 Å²	65.7	7%	0.074	33%	0.329	C	S	.	.	H	α-helix	trans	-57.9	-44	177.7	-174.7	62.1	172.2	-165.6	0	112.3	L204 I206 L258 I259 R264 R265 I266 D277 A279 T280 I283	L204-K262 HydrophobicContact CD1-CB 3.95Å; L204-K262 HydrophobicContact CD1-CD 4.26Å; L204-K262 HydrophobicContact CD1-CG 3.92Å; L204-K262 WeakPolarHBondContact O-CE 3.46Å; L204-K262 PolarHBondContact O-NZ 3.13Å; I206-K262 HydrophobicContact CD1-CB 4.22Å; I206-K262 HydrophobicContact CD1-CD 4.08Å; I206-K262 HydrophobicContact CG1-CB 4.02Å; I206-K262 HydrophobicContact CG1-CD 4.27Å; L258-K262 PolarHBondContact O-N 2.96Å; I259-K262 PolarHBondContact O-N 3.45Å; K262-R264 VanDerWaalsContact C-N 3.35Å; K262-R264 PolarHBondContact O-N 3.39Å; K262-R265 PolarHBondContact O-N 2.65Å; K262-I266 HydrophobicContact CD-CD1 4.21Å; K262-I266 HydrophobicContact CG-CD1 3.89Å; K262-I266 VanDerWaalsContact O-CG1 3.31Å; K262-I266 WeakPolarHBondContact O-CG1 3.37Å; K262-I266 PolarHBondContact O-N 3.41Å; K262-D277 WeakPolarHBondContact CE-OD1 3.42Å; K262-D277 VanDerWaalsContact NZ-CG 3.35Å; K262-D277 IonicContact NZ-OD1 3.56Å; K262-D277 PolarHBondContact NZ-OD1 3.27Å; K262-D277 IonicContact NZ-OD2 2.78Å; K262-D277 PolarHBondContact NZ-OD2 2.63Å; K262-A279 HydrophobicContact CG-CB 4.16Å; K262-T280 VanDerWaalsContact CE-OG1 3.25Å; K262-T280 WeakPolarHBondContact CE-OG1 3.5Å; K262-I283 HydrophobicContact CB-CD1 4.43Å; K262-I283 HydrophobicContact CG-CD1 3.87Å
263	R	96	Very high	92.2	Very high	51 Å²	51	71.6 Å²	71.6	19%	0.192	36%	0.358	C	S	.	.	H	α-helix	trans	-60.9	-42.1	176.1	-76.3	-175	175.7	106.8	6.6	111.7	I259 A260 E261 I266 S267 I283 E286 N297	I259-R263 HydrophobicContact CG2-CG 4.45Å; I259-R263 VanDerWaalsContact CG2-NH1 3.27Å; I259-R263 WeakPolarHBondContact O-CG 3.45Å; I259-R263 PolarHBondContact O-N 3.01Å; A260-R263 PolarHBondContact O-N 3.3Å; E261-R263 VanDerWaalsContact C-N 3.33Å; E261-R263 PolarHBondContact O-N 3.18Å; R263-I266 PolarHBondContact O-N 2.89Å; R263-S267 PolarHBondContact O-N 3.16Å; R263-S267 VanDerWaalsContact O-N 3.08Å; R263-I283 HydrophobicContact CG-CD1 3.82Å; R263-I283 HydrophobicContact CG-CG1 4.28Å; R263-I283 HydrophobicContact CG-CG2 4.26Å; R263-E286 IonicContact CZ-OE2 3.23Å; R263-E286 IonicContact NE-OE2 2.77Å; R263-E286 IonicContact NH2-OE1 3.03Å; R263-E286 IonicContact NH2-OE2 2.76Å; R263-E286 PolarHBondContact NH2-OE2 3.11Å; R263-N297 PolarHBondContact NH1-OD1 2.95Å; R263-N297 VanDerWaalsContact NH1-OD1 3.1Å; R263-N297 PolarHBondContact NH2-OD1 2.71Å
264	R	95.4	Very high	91.1	Very high	138 Å²	138	75.6 Å²	75.6	52%	0.521	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-49.1	176.1	-77.4	-171.7	-80	100.8	-0.1	111.4	A260 E261 K262 I266 S267 T268	A260-R264 PolarHBondContact O-N 3.32Å; A260-R264 VanDerWaalsContact O-N 3.1Å; E261-R264 WeakPolarHBondContact O-CB 3.21Å; E261-R264 PolarHBondContact O-N 3.48Å; E261-R264 VanDerWaalsContact O-N 3.13Å; E261-R264 IonicContact OE1-NH1 3.44Å; E261-R264 IonicContact OE2-CZ 3.1Å; E261-R264 IonicContact OE2-NH1 3.88Å; E261-R264 PolarHBondContact OE2-NH1 2.79Å; E261-R264 IonicContact OE2-NH2 2.76Å; E261-R264 PolarHBondContact OE2-NH2 3.05Å; K262-R264 VanDerWaalsContact C-N 3.35Å; K262-R264 PolarHBondContact O-N 3.39Å; R264-I266 PolarHBondContact O-N 2.75Å; R264-S267 PolarHBondContact O-N 3.38Å; R264-S267 VanDerWaalsContact O-N 3.11Å; R264-S267 PolarHBondContact O-OG 3.28Å; R264-T268 PolarHBondContact O-N 3.04Å; R264-T268 PolarHBondContact O-OG1 3.46Å
265	R	94.4	Very high	90.1	Very high	106 Å²	106	76.5 Å²	76.5	40%	0.4	38%	0.379	S	S	.	.	H	α-helix	trans	-59.3	-44.7	177.5	-65.8	-173.6	-171.8	-163	-2.6	112.6	E261 K262 S267 T268 E269	E261-R265 PolarHBondContact O-N 3.34Å; E261-R265 IonicContact OE1-CZ 3.27Å; E261-R265 IonicContact OE1-NE 3.34Å; E261-R265 PolarHBondContact OE1-NE 3.4Å; E261-R265 IonicContact OE1-NH2 2.64Å; E261-R265 PolarHBondContact OE1-NH2 3.09Å; K262-R265 PolarHBondContact O-N 2.65Å; R265-S267 PolarHBondContact O-N 2.85Å; R265-T268 PolarHBondContact O-N 2.9Å; R265-T268 PolarHBondContact O-OG1 3.23Å; R265-E269 WeakPolarHBondContact O-CB 3.41Å; R265-E269 PolarHBondContact O-N 3.11Å; R265-E269 VanDerWaalsContact O-N 3.12Å
266	I	93.4	Very high	89.7	Confident	12 Å²	12	78.9 Å²	78.9	6%	0.062	39%	0.391	C	S	.	.	H	α-helix	trans	-61.4	-33.6	177.4	-70.7	165.9	0	0	0	111.9	K262 R263 R264 T268 L272 T280 I283	K262-I266 HydrophobicContact CD-CD1 4.21Å; K262-I266 HydrophobicContact CG-CD1 3.89Å; K262-I266 VanDerWaalsContact O-CG1 3.31Å; K262-I266 WeakPolarHBondContact O-CG1 3.37Å; K262-I266 PolarHBondContact O-N 3.41Å; R263-I266 PolarHBondContact O-N 2.89Å; R264-I266 PolarHBondContact O-N 2.75Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 2.91Å; I266-L272 HydrophobicContact CB-CD1 4.34Å; I266-L272 HydrophobicContact CG1-CD1 4.29Å; I266-L272 HydrophobicContact CG2-CD1 3.9Å; I266-L272 HydrophobicContact CG2-CD2 4.32Å; I266-T280 HydrophobicContact CD1-CG2 4.04Å; I266-T280 HydrophobicContact CG1-CG2 4.21Å; I266-I283 HydrophobicContact CD1-CB 4.09Å; I266-I283 HydrophobicContact CD1-CD1 3.56Å; I266-I283 HydrophobicContact CD1-CG1 4.42Å; I266-I283 HydrophobicContact CD1-CG2 4.04Å
267	S	90.2	Very high	89.6	Confident	83 Å²	83	76.2 Å²	76.2	58%	0.58	38%	0.378	S	S	*	.	H	α-helix	trans	-73.2	-21.6	-179.8	66	0	0	0	0	114.4	R263 R264 R265	R263-S267 PolarHBondContact O-N 3.16Å; R263-S267 VanDerWaalsContact O-N 3.08Å; R264-S267 PolarHBondContact O-N 3.38Å; R264-S267 VanDerWaalsContact O-N 3.11Å; R264-S267 PolarHBondContact O-OG 3.28Å; R265-S267 PolarHBondContact O-N 2.85Å
268	T	90.5	Very high	89.6	Confident	113 Å²	113	71.7 Å²	71.7	69%	0.693	35%	0.351	S	S	*	.	H	α-helix	trans	-108	-1.8	-178.2	58.5	0	0	0	0	113.2	R264 R265 I266	R264-T268 PolarHBondContact O-N 3.04Å; R264-T268 PolarHBondContact O-OG1 3.46Å; R265-T268 PolarHBondContact O-N 2.9Å; R265-T268 PolarHBondContact O-OG1 3.23Å; I266-T268 VanDerWaalsContact C-N 3.31Å; I266-T268 PolarHBondContact O-N 2.91Å
269	E	87.8	Confident	89.5	Confident	91 Å²	91	71 Å²	71	43%	0.425	35%	0.347	S	S	.	.			trans	-79.6	120.6	-176	-176.2	60.9	-100.2	0	0	110.9	R265 K271 L272	R265-E269 WeakPolarHBondContact O-CB 3.41Å; R265-E269 PolarHBondContact O-N 3.11Å; R265-E269 VanDerWaalsContact O-N 3.12Å; E269-K271 PolarHBondContact OE1-N 3.11Å; E269-L272 HydrophobicContact CB-CD1 4.07Å; E269-L272 HydrophobicContact CG-CD1 4.12Å
270	E	74.3	Confident	89.5	Confident	188 Å²	188	71 Å²	71	88%	0.879	35%	0.347	S	S	*	.	S	Bend	trans	-77.3	-26.5	180	-69.8	-177	174.6	0	0	112.1
271	K	81.6	Confident	89.4	Confident	122 Å²	122	70.8 Å²	70.8	53%	0.53	34%	0.339	S	S	.	.			trans	-120.9	59.4	-175.4	-63.8	-174.7	178.9	-172.6	0	113.1	E269 E273 E274	E269-K271 PolarHBondContact OE1-N 3.11Å; K271-E273 PolarHBondContact O-N 3.45Å; K271-E273 VanDerWaalsContact O-N 3.14Å; K271-E274 PolarHBondContact O-N 3.01Å; K271-E274 VanDerWaalsContact O-N 3.14Å
272	L	78.8	Confident	89.5	Confident	38 Å²	38	68.6 Å²	68.6	20%	0.199	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-28.1	-174.8	-158.3	72	0	0	0	113.9	I266 E269 E274 C275 M276 T280 L284	I266-L272 HydrophobicContact CB-CD1 4.34Å; I266-L272 HydrophobicContact CG1-CD1 4.29Å; I266-L272 HydrophobicContact CG2-CD1 3.9Å; I266-L272 HydrophobicContact CG2-CD2 4.32Å; E269-L272 HydrophobicContact CB-CD1 4.07Å; E269-L272 HydrophobicContact CG-CD1 4.12Å; L272-E274 VanDerWaalsContact C-N 3.3Å; L272-E274 PolarHBondContact O-N 3.29Å; L272-C275 PolarHBondContact O-N 2.92Å; L272-M276 WeakPolarHBondContact O-CG 3.34Å; L272-T280 HydrophobicContact CD1-CG2 3.99Å; L272-T280 HydrophobicContact CD2-CG2 4.41Å; L272-T280 HydrophobicContact CG-CG2 4.16Å; L272-L284 HydrophobicContact CD2-CD1 3.77Å; L272-L284 HydrophobicContact CD2-CD2 3.72Å; L272-L284 HydrophobicContact CD2-CG 4.14Å
273	E	74.8	Confident	89.5	Confident	182 Å²	182	67.9 Å²	67.9	85%	0.85	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-29.9	179.2	-60.4	-170.2	172.3	0	0	113.1	K271	K271-E273 PolarHBondContact O-N 3.45Å; K271-E273 VanDerWaalsContact O-N 3.14Å
274	E	75.4	Confident	89.5	Confident	153 Å²	153	67.2 Å²	67.2	72%	0.715	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-19.8	-177.2	-66.6	179.4	-173	0	0	112.6	K271 L272	K271-E274 PolarHBondContact O-N 3.01Å; K271-E274 VanDerWaalsContact O-N 3.14Å; L272-E274 VanDerWaalsContact C-N 3.3Å; L272-E274 PolarHBondContact O-N 3.29Å
275	C	77.3	Confident	89.6	Confident	37 Å²	37	60.7 Å²	60.7	25%	0.25	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	22.2	-173.8	68.8	0	0	0	0	114.4	L272 D277	L272-C275 PolarHBondContact O-N 2.92Å; C275-D277 PolarHBondContact O-N 2.95Å
276	M	89.8	Confident	89.7	Confident	54 Å²	54	57.7 Å²	57.7	27%	0.266	29%	0.292	S	S	.	.			trans	-60.8	122.3	179.8	-69.9	-62.1	-73.2	0	0	112.6	L272 T280 E281 L284	L272-M276 WeakPolarHBondContact O-CG 3.34Å; M276-T280 HydrophobicContact CE-CG2 4.43Å; M276-T280 HydrophobicContact SD-CG2 3.65Å; M276-E281 HydrophobicContact CE-CB 4.44Å; M276-E281 HydrophobicContact CE-CG 3.55Å; M276-E281 WeakPolarHBondContact CE-OE1 3.36Å; M276-L284 HydrophobicContact CE-CD1 3.88Å; M276-L284 HydrophobicContact SD-CD1 3.97Å
277	D	94.8	Very high	89.7	Confident	10 Å²	10	63.5 Å²	63.5	5%	0.053	32%	0.317	C	S	.	.			trans	-135.4	177.3	170.8	59.7	46.8	0	0	0	110.6	K262 C275 A279 T280 E281	K262-D277 WeakPolarHBondContact CE-OD1 3.42Å; K262-D277 VanDerWaalsContact NZ-CG 3.35Å; K262-D277 IonicContact NZ-OD1 3.56Å; K262-D277 PolarHBondContact NZ-OD1 3.27Å; K262-D277 IonicContact NZ-OD2 2.78Å; K262-D277 PolarHBondContact NZ-OD2 2.63Å; C275-D277 PolarHBondContact O-N 2.95Å; D277-A279 PolarHBondContact O-N 2.97Å; D277-A279 PolarHBondContact OD1-N 2.83Å; D277-T280 PolarHBondContact O-N 2.75Å; D277-T280 PolarHBondContact OD1-N 2.8Å; D277-T280 PolarHBondContact OD1-OG1 3.29Å; D277-T280 VanDerWaalsContact OD1-OG1 3.1Å; D277-E281 WeakPolarHBondContact O-CG 3.4Å; D277-E281 PolarHBondContact O-N 2.78Å
278	F	97.8	Very high	90	Very high	6 Å²	6	66.5 Å²	66.5	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-56.9	-45.5	-175.4	175.2	-107.9	0	0	0	112.9	F147 F148 A151 F203 E281 L282 C299 I300 M303	F147-F278 HydrophobicContact CB-CE2 4.03Å; F148-F278 HydrophobicContact CD1-CE2 4.18Å; F148-F278 AromaticContact CD1-CZ 3.98Å; F148-F278 HydrophobicContact CD1-CZ 3.98Å; F148-F278 AromaticContact CD2-CE2 3.94Å; F148-F278 HydrophobicContact CD2-CE2 3.94Å; F148-F278 AromaticContact CD2-CZ 3.96Å; F148-F278 HydrophobicContact CD2-CZ 3.96Å; F148-F278 HydrophobicContact CE1-CE1 4.47Å; F148-F278 HydrophobicContact CE1-CE2 4.39Å; F148-F278 AromaticContact CE1-CZ 3.73Å; F148-F278 HydrophobicContact CE1-CZ 3.73Å; F148-F278 HydrophobicContact CE2-CE2 4.17Å; F148-F278 AromaticContact CE2-CZ 3.71Å; F148-F278 HydrophobicContact CE2-CZ 3.71Å; F148-F278 AromaticContact CG-CE2 3.95Å; F148-F278 HydrophobicContact CG-CE2 3.95Å; F148-F278 HydrophobicContact CG-CZ 4.09Å; F148-F278 HydrophobicContact CZ-CE1 4.46Å; F148-F278 HydrophobicContact CZ-CE2 4.39Å; F148-F278 AromaticContact CZ-CZ 3.6Å; F148-F278 HydrophobicContact CZ-CZ 3.6Å; A151-F278 HydrophobicContact CB-CB 3.79Å; A151-F278 HydrophobicContact CB-CD2 3.63Å; A151-F278 HydrophobicContact CB-CG 4.06Å; F203-F278 HydrophobicContact CB-CB 3.96Å; F203-F278 HydrophobicContact CB-CD1 4.32Å; F203-F278 HydrophobicContact CD1-CB 3.91Å; F203-F278 HydrophobicContact CG-CB 4.34Å; F278-E281 PolarHBondContact O-N 2.8Å; F278-L282 HydrophobicContact CD1-CD1 4.03Å; F278-L282 HydrophobicContact CD2-CD1 4.42Å; F278-L282 HydrophobicContact CE1-CD1 3.48Å; F278-L282 VanDerWaalsContact CE1-CD1 3.48Å; F278-L282 HydrophobicContact CE2-CD1 3.92Å; F278-L282 HydrophobicContact CE2-CG 4.29Å; F278-L282 HydrophobicContact CG-CD1 4.49Å; F278-L282 HydrophobicContact CZ-CD1 3.43Å; F278-L282 VanDerWaalsContact CZ-CD1 3.43Å; F278-L282 HydrophobicContact CZ-CG 4.27Å; F278-L282 WeakPolarHBondContact O-CG 3.24Å; F278-L282 PolarHBondContact O-N 2.76Å; F278-C299 HydrophobicContact CZ-CB 4.22Å; F278-I300 HydrophobicContact CE1-CG1 4.46Å; F278-M303 HydrophobicContact CD1-CB 3.98Å; F278-M303 HydrophobicContact CD1-CE 3.92Å; F278-M303 HydrophobicContact CD1-CG 3.9Å; F278-M303 HydrophobicContact CD2-CE 3.73Å; F278-M303 HydrophobicContact CE1-CB 3.52Å; F278-M303 HydrophobicContact CE1-CE 3.8Å; F278-M303 HydrophobicContact CE1-CG 3.91Å; F278-M303 HydrophobicContact CE2-CE 3.6Å; F278-M303 HydrophobicContact CG-CE 3.87Å; F278-M303 HydrophobicContact CZ-CB 4.21Å; F278-M303 HydrophobicContact CZ-CE 3.62Å
279	A	97.9	Very high	90.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-65.5	-40.8	178.7	0	0	0	0	0	111.7	F203 L204 K262 D277 L282 I283 I300	F203-A279 WeakPolarHBondContact O-CB 3.45Å; F203-A279 PolarHBondContact O-N 3.34Å; L204-A279 HydrophobicContact CD1-CB 3.71Å; K262-A279 HydrophobicContact CG-CB 4.16Å; D277-A279 PolarHBondContact O-N 2.97Å; D277-A279 PolarHBondContact OD1-N 2.83Å; A279-L282 PolarHBondContact O-N 2.91Å; A279-I283 WeakPolarHBondContact O-CB 3.5Å; A279-I283 WeakPolarHBondContact O-CD1 3.37Å; A279-I283 VanDerWaalsContact O-CG1 3.27Å; A279-I283 WeakPolarHBondContact O-CG1 3.47Å; A279-I283 PolarHBondContact O-N 2.64Å; A279-I300 HydrophobicContact CB-CD1 3.81Å; A279-I300 HydrophobicContact CB-CG1 4.18Å
280	T	96.9	Very high	90.6	Very high	1 Å²	1	64.3 Å²	64.3	1%	0.006	32%	0.317	C	S	.	.	H	α-helix	trans	-62.6	-45.7	176.3	-57	0	0	0	0	112	K262 I266 L272 M276 D277 L282 I283 L284	K262-T280 VanDerWaalsContact CE-OG1 3.25Å; K262-T280 WeakPolarHBondContact CE-OG1 3.5Å; I266-T280 HydrophobicContact CD1-CG2 4.04Å; I266-T280 HydrophobicContact CG1-CG2 4.21Å; L272-T280 HydrophobicContact CD1-CG2 3.99Å; L272-T280 HydrophobicContact CD2-CG2 4.41Å; L272-T280 HydrophobicContact CG-CG2 4.16Å; M276-T280 HydrophobicContact CE-CG2 4.43Å; M276-T280 HydrophobicContact SD-CG2 3.65Å; D277-T280 PolarHBondContact O-N 2.75Å; D277-T280 PolarHBondContact OD1-N 2.8Å; D277-T280 PolarHBondContact OD1-OG1 3.29Å; D277-T280 VanDerWaalsContact OD1-OG1 3.1Å; T280-L282 VanDerWaalsContact C-N 3.33Å; T280-L282 PolarHBondContact O-N 3.04Å; T280-I283 PolarHBondContact O-N 2.94Å; T280-L284 HydrophobicContact CG2-CD1 4.23Å; T280-L284 HydrophobicContact CG2-CG 4.37Å; T280-L284 WeakPolarHBondContact O-CB 3.22Å; T280-L284 WeakPolarHBondContact O-CG 3.37Å; T280-L284 PolarHBondContact O-N 3.1Å
281	E	96.8	Very high	91.7	Very high	38 Å²	38	55.9 Å²	55.9	18%	0.178	28%	0.278	C	S	.	.	H	α-helix	trans	-56.5	-45.1	177.2	-73.1	-82.4	-171	0	0	112.3	F147 K150 M276 D277 F278 L284 A285	F147-E281 HydrophobicContact CD1-CB 4.12Å; F147-E281 HydrophobicContact CE1-CB 4.47Å; K150-E281 WeakPolarHBondContact CE-OE1 3.33Å; K150-E281 IonicContact NZ-OE1 3.27Å; K150-E281 PolarHBondContact NZ-OE1 2.7Å; K150-E281 IonicContact NZ-OE2 3.4Å; M276-E281 HydrophobicContact CE-CB 4.44Å; M276-E281 HydrophobicContact CE-CG 3.55Å; M276-E281 WeakPolarHBondContact CE-OE1 3.36Å; D277-E281 WeakPolarHBondContact O-CG 3.4Å; D277-E281 PolarHBondContact O-N 2.78Å; F278-E281 PolarHBondContact O-N 2.8Å; E281-L284 PolarHBondContact O-N 2.91Å; E281-A285 WeakPolarHBondContact O-CB 3.29Å; E281-A285 PolarHBondContact O-N 3.32Å
282	L	98.2	Very high	92.5	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66	-44.4	178.1	-71.6	174	0	0	0	112.2	F147 F278 A279 T280 L284 A285 E286 L291 V296 C299 I300	F147-L282 HydrophobicContact CB-CD2 3.8Å; F147-L282 HydrophobicContact CD1-CD2 3.93Å; F147-L282 HydrophobicContact CD2-CD2 4.01Å; F147-L282 HydrophobicContact CG-CD2 3.64Å; F278-L282 HydrophobicContact CD1-CD1 4.03Å; F278-L282 HydrophobicContact CD2-CD1 4.42Å; F278-L282 HydrophobicContact CE1-CD1 3.48Å; F278-L282 VanDerWaalsContact CE1-CD1 3.48Å; F278-L282 HydrophobicContact CE2-CD1 3.92Å; F278-L282 HydrophobicContact CE2-CG 4.29Å; F278-L282 HydrophobicContact CG-CD1 4.49Å; F278-L282 HydrophobicContact CZ-CD1 3.43Å; F278-L282 VanDerWaalsContact CZ-CD1 3.43Å; F278-L282 HydrophobicContact CZ-CG 4.27Å; F278-L282 WeakPolarHBondContact O-CG 3.24Å; F278-L282 PolarHBondContact O-N 2.76Å; A279-L282 PolarHBondContact O-N 2.91Å; T280-L282 VanDerWaalsContact C-N 3.33Å; T280-L282 PolarHBondContact O-N 3.04Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 3.28Å; L282-A285 WeakPolarHBondContact O-CB 3.37Å; L282-A285 PolarHBondContact O-N 3.07Å; L282-E286 PolarHBondContact O-N 2.95Å; L282-L291 HydrophobicContact CD2-CD1 3.49Å; L282-L291 VanDerWaalsContact CD2-CD1 3.49Å; L282-V296 HydrophobicContact CB-CB 4.45Å; L282-V296 HydrophobicContact CB-CG1 3.89Å; L282-V296 HydrophobicContact CB-CG2 4.03Å; L282-V296 WeakPolarHBondContact O-CG2 3.45Å; L282-C299 HydrophobicContact CD1-CB 3.56Å; L282-C299 HydrophobicContact CD2-CB 4.37Å; L282-I300 HydrophobicContact CD1-CG1 3.9Å
283	I	97.6	Very high	93.4	Very high	3 Å²	3	58.1 Å²	58.1	2%	0.015	29%	0.29	C	S	.	.	H	α-helix	trans	-65.4	-35	178.8	-70.1	165.1	0	0	0	111	I259 K262 R263 I266 A279 T280 E286 K287 V296	I259-I283 HydrophobicContact CG2-CD1 4.49Å; K262-I283 HydrophobicContact CB-CD1 4.43Å; K262-I283 HydrophobicContact CG-CD1 3.87Å; R263-I283 HydrophobicContact CG-CD1 3.82Å; R263-I283 HydrophobicContact CG-CG1 4.28Å; R263-I283 HydrophobicContact CG-CG2 4.26Å; I266-I283 HydrophobicContact CD1-CB 4.09Å; I266-I283 HydrophobicContact CD1-CD1 3.56Å; I266-I283 HydrophobicContact CD1-CG1 4.42Å; I266-I283 HydrophobicContact CD1-CG2 4.04Å; A279-I283 WeakPolarHBondContact O-CB 3.5Å; A279-I283 WeakPolarHBondContact O-CD1 3.37Å; A279-I283 VanDerWaalsContact O-CG1 3.27Å; A279-I283 WeakPolarHBondContact O-CG1 3.47Å; A279-I283 PolarHBondContact O-N 2.64Å; T280-I283 PolarHBondContact O-N 2.94Å; I283-E286 WeakPolarHBondContact O-CB 2.93Å; I283-E286 PolarHBondContact O-N 3.35Å; I283-K287 WeakPolarHBondContact O-CG 3.36Å; I283-K287 PolarHBondContact O-N 3.08Å; I283-V296 HydrophobicContact CG1-CG1 4.05Å
284	L	95.8	Very high	94.4	Very high	37 Å²	37	55 Å²	55	19%	0.194	28%	0.276	C	S	.	.	H	α-helix	trans	-69	-39.7	173.4	-72.7	-177.6	0	0	0	112.2	L272 M276 T280 E281 L282 E286 K287 R288	L272-L284 HydrophobicContact CD2-CD1 3.77Å; L272-L284 HydrophobicContact CD2-CD2 3.72Å; L272-L284 HydrophobicContact CD2-CG 4.14Å; M276-L284 HydrophobicContact CE-CD1 3.88Å; M276-L284 HydrophobicContact SD-CD1 3.97Å; T280-L284 HydrophobicContact CG2-CD1 4.23Å; T280-L284 HydrophobicContact CG2-CG 4.37Å; T280-L284 WeakPolarHBondContact O-CB 3.22Å; T280-L284 WeakPolarHBondContact O-CG 3.37Å; T280-L284 PolarHBondContact O-N 3.1Å; E281-L284 PolarHBondContact O-N 2.91Å; L282-L284 VanDerWaalsContact C-N 3.3Å; L282-L284 PolarHBondContact O-N 3.28Å; L284-E286 VanDerWaalsContact C-N 3.3Å; L284-E286 PolarHBondContact O-N 2.81Å; L284-K287 HydrophobicContact CD2-CD 4.42Å; L284-K287 PolarHBondContact O-N 3.22Å; L284-R288 WeakPolarHBondContact O-CG 3.34Å; L284-R288 PolarHBondContact O-N 3.26Å; L284-R288 VanDerWaalsContact O-N 3.08Å
285	A	96.8	Very high	95.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-37.7	172.5	0	0	0	0	0	112.1	F147 E281 L282 R288 G289 D290 L291	F147-A285 HydrophobicContact CE1-CB 3.75Å; F147-A285 HydrophobicContact CE2-CB 4.45Å; F147-A285 HydrophobicContact CZ-CB 3.46Å; F147-A285 VanDerWaalsContact CZ-CB 3.46Å; E281-A285 WeakPolarHBondContact O-CB 3.29Å; E281-A285 PolarHBondContact O-N 3.32Å; L282-A285 WeakPolarHBondContact O-CB 3.37Å; L282-A285 PolarHBondContact O-N 3.07Å; A285-R288 PolarHBondContact O-N 3.28Å; A285-G289 PolarHBondContact O-N 2.81Å; A285-D290 HydrophobicContact CB-CB 4.1Å; A285-D290 WeakPolarHBondContact O-CB 3.13Å; A285-D290 PolarHBondContact O-N 3.12Å; A285-L291 HydrophobicContact CB-CB 4.48Å; A285-L291 HydrophobicContact CB-CD1 3.89Å; A285-L291 HydrophobicContact CB-CG 4.14Å; A285-L291 PolarHBondContact O-N 3.32Å
286	E	97	Very high	96.5	Very high	44 Å²	44	46 Å²	46	21%	0.206	23%	0.23	C	C	.	.	H	α-helix	trans	-59.6	-47.7	170.4	179	-170.9	174.4	0	0	111.7	R263 L282 I283 L284 R288 G289 L291 R293 V296	R263-E286 IonicContact CZ-OE2 3.23Å; R263-E286 IonicContact NE-OE2 2.77Å; R263-E286 IonicContact NH2-OE1 3.03Å; R263-E286 IonicContact NH2-OE2 2.76Å; R263-E286 PolarHBondContact NH2-OE2 3.11Å; L282-E286 PolarHBondContact O-N 2.95Å; I283-E286 WeakPolarHBondContact O-CB 2.93Å; I283-E286 PolarHBondContact O-N 3.35Å; L284-E286 VanDerWaalsContact C-N 3.3Å; L284-E286 PolarHBondContact O-N 2.81Å; E286-R288 PolarHBondContact O-N 3.23Å; E286-G289 PolarHBondContact O-N 3.41Å; E286-L291 WeakPolarHBondContact CA-O 3.26Å; E286-R293 WeakPolarHBondContact OE1-CA 3.34Å; E286-R293 WeakPolarHBondContact OE1-CB 3.46Å; E286-R293 VanDerWaalsContact OE1-CG 3.25Å; E286-R293 WeakPolarHBondContact OE1-CG 3.43Å; E286-V296 HydrophobicContact CB-CG2 3.9Å
287	K	94.8	Very high	97	Very high	134 Å²	134	44.5 Å²	44.5	58%	0.583	22%	0.223	S	C	*	.	H	α-helix	trans	-61.7	-29.7	178.4	-74.4	-176.7	178.6	-176.8	0	113.5	I283 L284 G289	I283-K287 WeakPolarHBondContact O-CG 3.36Å; I283-K287 PolarHBondContact O-N 3.08Å; L284-K287 HydrophobicContact CD2-CD 4.42Å; L284-K287 PolarHBondContact O-N 3.22Å; K287-G289 VanDerWaalsContact C-N 3.32Å
288	R	95.8	Very high	97.1	Very high	146 Å²	146	44.5 Å²	44.5	55%	0.551	22%	0.223	S	C	*	.	H	α-helix	trans	-80.7	-10.9	174.9	-67.3	-170.7	-53.9	-92.7	-1.5	113.7	L284 A285 E286 D290	L284-R288 WeakPolarHBondContact O-CG 3.34Å; L284-R288 PolarHBondContact O-N 3.26Å; L284-R288 VanDerWaalsContact O-N 3.08Å; A285-R288 PolarHBondContact O-N 3.28Å; E286-R288 PolarHBondContact O-N 3.23Å; R288-D290 IonicContact CZ-OD2 3.87Å; R288-D290 VanDerWaalsContact CZ-OD2 3.3Å; R288-D290 IonicContact NE-OD2 3.15Å; R288-D290 PolarHBondContact NE-OD2 3.24Å; R288-D290 IonicContact NH2-OD2 3.83Å; R288-D290 PolarHBondContact NH2-OD2 2.74Å
289	G	94.9	Very high	97.2	Very high	64 Å²	64	44.2 Å²	44.2	66%	0.66	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	84.5	8.7	-174.2	0	0	0	0	0	114.5	A285 E286 K287	A285-G289 PolarHBondContact O-N 2.81Å; E286-G289 PolarHBondContact O-N 3.41Å; K287-G289 VanDerWaalsContact C-N 3.32Å
290	D	95.8	Very high	97.2	Very high	93 Å²	93	44.3 Å²	44.3	50%	0.497	22%	0.222	S	C	.	.	S	Bend	trans	-74.3	-28.3	178.8	-58.4	-31.4	0	0	0	111.9	A285 R288	A285-D290 HydrophobicContact CB-CB 4.1Å; A285-D290 WeakPolarHBondContact O-CB 3.13Å; A285-D290 PolarHBondContact O-N 3.12Å; R288-D290 IonicContact CZ-OD2 3.87Å; R288-D290 VanDerWaalsContact CZ-OD2 3.3Å; R288-D290 IonicContact NE-OD2 3.15Å; R288-D290 PolarHBondContact NE-OD2 3.24Å; R288-D290 IonicContact NH2-OD2 3.83Å; R288-D290 PolarHBondContact NH2-OD2 2.74Å
291	L	96.9	Very high	97.3	Very high	12 Å²	12	44.4 Å²	44.4	6%	0.063	22%	0.223	C	C	.	.	S	Bend	trans	-135.3	150.6	-178.2	-69.3	178.5	0	0	0	111.5	F147 L282 A285 E286 V296	F147-L291 HydrophobicContact CD2-CD1 4.12Å; F147-L291 HydrophobicContact CE2-CD1 3.7Å; F147-L291 HydrophobicContact CE2-CG 4.28Å; F147-L291 HydrophobicContact CZ-CD1 4.01Å; L282-L291 HydrophobicContact CD2-CD1 3.49Å; L282-L291 VanDerWaalsContact CD2-CD1 3.49Å; A285-L291 HydrophobicContact CB-CB 4.48Å; A285-L291 HydrophobicContact CB-CD1 3.89Å; A285-L291 HydrophobicContact CB-CG 4.14Å; A285-L291 PolarHBondContact O-N 3.32Å; E286-L291 WeakPolarHBondContact CA-O 3.26Å; L291-V296 HydrophobicContact CB-CG2 3.96Å; L291-V296 HydrophobicContact CD1-CG2 4.16Å
292	T	98.1	Very high	97.4	Very high	86 Å²	86	42.7 Å²	42.7	53%	0.528	22%	0.215	S	C	.	.			trans	-84.8	152	173.1	67.7	0	0	0	0	111.2	E294 N295 V296	T292-E294 PolarHBondContact O-N 3.13Å; T292-N295 PolarHBondContact O-N 2.84Å; T292-N295 WeakPolarHBondContact OG1-CB 3.47Å; T292-N295 PolarHBondContact OG1-N 3.34Å; T292-V296 PolarHBondContact O-N 3.28Å
293	R	97.6	Very high	97.5	Very high	120 Å²	120	43.1 Å²	43.1	45%	0.453	22%	0.217	S	C	.	.	H	α-helix	trans	-51	-43.9	174.8	-167.7	176.9	97.3	88.6	2.9	112.6	E256 E286 V296 N297	E256-R293 IonicContact OE1-CZ 2.67Å; E256-R293 VanDerWaalsContact OE1-CZ 3.23Å; E256-R293 IonicContact OE1-NH1 3.78Å; E256-R293 PolarHBondContact OE1-NH1 3.49Å; E256-R293 IonicContact OE1-NH2 3.16Å; E256-R293 PolarHBondContact OE1-NH2 2.92Å; E286-R293 WeakPolarHBondContact OE1-CA 3.34Å; E286-R293 WeakPolarHBondContact OE1-CB 3.46Å; E286-R293 VanDerWaalsContact OE1-CG 3.25Å; E286-R293 WeakPolarHBondContact OE1-CG 3.43Å; R293-V296 PolarHBondContact O-N 3.05Å; R293-N297 VanDerWaalsContact O-CG 3.31Å; R293-N297 PolarHBondContact O-N 3.34Å; R293-N297 PolarHBondContact O-OD1 2.78Å
294	E	97.8	Very high	97.5	Very high	118 Å²	118	43.1 Å²	43.1	55%	0.551	22%	0.216	S	C	*	.	H	α-helix	trans	-65.5	-40.1	179.8	-60.8	-173.4	164.1	0	0	112.1	K130 T292 N297 Q298	K130-E294 HydrophobicContact CD-CB 4.24Å; K130-E294 WeakPolarHBondContact CE-OE2 3.45Å; K130-E294 IonicContact NZ-OE2 2.91Å; K130-E294 PolarHBondContact NZ-OE2 2.9Å; T292-E294 PolarHBondContact O-N 3.13Å; E294-N297 PolarHBondContact O-N 3.31Å; E294-Q298 WeakPolarHBondContact O-CB 3.5Å; E294-Q298 PolarHBondContact O-N 3.18Å
295	N	98.1	Very high	97.6	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.005	21%	0.207	C	C	.	.	H	α-helix	trans	-68.8	-40.9	177.6	-164.1	26.6	0	0	0	111	K130 G131 T144 T292 Q298 C299	K130-N295 WeakPolarHBondContact CA-OD1 3.01Å; G131-N295 PolarHBondContact N-OD1 3.11Å; T144-N295 PolarHBondContact OG1-ND2 2.91Å; T144-N295 VanDerWaalsContact OG1-ND2 3.1Å; T292-N295 PolarHBondContact O-N 2.84Å; T292-N295 WeakPolarHBondContact OG1-CB 3.47Å; T292-N295 PolarHBondContact OG1-N 3.34Å; N295-Q298 PolarHBondContact O-N 2.94Å; N295-C299 WeakPolarHBondContact O-CB 3.48Å; N295-C299 PolarHBondContact O-N 3.21Å; N295-C299 PolarHBondContact O-SG 2.87Å
296	V	98.6	Very high	97.7	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.4	-49.5	173.4	168.2	0	0	0	0	111.4	L282 I283 E286 L291 T292 R293 Q298 C299 I300	L282-V296 HydrophobicContact CB-CB 4.45Å; L282-V296 HydrophobicContact CB-CG1 3.89Å; L282-V296 HydrophobicContact CB-CG2 4.03Å; L282-V296 WeakPolarHBondContact O-CG2 3.45Å; I283-V296 HydrophobicContact CG1-CG1 4.05Å; E286-V296 HydrophobicContact CB-CG2 3.9Å; L291-V296 HydrophobicContact CB-CG2 3.96Å; L291-V296 HydrophobicContact CD1-CG2 4.16Å; T292-V296 PolarHBondContact O-N 3.28Å; R293-V296 PolarHBondContact O-N 3.05Å; V296-Q298 VanDerWaalsContact C-N 3.32Å; V296-Q298 PolarHBondContact O-N 3.12Å; V296-C299 PolarHBondContact O-N 3.4Å; V296-I300 HydrophobicContact CG1-CD1 3.97Å; V296-I300 WeakPolarHBondContact O-CG1 3.35Å; V296-I300 PolarHBondContact O-N 3.35Å
297	N	98.5	Very high	97.8	Very high	22 Å²	22	41.6 Å²	41.6	12%	0.118	22%	0.217	C	C	.	.	H	α-helix	trans	-60.2	-43.3	179.8	-71.5	10.9	0	0	0	111.5	I259 R263 R293 E294 L301	I259-N297 HydrophobicContact CD1-CB 4.03Å; R263-N297 PolarHBondContact NH1-OD1 2.95Å; R263-N297 VanDerWaalsContact NH1-OD1 3.1Å; R263-N297 PolarHBondContact NH2-OD1 2.71Å; R293-N297 VanDerWaalsContact O-CG 3.31Å; R293-N297 PolarHBondContact O-N 3.34Å; R293-N297 PolarHBondContact O-OD1 2.78Å; E294-N297 PolarHBondContact O-N 3.31Å; N297-L301 PolarHBondContact O-N 3.4Å; N297-L301 VanDerWaalsContact O-N 3.11Å
298	Q	98.7	Very high	97.9	Very high	9 Å²	9	35.3 Å²	35.3	4%	0.042	19%	0.19	C	C	.	.	H	α-helix	trans	-65.7	-38.3	176.3	-175.9	62.9	28.8	0	0	112.1	G126 K130 Y220 E294 N295 V296 L301 E302	G126-Q298 VanDerWaalsContact O-CD 3.24Å; G126-Q298 WeakPolarHBondContact O-CG 3.34Å; G126-Q298 PolarHBondContact O-OE1 2.96Å; K130-Q298 HydrophobicContact CB-CB 4.08Å; K130-Q298 HydrophobicContact CB-CG 3.91Å; Y220-Q298 PolarHBondContact OH-NE2 3.39Å; E294-Q298 WeakPolarHBondContact O-CB 3.5Å; E294-Q298 PolarHBondContact O-N 3.18Å; N295-Q298 PolarHBondContact O-N 2.94Å; V296-Q298 VanDerWaalsContact C-N 3.32Å; V296-Q298 PolarHBondContact O-N 3.12Å; Q298-L301 PolarHBondContact O-N 3.46Å; Q298-E302 HydrophobicContact CG-CG 4.47Å; Q298-E302 PolarHBondContact NE2-OE1 3.04Å; Q298-E302 WeakPolarHBondContact O-CG 3.36Å; Q298-E302 PolarHBondContact O-N 3.42Å
299	C	98.9	Very high	98	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.9	-41.6	178.6	-71	0	0	0	0	112.5	T144 F148 F278 L282 N295 V296 L301 E302 M303	T144-C299 WeakPolarHBondContact CG2-SG 3.36Å; F148-C299 HydrophobicContact CE2-CB 3.9Å; F148-C299 HydrophobicContact CZ-CB 3.9Å; F148-C299 WeakPolarHBondContact CZ-O 3.2Å; F278-C299 HydrophobicContact CZ-CB 4.22Å; L282-C299 HydrophobicContact CD1-CB 3.56Å; L282-C299 HydrophobicContact CD2-CB 4.37Å; N295-C299 WeakPolarHBondContact O-CB 3.48Å; N295-C299 PolarHBondContact O-N 3.21Å; N295-C299 PolarHBondContact O-SG 2.87Å; V296-C299 PolarHBondContact O-N 3.4Å; C299-L301 VanDerWaalsContact C-N 3.35Å; C299-E302 PolarHBondContact O-N 2.92Å; C299-M303 PolarHBondContact O-N 3.18Å
300	I	98.8	Very high	98.1	Very high	3 Å²	3	28.8 Å²	28.8	2%	0.015	15%	0.153	C	C	.	.	H	α-helix	trans	-64.4	-43	175.9	-66	170	0	0	0	110	L204 I255 I259 F278 A279 L282 V296 M303 L304	L204-I300 HydrophobicContact CD1-CG2 4.39Å; L204-I300 HydrophobicContact CD2-CG2 4.32Å; I255-I300 HydrophobicContact CG2-CG2 4.49Å; I259-I300 HydrophobicContact CD1-CB 3.94Å; I259-I300 HydrophobicContact CD1-CD1 3.91Å; I259-I300 HydrophobicContact CD1-CG2 4.01Å; I259-I300 HydrophobicContact CG1-CB 4.37Å; I259-I300 HydrophobicContact CG1-CD1 3.88Å; I259-I300 HydrophobicContact CG1-CG2 3.99Å; I259-I300 HydrophobicContact CG2-CD1 4.13Å; F278-I300 HydrophobicContact CE1-CG1 4.46Å; A279-I300 HydrophobicContact CB-CD1 3.81Å; A279-I300 HydrophobicContact CB-CG1 4.18Å; L282-I300 HydrophobicContact CD1-CG1 3.9Å; V296-I300 HydrophobicContact CG1-CD1 3.97Å; V296-I300 WeakPolarHBondContact O-CG1 3.35Å; V296-I300 PolarHBondContact O-N 3.35Å; I300-M303 PolarHBondContact O-N 3.1Å; I300-L304 HydrophobicContact CG2-CD1 4.28Å; I300-L304 WeakPolarHBondContact O-CG 3.33Å; I300-L304 PolarHBondContact O-N 2.85Å; I300-L304 VanDerWaalsContact O-N 3.11Å
301	L	98.8	Very high	98.3	Very high	3 Å²	3	24.8 Å²	24.8	2%	0.016	13%	0.131	C	C	.	.	H	α-helix	trans	-57.4	-52.1	173.3	-178.2	158.5	0	0	0	111.5	Y220 L251 K252 I255 N297 Q298 C299 M303 L304 I305	Y220-L301 HydrophobicContact CE1-CD2 3.91Å; Y220-L301 HydrophobicContact CE2-CD1 4.28Å; Y220-L301 HydrophobicContact CE2-CD2 4.23Å; L251-L301 HydrophobicContact CD2-CD1 4.22Å; L251-L301 HydrophobicContact CD2-CG 4.3Å; L251-L301 HydrophobicContact CG-CD1 4.38Å; K252-L301 HydrophobicContact CG-CD1 3.85Å; I255-L301 HydrophobicContact CD1-CB 3.79Å; I255-L301 HydrophobicContact CD1-CD1 3.9Å; I255-L301 HydrophobicContact CD1-CG 3.56Å; I255-L301 HydrophobicContact CG2-CB 4.46Å; N297-L301 PolarHBondContact O-N 3.4Å; N297-L301 VanDerWaalsContact O-N 3.11Å; Q298-L301 PolarHBondContact O-N 3.46Å; C299-L301 VanDerWaalsContact C-N 3.35Å; L301-M303 VanDerWaalsContact C-N 3.26Å; L301-M303 PolarHBondContact O-N 3.16Å; L301-L304 PolarHBondContact O-N 3.39Å; L301-L304 VanDerWaalsContact O-N 3.08Å; L301-I305 HydrophobicContact CD2-CD1 3.88Å; L301-I305 HydrophobicContact CD2-CG1 4.41Å; L301-I305 HydrophobicContact CD2-CG2 4.14Å; L301-I305 WeakPolarHBondContact O-CG2 3.28Å; L301-I305 PolarHBondContact O-N 3.1Å
302	E	98.8	Very high	98.4	Very high	2 Å²	2	24.2 Å²	24.2	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-59.4	-36.1	-179.4	-76.4	-173.2	-170	0	0	112.8	M127 G131 I132 I133 F148 Q298 C299 A306	M127-E302 HydrophobicContact CE-CG 4.49Å; G131-E302 WeakPolarHBondContact CA-OE2 3.5Å; I132-E302 PolarHBondContact N-OE2 3Å; I133-E302 HydrophobicContact CD1-CB 3.96Å; I133-E302 HydrophobicContact CD1-CG 3.84Å; I133-E302 HydrophobicContact CG1-CB 4.45Å; I133-E302 HydrophobicContact CG1-CG 4.3Å; I133-E302 WeakPolarHBondContact CG1-OE2 3.48Å; I133-E302 PolarHBondContact N-OE2 3.41Å; F148-E302 HydrophobicContact CZ-CB 4.33Å; Q298-E302 HydrophobicContact CG-CG 4.47Å; Q298-E302 PolarHBondContact NE2-OE1 3.04Å; Q298-E302 WeakPolarHBondContact O-CG 3.36Å; Q298-E302 PolarHBondContact O-N 3.42Å; C299-E302 PolarHBondContact O-N 2.92Å; E302-A306 WeakPolarHBondContact O-CB 3.16Å; E302-A306 PolarHBondContact O-N 3.21Å
303	M	98.8	Very high	98.4	Very high	9 Å²	9	20.3 Å²	20.3	4%	0.044	10%	0.104	C	C	.	.	H	α-helix	trans	-66.3	-41	175.4	-173.2	64.2	81.1	0	0	112.3	F148 A151 L152 F203 F278 C299 I300 L301	F148-M303 HydrophobicContact CB-CE 4.44Å; F148-M303 HydrophobicContact CD1-CE 3.3Å; F148-M303 HydrophobicContact CD1-SD 4.25Å; F148-M303 HydrophobicContact CE1-CB 4.18Å; F148-M303 HydrophobicContact CE1-CE 3.76Å; F148-M303 HydrophobicContact CE1-SD 4.41Å; F148-M303 HydrophobicContact CG-CE 4.06Å; A151-M303 HydrophobicContact CB-CE 4.39Å; L152-M303 HydrophobicContact CD1-CE 4.18Å; L152-M303 HydrophobicContact CD1-SD 4.47Å; L152-M303 HydrophobicContact CD2-CE 4.23Å; L152-M303 HydrophobicContact CD2-SD 3.92Å; L152-M303 HydrophobicContact CG-CE 4.1Å; L152-M303 HydrophobicContact CG-SD 4.4Å; F203-M303 HydrophobicContact CB-CG 3.9Å; F203-M303 HydrophobicContact CD1-CE 4.44Å; F203-M303 HydrophobicContact CD1-CG 4.31Å; F203-M303 HydrophobicContact CD1-SD 4.35Å; F203-M303 HydrophobicContact CD2-CG 3.44Å; F203-M303 VanDerWaalsContact CD2-CG 3.44Å; F203-M303 HydrophobicContact CD2-SD 3.81Å; F203-M303 HydrophobicContact CE1-CE 4.47Å; F203-M303 HydrophobicContact CE1-SD 4.29Å; F203-M303 HydrophobicContact CE2-CG 4.02Å; F203-M303 HydrophobicContact CE2-SD 3.75Å; F203-M303 HydrophobicContact CG-CG 3.62Å; F203-M303 HydrophobicContact CG-SD 4.14Å; F203-M303 HydrophobicContact CZ-SD 4Å; F278-M303 HydrophobicContact CD1-CB 3.98Å; F278-M303 HydrophobicContact CD1-CE 3.92Å; F278-M303 HydrophobicContact CD1-CG 3.9Å; F278-M303 HydrophobicContact CD2-CE 3.73Å; F278-M303 HydrophobicContact CE1-CB 3.52Å; F278-M303 HydrophobicContact CE1-CE 3.8Å; F278-M303 HydrophobicContact CE1-CG 3.91Å; F278-M303 HydrophobicContact CE2-CE 3.6Å; F278-M303 HydrophobicContact CG-CE 3.87Å; F278-M303 HydrophobicContact CZ-CB 4.21Å; F278-M303 HydrophobicContact CZ-CE 3.62Å; C299-M303 PolarHBondContact O-N 3.18Å; I300-M303 PolarHBondContact O-N 3.1Å; L301-M303 VanDerWaalsContact C-N 3.26Å; L301-M303 PolarHBondContact O-N 3.16Å
304	L	98.6	Very high	98.4	Very high	2 Å²	2	15.3 Å²	15.3	1%	0.01	9%	0.088	C	C	.	.	H	α-helix	trans	-74.4	-30.2	-177.6	-70.2	178.8	0	0	0	113.7	N200 L204 I255 I300 L301 P308	N200-L304 HydrophobicContact CB-CD2 4.46Å; L204-L304 HydrophobicContact CD2-CD1 3.86Å; I255-L304 HydrophobicContact CD1-CD1 4.48Å; I300-L304 HydrophobicContact CG2-CD1 4.28Å; I300-L304 WeakPolarHBondContact O-CG 3.33Å; I300-L304 PolarHBondContact O-N 2.85Å; I300-L304 VanDerWaalsContact O-N 3.11Å; L301-L304 PolarHBondContact O-N 3.39Å; L301-L304 VanDerWaalsContact O-N 3.08Å; L304-P308 WeakPolarHBondContact O-CD 3.3Å; L304-P308 WeakPolarHBondContact O-CG 3.36Å
305	I	98.4	Very high	98.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-83.2	-26.3	179.6	67.2	172.1	0	0	0	113.3	M127 I217 Y220 L251 L301 A307 P308 D309	M127-I305 HydrophobicContact CE-CD1 4.34Å; I217-I305 HydrophobicContact CB-CG2 4.38Å; I217-I305 HydrophobicContact CD1-CG2 4.13Å; I217-I305 HydrophobicContact CG1-CG2 3.84Å; I217-I305 HydrophobicContact CG2-CB 3.94Å; I217-I305 HydrophobicContact CG2-CG2 3.84Å; Y220-I305 HydrophobicContact CD1-CD1 3.87Å; Y220-I305 HydrophobicContact CE1-CD1 3.61Å; L251-I305 HydrophobicContact CD2-CG2 3.94Å; L301-I305 HydrophobicContact CD2-CD1 3.88Å; L301-I305 HydrophobicContact CD2-CG1 4.41Å; L301-I305 HydrophobicContact CD2-CG2 4.14Å; L301-I305 WeakPolarHBondContact O-CG2 3.28Å; L301-I305 PolarHBondContact O-N 3.1Å; I305-A307 PolarHBondContact O-N 3.37Å; I305-P308 WeakPolarHBondContact O-CD 3.37Å; I305-D309 WeakPolarHBondContact O-CB 3.11Å; I305-D309 VanDerWaalsContact O-CG 3.29Å; I305-D309 PolarHBondContact O-N 3Å
306	A	98.3	Very high	98.5	Very high	42 Å²	42	9.8 Å²	9.8	35%	0.347	6%	0.062	S	C	.	.	H	α-helix	trans	-58.8	-44.9	-168.6	0	0	0	0	0	113.8	E302 T310	E302-A306 WeakPolarHBondContact O-CB 3.16Å; E302-A306 PolarHBondContact O-N 3.21Å; A306-T310 PolarHBondContact O-N 3.37Å; A306-T310 PolarHBondContact O-OG1 3.47Å
307	A	98.2	Very high	98.6	Very high	7 Å²	7	9.9 Å²	9.9	6%	0.058	6%	0.062	C	C	.	.	H	α-helix	trans	-75.1	-48.5	179.5	0	0	0	0	0	112.4	M195 I305 D309 T310 M311	M195-A307 HydrophobicContact CB-CB 4.01Å; M195-A307 HydrophobicContact CG-CB 4.32Å; M195-A307 HydrophobicContact SD-CB 4.21Å; I305-A307 PolarHBondContact O-N 3.37Å; A307-D309 VanDerWaalsContact C-N 3.27Å; A307-D309 PolarHBondContact O-N 2.92Å; A307-T310 PolarHBondContact O-N 3.47Å; A307-M311 HydrophobicContact CB-CB 4.49Å; A307-M311 HydrophobicContact CB-CG 4.12Å; A307-M311 VanDerWaalsContact O-CB 3.23Å; A307-M311 WeakPolarHBondContact O-CB 3.22Å; A307-M311 PolarHBondContact O-N 2.99Å
308	P	98.6	Very high	98.6	Very high	2 Å²	2	9 Å²	9	1%	0.013	6%	0.057	C	C	.	.	H	α-helix	trans	-52.8	-40.5	173.6	-29.8	36.1	0	0	0	114.1	M195 L196 I217 L304 I305 S312	M195-P308 HydrophobicContact CB-CB 4.45Å; M195-P308 HydrophobicContact CB-CG 3.99Å; L196-P308 HydrophobicContact CB-CG 4.07Å; I217-P308 HydrophobicContact CD1-CB 4.48Å; I217-P308 HydrophobicContact CD1-CG 4.2Å; I217-P308 HydrophobicContact CG2-CB 4.22Å; L304-P308 WeakPolarHBondContact O-CD 3.3Å; L304-P308 WeakPolarHBondContact O-CG 3.36Å; I305-P308 WeakPolarHBondContact O-CD 3.37Å; P308-S312 WeakPolarHBondContact O-CB 3.46Å; P308-S312 PolarHBondContact O-OG 2.65Å
309	D	96.4	Very high	98.6	Very high	18 Å²	18	8.6 Å²	8.6	10%	0.096	6%	0.056	C	C	.	.	H	α-helix	trans	-71.8	-40.9	-177.5	-71.9	-18	0	0	0	113.1	I217 F221 I305 A307	I217-D309 WeakPolarHBondContact CG2-OD1 3.36Å; F221-D309 HydrophobicContact CD2-CB 4.2Å; I305-D309 WeakPolarHBondContact O-CB 3.11Å; I305-D309 VanDerWaalsContact O-CG 3.29Å; I305-D309 PolarHBondContact O-N 3Å; A307-D309 VanDerWaalsContact C-N 3.27Å; A307-D309 PolarHBondContact O-N 2.92Å
310	T	98.3	Very high	98.6	Very high	56 Å²	56	8.6 Å²	8.6	34%	0.344	6%	0.056	S	C	.	.	H	α-helix	trans	-107.3	-41.8	-168.4	59.7	0	0	0	0	114.1	A306 A307 S314 V370	A306-T310 PolarHBondContact O-N 3.37Å; A306-T310 PolarHBondContact O-OG1 3.47Å; A307-T310 PolarHBondContact O-N 3.47Å; T310-S314 WeakPolarHBondContact O-CB 3.34Å; T310-S314 PolarHBondContact O-N 3.39Å; T310-S314 VanDerWaalsContact O-N 3.12Å; T310-S314 PolarHBondContact O-OG 2.93Å; T310-V370 HydrophobicContact CG2-CG2 4.12Å
311	M	98.4	Very high	98.6	Very high	9 Å²	9	8.6 Å²	8.6	4%	0.044	6%	0.055	C	C	.	.	H	α-helix	trans	-75.8	-40.5	-174	-66.1	-77.9	-62	0	0	111.2	M195 A307 V313 S314 L315 A443 M446 M447	M195-M311 HydrophobicContact CE-CB 4.2Å; M195-M311 HydrophobicContact CG-CB 3.96Å; M195-M311 HydrophobicContact SD-CB 3.46Å; M195-M311 WeakPolarHBondContact SD-CB 3.32Å; M195-M311 HydrophobicContact SD-CE 4.46Å; M195-M311 HydrophobicContact SD-CG 4.21Å; A307-M311 HydrophobicContact CB-CB 4.49Å; A307-M311 HydrophobicContact CB-CG 4.12Å; A307-M311 VanDerWaalsContact O-CB 3.23Å; A307-M311 WeakPolarHBondContact O-CB 3.22Å; A307-M311 PolarHBondContact O-N 2.99Å; M311-V313 VanDerWaalsContact C-N 3.35Å; M311-V313 PolarHBondContact O-N 2.88Å; M311-S314 PolarHBondContact O-N 2.75Å; M311-L315 WeakPolarHBondContact O-CB 3.49Å; M311-L315 WeakPolarHBondContact O-CG 3.35Å; M311-L315 PolarHBondContact O-N 3.19Å; M311-A443 HydrophobicContact SD-CB 3.76Å; M311-M446 HydrophobicContact CE-CB 3.55Å; M311-M446 HydrophobicContact CE-CE 3.86Å; M311-M446 HydrophobicContact CG-CE 4.27Å; M311-M446 HydrophobicContact SD-CE 4.18Å; M311-M447 HydrophobicContact CE-CB 4.37Å; M311-M447 HydrophobicContact CE-CG 3.32Å; M311-M447 HydrophobicContact CE-SD 4.4Å; M311-M447 HydrophobicContact SD-CG 4.01Å; M311-M447 HydrophobicContact SD-SD 4.36Å
312	S	98.8	Very high	98.5	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.1	-46.9	179.2	70.6	0	0	0	0	111.4	L191 R192 P308 L315 F316	L191-S312 VanDerWaalsContact CD1-O 3.31Å; L191-S312 WeakPolarHBondContact CD1-O 3.24Å; R192-S312 WeakPolarHBondContact CG-OG 3.26Å; P308-S312 WeakPolarHBondContact O-CB 3.46Å; P308-S312 PolarHBondContact O-OG 2.65Å; S312-L315 PolarHBondContact O-N 3.48Å; S312-F316 VanDerWaalsContact O-CB 3.23Å; S312-F316 WeakPolarHBondContact O-CB 3.39Å; S312-F316 PolarHBondContact O-N 3.02Å
313	V	98.8	Very high	98.5	Very high	3 Å²	3	9.4 Å²	9.4	2%	0.018	6%	0.063	C	C	.	.	H	α-helix	trans	-69	-37.2	179	-172.6	0	0	0	0	111.5	L188 M311 F316 F317 V369 H480	L188-V313 HydrophobicContact CD2-CG2 4.37Å; M311-V313 VanDerWaalsContact C-N 3.35Å; M311-V313 PolarHBondContact O-N 2.88Å; V313-F316 WeakPolarHBondContact O-CB 3.43Å; V313-F316 PolarHBondContact O-N 2.69Å; V313-F317 HydrophobicContact CG1-CD2 4.14Å; V313-F317 HydrophobicContact CG1-CE2 3.73Å; V313-F317 HydrophobicContact CG1-CZ 4.26Å; V313-F317 WeakPolarHBondContact O-CD2 3.34Å; V313-F317 PolarHBondContact O-N 3.37Å; V313-V369 HydrophobicContact CB-CG1 4.13Å; V313-V369 HydrophobicContact CB-CG2 3.97Å; V313-V369 HydrophobicContact CG1-CG1 4.16Å; V313-V369 HydrophobicContact CG1-CG2 3.7Å; V313-H480 HydrophobicContact CG1-CB 3.93Å; V313-H480 HydrophobicContact CG2-CB 4.46Å
314	S	98.9	Very high	98.4	Very high	16 Å²	16	12.4 Å²	12.4	11%	0.112	8%	0.076	C	C	.	.	H	α-helix	trans	-65.5	-47	177.7	-60.9	0	0	0	0	111.1	T310 M311 F316 F317 M318 V369	T310-S314 WeakPolarHBondContact O-CB 3.34Å; T310-S314 PolarHBondContact O-N 3.39Å; T310-S314 VanDerWaalsContact O-N 3.12Å; T310-S314 PolarHBondContact O-OG 2.93Å; M311-S314 PolarHBondContact O-N 2.75Å; S314-F316 VanDerWaalsContact C-N 3.33Å; S314-F317 PolarHBondContact O-N 3.47Å; S314-M318 VanDerWaalsContact O-CG 3.23Å; S314-M318 WeakPolarHBondContact O-CG 3.43Å; S314-M318 PolarHBondContact O-N 3.41Å; S314-V369 WeakPolarHBondContact OG-CG2 3.16Å
315	L	98.9	Very high	98.4	Very high	1 Å²	1	14.6 Å²	14.6	1%	0.005	9%	0.086	C	C	.	.	H	α-helix	trans	-66.1	-36.4	176.8	-77.1	164.6	0	0	0	111.8	L191 M195 M311 S312 M318 L319 M447 I450 L451	L191-L315 HydrophobicContact CD1-CB 3.74Å; L191-L315 HydrophobicContact CD2-CB 4.23Å; L191-L315 HydrophobicContact CD2-CD1 4.28Å; M195-L315 HydrophobicContact CE-CD1 3.34Å; M311-L315 WeakPolarHBondContact O-CB 3.49Å; M311-L315 WeakPolarHBondContact O-CG 3.35Å; M311-L315 PolarHBondContact O-N 3.19Å; S312-L315 PolarHBondContact O-N 3.48Å; L315-M318 HydrophobicContact CD2-SD 4.16Å; L315-M318 WeakPolarHBondContact O-CB 3.29Å; L315-M318 PolarHBondContact O-N 3.14Å; L315-L319 VanDerWaalsContact O-CG 3.27Å; L315-L319 WeakPolarHBondContact O-CG 3.45Å; L315-L319 PolarHBondContact O-N 2.97Å; L315-M447 HydrophobicContact CD2-CB 4.25Å; L315-M447 HydrophobicContact CD2-CG 4.19Å; L315-M447 HydrophobicContact CG-CG 4.3Å; L315-I450 HydrophobicContact CD1-CB 4.36Å; L315-I450 HydrophobicContact CD1-CD1 4.16Å; L315-I450 HydrophobicContact CD1-CG2 3.97Å; L315-I450 HydrophobicContact CD2-CG2 4.39Å; L315-L451 HydrophobicContact CD2-CD1 4.07Å; L315-L451 HydrophobicContact CD2-CD2 3.81Å; L315-L451 HydrophobicContact CD2-CG 3.62Å
316	F	98.8	Very high	98.4	Very high	1 Å²	1	18.2 Å²	18.2	0%	0.004	11%	0.109	C	C	.	.	H	α-helix	trans	-56.9	-52	171.9	170.3	-94.2	0	0	0	111.6	V187 L188 L191 S312 V313 S314 M318 L319 F320 I471 P481 L488	V187-F316 HydrophobicContact CB-CD2 4.22Å; V187-F316 HydrophobicContact CG1-CD2 4.09Å; L188-F316 HydrophobicContact CD1-CD2 4.49Å; L188-F316 HydrophobicContact CD1-CE2 4.39Å; L188-F316 HydrophobicContact CD2-CB 3.78Å; L188-F316 HydrophobicContact CD2-CD1 4.3Å; L188-F316 HydrophobicContact CD2-CD2 3.93Å; L188-F316 HydrophobicContact CD2-CG 3.74Å; L188-F316 HydrophobicContact CG-CB 4.5Å; L188-F316 HydrophobicContact CG-CD2 3.73Å; L188-F316 HydrophobicContact CG-CE2 4.04Å; L188-F316 HydrophobicContact CG-CG 4.06Å; L191-F316 HydrophobicContact CD1-CB 4.19Å; S312-F316 VanDerWaalsContact O-CB 3.23Å; S312-F316 WeakPolarHBondContact O-CB 3.39Å; S312-F316 PolarHBondContact O-N 3.02Å; V313-F316 WeakPolarHBondContact O-CB 3.43Å; V313-F316 PolarHBondContact O-N 2.69Å; S314-F316 VanDerWaalsContact C-N 3.33Å; F316-M318 VanDerWaalsContact C-N 3.31Å; F316-M318 PolarHBondContact O-N 3.14Å; F316-L319 PolarHBondContact O-N 2.95Å; F316-F320 HydrophobicContact CD2-CD2 4.28Å; F316-F320 HydrophobicContact CD2-CE2 4.06Å; F316-F320 HydrophobicContact CE1-CD2 4.1Å; F316-F320 HydrophobicContact CE1-CE2 4.06Å; F316-F320 AromaticContact CE2-CD2 3.87Å; F316-F320 HydrophobicContact CE2-CD2 3.87Å; F316-F320 AromaticContact CE2-CE2 3.29Å; F316-F320 HydrophobicContact CE2-CE2 3.29Å; F316-F320 HydrophobicContact CE2-CZ 4.13Å; F316-F320 AromaticContact CZ-CD2 3.76Å; F316-F320 HydrophobicContact CZ-CD2 3.76Å; F316-F320 AromaticContact CZ-CE2 3.26Å; F316-F320 HydrophobicContact CZ-CE2 3.26Å; F316-F320 AromaticContact CZ-CZ 3.8Å; F316-F320 HydrophobicContact CZ-CZ 3.8Å; F316-F320 WeakPolarHBondContact O-CD2 3.3Å; F316-F320 PolarHBondContact O-N 3.09Å; F316-F320 VanDerWaalsContact O-N 3.09Å; F316-I471 HydrophobicContact CE1-CD1 3.85Å; F316-I471 HydrophobicContact CZ-CD1 4.12Å; F316-P481 HydrophobicContact CD1-CG 3.78Å; F316-P481 HydrophobicContact CE1-CB 4.38Å; F316-P481 HydrophobicContact CE1-CG 3.42Å; F316-P481 VanDerWaalsContact CE1-CG 3.42Å; F316-P481 HydrophobicContact CZ-CG 4.2Å; F316-L488 HydrophobicContact CE2-CB 4.35Å; F316-L488 VanDerWaalsContact CE2-O 3.25Å; F316-L488 WeakPolarHBondContact CE2-O 3.45Å; F316-L488 HydrophobicContact CZ-CB 4.15Å; F316-L488 HydrophobicContact CZ-CD2 4.11Å
317	F	98.9	Very high	98.3	Very high	2 Å²	2	21.3 Å²	21.3	1%	0.009	12%	0.12	C	C	.	.	H	α-helix	trans	-63.3	-37.5	176.3	-71.2	-40.2	0	0	0	112.5	V313 S314 F320 L321 Q367 V369 V468 I471 K473 P481	V313-F317 HydrophobicContact CG1-CD2 4.14Å; V313-F317 HydrophobicContact CG1-CE2 3.73Å; V313-F317 HydrophobicContact CG1-CZ 4.26Å; V313-F317 WeakPolarHBondContact O-CD2 3.34Å; V313-F317 PolarHBondContact O-N 3.37Å; S314-F317 PolarHBondContact O-N 3.47Å; F317-F320 PolarHBondContact O-N 3.27Å; F317-L321 WeakPolarHBondContact O-CG 3.49Å; F317-L321 PolarHBondContact O-N 3.45Å; F317-Q367 HydrophobicContact CB-CG 3.98Å; F317-Q367 HydrophobicContact CD1-CG 4.03Å; F317-Q367 HydrophobicContact CD2-CG 3.65Å; F317-Q367 HydrophobicContact CE1-CG 4.43Å; F317-Q367 HydrophobicContact CE2-CG 4.07Å; F317-Q367 HydrophobicContact CG-CG 3.64Å; F317-Q367 HydrophobicContact CZ-CG 4.45Å; F317-V369 HydrophobicContact CD2-CG2 3.82Å; F317-V369 HydrophobicContact CE2-CG2 3.98Å; F317-V468 HydrophobicContact CB-CG1 4.44Å; F317-V468 HydrophobicContact CD1-CG1 4.15Å; F317-I471 HydrophobicContact CE1-CD1 4.38Å; F317-K473 HydrophobicContact CE1-CD 4.43Å; F317-K473 HydrophobicContact CZ-CD 4.15Å; F317-K473 HydrophobicContact CZ-CG 4.35Å; F317-P481 HydrophobicContact CE1-CG 3.87Å; F317-P481 HydrophobicContact CZ-CG 3.93Å
318	M	98.9	Very high	98.4	Very high	3 Å²	3	21.4 Å²	21.4	2%	0.015	12%	0.12	C	C	.	.	H	α-helix	trans	-60	-44	173.9	-74	166.8	-169.2	0	0	111.9	S314 L315 F316 F320 L321 I322 F359 I360 M364 M447 L451	S314-M318 VanDerWaalsContact O-CG 3.23Å; S314-M318 WeakPolarHBondContact O-CG 3.43Å; S314-M318 PolarHBondContact O-N 3.41Å; L315-M318 HydrophobicContact CD2-SD 4.16Å; L315-M318 WeakPolarHBondContact O-CB 3.29Å; L315-M318 PolarHBondContact O-N 3.14Å; F316-M318 VanDerWaalsContact C-N 3.31Å; F316-M318 PolarHBondContact O-N 3.14Å; M318-F320 VanDerWaalsContact C-N 3.35Å; M318-F320 PolarHBondContact O-N 3.45Å; M318-L321 WeakPolarHBondContact O-CB 3.3Å; M318-L321 PolarHBondContact O-N 2.81Å; M318-I322 WeakPolarHBondContact O-CG1 3.37Å; M318-I322 PolarHBondContact O-N 2.72Å; M318-F359 HydrophobicContact CB-CE1 3.81Å; M318-F359 HydrophobicContact CB-CZ 3.68Å; M318-F359 HydrophobicContact CG-CE1 3.92Å; M318-F359 HydrophobicContact CG-CZ 3.97Å; M318-F359 WeakPolarHBondContact O-CZ 3.3Å; M318-F359 HydrophobicContact SD-CE1 4.48Å; M318-I360 HydrophobicContact CE-CB 4.35Å; M318-I360 HydrophobicContact CE-CG1 4.44Å; M318-I360 HydrophobicContact CE-CG2 3.87Å; M318-I360 HydrophobicContact SD-CG1 4.25Å; M318-M364 HydrophobicContact CE-CG 3.85Å; M318-M447 HydrophobicContact CE-SD 3.6Å; M318-M447 HydrophobicContact SD-SD 4.07Å; M318-L451 HydrophobicContact CB-CD2 4.47Å; M318-L451 HydrophobicContact SD-CD1 4.11Å
319	L	98.8	Very high	98.4	Very high	1 Å²	1	21.9 Å²	21.9	1%	0.005	12%	0.122	C	C	.	.	H	α-helix	trans	-65.3	-39	178.3	-68.7	167	0	0	0	111.7	V187 L191 L315 F316 I322 A323 L451 L454 L455 V460 M490	V187-L319 HydrophobicContact CG1-CD1 3.66Å; L191-L319 HydrophobicContact CD1-CD1 4.22Å; L315-L319 VanDerWaalsContact O-CG 3.27Å; L315-L319 WeakPolarHBondContact O-CG 3.45Å; L315-L319 PolarHBondContact O-N 2.97Å; F316-L319 PolarHBondContact O-N 2.95Å; L319-I322 PolarHBondContact O-N 3.45Å; L319-A323 WeakPolarHBondContact O-CB 3.35Å; L319-A323 PolarHBondContact O-N 3.19Å; L319-L451 HydrophobicContact CD2-CD2 4.17Å; L319-L454 HydrophobicContact CD1-CD1 4.04Å; L319-L454 HydrophobicContact CD2-CD1 4.11Å; L319-L454 HydrophobicContact CD2-CD2 3.86Å; L319-L455 HydrophobicContact CD2-CD2 4.43Å; L319-V460 HydrophobicContact CD2-CG1 4.21Å; L319-V460 HydrophobicContact CD2-CG2 4.37Å; L319-M490 HydrophobicContact CB-CE 4.05Å; L319-M490 HydrophobicContact CB-SD 3.76Å
320	F	98.6	Very high	98.4	Very high	1 Å²	1	27.7 Å²	27.7	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-63.7	-38.9	172.5	-92.2	-106.5	0	0	0	112.7	F316 F317 M318 K324 T462 Q466 V468 I471 M490	F316-F320 HydrophobicContact CD2-CD2 4.28Å; F316-F320 HydrophobicContact CD2-CE2 4.06Å; F316-F320 HydrophobicContact CE1-CD2 4.1Å; F316-F320 HydrophobicContact CE1-CE2 4.06Å; F316-F320 AromaticContact CE2-CD2 3.87Å; F316-F320 HydrophobicContact CE2-CD2 3.87Å; F316-F320 AromaticContact CE2-CE2 3.29Å; F316-F320 HydrophobicContact CE2-CE2 3.29Å; F316-F320 HydrophobicContact CE2-CZ 4.13Å; F316-F320 AromaticContact CZ-CD2 3.76Å; F316-F320 HydrophobicContact CZ-CD2 3.76Å; F316-F320 AromaticContact CZ-CE2 3.26Å; F316-F320 HydrophobicContact CZ-CE2 3.26Å; F316-F320 AromaticContact CZ-CZ 3.8Å; F316-F320 HydrophobicContact CZ-CZ 3.8Å; F316-F320 WeakPolarHBondContact O-CD2 3.3Å; F316-F320 PolarHBondContact O-N 3.09Å; F316-F320 VanDerWaalsContact O-N 3.09Å; F317-F320 PolarHBondContact O-N 3.27Å; M318-F320 VanDerWaalsContact C-N 3.35Å; M318-F320 PolarHBondContact O-N 3.45Å; F320-K324 PolarHBondContact O-N 3.47Å; F320-T462 HydrophobicContact CD1-CG2 3.5Å; F320-T462 HydrophobicContact CE1-CG2 3.74Å; F320-T462 HydrophobicContact CG-CG2 4.02Å; F320-T462 HydrophobicContact CZ-CG2 4.4Å; F320-Q466 HydrophobicContact CE1-CB 4.03Å; F320-V468 HydrophobicContact CB-CG1 3.47Å; F320-V468 VanDerWaalsContact CB-CG1 3.47Å; F320-V468 HydrophobicContact CG-CG1 4.43Å; F320-I471 HydrophobicContact CD1-CD1 3.7Å; F320-I471 HydrophobicContact CE1-CD1 3.71Å; F320-I471 HydrophobicContact CE1-CG1 4.32Å; F320-I471 HydrophobicContact CG-CD1 4.13Å; F320-I471 HydrophobicContact CZ-CD1 4.19Å; F320-M490 HydrophobicContact CD2-CE 4.21Å; F320-M490 HydrophobicContact CD2-CG 4.25Å; F320-M490 HydrophobicContact CD2-SD 3.73Å; F320-M490 HydrophobicContact CE2-CE 4.45Å; F320-M490 HydrophobicContact CE2-CG 3.61Å; F320-M490 HydrophobicContact CE2-SD 3.7Å; F320-M490 HydrophobicContact CZ-CG 4.19Å
321	L	98.7	Very high	98.5	Very high	2 Å²	2	26.9 Å²	26.9	1%	0.01	15%	0.148	C	C	.	.	H	α-helix	trans	-64.7	-47.3	174.8	-74.9	163.2	0	0	0	110.9	F317 M318 A323 K324 H325 F359 Y366 F413 V468	F317-L321 WeakPolarHBondContact O-CG 3.49Å; F317-L321 PolarHBondContact O-N 3.45Å; M318-L321 WeakPolarHBondContact O-CB 3.3Å; M318-L321 PolarHBondContact O-N 2.81Å; L321-A323 VanDerWaalsContact C-N 3.32Å; L321-A323 PolarHBondContact O-N 2.95Å; L321-K324 CarbonylContact O-C 3.53Å; L321-K324 PolarHBondContact O-N 2.76Å; L321-H325 WeakPolarHBondContact O-CB 3.39Å; L321-H325 PolarHBondContact O-CD2 3.26Å; L321-H325 PolarHBondContact O-N 2.96Å; L321-F359 HydrophobicContact CB-CE2 4.24Å; L321-Y366 HydrophobicContact CD2-CD1 4.27Å; L321-Y366 HydrophobicContact CD2-CE1 4.42Å; L321-F413 HydrophobicContact CB-CE2 4.4Å; L321-F413 HydrophobicContact CB-CZ 4.18Å; L321-F413 HydrophobicContact CD1-CD2 4.06Å; L321-F413 HydrophobicContact CD1-CE2 3.71Å; L321-F413 HydrophobicContact CD1-CZ 4.3Å; L321-F413 HydrophobicContact CD2-CB 4.36Å; L321-F413 HydrophobicContact CD2-CD1 4.18Å; L321-F413 HydrophobicContact CD2-CD2 3.7Å; L321-F413 HydrophobicContact CD2-CE1 4.4Å; L321-F413 HydrophobicContact CD2-CE2 3.97Å; L321-F413 HydrophobicContact CD2-CG 3.81Å; L321-F413 HydrophobicContact CD2-CZ 4.3Å; L321-F413 HydrophobicContact CG-CD2 4.43Å; L321-F413 HydrophobicContact CG-CE2 4.24Å; L321-F413 HydrophobicContact CG-CZ 4.5Å; L321-V468 HydrophobicContact CD2-CG1 4.38Å; L321-V468 HydrophobicContact CD2-CG2 3.74Å; L321-V468 HydrophobicContact CG-CG1 3.99Å; L321-V468 HydrophobicContact CG-CG2 4.24Å
322	I	98.6	Very high	98.5	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-55.7	-49.1	176.6	-72.1	166.7	0	0	0	110.6	M318 L319 K324 H325 E329 F359 L451 L455 V460	M318-I322 WeakPolarHBondContact O-CG1 3.37Å; M318-I322 PolarHBondContact O-N 2.72Å; L319-I322 PolarHBondContact O-N 3.45Å; I322-K324 PolarHBondContact O-N 3.03Å; I322-H325 CarbonylContact O-C 3.54Å; I322-H325 PolarHBondContact O-N 2.97Å; I322-H325 VanDerWaalsContact O-N 3.08Å; I322-E329 HydrophobicContact CG2-CB 3.86Å; I322-E329 HydrophobicContact CG2-CG 3.67Å; I322-F359 HydrophobicContact CD1-CE1 3.75Å; I322-F359 HydrophobicContact CD1-CE2 4.31Å; I322-F359 HydrophobicContact CD1-CZ 3.59Å; I322-F359 HydrophobicContact CG1-CE1 4.04Å; I322-F359 HydrophobicContact CG1-CE2 3.66Å; I322-F359 HydrophobicContact CG1-CZ 3.39Å; I322-L451 HydrophobicContact CD1-CD2 4.12Å; I322-L455 HydrophobicContact CD1-CD1 3.69Å; I322-L455 HydrophobicContact CD1-CD2 4.09Å; I322-L455 HydrophobicContact CD1-CG 4.43Å; I322-L455 HydrophobicContact CG2-CD2 4.04Å; I322-V460 HydrophobicContact CG2-CG2 4.02Å
323	A	97.9	Very high	98.4	Very high	22 Å²	22	27.4 Å²	27.4	18%	0.182	15%	0.15	C	C	.	.	H	α-helix	trans	-61.9	-17.7	-179.7	0	0	0	0	0	114.1	L319 L321 V460 T462 M490	L319-A323 WeakPolarHBondContact O-CB 3.35Å; L319-A323 PolarHBondContact O-N 3.19Å; L321-A323 VanDerWaalsContact C-N 3.32Å; L321-A323 PolarHBondContact O-N 2.95Å; A323-V460 HydrophobicContact CB-CG2 4.27Å; A323-V460 WeakPolarHBondContact CB-O 2.97Å; A323-T462 HydrophobicContact CB-CG2 3.72Å; A323-M490 HydrophobicContact CB-CE 3.99Å
324	K	97.4	Very high	98.4	Very high	73 Å²	73	34.1 Å²	34.1	32%	0.317	18%	0.179	S	C	.	.	H	α-helix	trans	-106.5	-5.3	177.2	-66.8	-53.4	-173.8	-161.4	0	114.8	F320 L321 I322 P326 T462 Q466 C467	F320-K324 PolarHBondContact O-N 3.47Å; L321-K324 CarbonylContact O-C 3.53Å; L321-K324 PolarHBondContact O-N 2.76Å; I322-K324 PolarHBondContact O-N 3.03Å; K324-P326 WeakPolarHBondContact O-CD 3.1Å; K324-T462 VanDerWaalsContact CE-OG1 3.24Å; K324-T462 WeakPolarHBondContact CE-OG1 3.47Å; K324-T462 PolarHBondContact NZ-OG1 3.02Å; K324-Q466 WeakPolarHBondContact CE-O 3.34Å; K324-Q466 PolarHBondContact NZ-O 2.93Å; K324-C467 HydrophobicContact CD-CB 4.47Å; K324-C467 HydrophobicContact CG-CB 3.93Å
325	H	98.2	Very high	98.4	Very high	48 Å²	48	34.4 Å²	34.4	22%	0.222	18%	0.179	C	C	.	.			trans	-127.9	72.4	-178.9	-66.3	-71.8	0	0	0	110	L321 I322 N327 V328 E329 F413	L321-H325 WeakPolarHBondContact O-CB 3.39Å; L321-H325 PolarHBondContact O-CD2 3.26Å; L321-H325 PolarHBondContact O-N 2.96Å; I322-H325 CarbonylContact O-C 3.54Å; I322-H325 PolarHBondContact O-N 2.97Å; I322-H325 VanDerWaalsContact O-N 3.08Å; H325-N327 PolarHBondContact O-N 3.1Å; H325-V328 HydrophobicContact CB-CB 4Å; H325-V328 HydrophobicContact CB-CG2 3.99Å; H325-V328 WeakPolarHBondContact O-CA 3.41Å; H325-V328 WeakPolarHBondContact O-CB 3.44Å; H325-V328 PolarHBondContact O-N 2.96Å; H325-E329 PolarHBondContact O-N 3.22Å; H325-F413 HydrophobicContact CB-CE1 4.31Å; H325-F413 AromaticContact CD2-CD1 3.3Å; H325-F413 WeakPolarHBondContact CD2-CD1 3.29Å; H325-F413 AromaticContact CD2-CE1 3.53Å; H325-F413 AromaticContact CE1-CD1 3.7Å; H325-F413 AromaticContact CG-CD1 3.75Å; H325-F413 AromaticContact CG-CE1 3.85Å; H325-F413 AromaticContact ND1-CD1 3.97Å; H325-F413 AromaticContact NE2-CD1 3.29Å; H325-F413 VanDerWaalsContact NE2-CD1 3.29Å; H325-F413 WeakPolarHBondContact NE2-CD1 3.42Å; H325-F413 AromaticContact NE2-CG 3.91Å
326	P	97.1	Very high	98.4	Very high	75 Å²	75	34.5 Å²	34.5	49%	0.487	18%	0.179	S	C	.	.	H	α-helix	trans	-59.7	-33.5	-174.6	23.5	-34.1	0	0	0	113	K324 V328 E329 E330	K324-P326 WeakPolarHBondContact O-CD 3.1Å; P326-V328 VanDerWaalsContact C-N 3.27Å; P326-V328 PolarHBondContact O-N 3.49Å; P326-E329 PolarHBondContact O-N 3.29Å; P326-E330 WeakPolarHBondContact O-CG 3.17Å; P326-E330 PolarHBondContact O-N 3.38Å
327	N	98.1	Very high	98.3	Very high	107 Å²	107	39.2 Å²	39.2	57%	0.572	20%	0.201	S	C	*	.	H	α-helix	trans	-61.5	-33.9	173.5	61.2	-51.4	0	0	0	113	H325 A331	H325-N327 PolarHBondContact O-N 3.1Å; N327-A331 PolarHBondContact O-N 3.39Å
328	V	98.5	Very high	98.3	Very high	10 Å²	10	44.4 Å²	44.4	6%	0.061	23%	0.233	C	C	.	.	H	α-helix	trans	-77	-40.8	175.1	175.7	0	0	0	0	110.4	H325 P326 E330 A331 I332 F359 F413 L415	H325-V328 HydrophobicContact CB-CB 4Å; H325-V328 HydrophobicContact CB-CG2 3.99Å; H325-V328 WeakPolarHBondContact O-CA 3.41Å; H325-V328 WeakPolarHBondContact O-CB 3.44Å; H325-V328 PolarHBondContact O-N 2.96Å; P326-V328 VanDerWaalsContact C-N 3.27Å; P326-V328 PolarHBondContact O-N 3.49Å; V328-E330 PolarHBondContact O-N 2.86Å; V328-A331 PolarHBondContact O-N 3.14Å; V328-I332 HydrophobicContact CG1-CD1 3.85Å; V328-I332 HydrophobicContact CG1-CG1 4.42Å; V328-I332 WeakPolarHBondContact O-CG1 3.48Å; V328-I332 PolarHBondContact O-N 3.31Å; V328-F359 HydrophobicContact CG1-CD2 3.76Å; V328-F359 HydrophobicContact CG1-CE2 4.49Å; V328-F359 HydrophobicContact CG1-CG 4.43Å; V328-F413 HydrophobicContact CG2-CE1 4.48Å; V328-L415 HydrophobicContact CG1-CD1 4.08Å; V328-L415 HydrophobicContact CG2-CD1 4.33Å; V328-L415 HydrophobicContact CG2-CG 4.27Å
329	E	98.4	Very high	98.2	Very high	12 Å²	12	46.1 Å²	46.1	6%	0.056	24%	0.244	C	C	.	.	H	α-helix	trans	-57.5	-46.6	174.2	-170.2	176.1	-159.8	0	0	111.5	I322 H325 P326 A331 I332 M333 H459 R495	I322-E329 HydrophobicContact CG2-CB 3.86Å; I322-E329 HydrophobicContact CG2-CG 3.67Å; H325-E329 PolarHBondContact O-N 3.22Å; P326-E329 PolarHBondContact O-N 3.29Å; E329-A331 PolarHBondContact O-N 3.02Å; E329-I332 PolarHBondContact O-N 3.07Å; E329-M333 HydrophobicContact CG-CG 4.48Å; E329-M333 WeakPolarHBondContact O-CB 3.37Å; E329-M333 VanDerWaalsContact O-CG 3.29Å; E329-M333 WeakPolarHBondContact O-CG 3.31Å; E329-M333 PolarHBondContact O-N 3.4Å; E329-H459 IonicContact OE1-CE1 3.16Å; E329-H459 IonicContact OE1-CG 3.9Å; E329-H459 IonicContact OE1-ND1 2.71Å; E329-H459 PolarHBondContact OE1-ND1 2.87Å; E329-H459 IonicContact OE2-CE1 2.65Å; E329-H459 PolarHBondContact OE2-CE1 2.74Å; E329-H459 IonicContact OE2-ND1 3.7Å; E329-H459 PolarHBondContact OE2-ND1 3.03Å; E329-H459 VanDerWaalsContact OE2-ND1 3.08Å; E329-R495 IonicContact OE1-CZ 3.32Å; E329-R495 IonicContact OE1-NH2 2.64Å; E329-R495 PolarHBondContact OE1-NH2 3.32Å; E329-R495 IonicContact OE2-NH2 3.34Å
330	E	98.3	Very high	98.1	Very high	139 Å²	139	46.6 Å²	46.6	65%	0.65	25%	0.247	S	C	*	.	H	α-helix	trans	-60.1	-44.2	176.6	-75.6	174.2	-167.7	0	0	112.4	P326 V328 M333 K334	P326-E330 WeakPolarHBondContact O-CG 3.17Å; P326-E330 PolarHBondContact O-N 3.38Å; V328-E330 PolarHBondContact O-N 2.86Å; E330-M333 PolarHBondContact O-N 2.76Å; E330-K334 WeakPolarHBondContact O-CB 3.36Å; E330-K334 PolarHBondContact O-N 3.38Å
331	A	98.6	Very high	97.9	Very high	40 Å²	40	47.5 Å²	47.5	33%	0.331	26%	0.257	S	S	.	.	H	α-helix	trans	-64	-41.4	177.9	0	0	0	0	0	112.1	N327 V328 E329 E335 V355	N327-A331 PolarHBondContact O-N 3.39Å; V328-A331 PolarHBondContact O-N 3.14Å; E329-A331 PolarHBondContact O-N 3.02Å; A331-E335 PolarHBondContact O-N 3.25Å; A331-V355 HydrophobicContact CB-CG1 3.96Å
332	I	98.7	Very high	97.4	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-46.2	175	-71.3	169.6	0	0	0	110.5	V328 E329 K334 E335 I336 V355 M356 F359 L455	V328-I332 HydrophobicContact CG1-CD1 3.85Å; V328-I332 HydrophobicContact CG1-CG1 4.42Å; V328-I332 WeakPolarHBondContact O-CG1 3.48Å; V328-I332 PolarHBondContact O-N 3.31Å; E329-I332 PolarHBondContact O-N 3.07Å; I332-K334 PolarHBondContact O-N 3.33Å; I332-E335 WeakPolarHBondContact O-CB 3.44Å; I332-E335 PolarHBondContact O-N 3.4Å; I332-I336 HydrophobicContact CG2-CD1 3.75Å; I332-I336 HydrophobicContact CG2-CG1 4.35Å; I332-I336 VanDerWaalsContact O-CG1 3.31Å; I332-I336 WeakPolarHBondContact O-CG1 3.45Å; I332-I336 PolarHBondContact O-N 2.97Å; I332-V355 HydrophobicContact CG1-CG1 4Å; I332-M356 HydrophobicContact CD1-SD 4.32Å; I332-M356 HydrophobicContact CG2-CE 3.35Å; I332-M356 HydrophobicContact CG2-SD 4.12Å; I332-F359 HydrophobicContact CD1-CB 3.92Å; I332-F359 HydrophobicContact CD1-CD1 3.92Å; I332-F359 HydrophobicContact CD1-CD2 4.07Å; I332-F359 HydrophobicContact CD1-CG 3.66Å; I332-L455 HydrophobicContact CG2-CD1 3.93Å
333	M	98.3	Very high	97.2	Very high	20 Å²	20	59.7 Å²	59.7	10%	0.099	31%	0.309	C	S	.	.	H	α-helix	trans	-63.4	-41.3	180	-73.4	-56.4	-57.8	0	0	112.2	E329 E330 E335 I336 Q337 L455	E329-M333 HydrophobicContact CG-CG 4.48Å; E329-M333 WeakPolarHBondContact O-CB 3.37Å; E329-M333 VanDerWaalsContact O-CG 3.29Å; E329-M333 WeakPolarHBondContact O-CG 3.31Å; E329-M333 PolarHBondContact O-N 3.4Å; E330-M333 PolarHBondContact O-N 2.76Å; M333-E335 VanDerWaalsContact C-N 3.32Å; M333-E335 PolarHBondContact O-N 3Å; M333-I336 PolarHBondContact O-N 3.36Å; M333-I336 HydrophobicContact SD-CD1 4.12Å; M333-Q337 WeakPolarHBondContact O-CG 3.13Å; M333-Q337 PolarHBondContact O-N 3.11Å; M333-L455 HydrophobicContact SD-CB 3.95Å; M333-L455 VanDerWaalsContact SD-O 3.39Å
334	K	98.4	Very high	96.9	Very high	144 Å²	144	62.4 Å²	62.4	63%	0.626	32%	0.32	S	S	*	.	H	α-helix	trans	-61.4	-41	174	-175.6	175.1	-178.2	175.6	0	111.9	E330 I332 Q337 T338	E330-K334 WeakPolarHBondContact O-CB 3.36Å; E330-K334 PolarHBondContact O-N 3.38Å; I332-K334 PolarHBondContact O-N 3.33Å; K334-Q337 PolarHBondContact O-N 3.05Å; K334-T338 WeakPolarHBondContact O-CB 3.22Å; K334-T338 PolarHBondContact O-N 2.75Å; K334-T338 PolarHBondContact O-OG1 3.2Å
335	E	98.6	Very high	96.8	Very high	22 Å²	22	59.2 Å²	59.2	10%	0.103	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-45.2	174.6	179	173.3	-104.9	0	0	111.6	A331 I332 M333 Q337 T338 V339 L353 K354 V355 M356	A331-E335 PolarHBondContact O-N 3.25Å; I332-E335 WeakPolarHBondContact O-CB 3.44Å; I332-E335 PolarHBondContact O-N 3.4Å; M333-E335 VanDerWaalsContact C-N 3.32Å; M333-E335 PolarHBondContact O-N 3Å; E335-Q337 PolarHBondContact O-N 3.04Å; E335-T338 PolarHBondContact O-N 2.95Å; E335-V339 HydrophobicContact CG-CG2 4.16Å; E335-V339 WeakPolarHBondContact O-CB 3.49Å; E335-V339 WeakPolarHBondContact O-CG2 3.23Å; E335-V339 PolarHBondContact O-N 3.28Å; E335-L353 HydrophobicContact CG-CD2 4.01Å; E335-L353 VanDerWaalsContact OE2-C 3.28Å; E335-L353 WeakPolarHBondContact OE2-CA 3.43Å; E335-K354 VanDerWaalsContact CD-N 3.32Å; E335-K354 PolarHBondContact OE1-N 2.8Å; E335-K354 PolarHBondContact OE2-N 2.88Å; E335-V355 HydrophobicContact CB-CB 4.41Å; E335-V355 VanDerWaalsContact CD-N 3.3Å; E335-V355 WeakPolarHBondContact OE1-CG2 3.36Å; E335-V355 PolarHBondContact OE1-N 2.86Å; E335-V355 WeakPolarHBondContact OE2-CB 3.21Å; E335-V355 PolarHBondContact OE2-N 2.95Å; E335-V355 VanDerWaalsContact OE2-N 3.14Å; E335-M356 PolarHBondContact OE2-N 3.22Å
336	I	98.3	Very high	96.6	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-58.4	-47.7	176.8	-69.5	168.6	0	0	0	110.7	I332 M333 T338 V340 G341 M356 V452 L455	I332-I336 HydrophobicContact CG2-CD1 3.75Å; I332-I336 HydrophobicContact CG2-CG1 4.35Å; I332-I336 VanDerWaalsContact O-CG1 3.31Å; I332-I336 WeakPolarHBondContact O-CG1 3.45Å; I332-I336 PolarHBondContact O-N 2.97Å; M333-I336 PolarHBondContact O-N 3.36Å; M333-I336 HydrophobicContact SD-CD1 4.12Å; I336-T338 VanDerWaalsContact C-N 3.32Å; I336-T338 PolarHBondContact O-N 3.07Å; I336-V340 WeakPolarHBondContact O-CA 3.4Å; I336-V340 WeakPolarHBondContact O-CB 3.39Å; I336-V340 PolarHBondContact O-N 3.34Å; I336-G341 PolarHBondContact O-N 2.87Å; I336-M356 HydrophobicContact CD1-CE 4.09Å; I336-V452 HydrophobicContact CD1-CG2 4.3Å; I336-V452 HydrophobicContact CG1-CG1 4.42Å; I336-V452 HydrophobicContact CG1-CG2 4.15Å; I336-V452 HydrophobicContact CG2-CG1 4.26Å; I336-L455 HydrophobicContact CD1-CB 4.45Å
337	Q	97.4	Very high	96.5	Very high	100 Å²	100	60.6 Å²	60.6	47%	0.467	31%	0.307	S	S	.	.	H	α-helix	trans	-60.3	-41.7	177.9	-72.4	168.6	-10.1	0	0	112.1	M333 K334 E335 G341	M333-Q337 WeakPolarHBondContact O-CG 3.13Å; M333-Q337 PolarHBondContact O-N 3.11Å; K334-Q337 PolarHBondContact O-N 3.05Å; E335-Q337 PolarHBondContact O-N 3.04Å; Q337-G341 WeakPolarHBondContact O-CA 3.2Å; Q337-G341 PolarHBondContact O-N 3.34Å
338	T	97.8	Very high	96.3	Very high	111 Å²	111	60.8 Å²	60.8	68%	0.681	31%	0.308	S	S	*	.	H	α-helix	trans	-71.3	-42.7	-177.9	-56.2	0	0	0	0	112.5	K334 E335 I336	K334-T338 WeakPolarHBondContact O-CB 3.22Å; K334-T338 PolarHBondContact O-N 2.75Å; K334-T338 PolarHBondContact O-OG1 3.2Å; E335-T338 PolarHBondContact O-N 2.95Å; I336-T338 VanDerWaalsContact C-N 3.32Å; I336-T338 PolarHBondContact O-N 3.07Å
339	V	97.9	Very high	96.2	Very high	38 Å²	38	60.8 Å²	60.8	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-89.2	-41.5	-171.3	174.3	0	0	0	0	112	E335 D349 K352 L353	E335-V339 HydrophobicContact CG-CG2 4.16Å; E335-V339 WeakPolarHBondContact O-CB 3.49Å; E335-V339 WeakPolarHBondContact O-CG2 3.23Å; E335-V339 PolarHBondContact O-N 3.28Å; V339-D349 HydrophobicContact CG1-CB 4.17Å; V339-K352 HydrophobicContact CG1-CB 3.62Å; V339-K352 HydrophobicContact CG1-CD 4.06Å; V339-K352 HydrophobicContact CG2-CB 4.08Å; V339-L353 HydrophobicContact CB-CD2 4.22Å; V339-L353 HydrophobicContact CG1-CD2 4.2Å; V339-L353 HydrophobicContact CG1-CG 4.41Å
340	V	96.8	Very high	96.1	Very high	12 Å²	12	60.7 Å²	60.7	7%	0.073	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.7	-41.8	-169.7	-175.7	0	0	0	0	111.3	I336 R343 D349 L353	I336-V340 WeakPolarHBondContact O-CA 3.4Å; I336-V340 WeakPolarHBondContact O-CB 3.39Å; I336-V340 PolarHBondContact O-N 3.34Å; V340-R343 WeakPolarHBondContact CG1-O 3.13Å; V340-R343 WeakPolarHBondContact O-CB 3.44Å; V340-R343 PolarHBondContact O-N 3.29Å; V340-D349 HydrophobicContact CG2-CB 4.11Å; V340-L353 HydrophobicContact CG2-CD2 4.36Å
341	G	93.4	Very high	96	Very high	20 Å²	20	62.3 Å²	62.3	21%	0.206	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	-137.4	-170.4	0	0	0	0	0	111.6	I336 Q337 R343 R456	I336-G341 PolarHBondContact O-N 2.87Å; Q337-G341 WeakPolarHBondContact O-CA 3.2Å; Q337-G341 PolarHBondContact O-N 3.34Å; G341-R343 VanDerWaalsContact C-N 3.32Å; G341-R456 PolarHBondContact O-NH1 3.11Å; G341-R456 VanDerWaalsContact O-NH1 3.15Å
342	E	89.9	Confident	95.9	Very high	154 Å²	154	66.3 Å²	66.3	72%	0.72	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.6	178.5	-58.6	-50.4	135.7	0	0	113.8
343	R	94	Very high	95.9	Very high	103 Å²	103	66.3 Å²	66.3	39%	0.389	32%	0.324	S	S	.	.	S	Bend	trans	-72.5	155.1	-176.3	-149.3	-173.4	61.9	57.8	9.8	111.2	V340 G341 K346 D349 R456	V340-R343 WeakPolarHBondContact CG1-O 3.13Å; V340-R343 WeakPolarHBondContact O-CB 3.44Å; V340-R343 PolarHBondContact O-N 3.29Å; G341-R343 VanDerWaalsContact C-N 3.32Å; R343-K346 VanDerWaalsContact NH1-CD 3.3Å; R343-K346 VanDerWaalsContact NH2-CD 3.28Å; R343-K346 VanDerWaalsContact NH2-CG 3.27Å; R343-D349 IonicContact NH2-OD2 3.11Å; R343-D349 PolarHBondContact NH2-OD2 3.18Å; R343-R456 PolarHBondContact O-NH1 2.78Å
344	D	91.7	Very high	95.9	Very high	79 Å²	79	69.9 Å²	69.9	42%	0.422	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-63.6	139.6	171.9	-72.7	-41.8	0	0	0	113.1	K169 K346	K169-D344 IonicContact NZ-OD1 3.49Å; K169-D344 PolarHBondContact NZ-OD1 2.93Å; K169-D344 IonicContact NZ-OD2 3.29Å; D344-K346 PolarHBondContact O-N 3.32Å
345	V	94.1	Very high	95.9	Very high	6 Å²	6	65.1 Å²	65.1	4%	0.036	32%	0.322	C	S	.	.	P	Polyproline II helix	trans	-62.1	131.9	180	67.4	0	0	0	0	111.2	V161 A165 M350 V452	V161-V345 HydrophobicContact CG1-CG1 4.1Å; V161-V345 HydrophobicContact CG1-CG2 4.21Å; A165-V345 HydrophobicContact CB-CG1 3.67Å; V345-M350 HydrophobicContact CG2-CE 3.18Å; V345-V452 HydrophobicContact CG2-CG1 4.49Å
346	K	94.2	Very high	95.9	Very high	105 Å²	105	64.1 Å²	64.1	46%	0.457	32%	0.317	S	S	.	.			trans	-123.8	166.4	178.2	-74.8	-175.6	-179.8	160.1	0	111.5	R343 D344 D348 D349	R343-K346 VanDerWaalsContact NH1-CD 3.3Å; R343-K346 VanDerWaalsContact NH2-CD 3.28Å; R343-K346 VanDerWaalsContact NH2-CG 3.27Å; D344-K346 PolarHBondContact O-N 3.32Å; K346-D348 VanDerWaalsContact C-N 3.26Å; K346-D348 PolarHBondContact O-N 3.21Å; K346-D349 PolarHBondContact N-OD2 3.23Å; K346-D349 WeakPolarHBondContact O-CB 3.18Å; K346-D349 PolarHBondContact O-N 2.79Å; K346-D349 VanDerWaalsContact O-N 3.12Å
347	I	94.4	Very high	96	Very high	48 Å²	48	65.7 Å²	65.7	25%	0.246	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-58.4	-37.1	179.4	-172.3	62.2	0	0	0	113	L157 V158 V161 D349 M350	L157-I347 HydrophobicContact CD2-CD1 3.73Å; V158-I347 HydrophobicContact CG1-CB 4.28Å; V158-I347 HydrophobicContact CG1-CG2 4.03Å; V158-I347 HydrophobicContact CG2-CG1 4.33Å; V161-I347 HydrophobicContact CG2-CB 4.13Å; V161-I347 HydrophobicContact CG2-CD1 3.67Å; V161-I347 HydrophobicContact CG2-CG1 4.49Å; I347-D349 PolarHBondContact O-N 3.49Å; I347-M350 HydrophobicContact CD1-CG 4.09Å; I347-M350 VanDerWaalsContact O-CB 3.3Å; I347-M350 WeakPolarHBondContact O-CB 3.47Å; I347-M350 WeakPolarHBondContact O-CG 3.42Å; I347-M350 PolarHBondContact O-N 2.73Å; I347-M350 VanDerWaalsContact O-N 3.09Å
348	D	95.3	Very high	96	Very high	111 Å²	111	62.2 Å²	62.2	59%	0.594	31%	0.31	S	S	*	.	G	3₁₀ helix	trans	-68.1	-17.6	-179.2	-60	-23.9	0	0	0	113	K346 K352	K346-D348 VanDerWaalsContact C-N 3.26Å; K346-D348 PolarHBondContact O-N 3.21Å; D348-K352 WeakPolarHBondContact O-CE 3.35Å
349	D	96.8	Very high	96.1	Very high	9 Å²	9	57 Å²	57	5%	0.048	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-78.8	-29.1	176.5	-52.8	-36.1	0	0	0	110.5	V339 V340 R343 K346 I347 Q351 K352 L353	V339-D349 HydrophobicContact CG1-CB 4.17Å; V340-D349 HydrophobicContact CG2-CB 4.11Å; R343-D349 IonicContact NH2-OD2 3.11Å; R343-D349 PolarHBondContact NH2-OD2 3.18Å; K346-D349 PolarHBondContact N-OD2 3.23Å; K346-D349 WeakPolarHBondContact O-CB 3.18Å; K346-D349 PolarHBondContact O-N 2.79Å; K346-D349 VanDerWaalsContact O-N 3.12Å; I347-D349 PolarHBondContact O-N 3.49Å; D349-Q351 VanDerWaalsContact C-N 3.27Å; D349-Q351 PolarHBondContact O-N 3.39Å; D349-Q351 VanDerWaalsContact O-N 3.15Å; D349-K352 PolarHBondContact O-N 2.76Å; D349-L353 WeakPolarHBondContact O-CG 3.49Å; D349-L353 PolarHBondContact O-N 3.19Å
350	M	95.6	Very high	96.1	Very high	10 Å²	10	55.1 Å²	55.1	5%	0.049	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-35.7	-172.9	-64.2	-61.3	110.5	0	0	113.5	V161 V345 I347 L353 V445 K448	V161-M350 HydrophobicContact CG1-CE 4.04Å; V161-M350 HydrophobicContact CG2-CG 4.16Å; V345-M350 HydrophobicContact CG2-CE 3.18Å; I347-M350 HydrophobicContact CD1-CG 4.09Å; I347-M350 VanDerWaalsContact O-CB 3.3Å; I347-M350 WeakPolarHBondContact O-CB 3.47Å; I347-M350 WeakPolarHBondContact O-CG 3.42Å; I347-M350 PolarHBondContact O-N 2.73Å; I347-M350 VanDerWaalsContact O-N 3.09Å; M350-L353 HydrophobicContact CE-CD1 4.11Å; M350-V445 HydrophobicContact CG-CG1 4.23Å; M350-V445 HydrophobicContact CG-CG2 4.45Å; M350-V445 HydrophobicContact SD-CG1 4.16Å; M350-K448 PolarHBondContact O-NZ 3.22Å; M350-K448 HydrophobicContact SD-CB 3.71Å; M350-K448 HydrophobicContact SD-CD 4.26Å
351	Q	94.9	Very high	96.2	Very high	174 Å²	174	57.4 Å²	57.4	81%	0.813	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78	-23.6	179.6	-66	-177	3.4	0	0	112.9	D349	D349-Q351 VanDerWaalsContact C-N 3.27Å; D349-Q351 PolarHBondContact O-N 3.39Å; D349-Q351 VanDerWaalsContact O-N 3.15Å
352	K	98.1	Very high	96.5	Very high	123 Å²	123	56.5 Å²	56.5	54%	0.535	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.1	-24	-176.9	-59.6	173.1	-169.6	167.3	0	112.5	V339 D348 D349 K354	V339-K352 HydrophobicContact CG1-CB 3.62Å; V339-K352 HydrophobicContact CG1-CD 4.06Å; V339-K352 HydrophobicContact CG2-CB 4.08Å; D348-K352 WeakPolarHBondContact O-CE 3.35Å; D349-K352 PolarHBondContact O-N 2.76Å; K352-K354 VanDerWaalsContact C-N 3.28Å; K352-K354 PolarHBondContact O-N 3.38Å
353	L	98.3	Very high	96.9	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	23%	0.231	C	C	.	.			trans	-74.4	74.5	175.9	-64.9	169.9	0	0	0	111	E335 V339 V340 D349 M350 M356 E357 K448 V452	E335-L353 HydrophobicContact CG-CD2 4.01Å; E335-L353 VanDerWaalsContact OE2-C 3.28Å; E335-L353 WeakPolarHBondContact OE2-CA 3.43Å; V339-L353 HydrophobicContact CB-CD2 4.22Å; V339-L353 HydrophobicContact CG1-CD2 4.2Å; V339-L353 HydrophobicContact CG1-CG 4.41Å; V340-L353 HydrophobicContact CG2-CD2 4.36Å; D349-L353 WeakPolarHBondContact O-CG 3.49Å; D349-L353 PolarHBondContact O-N 3.19Å; M350-L353 HydrophobicContact CE-CD1 4.11Å; L353-M356 HydrophobicContact CB-CB 4.14Å; L353-E357 WeakPolarHBondContact O-CB 3.21Å; L353-E357 PolarHBondContact O-N 3.04Å; L353-K448 HydrophobicContact CB-CD 4.29Å; L353-K448 HydrophobicContact CD1-CB 4.5Å; L353-K448 PolarHBondContact O-NZ 3.33Å; L353-V452 HydrophobicContact CD1-CG2 3.65Å; L353-V452 HydrophobicContact CD2-CG2 4.38Å
354	K	98.3	Very high	97.2	Very high	96 Å²	96	45.4 Å²	45.4	42%	0.417	22%	0.217	S	C	.	.	H	α-helix	trans	-86.5	-38.6	-172.3	-174.1	64.7	-166.7	174.4	0	113.2	E335 K352 E357 N358	E335-K354 VanDerWaalsContact CD-N 3.32Å; E335-K354 PolarHBondContact OE1-N 2.8Å; E335-K354 PolarHBondContact OE2-N 2.88Å; K352-K354 VanDerWaalsContact C-N 3.28Å; K352-K354 PolarHBondContact O-N 3.38Å; K354-E357 IonicContact NZ-OE1 2.71Å; K354-E357 PolarHBondContact NZ-OE1 3.28Å; K354-E357 WeakPolarHBondContact O-CB 3.15Å; K354-E357 PolarHBondContact O-N 2.93Å; K354-N358 WeakPolarHBondContact CE-OD1 3.35Å; K354-N358 PolarHBondContact O-N 3.21Å
355	V	98.7	Very high	97.5	Very high	44 Å²	44	41.7 Å²	41.7	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-62.4	-47.1	172.8	179.3	0	0	0	0	109.2	A331 I332 E335 E357 N358 F359 L415	A331-V355 HydrophobicContact CB-CG1 3.96Å; I332-V355 HydrophobicContact CG1-CG1 4Å; E335-V355 HydrophobicContact CB-CB 4.41Å; E335-V355 VanDerWaalsContact CD-N 3.3Å; E335-V355 WeakPolarHBondContact OE1-CG2 3.36Å; E335-V355 PolarHBondContact OE1-N 2.86Å; E335-V355 WeakPolarHBondContact OE2-CB 3.21Å; E335-V355 PolarHBondContact OE2-N 2.95Å; E335-V355 VanDerWaalsContact OE2-N 3.14Å; V355-E357 VanDerWaalsContact C-N 3.31Å; V355-E357 PolarHBondContact O-N 3.37Å; V355-N358 PolarHBondContact O-N 3.27Å; V355-F359 WeakPolarHBondContact O-CB 3.42Å; V355-F359 PolarHBondContact O-N 3.16Å; V355-L415 HydrophobicContact CG1-CD1 4.19Å
356	M	98.8	Very high	97.7	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-58.6	-41.6	173.6	-175.5	69.5	83.1	0	0	112	I332 E335 I336 L353 F359 I360 K448 L451 V452 L455	I332-M356 HydrophobicContact CD1-SD 4.32Å; I332-M356 HydrophobicContact CG2-CE 3.35Å; I332-M356 HydrophobicContact CG2-SD 4.12Å; E335-M356 PolarHBondContact OE2-N 3.22Å; I336-M356 HydrophobicContact CD1-CE 4.09Å; L353-M356 HydrophobicContact CB-CB 4.14Å; M356-F359 WeakPolarHBondContact O-CB 3.43Å; M356-F359 PolarHBondContact O-N 3.37Å; M356-F359 HydrophobicContact SD-CD1 4.1Å; M356-I360 HydrophobicContact CG-CD1 4.03Å; M356-I360 WeakPolarHBondContact O-CG1 3.25Å; M356-I360 PolarHBondContact O-N 3.49Å; M356-K448 HydrophobicContact CG-CG 4.01Å; M356-L451 HydrophobicContact CE-CB 3.65Å; M356-L451 HydrophobicContact SD-CB 3.73Å; M356-L451 HydrophobicContact SD-CD1 3.66Å; M356-L451 HydrophobicContact SD-CG 4.34Å; M356-V452 HydrophobicContact CE-CG2 3.96Å; M356-L455 HydrophobicContact CE-CD1 4.17Å
357	E	98.8	Very high	97.9	Very high	37 Å²	37	38.4 Å²	38.4	17%	0.173	18%	0.183	C	C	.	.	H	α-helix	trans	-60.3	-49.3	176.4	-169.8	171.5	99.3	0	0	112.6	L353 K354 V355 F359 I360 Y361 M444 K448	L353-E357 WeakPolarHBondContact O-CB 3.21Å; L353-E357 PolarHBondContact O-N 3.04Å; K354-E357 IonicContact NZ-OE1 2.71Å; K354-E357 PolarHBondContact NZ-OE1 3.28Å; K354-E357 WeakPolarHBondContact O-CB 3.15Å; K354-E357 PolarHBondContact O-N 2.93Å; V355-E357 VanDerWaalsContact C-N 3.31Å; V355-E357 PolarHBondContact O-N 3.37Å; E357-F359 VanDerWaalsContact C-N 3.28Å; E357-F359 PolarHBondContact O-N 3.18Å; E357-I360 PolarHBondContact O-N 3.08Å; E357-Y361 HydrophobicContact CG-CD2 3.91Å; E357-Y361 HydrophobicContact CG-CE2 3.45Å; E357-Y361 VanDerWaalsContact CG-CE2 3.45Å; E357-Y361 WeakPolarHBondContact O-CD2 3.32Å; E357-Y361 PolarHBondContact O-N 2.81Å; E357-M444 HydrophobicContact CG-CE 4.02Å; E357-K448 IonicContact OE2-NZ 3.08Å; E357-K448 PolarHBondContact OE2-NZ 2.93Å
358	N	98.8	Very high	98.1	Very high	27 Å²	27	37 Å²	37	14%	0.144	18%	0.176	C	C	.	.	H	α-helix	trans	-63.8	-37.4	178.1	-74.6	-6.3	0	0	0	111.1	K354 V355 Y361 E362 F418	K354-N358 WeakPolarHBondContact CE-OD1 3.35Å; K354-N358 PolarHBondContact O-N 3.21Å; V355-N358 PolarHBondContact O-N 3.27Å; N358-Y361 PolarHBondContact O-N 3.04Å; N358-E362 VanDerWaalsContact O-CB 3.28Å; N358-E362 WeakPolarHBondContact O-CB 3.44Å; N358-E362 PolarHBondContact O-N 2.82Å; N358-F418 HydrophobicContact CB-CB 4.11Å; N358-F418 PolarHBondContact ND2-O 3.08Å
359	F	98.9	Very high	98.3	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-61.3	-46.5	173	164.1	-98.7	0	0	0	112.4	M318 L321 I322 V328 I332 V355 M356 E357 E362 S363 F413 L415 L451	M318-F359 HydrophobicContact CB-CE1 3.81Å; M318-F359 HydrophobicContact CB-CZ 3.68Å; M318-F359 HydrophobicContact CG-CE1 3.92Å; M318-F359 HydrophobicContact CG-CZ 3.97Å; M318-F359 WeakPolarHBondContact O-CZ 3.3Å; M318-F359 HydrophobicContact SD-CE1 4.48Å; L321-F359 HydrophobicContact CB-CE2 4.24Å; I322-F359 HydrophobicContact CD1-CE1 3.75Å; I322-F359 HydrophobicContact CD1-CE2 4.31Å; I322-F359 HydrophobicContact CD1-CZ 3.59Å; I322-F359 HydrophobicContact CG1-CE1 4.04Å; I322-F359 HydrophobicContact CG1-CE2 3.66Å; I322-F359 HydrophobicContact CG1-CZ 3.39Å; V328-F359 HydrophobicContact CG1-CD2 3.76Å; V328-F359 HydrophobicContact CG1-CE2 4.49Å; V328-F359 HydrophobicContact CG1-CG 4.43Å; I332-F359 HydrophobicContact CD1-CB 3.92Å; I332-F359 HydrophobicContact CD1-CD1 3.92Å; I332-F359 HydrophobicContact CD1-CD2 4.07Å; I332-F359 HydrophobicContact CD1-CG 3.66Å; V355-F359 WeakPolarHBondContact O-CB 3.42Å; V355-F359 PolarHBondContact O-N 3.16Å; M356-F359 WeakPolarHBondContact O-CB 3.43Å; M356-F359 PolarHBondContact O-N 3.37Å; M356-F359 HydrophobicContact SD-CD1 4.1Å; E357-F359 VanDerWaalsContact C-N 3.28Å; E357-F359 PolarHBondContact O-N 3.18Å; F359-E362 PolarHBondContact O-N 2.87Å; F359-S363 VanDerWaalsContact CE2-OG 3.31Å; F359-S363 WeakPolarHBondContact CE2-OG 3.39Å; F359-S363 WeakPolarHBondContact CZ-OG 3.1Å; F359-S363 VanDerWaalsContact O-CB 3.3Å; F359-S363 WeakPolarHBondContact O-CB 3.47Å; F359-S363 PolarHBondContact O-N 2.86Å; F359-S363 PolarHBondContact O-OG 3.26Å; F359-F413 AromaticContact CD2-CZ 3.81Å; F359-F413 HydrophobicContact CD2-CZ 3.81Å; F359-F413 AromaticContact CE2-CZ 3.78Å; F359-F413 HydrophobicContact CE2-CZ 3.78Å; F359-L415 HydrophobicContact CB-CD2 4.15Å; F359-L451 HydrophobicContact CD1-CD1 4.25Å; F359-L451 HydrophobicContact CE1-CD1 3.87Å
360	I	98.9	Very high	98.4	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-60.8	-47.7	177.1	-72.4	162.5	0	0	0	110	M318 M356 E357 S363 M364 M444 M447 K448 L451	M318-I360 HydrophobicContact CE-CB 4.35Å; M318-I360 HydrophobicContact CE-CG1 4.44Å; M318-I360 HydrophobicContact CE-CG2 3.87Å; M318-I360 HydrophobicContact SD-CG1 4.25Å; M356-I360 HydrophobicContact CG-CD1 4.03Å; M356-I360 WeakPolarHBondContact O-CG1 3.25Å; M356-I360 PolarHBondContact O-N 3.49Å; E357-I360 PolarHBondContact O-N 3.08Å; I360-S363 PolarHBondContact O-N 3.45Å; I360-M364 HydrophobicContact CG2-SD 4.18Å; I360-M364 WeakPolarHBondContact O-CG 3.32Å; I360-M364 PolarHBondContact O-N 3.44Å; I360-M444 HydrophobicContact CB-CE 4.07Å; I360-M444 HydrophobicContact CD1-CE 4.3Å; I360-M444 HydrophobicContact CG2-CE 3.61Å; I360-M444 HydrophobicContact CG2-SD 3.61Å; I360-M447 HydrophobicContact CD1-CB 3.84Å; I360-M447 HydrophobicContact CG1-CB 4.36Å; I360-M447 HydrophobicContact CG2-CE 3.61Å; I360-M447 HydrophobicContact CG2-SD 3.91Å; I360-K448 HydrophobicContact CD1-CB 4.48Å; I360-K448 HydrophobicContact CD1-CG 3.55Å; I360-L451 HydrophobicContact CD1-CD1 4.13Å; I360-L451 HydrophobicContact CG1-CD1 3.88Å
361	Y	98.9	Very high	98.5	Very high	60 Å²	60	34.4 Å²	34.4	24%	0.235	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-44	179	-70.3	-34.3	0	0	0	112.9	E357 N358 S363 M364 R365 F418 F427 M444	E357-Y361 HydrophobicContact CG-CD2 3.91Å; E357-Y361 HydrophobicContact CG-CE2 3.45Å; E357-Y361 VanDerWaalsContact CG-CE2 3.45Å; E357-Y361 WeakPolarHBondContact O-CD2 3.32Å; E357-Y361 PolarHBondContact O-N 2.81Å; N358-Y361 PolarHBondContact O-N 3.04Å; Y361-S363 VanDerWaalsContact C-N 3.32Å; Y361-S363 PolarHBondContact O-N 3.38Å; Y361-M364 PolarHBondContact O-N 2.79Å; Y361-R365 WeakPolarHBondContact O-CB 3.49Å; Y361-R365 PolarHBondContact O-N 2.98Å; Y361-F418 HydrophobicContact CD2-CD1 4.37Å; Y361-F418 HydrophobicContact CD2-CE1 4.34Å; Y361-F418 HydrophobicContact CG-CE1 4.23Å; Y361-F427 AromaticContact CD1-CE1 3.77Å; Y361-F427 HydrophobicContact CD1-CE1 3.77Å; Y361-F427 HydrophobicContact CD1-CZ 4.4Å; Y361-F427 AromaticContact CG-CE1 3.89Å; Y361-F427 HydrophobicContact CG-CE1 3.89Å; Y361-F427 WeakPolarHBondContact O-CZ 3.49Å; Y361-M444 HydrophobicContact CD1-CE 4Å; Y361-M444 HydrophobicContact CD1-SD 4.11Å; Y361-M444 HydrophobicContact CE1-CE 3.46Å; Y361-M444 VanDerWaalsContact CE1-CE 3.46Å; Y361-M444 HydrophobicContact CE1-CG 4.4Å; Y361-M444 HydrophobicContact CE1-SD 3.51Å; Y361-M444 VanDerWaalsContact CE1-SD 3.51Å; Y361-M444 HydrophobicContact CE2-CE 4.37Å
362	E	98.9	Very high	98.7	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-65.1	-37.6	177	-179.8	60.5	-173.7	0	0	111.8	N358 F359 R365 Y366 F413 T414 L415 N417 F418	N358-E362 VanDerWaalsContact O-CB 3.28Å; N358-E362 WeakPolarHBondContact O-CB 3.44Å; N358-E362 PolarHBondContact O-N 2.82Å; F359-E362 PolarHBondContact O-N 2.87Å; E362-R365 PolarHBondContact O-N 3.13Å; E362-R365 IonicContact OE1-CZ 2.87Å; E362-R365 IonicContact OE1-NE 3.98Å; E362-R365 PolarHBondContact OE1-NE 3.28Å; E362-R365 IonicContact OE1-NH2 3.2Å; E362-R365 PolarHBondContact OE1-NH2 3.46Å; E362-R365 IonicContact OE2-CZ 2.65Å; E362-R365 IonicContact OE2-NE 3.74Å; E362-R365 PolarHBondContact OE2-NE 2.93Å; E362-R365 IonicContact OE2-NH2 3.29Å; E362-Y366 VanDerWaalsContact O-CB 3.24Å; E362-Y366 WeakPolarHBondContact O-CB 3.49Å; E362-Y366 PolarHBondContact O-N 3.33Å; E362-F413 HydrophobicContact CB-CE2 4.18Å; E362-F413 HydrophobicContact CG-CD2 3.69Å; E362-F413 HydrophobicContact CG-CE2 3.61Å; E362-F413 HydrophobicContact CG-CG 4.4Å; E362-F413 HydrophobicContact CG-CZ 4.26Å; E362-T414 WeakPolarHBondContact CG-O 3.48Å; E362-T414 PolarHBondContact OE1-N 3Å; E362-L415 HydrophobicContact CB-CD2 3.95Å; E362-L415 HydrophobicContact CG-CD2 4.27Å; E362-N417 PolarHBondContact OE1-ND2 2.77Å; E362-N417 VanDerWaalsContact OE2-CB 3.3Å; E362-N417 WeakPolarHBondContact OE2-CB 3.46Å; E362-N417 PolarHBondContact OE2-ND2 3.29Å; E362-F418 HydrophobicContact CB-CD2 3.92Å; E362-F418 HydrophobicContact CB-CE2 4.07Å; E362-F418 WeakPolarHBondContact OE2-CD2 3.2Å; E362-F418 VanDerWaalsContact OE2-CE2 3.22Å; E362-F418 WeakPolarHBondContact OE2-CE2 3.14Å
363	S	98.9	Very high	98.7	Very high	3 Å²	3	21.5 Å²	21.5	2%	0.021	11%	0.108	C	C	.	.	H	α-helix	trans	-63.1	-46.5	175.2	-59.7	0	0	0	0	111.5	F359 I360 Y361 R365 Y366 Q367	F359-S363 VanDerWaalsContact CE2-OG 3.31Å; F359-S363 WeakPolarHBondContact CE2-OG 3.39Å; F359-S363 WeakPolarHBondContact CZ-OG 3.1Å; F359-S363 VanDerWaalsContact O-CB 3.3Å; F359-S363 WeakPolarHBondContact O-CB 3.47Å; F359-S363 PolarHBondContact O-N 2.86Å; F359-S363 PolarHBondContact O-OG 3.26Å; I360-S363 PolarHBondContact O-N 3.45Å; Y361-S363 VanDerWaalsContact C-N 3.32Å; Y361-S363 PolarHBondContact O-N 3.38Å; S363-R365 VanDerWaalsContact C-N 3.32Å; S363-R365 PolarHBondContact O-N 2.93Å; S363-Y366 PolarHBondContact O-N 3.11Å; S363-Q367 CarbonylContact O-C 3.58Å; S363-Q367 WeakPolarHBondContact O-CA 3.41Å; S363-Q367 PolarHBondContact O-N 3.35Å
364	M	98.9	Very high	98.7	Very high	22 Å²	22	21.7 Å²	21.7	11%	0.108	11%	0.109	C	C	.	.	H	α-helix	trans	-67.1	-31.3	176.8	-66.8	-178.4	82	0	0	113	M318 I360 Y361 P368 P429 F430 M447	M318-M364 HydrophobicContact CE-CG 3.85Å; I360-M364 HydrophobicContact CG2-SD 4.18Å; I360-M364 WeakPolarHBondContact O-CG 3.32Å; I360-M364 PolarHBondContact O-N 3.44Å; Y361-M364 PolarHBondContact O-N 2.79Å; M364-P368 WeakPolarHBondContact O-CA 3.49Å; M364-P368 WeakPolarHBondContact O-CB 3.1Å; M364-P429 HydrophobicContact CB-CB 4.22Å; M364-P429 HydrophobicContact CE-CB 3.73Å; M364-P429 HydrophobicContact SD-CB 4.14Å; M364-F430 HydrophobicContact CE-CD1 4.23Å; M364-F430 HydrophobicContact CE-CE1 3.57Å; M364-F430 HydrophobicContact CE-CE2 4.01Å; M364-F430 HydrophobicContact CE-CZ 3.45Å; M364-F430 VanDerWaalsContact CE-CZ 3.45Å; M364-F430 HydrophobicContact SD-CE1 4.4Å; M364-F430 HydrophobicContact SD-CE2 4.01Å; M364-F430 HydrophobicContact SD-CZ 3.68Å; M364-M447 HydrophobicContact SD-CE 4.07Å
365	R	98.8	Very high	98.8	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-70.5	-48.4	175.8	-171.7	-155.6	65.1	77.7	-0.5	111.3	Y361 E362 S363 H402 F407 P410 E412 N417 F418 F427	Y361-R365 WeakPolarHBondContact O-CB 3.49Å; Y361-R365 PolarHBondContact O-N 2.98Å; E362-R365 PolarHBondContact O-N 3.13Å; E362-R365 IonicContact OE1-CZ 2.87Å; E362-R365 IonicContact OE1-NE 3.98Å; E362-R365 PolarHBondContact OE1-NE 3.28Å; E362-R365 IonicContact OE1-NH2 3.2Å; E362-R365 PolarHBondContact OE1-NH2 3.46Å; E362-R365 IonicContact OE2-CZ 2.65Å; E362-R365 IonicContact OE2-NE 3.74Å; E362-R365 PolarHBondContact OE2-NE 2.93Å; E362-R365 IonicContact OE2-NH2 3.29Å; S363-R365 VanDerWaalsContact C-N 3.32Å; S363-R365 PolarHBondContact O-N 2.93Å; R365-H402 HydrophobicContact CG-CB 3.72Å; R365-H402 PolarHBondContact NH1-O 3.45Å; R365-F407 VanDerWaalsContact CD-CE1 3.5Å; R365-F407 VanDerWaalsContact CD-CE2 3.45Å; R365-F407 HydrophobicContact CG-CD2 4.26Å; R365-F407 HydrophobicContact CG-CE1 4.45Å; R365-F407 HydrophobicContact CG-CE2 3.81Å; R365-F407 HydrophobicContact CG-CZ 3.9Å; R365-P410 PolarHBondContact NH1-O 3.4Å; R365-P410 PolarHBondContact NH2-O 3.44Å; R365-E412 PolarHBondContact NH2-O 2.86Å; R365-N417 PolarHBondContact NH2-ND2 3.18Å; R365-F418 HydrophobicContact CB-CE2 4.25Å; R365-F418 HydrophobicContact CB-CZ 4.41Å; R365-F427 HydrophobicContact CB-CD2 4.39Å; R365-F427 HydrophobicContact CB-CE2 3.61Å; R365-F427 HydrophobicContact CB-CZ 4.17Å; R365-F427 HydrophobicContact CG-CD2 4.28Å; R365-F427 HydrophobicContact CG-CE2 3.98Å
366	Y	98.8	Very high	98.8	Very high	25 Å²	25	17 Å²	17	10%	0.098	9%	0.085	C	C	.	.	H	α-helix	trans	-79.5	-47	-173.2	-178.5	-104	0	0	0	111.9	L321 E362 S363 P368 R403 F413 V468 E469	L321-Y366 HydrophobicContact CD2-CD1 4.27Å; L321-Y366 HydrophobicContact CD2-CE1 4.42Å; E362-Y366 VanDerWaalsContact O-CB 3.24Å; E362-Y366 WeakPolarHBondContact O-CB 3.49Å; E362-Y366 PolarHBondContact O-N 3.33Å; S363-Y366 PolarHBondContact O-N 3.11Å; Y366-P368 VanDerWaalsContact C-CD 3.49Å; Y366-P368 WeakPolarHBondContact O-CD 3.33Å; Y366-R403 PolarHBondContact O-NH2 3.01Å; Y366-F413 HydrophobicContact CD1-CB 3.82Å; Y366-F413 AromaticContact CD1-CD2 3.99Å; Y366-F413 HydrophobicContact CD1-CD2 3.99Å; Y366-F413 HydrophobicContact CD1-CG 4.34Å; Y366-F413 HydrophobicContact CD2-CB 4.22Å; Y366-F413 HydrophobicContact CE1-CB 3.9Å; Y366-F413 HydrophobicContact CE2-CB 4.31Å; Y366-F413 HydrophobicContact CG-CB 3.97Å; Y366-F413 HydrophobicContact CG-CD2 4.12Å; Y366-V468 HydrophobicContact CE1-CG2 4.17Å; Y366-E469 WeakPolarHBondContact CE1-OE1 3.3Å; Y366-E469 PolarHBondContact OH-OE1 3.32Å
367	Q	98.6	Very high	98.8	Very high	18 Å²	18	17 Å²	17	8%	0.084	9%	0.085	C	C	.	.	S	Bend	trans	-123.2	75	179.3	-172.3	79.3	-31	0	0	110.4	F317 S363 V468 K473	F317-Q367 HydrophobicContact CB-CG 3.98Å; F317-Q367 HydrophobicContact CD1-CG 4.03Å; F317-Q367 HydrophobicContact CD2-CG 3.65Å; F317-Q367 HydrophobicContact CE1-CG 4.43Å; F317-Q367 HydrophobicContact CE2-CG 4.07Å; F317-Q367 HydrophobicContact CG-CG 3.64Å; F317-Q367 HydrophobicContact CZ-CG 4.45Å; S363-Q367 CarbonylContact O-C 3.58Å; S363-Q367 WeakPolarHBondContact O-CA 3.41Å; S363-Q367 PolarHBondContact O-N 3.35Å; Q367-V468 HydrophobicContact CG-CB 4.35Å; Q367-V468 PolarHBondContact NE2-O 3.13Å; Q367-K473 VanDerWaalsContact NE2-NZ 3.17Å
368	P	98.6	Very high	98.8	Very high	17 Å²	17	17.3 Å²	17.3	11%	0.11	9%	0.088	C	C	.	.			trans	-69.2	142.8	179.5	28.3	-34.8	0	0	0	111.8	M364 Y366 D371 S479	M364-P368 WeakPolarHBondContact O-CA 3.49Å; M364-P368 WeakPolarHBondContact O-CB 3.1Å; Y366-P368 VanDerWaalsContact C-CD 3.49Å; Y366-P368 WeakPolarHBondContact O-CD 3.33Å; P368-D371 HydrophobicContact CB-CB 3.72Å; P368-D371 HydrophobicContact CG-CB 3.51Å; P368-S479 WeakPolarHBondContact O-CB 3.3Å; P368-S479 PolarHBondContact O-OG 2.96Å
369	V	98.7	Very high	98.7	Very high	6 Å²	6	21.9 Å²	21.9	4%	0.036	11%	0.108	C	C	.	.	S	Bend	trans	-87.2	-50.1	164.2	177.1	0	0	0	0	110.1	V313 S314 F317 S478 S479	V313-V369 HydrophobicContact CB-CG1 4.13Å; V313-V369 HydrophobicContact CB-CG2 3.97Å; V313-V369 HydrophobicContact CG1-CG1 4.16Å; V313-V369 HydrophobicContact CG1-CG2 3.7Å; S314-V369 WeakPolarHBondContact OG-CG2 3.16Å; F317-V369 HydrophobicContact CD2-CG2 3.82Å; F317-V369 HydrophobicContact CE2-CG2 3.98Å; V369-S478 CarbonylContact O-C 3.3Å; V369-S478 WeakPolarHBondContact O-CA 3.36Å; V369-S478 WeakPolarHBondContact O-CB 3.26Å; V369-S479 WeakPolarHBondContact CA-O 3.24Å; V369-S479 PolarHBondContact O-N 2.79Å
370	V	98.6	Very high	98.7	Very high	65 Å²	65	27.5 Å²	27.5	39%	0.394	14%	0.138	S	C	.	.	S	Bend	trans	-98.1	91.9	172.7	-176.5	0	0	0	0	107.8	T310	T310-V370 HydrophobicContact CG2-CG2 4.12Å
371	D	98.3	Very high	98.7	Very high	6 Å²	6	29.8 Å²	29.8	3%	0.032	15%	0.151	C	C	.	.			trans	-101	-5	-175.4	81.7	-51.1	0	0	0	113.2	P368 N397 I398 G399 H475	P368-D371 HydrophobicContact CB-CB 3.72Å; P368-D371 HydrophobicContact CG-CB 3.51Å; D371-N397 CarbonylContact O-C 3.5Å; D371-I398 VanDerWaalsContact C-CG1 3.46Å; D371-I398 WeakPolarHBondContact O-CG1 3.32Å; D371-I398 PolarHBondContact O-N 3.4Å; D371-G399 PolarHBondContact O-N 2.84Å; D371-H475 IonicContact OD1-CD2 2.75Å; D371-H475 IonicContact OD1-NE2 3.62Å; D371-H475 PolarHBondContact OD1-NE2 3.07Å; D371-H475 IonicContact OD2-CD2 3.63Å; D371-H475 IonicContact OD2-CE1 3.19Å; D371-H475 PolarHBondContact OD2-CE1 3.42Å; D371-H475 VanDerWaalsContact OD2-CE1 3.27Å; D371-H475 IonicContact OD2-NE2 2.75Å; D371-H475 PolarHBondContact OD2-NE2 3.4Å
372	L	98.7	Very high	98.7	Very high	9 Å²	9	31.3 Å²	31.3	5%	0.047	17%	0.166	C	C	.	.			trans	-136.3	151.8	176	65.5	90	0	0	0	112.6	I70 G71 M374 I395 L396	I70-L372 HydrophobicContact CB-CD2 4.28Å; I70-L372 HydrophobicContact CG2-CD1 4.18Å; I70-L372 HydrophobicContact CG2-CD2 3.73Å; G71-L372 VanDerWaalsContact CA-CD2 3.44Å; L372-M374 HydrophobicContact CD1-CG 4.23Å; L372-I395 HydrophobicContact CB-CG2 3.97Å; L372-I395 HydrophobicContact CD1-CG2 4.18Å; L372-L396 CarbonylContact C-O 3.58Å; L372-L396 WeakPolarHBondContact CA-O 3.48Å
373	V	98.8	Very high	98.6	Very high	17 Å²	17	31.3 Å²	31.3	10%	0.103	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	117.3	178.2	-175.5	0	0	0	0	110.2	M107 R375 L396 I398	M107-V373 HydrophobicContact CE-CB 4.34Å; M107-V373 HydrophobicContact CE-CG1 4.45Å; M107-V373 HydrophobicContact CE-CG2 4.14Å; V373-R375 HydrophobicContact CG1-CG 4.46Å; V373-L396 HydrophobicContact CB-CB 4.23Å; V373-L396 PolarHBondContact N-O 3.42Å; V373-L396 PolarHBondContact O-N 2.95Å; V373-I398 HydrophobicContact CG2-CD1 3.84Å; V373-I398 HydrophobicContact CG2-CG1 4.37Å; V373-I398 HydrophobicContact CG2-CG2 4.47Å
374	M	98.8	Very high	98.4	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.02	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	131.8	176.2	-62.4	170.2	79.6	0	0	111.3	R115 F116 F134 L228 I229 L372 I394 I395 L477	R115-M374 WeakPolarHBondContact CG-O 3.3Å; R115-M374 PolarHBondContact NH1-O 3.47Å; F116-M374 HydrophobicContact CD1-CB 4.11Å; F116-M374 HydrophobicContact CD1-CE 3.95Å; F116-M374 HydrophobicContact CD2-CE 3.89Å; F116-M374 HydrophobicContact CE1-CB 3.8Å; F116-M374 HydrophobicContact CE1-CE 3.58Å; F116-M374 HydrophobicContact CE1-CG 4Å; F116-M374 HydrophobicContact CE2-CE 3.51Å; F116-M374 HydrophobicContact CG-CE 4.1Å; F116-M374 HydrophobicContact CZ-CE 3.35Å; F116-M374 HydrophobicContact CZ-CG 4.38Å; F116-M374 VanDerWaalsContact O-CE 3.26Å; F116-M374 WeakPolarHBondContact O-CE 3.42Å; F134-M374 HydrophobicContact CE1-CE 4.3Å; F134-M374 HydrophobicContact CE1-SD 3.93Å; F134-M374 HydrophobicContact CZ-SD 3.7Å; L228-M374 HydrophobicContact CD2-CE 4.1Å; L228-M374 HydrophobicContact CD2-SD 3.69Å; L228-M374 HydrophobicContact CG-CE 4.47Å; I229-M374 HydrophobicContact CG2-CE 4.27Å; L372-M374 HydrophobicContact CD1-CG 4.23Å; M374-I394 CarbonylContact C-O 3.53Å; M374-I394 WeakPolarHBondContact CA-O 3.49Å; M374-I395 HydrophobicContact CG-CG1 4.38Å; M374-L477 HydrophobicContact SD-CD1 4.4Å
375	R	98.8	Very high	98.2	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	166.3	175.4	-63.9	-60.4	-165	88	4.2	110.9	I106 Y112 S114 F116 V373 I394 L396	I106-R375 HydrophobicContact CG2-CB 4.22Å; I106-R375 HydrophobicContact CG2-CG 4.08Å; I106-R375 PolarHBondContact O-NH1 2.9Å; Y112-R375 WeakPolarHBondContact O-CD 3.47Å; Y112-R375 PolarHBondContact O-NH1 3.06Å; S114-R375 CarbonylContact O-C 3.55Å; S114-R375 WeakPolarHBondContact O-CA 3.3Å; F116-R375 VanDerWaalsContact CD1-O 3.3Å; F116-R375 WeakPolarHBondContact CD1-O 3.44Å; V373-R375 HydrophobicContact CG1-CG 4.46Å; R375-I394 HydrophobicContact CB-CB 4.12Å; R375-I394 HydrophobicContact CB-CG2 4.48Å; R375-I394 PolarHBondContact N-O 3.17Å; R375-I394 PolarHBondContact O-N 2.86Å; R375-I394 VanDerWaalsContact O-O 3.14Å; R375-L396 HydrophobicContact CG-CD1 4.34Å
376	K	98.8	Very high	98.1	Very high	39 Å²	39	39 Å²	39	17%	0.17	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	137.8	171.4	-167.4	175.8	-175.3	74.1	0	109.7	E92 S114 F116 G391 N393	E92-K376 IonicContact OE1-NZ 2.6Å; E92-K376 IonicContact OE2-NZ 3.63Å; E92-K376 PolarHBondContact OE2-NZ 2.92Å; S114-K376 PolarHBondContact O-N 3.08Å; F116-K376 HydrophobicContact CB-CD 4.26Å; K376-G391 WeakPolarHBondContact CE-O 3.46Å; K376-G391 PolarHBondContact NZ-O 3.01Å; K376-N393 PolarHBondContact NZ-OD1 3.07Å
377	A	98.8	Very high	97.9	Very high	1 Å²	1	41.3 Å²	41.3	1%	0.008	24%	0.236	C	C	.	.			trans	-73.8	127.9	175.2	0	0	0	0	0	110.4	Y112 V388 K389 G391 T392	Y112-A377 HydrophobicContact CD1-CB 4.12Å; Y112-A377 HydrophobicContact CE1-CB 3.84Å; A377-V388 HydrophobicContact CB-CG1 4.07Å; A377-K389 WeakPolarHBondContact CB-O 3.47Å; A377-G391 PolarHBondContact O-N 3.43Å; A377-T392 PolarHBondContact N-O 3.49Å
378	L	98.6	Very high	97.9	Very high	44 Å²	44	40.6 Å²	40.6	23%	0.23	23%	0.233	C	C	.	.	S	Bend	trans	-98.3	-15.7	178.6	-61.2	175.7	0	0	0	112.6	H111 P138 K390	H111-L378 HydrophobicContact CB-CB 4.33Å; H111-L378 WeakPolarHBondContact O-CB 3.24Å; H111-L378 WeakPolarHBondContact O-CG 3.47Å; H111-L378 PolarHBondContact O-N 3.48Å; P138-L378 HydrophobicContact CG-CD1 4.31Å; P138-L378 HydrophobicContact CG-CD2 4.47Å; L378-K390 WeakPolarHBondContact O-CD 3.3Å; L378-K390 WeakPolarHBondContact O-CE 3.39Å; L378-K390 VanDerWaalsContact O-CG 3.27Å; L378-K390 WeakPolarHBondContact O-CG 3.49Å
379	E	98.6	Very high	97.9	Very high	123 Å²	123	46.6 Å²	46.6	58%	0.575	26%	0.257	S	S	*	.	S	Bend	trans	-141.4	158.7	178.4	-62.9	-178.5	-179.5	0	0	109.2	H111	H111-E379 HydrophobicContact CB-CB 3.99Å; H111-E379 HydrophobicContact CB-CG 3.99Å
380	D	98.6	Very high	97.9	Very high	118 Å²	118	53.1 Å²	53.1	63%	0.631	29%	0.285	S	S	*	.			trans	-70.1	142.2	173.4	-69.6	-7.1	0	0	0	110	V388 K389 K390	D380-V388 WeakPolarHBondContact CA-O 3.46Å; D380-K389 WeakPolarHBondContact OD1-CA 3.18Å; D380-K390 WeakPolarHBondContact OD1-CB 3.44Å; D380-K390 PolarHBondContact OD1-N 2.86Å
381	D	98.4	Very high	97.8	Very high	48 Å²	48	51.3 Å²	51.3	26%	0.257	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	172.2	179.2	-152.1	-20.5	0	0	0	111.9	H105 H111 Y112 V388	H105-D381 IonicContact CE1-OD2 3.78Å; H105-D381 PolarHBondContact CE1-OD2 2.99Å; H105-D381 IonicContact NE2-OD2 2.81Å; H111-D381 IonicContact CD2-OD2 2.66Å; H111-D381 IonicContact CE1-OD2 2.88Å; H111-D381 PolarHBondContact CE1-OD2 3.23Å; H111-D381 IonicContact NE2-OD2 2.63Å; H111-D381 PolarHBondContact NE2-OD2 3.46Å; Y112-D381 VanDerWaalsContact OH-CB 3.26Å; Y112-D381 WeakPolarHBondContact OH-CB 3.35Å; Y112-D381 PolarHBondContact OH-OD2 2.94Å; D381-V388 PolarHBondContact N-O 2.9Å; D381-V388 PolarHBondContact O-N 3.38Å
382	V	98	Very high	97.9	Very high	91 Å²	91	51.7 Å²	51.7	55%	0.552	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.6	114.8	169.4	-179.6	0	0	0	0	109.4	Y386	V382-Y386 CarbonylContact C-O 3.5Å; V382-Y386 WeakPolarHBondContact CA-O 3.31Å
383	I	97.6	Very high	97.9	Very high	1 Å²	1	51.3 Å²	51.3	1%	0.005	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.9	-178.2	-47.6	-178.8	0	0	0	109.5	F84 I106 Y112 G385 Y386 V388	F84-I383 HydrophobicContact CE2-CB 4.38Å; F84-I383 HydrophobicContact CE2-CG2 4.36Å; I106-I383 HydrophobicContact CD1-CD1 3.88Å; I106-I383 HydrophobicContact CG1-CD1 3.65Å; Y112-I383 HydrophobicContact CE1-CD1 4.04Å; Y112-I383 HydrophobicContact CE2-CD1 4.48Å; Y112-I383 WeakPolarHBondContact OH-CD1 3.43Å; Y112-I383 WeakPolarHBondContact OH-CG1 3.44Å; I383-G385 PolarHBondContact O-N 2.88Å; I383-G385 VanDerWaalsContact O-N 3.08Å; I383-Y386 PolarHBondContact N-O 3.09Å; I383-Y386 PolarHBondContact O-N 3.44Å; I383-V388 HydrophobicContact CB-CG2 4.16Å; I383-V388 HydrophobicContact CD1-CB 4.19Å; I383-V388 HydrophobicContact CD1-CG1 4.38Å; I383-V388 HydrophobicContact CD1-CG2 3.68Å; I383-V388 HydrophobicContact CG1-CB 4.31Å; I383-V388 HydrophobicContact CG1-CG2 3.74Å
384	D	95.2	Very high	97.9	Very high	71 Å²	71	50.5 Å²	50.5	38%	0.38	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.1	36.4	-179.8	-70.6	-17.1	0	0	0	113.6	S101 S102	S101-D384 WeakPolarHBondContact CB-OD2 3.41Å; S101-D384 PolarHBondContact OG-OD2 2.71Å; S102-D384 WeakPolarHBondContact CB-OD2 3.29Å; S102-D384 PolarHBondContact N-OD2 3.1Å; S102-D384 VanDerWaalsContact OG-CG 3.3Å; S102-D384 PolarHBondContact OG-OD2 2.89Å
385	G	93.8	Very high	97.9	Very high	61 Å²	61	50.3 Å²	50.3	63%	0.629	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	88.8	-1.5	179.7	0	0	0	0	0	115.5	I383	I383-G385 PolarHBondContact O-N 2.88Å; I383-G385 VanDerWaalsContact O-N 3.08Å
386	Y	96.3	Very high	97.9	Very high	55 Å²	55	50.2 Å²	50.2	22%	0.216	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	133.9	177.7	-62.8	-76.6	0	0	0	112	S46 I47 F84 V382 I383 V388	S46-Y386 WeakPolarHBondContact O-CE1 3.44Å; I47-Y386 HydrophobicContact CB-CD1 4.39Å; I47-Y386 HydrophobicContact CG1-CD1 3.68Å; I47-Y386 HydrophobicContact CG1-CE1 4.46Å; I47-Y386 HydrophobicContact CG1-CG 4.36Å; F84-Y386 HydrophobicContact CB-CE2 4.31Å; F84-Y386 AromaticContact CD1-CD2 3.73Å; F84-Y386 HydrophobicContact CD1-CD2 3.73Å; F84-Y386 HydrophobicContact CD1-CE2 4.02Å; F84-Y386 HydrophobicContact CD1-CG 4.03Å; F84-Y386 AromaticContact CD2-CD2 3.97Å; F84-Y386 HydrophobicContact CD2-CD2 3.97Å; F84-Y386 HydrophobicContact CD2-CE2 4.39Å; F84-Y386 HydrophobicContact CE1-CD1 4.42Å; F84-Y386 AromaticContact CE1-CD2 3.74Å; F84-Y386 HydrophobicContact CE1-CD2 3.74Å; F84-Y386 HydrophobicContact CE1-CE2 4.47Å; F84-Y386 AromaticContact CE1-CG 3.69Å; F84-Y386 HydrophobicContact CE1-CG 3.69Å; F84-Y386 AromaticContact CE2-CD2 3.95Å; F84-Y386 HydrophobicContact CE2-CD2 3.95Å; F84-Y386 HydrophobicContact CE2-CG 4.5Å; F84-Y386 AromaticContact CG-CD2 3.87Å; F84-Y386 HydrophobicContact CG-CD2 3.87Å; F84-Y386 AromaticContact CG-CE2 4Å; F84-Y386 HydrophobicContact CG-CE2 4Å; F84-Y386 AromaticContact CZ-CD2 3.84Å; F84-Y386 HydrophobicContact CZ-CD2 3.84Å; F84-Y386 AromaticContact CZ-CG 3.95Å; F84-Y386 HydrophobicContact CZ-CG 3.95Å; V382-Y386 CarbonylContact C-O 3.5Å; V382-Y386 WeakPolarHBondContact CA-O 3.31Å; I383-Y386 PolarHBondContact N-O 3.09Å; I383-Y386 PolarHBondContact O-N 3.44Å; Y386-V388 PolarHBondContact O-N 3.43Å
387	P	96.2	Very high	97.9	Very high	73 Å²	73	48.4 Å²	48.4	47%	0.474	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.6	173.9	29.8	-33.2	0	0	0	110.4
388	V	98.1	Very high	97.9	Very high	2 Å²	2	48.5 Å²	48.5	1%	0.012	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	109.9	177	-177.3	0	0	0	0	108.2	F84 L95 A377 D380 D381 I383 Y386 T392	F84-V388 HydrophobicContact CZ-CG2 4.37Å; L95-V388 HydrophobicContact CD1-CB 4.5Å; L95-V388 HydrophobicContact CD1-CG1 4.08Å; L95-V388 HydrophobicContact CD1-CG2 3.72Å; A377-V388 HydrophobicContact CB-CG1 4.07Å; D380-V388 WeakPolarHBondContact CA-O 3.46Å; D381-V388 PolarHBondContact N-O 2.9Å; D381-V388 PolarHBondContact O-N 3.38Å; I383-V388 HydrophobicContact CB-CG2 4.16Å; I383-V388 HydrophobicContact CD1-CB 4.19Å; I383-V388 HydrophobicContact CD1-CG1 4.38Å; I383-V388 HydrophobicContact CD1-CG2 3.68Å; I383-V388 HydrophobicContact CG1-CB 4.31Å; I383-V388 HydrophobicContact CG1-CG2 3.74Å; Y386-V388 PolarHBondContact O-N 3.43Å; V388-T392 HydrophobicContact CG1-CG2 4.2Å
389	K	98.1	Very high	97.9	Very high	143 Å²	143	46.8 Å²	46.8	62%	0.622	26%	0.259	S	S	*	.			trans	-78.3	153.1	-179.3	-63.5	178	-177.4	174.6	0	110.9	A377 D380 G391 T392	A377-K389 WeakPolarHBondContact CB-O 3.47Å; D380-K389 WeakPolarHBondContact OD1-CA 3.18Å; K389-G391 PolarHBondContact O-N 3.27Å; K389-T392 WeakPolarHBondContact O-CB 3.43Å; K389-T392 PolarHBondContact O-N 3.12Å; K389-T392 VanDerWaalsContact O-N 3.09Å; K389-T392 PolarHBondContact O-OG1 2.74Å
390	K	98.3	Very high	97.9	Very high	143 Å²	143	43.1 Å²	43.1	62%	0.622	24%	0.24	S	C	*	.	T	Hydrogen-bonded Turn	trans	-52.5	136.7	166	175	174	-175.4	169.8	0	109.7	L378 D380 T392	L378-K390 WeakPolarHBondContact O-CD 3.3Å; L378-K390 WeakPolarHBondContact O-CE 3.39Å; L378-K390 VanDerWaalsContact O-CG 3.27Å; L378-K390 WeakPolarHBondContact O-CG 3.49Å; D380-K390 WeakPolarHBondContact OD1-CB 3.44Å; D380-K390 PolarHBondContact OD1-N 2.86Å; K390-T392 VanDerWaalsContact C-N 3.29Å
391	G	97.9	Very high	97.9	Very high	28 Å²	28	37.6 Å²	37.6	29%	0.289	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-12.5	-177.6	0	0	0	0	0	113.9	K376 A377 K389 N393	K376-G391 WeakPolarHBondContact CE-O 3.46Å; K376-G391 PolarHBondContact NZ-O 3.01Å; A377-G391 PolarHBondContact O-N 3.43Å; K389-G391 PolarHBondContact O-N 3.27Å; G391-N393 PolarHBondContact O-N 3.13Å
392	T	98.7	Very high	97.9	Very high	13 Å²	13	35.4 Å²	35.4	8%	0.08	20%	0.199	C	C	.	.			trans	-62	127.8	173.7	-62.3	0	0	0	0	110.5	L95 A377 V388 K389 K390	L95-T392 HydrophobicContact CD1-CG2 3.88Å; L95-T392 HydrophobicContact CG-CG2 3.71Å; A377-T392 PolarHBondContact N-O 3.49Å; V388-T392 HydrophobicContact CG1-CG2 4.2Å; K389-T392 WeakPolarHBondContact O-CB 3.43Å; K389-T392 PolarHBondContact O-N 3.12Å; K389-T392 VanDerWaalsContact O-N 3.09Å; K389-T392 PolarHBondContact O-OG1 2.74Å; K390-T392 VanDerWaalsContact C-N 3.29Å
393	N	98.9	Very high	97.9	Very high	1 Å²	1	34.6 Å²	34.6	1%	0.005	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	151.5	173.9	-66.6	-28	0	0	0	109.7	E92 E93 T94 L95 F116 K376 G391	E92-N393 PolarHBondContact OE2-ND2 2.99Å; E92-N393 PolarHBondContact OE2-OD1 3.16Å; E93-N393 PolarHBondContact O-N 3.01Å; T94-N393 CarbonylContact C-O 3.59Å; T94-N393 VanDerWaalsContact CA-O 3.28Å; T94-N393 WeakPolarHBondContact CA-O 2.99Å; T94-N393 HydrophobicContact CG2-CB 3.75Å; T94-N393 WeakPolarHBondContact OG1-CB 3.03Å; L95-N393 PolarHBondContact N-O 2.84Å; F116-N393 HydrophobicContact CB-CB 4.44Å; F116-N393 WeakPolarHBondContact CB-OD1 3.11Å; F116-N393 HydrophobicContact CD1-CB 3.7Å; F116-N393 HydrophobicContact CD2-CB 3.87Å; F116-N393 VanDerWaalsContact CD2-CG 3.42Å; F116-N393 WeakPolarHBondContact CD2-ND2 3.45Å; F116-N393 HydrophobicContact CE1-CB 3.77Å; F116-N393 HydrophobicContact CE2-CB 3.94Å; F116-N393 HydrophobicContact CG-CB 3.74Å; F116-N393 VanDerWaalsContact CG-OD1 3.3Å; F116-N393 WeakPolarHBondContact CG-OD1 3.19Å; F116-N393 HydrophobicContact CZ-CB 3.88Å; K376-N393 PolarHBondContact NZ-OD1 3.07Å; G391-N393 PolarHBondContact O-N 3.13Å
394	I	98.9	Very high	97.9	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	131.3	-177.1	-61.2	172	0	0	0	109	L95 I97 I106 Y112 F116 M374 R375 L396	L95-I394 CarbonylContact O-C 3.6Å; L95-I394 WeakPolarHBondContact O-CA 3.39Å; I97-I394 HydrophobicContact CD1-CG2 4.15Å; I106-I394 HydrophobicContact CD1-CD1 4.21Å; I106-I394 HydrophobicContact CD1-CG2 4.1Å; I106-I394 HydrophobicContact CG1-CD1 4.4Å; I106-I394 HydrophobicContact CG2-CD1 4.36Å; Y112-I394 HydrophobicContact CD1-CD1 3.81Å; Y112-I394 HydrophobicContact CE1-CD1 3.86Å; F116-I394 WeakPolarHBondContact CE1-O 3.26Å; M374-I394 CarbonylContact C-O 3.53Å; M374-I394 WeakPolarHBondContact CA-O 3.49Å; R375-I394 HydrophobicContact CB-CB 4.12Å; R375-I394 HydrophobicContact CB-CG2 4.48Å; R375-I394 PolarHBondContact N-O 3.17Å; R375-I394 PolarHBondContact O-N 2.86Å; R375-I394 VanDerWaalsContact O-O 3.14Å; I394-L396 HydrophobicContact CG2-CD2 3.97Å; I394-L396 HydrophobicContact CG2-CG 4.14Å
395	I	98.9	Very high	97.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	113.7	166.9	-54.4	177	0	0	0	107.9	F65 I70 I89 T94 L95 I96 I97 F116 L372 M374	F65-I395 HydrophobicContact CE1-CD1 4.02Å; F65-I395 HydrophobicContact CZ-CD1 4.38Å; I70-I395 HydrophobicContact CG2-CD1 4.04Å; I89-I395 HydrophobicContact CD1-CD1 4.12Å; T94-I395 HydrophobicContact CG2-CD1 4.18Å; T94-I395 HydrophobicContact CG2-CG1 4.02Å; L95-I395 PolarHBondContact O-N 2.71Å; I96-I395 WeakPolarHBondContact CA-O 3.29Å; I97-I395 PolarHBondContact N-O 3.12Å; F116-I395 HydrophobicContact CE1-CG1 4.02Å; F116-I395 HydrophobicContact CZ-CD1 4.08Å; F116-I395 HydrophobicContact CZ-CG1 3.78Å; L372-I395 HydrophobicContact CB-CG2 3.97Å; L372-I395 HydrophobicContact CD1-CG2 4.18Å; M374-I395 HydrophobicContact CG-CG1 4.38Å
396	L	98.9	Very high	98.1	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	109.7	172.8	-60.5	173	0	0	0	108.7	I97 M103 I106 M107 L372 V373 R375 I394 I398	I97-L396 HydrophobicContact CB-CD2 4.23Å; I97-L396 CarbonylContact O-C 3.36Å; I97-L396 VanDerWaalsContact O-CA 3.3Å; I97-L396 WeakPolarHBondContact O-CA 3.34Å; M103-L396 HydrophobicContact CB-CD2 4.26Å; M103-L396 HydrophobicContact CG-CD1 4.25Å; I106-L396 HydrophobicContact CB-CD1 4.43Å; I106-L396 HydrophobicContact CD1-CD2 3.76Å; I106-L396 HydrophobicContact CG2-CD1 4.01Å; I106-L396 HydrophobicContact CG2-CD2 4.48Å; M107-L396 HydrophobicContact CE-CD1 3.53Å; M107-L396 HydrophobicContact CG-CD1 3.92Å; L372-L396 CarbonylContact C-O 3.58Å; L372-L396 WeakPolarHBondContact CA-O 3.48Å; V373-L396 HydrophobicContact CB-CB 4.23Å; V373-L396 PolarHBondContact N-O 3.42Å; V373-L396 PolarHBondContact O-N 2.95Å; R375-L396 HydrophobicContact CG-CD1 4.34Å; I394-L396 HydrophobicContact CG2-CD2 3.97Å; I394-L396 HydrophobicContact CG2-CG 4.14Å; L396-I398 VanDerWaalsContact C-N 3.33Å; L396-I398 HydrophobicContact CB-CG2 4.2Å; L396-I398 PolarHBondContact O-N 3.44Å; L396-I398 VanDerWaalsContact O-N 3.09Å
397	N	98.8	Very high	98.2	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.183	C	C	.	.			trans	-84.4	75.6	178.3	-174.3	-6.4	0	0	0	109.9	N75 N78 I97 D371 R400 M401	N75-N397 PolarHBondContact OD1-ND2 2.96Å; N78-N397 PolarHBondContact OD1-ND2 3.49Å; I97-N397 PolarHBondContact O-N 3.45Å; D371-N397 CarbonylContact O-C 3.5Å; N397-R400 HydrophobicContact CB-CB 4.36Å; N397-R400 VanDerWaalsContact CG-CB 3.43Å; N397-R400 WeakPolarHBondContact ND2-CB 3.4Å; N397-R400 PolarHBondContact O-N 3.35Å; N397-R400 VanDerWaalsContact OD1-CB 3.26Å; N397-R400 WeakPolarHBondContact OD1-CB 3.48Å; N397-R400 PolarHBondContact OD1-N 3.48Å; N397-M401 PolarHBondContact O-N 3.36Å
398	I	98.8	Very high	98.3	Very high	3 Å²	3	38.3 Å²	38.3	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-70.2	-30.3	-173.4	57.9	168.6	0	0	0	112.9	M103 M107 D371 V373 L396 M401 H402 Q428	M103-I398 HydrophobicContact CG-CG2 4.19Å; M107-I398 HydrophobicContact CE-CG2 4.15Å; D371-I398 VanDerWaalsContact C-CG1 3.46Å; D371-I398 WeakPolarHBondContact O-CG1 3.32Å; D371-I398 PolarHBondContact O-N 3.4Å; V373-I398 HydrophobicContact CG2-CD1 3.84Å; V373-I398 HydrophobicContact CG2-CG1 4.37Å; V373-I398 HydrophobicContact CG2-CG2 4.47Å; L396-I398 VanDerWaalsContact C-N 3.33Å; L396-I398 HydrophobicContact CB-CG2 4.2Å; L396-I398 PolarHBondContact O-N 3.44Å; L396-I398 VanDerWaalsContact O-N 3.09Å; I398-M401 HydrophobicContact CB-CE 4.4Å; I398-M401 HydrophobicContact CG2-CE 4.37Å; I398-M401 WeakPolarHBondContact O-CB 3.1Å; I398-M401 PolarHBondContact O-N 3.2Å; I398-H402 PolarHBondContact O-CD2 3.37Å; I398-H402 PolarHBondContact O-N 3.44Å; I398-Q428 WeakPolarHBondContact CD1-O 3.23Å
399	G	98.6	Very high	98.3	Very high	7 Å²	7	41.7 Å²	41.7	7%	0.072	20%	0.203	C	C	.	.	H	α-helix	trans	-65.5	-40.2	175.6	0	0	0	0	0	112	D371	D371-G399 PolarHBondContact O-N 2.84Å
400	R	98.6	Very high	98.3	Very high	47 Å²	47	36.4 Å²	36.4	18%	0.177	18%	0.183	C	C	.	.	H	α-helix	trans	-66.9	-44.2	171.3	-176.4	172.1	177.4	73.8	3.6	111.9	E83 N397 H402 R403 L404	E83-R400 IonicContact OE1-CZ 3.01Å; E83-R400 IonicContact OE1-NE 3.69Å; E83-R400 PolarHBondContact OE1-NE 2.99Å; E83-R400 IonicContact OE1-NH2 2.72Å; E83-R400 PolarHBondContact OE1-NH2 3.01Å; E83-R400 WeakPolarHBondContact OE2-CD 3.46Å; E83-R400 IonicContact OE2-CZ 2.78Å; E83-R400 IonicContact OE2-NE 2.86Å; E83-R400 PolarHBondContact OE2-NE 3.14Å; E83-R400 IonicContact OE2-NH2 3.3Å; N397-R400 HydrophobicContact CB-CB 4.36Å; N397-R400 VanDerWaalsContact CG-CB 3.43Å; N397-R400 WeakPolarHBondContact ND2-CB 3.4Å; N397-R400 PolarHBondContact O-N 3.35Å; N397-R400 VanDerWaalsContact OD1-CB 3.26Å; N397-R400 WeakPolarHBondContact OD1-CB 3.48Å; N397-R400 PolarHBondContact OD1-N 3.48Å; R400-H402 VanDerWaalsContact C-N 3.28Å; R400-H402 PolarHBondContact O-N 3.41Å; R400-R403 PolarHBondContact O-N 3.21Å; R400-L404 HydrophobicContact CG-CD1 3.76Å; R400-L404 HydrophobicContact CG-CG 4.26Å; R400-L404 WeakPolarHBondContact O-CG 3.27Å; R400-L404 PolarHBondContact O-N 3.27Å
401	M	98.8	Very high	98.2	Very high	1 Å²	1	34.8 Å²	34.8	1%	0.005	18%	0.182	C	C	.	.	H	α-helix	trans	-54.4	-44.4	176.9	-178.2	-169.4	75.1	0	0	111.7	S98 M103 N397 I398 R403 L404 E405 Q428	S98-M401 VanDerWaalsContact O-CB 3.22Å; S98-M401 WeakPolarHBondContact O-CB 3.36Å; S98-M401 VanDerWaalsContact O-CG 3.26Å; S98-M401 WeakPolarHBondContact O-CG 3.33Å; M103-M401 HydrophobicContact CB-SD 3.91Å; M103-M401 HydrophobicContact CE-CE 3.79Å; M103-M401 HydrophobicContact CE-SD 3.67Å; M103-M401 HydrophobicContact CG-CE 4.4Å; M103-M401 HydrophobicContact CG-SD 3.81Å; N397-M401 PolarHBondContact O-N 3.36Å; I398-M401 HydrophobicContact CB-CE 4.4Å; I398-M401 HydrophobicContact CG2-CE 4.37Å; I398-M401 WeakPolarHBondContact O-CB 3.1Å; I398-M401 PolarHBondContact O-N 3.2Å; M401-R403 PolarHBondContact O-N 3.3Å; M401-R403 VanDerWaalsContact O-N 3.1Å; M401-L404 PolarHBondContact O-N 3.24Å; M401-L404 VanDerWaalsContact O-N 3.12Å; M401-E405 PolarHBondContact O-N 3.39Å; M401-E405 VanDerWaalsContact O-N 3.11Å; M401-Q428 HydrophobicContact CE-CB 4.46Å
402	H	98.7	Very high	98.2	Very high	3 Å²	3	39 Å²	39	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-64.8	-11	178.4	-66.3	169.7	0	0	0	114.6	R365 I398 R400 F407 F427 Q428	R365-H402 HydrophobicContact CG-CB 3.72Å; R365-H402 PolarHBondContact NH1-O 3.45Å; I398-H402 PolarHBondContact O-CD2 3.37Å; I398-H402 PolarHBondContact O-N 3.44Å; R400-H402 VanDerWaalsContact C-N 3.28Å; R400-H402 PolarHBondContact O-N 3.41Å; H402-F407 HydrophobicContact CB-CE2 4.47Å; H402-F407 VanDerWaalsContact O-CD2 3.29Å; H402-F407 WeakPolarHBondContact O-CD2 3.09Å; H402-F427 AromaticContact CD2-CD2 3.84Å; H402-F427 AromaticContact CE1-CD2 3.7Å; H402-F427 AromaticContact CE1-CE2 3.67Å; H402-F427 AromaticContact CG-CD2 3.93Å; H402-F427 AromaticContact ND1-CD2 3.82Å; H402-F427 AromaticContact ND1-CE2 3.65Å; H402-F427 AromaticContact NE2-CD2 3.72Å; H402-Q428 PolarHBondContact NE2-N 3.44Å
403	R	98.3	Very high	98.2	Very high	74 Å²	74	39.2 Å²	39.2	28%	0.279	19%	0.194	S	C	.	.	H	α-helix	trans	-105.5	-13.5	175.6	-66.9	-177.6	173	-90.4	1	113.7	Y366 R400 M401 P410	Y366-R403 PolarHBondContact O-NH2 3.01Å; R400-R403 PolarHBondContact O-N 3.21Å; M401-R403 PolarHBondContact O-N 3.3Å; M401-R403 VanDerWaalsContact O-N 3.1Å; R403-P410 WeakPolarHBondContact O-CB 3.39Å
404	L	97.9	Very high	98.2	Very high	88 Å²	88	40.3 Å²	40.3	46%	0.461	20%	0.201	S	C	.	.	H	α-helix	trans	-104.8	-28.1	-176.8	-67.9	180	0	0	0	113.1	E83 R400 M401	E83-L404 HydrophobicContact CG-CD1 4.01Å; E83-L404 WeakPolarHBondContact OE2-CD1 3.46Å; R400-L404 HydrophobicContact CG-CD1 3.76Å; R400-L404 HydrophobicContact CG-CG 4.26Å; R400-L404 WeakPolarHBondContact O-CG 3.27Å; R400-L404 PolarHBondContact O-N 3.27Å; M401-L404 PolarHBondContact O-N 3.24Å; M401-L404 VanDerWaalsContact O-N 3.12Å
405	E	95.3	Very high	98.2	Very high	53 Å²	53	42 Å²	42	25%	0.248	21%	0.21	C	C	.	.	S	Bend	trans	-121.5	147.1	-170.6	-61.6	-164.9	-147.6	0	0	112.4	K99 S100 M401 F407	K99-E405 WeakPolarHBondContact CA-OE1 3.37Å; S100-E405 WeakPolarHBondContact CB-OE2 3.49Å; S100-E405 PolarHBondContact N-OE1 3.24Å; S100-E405 PolarHBondContact OG-OE2 2.85Å; M401-E405 PolarHBondContact O-N 3.39Å; M401-E405 VanDerWaalsContact O-N 3.11Å; E405-F407 WeakPolarHBondContact O-CD2 3.44Å; E405-F407 PolarHBondContact O-N 2.73Å
406	F	97.9	Very high	98.1	Very high	94 Å²	94	47.1 Å²	47.1	41%	0.412	23%	0.233	S	C	.	.	S	Bend	trans	67.1	-46	169.9	-174.8	-89.8	0	0	0	118	V422 P423 Y426	F406-V422 HydrophobicContact CD1-CG1 3.89Å; F406-V422 HydrophobicContact CE1-CB 4.04Å; F406-V422 HydrophobicContact CE1-CG1 3.6Å; F406-V422 HydrophobicContact CE1-CG2 3.92Å; F406-V422 HydrophobicContact CZ-CG1 4.35Å; F406-P423 HydrophobicContact CE2-CG 3.81Å; F406-P423 HydrophobicContact CZ-CG 4.12Å; F406-Y426 HydrophobicContact CB-CD1 4.19Å; F406-Y426 HydrophobicContact CB-CD2 4.19Å; F406-Y426 HydrophobicContact CB-CG 3.73Å; F406-Y426 AromaticContact CD2-CD2 3.32Å; F406-Y426 HydrophobicContact CD2-CD2 3.32Å; F406-Y426 AromaticContact CD2-CE2 3.89Å; F406-Y426 HydrophobicContact CD2-CE2 3.89Å; F406-Y426 AromaticContact CD2-CG 3.79Å; F406-Y426 HydrophobicContact CD2-CG 3.79Å; F406-Y426 AromaticContact CE2-CD2 3.96Å; F406-Y426 HydrophobicContact CE2-CD2 3.96Å; F406-Y426 HydrophobicContact CE2-CE2 4.44Å; F406-Y426 AromaticContact CG-CD2 3.9Å; F406-Y426 HydrophobicContact CG-CD2 3.9Å; F406-Y426 AromaticContact CG-CG 3.9Å; F406-Y426 HydrophobicContact CG-CG 3.9Å
407	F	98.4	Very high	98.1	Very high	13 Å²	13	47.3 Å²	47.3	6%	0.057	23%	0.234	C	C	.	.			trans	-74.3	137.4	-168.9	-67.9	-77.1	0	0	0	113.2	R365 H402 E405 P410 N417 F418 V422 F427	R365-F407 VanDerWaalsContact CD-CE1 3.5Å; R365-F407 VanDerWaalsContact CD-CE2 3.45Å; R365-F407 HydrophobicContact CG-CD2 4.26Å; R365-F407 HydrophobicContact CG-CE1 4.45Å; R365-F407 HydrophobicContact CG-CE2 3.81Å; R365-F407 HydrophobicContact CG-CZ 3.9Å; H402-F407 HydrophobicContact CB-CE2 4.47Å; H402-F407 VanDerWaalsContact O-CD2 3.29Å; H402-F407 WeakPolarHBondContact O-CD2 3.09Å; E405-F407 WeakPolarHBondContact O-CD2 3.44Å; E405-F407 PolarHBondContact O-N 2.73Å; F407-P410 HydrophobicContact CB-CB 4.38Å; F407-P410 WeakPolarHBondContact O-CD 3.25Å; F407-N417 HydrophobicContact CD1-CB 3.79Å; F407-N417 HydrophobicContact CE1-CB 4.42Å; F407-F418 HydrophobicContact CD1-CE2 4.5Å; F407-F418 HydrophobicContact CE1-CD2 4.31Å; F407-F418 HydrophobicContact CE1-CE1 4.09Å; F407-F418 AromaticContact CE1-CE2 3.65Å; F407-F418 HydrophobicContact CE1-CE2 3.65Å; F407-F418 AromaticContact CE1-CZ 3.53Å; F407-F418 HydrophobicContact CE1-CZ 3.53Å; F407-F418 HydrophobicContact CZ-CE1 4.38Å; F407-F418 HydrophobicContact CZ-CE2 4.19Å; F407-F418 AromaticContact CZ-CZ 3.73Å; F407-F418 HydrophobicContact CZ-CZ 3.73Å; F407-V422 HydrophobicContact CE1-CG1 4.09Å; F407-V422 HydrophobicContact CE1-CG2 4.06Å; F407-V422 HydrophobicContact CZ-CG1 4.05Å; F407-F427 HydrophobicContact CE2-CB 4.27Å; F407-F427 HydrophobicContact CE2-CD2 4.08Å; F407-F427 HydrophobicContact CE2-CG 4.46Å; F407-F427 HydrophobicContact CZ-CB 3.79Å; F407-F427 AromaticContact CZ-CD2 3.7Å; F407-F427 HydrophobicContact CZ-CD2 3.7Å; F407-F427 AromaticContact CZ-CG 3.81Å; F407-F427 HydrophobicContact CZ-CG 3.81Å
408	P	97.7	Very high	98.1	Very high	91 Å²	91	47.9 Å²	47.9	59%	0.591	24%	0.237	S	C	*	.	S	Bend	trans	-69.2	-38.1	-175.7	26	-34.6	0	0	0	113.7	P410 N417	P408-P410 VanDerWaalsContact C-CD 3.49Å; P408-P410 WeakPolarHBondContact O-CD 3.28Å; P408-N417 VanDerWaalsContact CD-OD1 3.23Å; P408-N417 WeakPolarHBondContact CD-OD1 3.49Å; P408-N417 WeakPolarHBondContact CG-OD1 3.44Å
409	K	98.1	Very high	98	Very high	73 Å²	73	51.6 Å²	51.6	32%	0.317	27%	0.268	S	S	.	.	S	Bend	trans	-124.4	69.5	179.5	-69.9	177.1	174.1	174.8	0	109.3	N411 E412 T414 E416 N417	K409-N411 VanDerWaalsContact C-N 3.29Å; K409-N411 PolarHBondContact O-N 2.86Å; K409-E412 PolarHBondContact O-N 2.98Å; K409-T414 HydrophobicContact CB-CG2 3.77Å; K409-T414 HydrophobicContact CD-CG2 3.83Å; K409-T414 HydrophobicContact CG-CG2 4.44Å; K409-E416 VanDerWaalsContact CE-OE2 3.25Å; K409-E416 WeakPolarHBondContact CE-OE2 3.41Å; K409-E416 VanDerWaalsContact NZ-CD 3.28Å; K409-E416 IonicContact NZ-OE1 3.77Å; K409-E416 PolarHBondContact NZ-OE1 2.92Å; K409-E416 VanDerWaalsContact NZ-OE1 3.11Å; K409-E416 IonicContact NZ-OE2 3.69Å; K409-E416 PolarHBondContact NZ-OE2 3.39Å; K409-N417 PolarHBondContact N-OD1 3.05Å; K409-N417 PolarHBondContact O-ND2 3.09Å; K409-N417 PolarHBondContact O-OD1 3.23Å
410	P	97.5	Very high	97.9	Very high	31 Å²	31	59.8 Å²	59.8	20%	0.201	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-24.3	-166.2	26.4	-34	0	0	0	114	R365 R403 F407 P408	R365-P410 PolarHBondContact NH1-O 3.4Å; R365-P410 PolarHBondContact NH2-O 3.44Å; R403-P410 WeakPolarHBondContact O-CB 3.39Å; F407-P410 HydrophobicContact CB-CB 4.38Å; F407-P410 WeakPolarHBondContact O-CD 3.25Å; P408-P410 VanDerWaalsContact C-CD 3.49Å; P408-P410 WeakPolarHBondContact O-CD 3.28Å
411	N	97.6	Very high	97.7	Very high	110 Å²	110	64.7 Å²	64.7	59%	0.588	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100	4.2	-176.1	-65.9	-45.2	0	0	0	114.1	K409	K409-N411 VanDerWaalsContact C-N 3.29Å; K409-N411 PolarHBondContact O-N 2.86Å
412	E	97.6	Very high	97.7	Very high	116 Å²	116	65.5 Å²	65.5	54%	0.542	34%	0.336	S	S	.	.	S	Bend	trans	-119.8	150.3	177.7	-65	171.6	-158.4	0	0	109.3	R365 K409 T414	R365-E412 PolarHBondContact NH2-O 2.86Å; K409-E412 PolarHBondContact O-N 2.98Å; E412-T414 PolarHBondContact O-N 3.36Å
413	F	98.7	Very high	97.7	Very high	18 Å²	18	67.6 Å²	67.6	8%	0.079	35%	0.35	C	S	.	.			trans	-83.2	109.9	169.3	179.1	-95.9	0	0	0	109.3	L321 H325 V328 F359 E362 Y366	L321-F413 HydrophobicContact CB-CE2 4.4Å; L321-F413 HydrophobicContact CB-CZ 4.18Å; L321-F413 HydrophobicContact CD1-CD2 4.06Å; L321-F413 HydrophobicContact CD1-CE2 3.71Å; L321-F413 HydrophobicContact CD1-CZ 4.3Å; L321-F413 HydrophobicContact CD2-CB 4.36Å; L321-F413 HydrophobicContact CD2-CD1 4.18Å; L321-F413 HydrophobicContact CD2-CD2 3.7Å; L321-F413 HydrophobicContact CD2-CE1 4.4Å; L321-F413 HydrophobicContact CD2-CE2 3.97Å; L321-F413 HydrophobicContact CD2-CG 3.81Å; L321-F413 HydrophobicContact CD2-CZ 4.3Å; L321-F413 HydrophobicContact CG-CD2 4.43Å; L321-F413 HydrophobicContact CG-CE2 4.24Å; L321-F413 HydrophobicContact CG-CZ 4.5Å; H325-F413 HydrophobicContact CB-CE1 4.31Å; H325-F413 AromaticContact CD2-CD1 3.3Å; H325-F413 WeakPolarHBondContact CD2-CD1 3.29Å; H325-F413 AromaticContact CD2-CE1 3.53Å; H325-F413 AromaticContact CE1-CD1 3.7Å; H325-F413 AromaticContact CG-CD1 3.75Å; H325-F413 AromaticContact CG-CE1 3.85Å; H325-F413 AromaticContact ND1-CD1 3.97Å; H325-F413 AromaticContact NE2-CD1 3.29Å; H325-F413 VanDerWaalsContact NE2-CD1 3.29Å; H325-F413 WeakPolarHBondContact NE2-CD1 3.42Å; H325-F413 AromaticContact NE2-CG 3.91Å; V328-F413 HydrophobicContact CG2-CE1 4.48Å; F359-F413 AromaticContact CD2-CZ 3.81Å; F359-F413 HydrophobicContact CD2-CZ 3.81Å; F359-F413 AromaticContact CE2-CZ 3.78Å; F359-F413 HydrophobicContact CE2-CZ 3.78Å; E362-F413 HydrophobicContact CB-CE2 4.18Å; E362-F413 HydrophobicContact CG-CD2 3.69Å; E362-F413 HydrophobicContact CG-CE2 3.61Å; E362-F413 HydrophobicContact CG-CG 4.4Å; E362-F413 HydrophobicContact CG-CZ 4.26Å; Y366-F413 HydrophobicContact CD1-CB 3.82Å; Y366-F413 AromaticContact CD1-CD2 3.99Å; Y366-F413 HydrophobicContact CD1-CD2 3.99Å; Y366-F413 HydrophobicContact CD1-CG 4.34Å; Y366-F413 HydrophobicContact CD2-CB 4.22Å; Y366-F413 HydrophobicContact CE1-CB 3.9Å; Y366-F413 HydrophobicContact CE2-CB 4.31Å; Y366-F413 HydrophobicContact CG-CB 3.97Å; Y366-F413 HydrophobicContact CG-CD2 4.12Å
414	T	98.4	Very high	97.6	Very high	24 Å²	24	70.5 Å²	70.5	15%	0.147	36%	0.362	C	S	.	.			trans	-155.8	136.4	177.6	176.7	0	0	0	0	112.3	E362 K409 E412 E416 N417	E362-T414 WeakPolarHBondContact CG-O 3.48Å; E362-T414 PolarHBondContact OE1-N 3Å; K409-T414 HydrophobicContact CB-CG2 3.77Å; K409-T414 HydrophobicContact CD-CG2 3.83Å; K409-T414 HydrophobicContact CG-CG2 4.44Å; E412-T414 PolarHBondContact O-N 3.36Å; T414-E416 HydrophobicContact CG2-CB 4.14Å; T414-E416 PolarHBondContact O-N 3.38Å; T414-E416 VanDerWaalsContact O-N 3.14Å; T414-E416 WeakPolarHBondContact OG1-CB 3.46Å; T414-E416 WeakPolarHBondContact OG1-CG 3.31Å; T414-E416 PolarHBondContact OG1-N 3.24Å; T414-N417 WeakPolarHBondContact CG2-ND2 3.45Å; T414-N417 WeakPolarHBondContact O-CB 3.43Å; T414-N417 PolarHBondContact O-N 3.09Å; T414-N417 PolarHBondContact O-ND2 3.49Å
415	L	98.4	Very high	97.5	Very high	36 Å²	36	71.1 Å²	71.1	19%	0.188	36%	0.358	C	S	.	.	G	3₁₀ helix	trans	-66.6	-12.8	175.9	-55.4	-168.2	0	0	0	112.7	V328 V355 F359 E362 N417 F418 A419	V328-L415 HydrophobicContact CG1-CD1 4.08Å; V328-L415 HydrophobicContact CG2-CD1 4.33Å; V328-L415 HydrophobicContact CG2-CG 4.27Å; V355-L415 HydrophobicContact CG1-CD1 4.19Å; F359-L415 HydrophobicContact CB-CD2 4.15Å; E362-L415 HydrophobicContact CB-CD2 3.95Å; E362-L415 HydrophobicContact CG-CD2 4.27Å; L415-N417 PolarHBondContact O-N 2.63Å; L415-F418 CarbonylContact O-C 3.48Å; L415-F418 PolarHBondContact O-N 2.86Å; L415-A419 PolarHBondContact O-N 3.32Å; L415-A419 VanDerWaalsContact O-N 3.16Å
416	E	97.9	Very high	97.7	Very high	106 Å²	106	71.8 Å²	71.8	50%	0.495	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-57.4	-30.7	172.3	-69.9	176.9	-143.2	0	0	112.5	K409 T414 F418 A419	K409-E416 VanDerWaalsContact CE-OE2 3.25Å; K409-E416 WeakPolarHBondContact CE-OE2 3.41Å; K409-E416 VanDerWaalsContact NZ-CD 3.28Å; K409-E416 IonicContact NZ-OE1 3.77Å; K409-E416 PolarHBondContact NZ-OE1 2.92Å; K409-E416 VanDerWaalsContact NZ-OE1 3.11Å; K409-E416 IonicContact NZ-OE2 3.69Å; K409-E416 PolarHBondContact NZ-OE2 3.39Å; T414-E416 HydrophobicContact CG2-CB 4.14Å; T414-E416 PolarHBondContact O-N 3.38Å; T414-E416 VanDerWaalsContact O-N 3.14Å; T414-E416 WeakPolarHBondContact OG1-CB 3.46Å; T414-E416 WeakPolarHBondContact OG1-CG 3.31Å; T414-E416 PolarHBondContact OG1-N 3.24Å; E416-F418 PolarHBondContact O-N 3.43Å; E416-F418 VanDerWaalsContact O-N 3.14Å; E416-A419 WeakPolarHBondContact O-CB 3.27Å; E416-A419 PolarHBondContact O-N 2.89Å; E416-A419 VanDerWaalsContact O-N 3.11Å
417	N	98.4	Very high	97.7	Very high	4 Å²	4	68 Å²	68	2%	0.021	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-59.6	-23.7	175	-75.9	-42	0	0	0	112.7	E362 R365 F407 P408 K409 T414 L415	E362-N417 PolarHBondContact OE1-ND2 2.77Å; E362-N417 VanDerWaalsContact OE2-CB 3.3Å; E362-N417 WeakPolarHBondContact OE2-CB 3.46Å; E362-N417 PolarHBondContact OE2-ND2 3.29Å; R365-N417 PolarHBondContact NH2-ND2 3.18Å; F407-N417 HydrophobicContact CD1-CB 3.79Å; F407-N417 HydrophobicContact CE1-CB 4.42Å; P408-N417 VanDerWaalsContact CD-OD1 3.23Å; P408-N417 WeakPolarHBondContact CD-OD1 3.49Å; P408-N417 WeakPolarHBondContact CG-OD1 3.44Å; K409-N417 PolarHBondContact N-OD1 3.05Å; K409-N417 PolarHBondContact O-ND2 3.09Å; K409-N417 PolarHBondContact O-OD1 3.23Å; T414-N417 WeakPolarHBondContact CG2-ND2 3.45Å; T414-N417 WeakPolarHBondContact O-CB 3.43Å; T414-N417 PolarHBondContact O-N 3.09Å; T414-N417 PolarHBondContact O-ND2 3.49Å; L415-N417 PolarHBondContact O-N 2.63Å
418	F	98.5	Very high	97.7	Very high	13 Å²	13	67.9 Å²	67.9	6%	0.057	34%	0.342	C	S	.	.	G	3₁₀ helix	trans	-118.3	16.3	178.4	-70.8	-92	0	0	0	113	N358 Y361 E362 R365 F407 L415 E416 K420 V422 F427	N358-F418 HydrophobicContact CB-CB 4.11Å; N358-F418 PolarHBondContact ND2-O 3.08Å; Y361-F418 HydrophobicContact CD2-CD1 4.37Å; Y361-F418 HydrophobicContact CD2-CE1 4.34Å; Y361-F418 HydrophobicContact CG-CE1 4.23Å; E362-F418 HydrophobicContact CB-CD2 3.92Å; E362-F418 HydrophobicContact CB-CE2 4.07Å; E362-F418 WeakPolarHBondContact OE2-CD2 3.2Å; E362-F418 VanDerWaalsContact OE2-CE2 3.22Å; E362-F418 WeakPolarHBondContact OE2-CE2 3.14Å; R365-F418 HydrophobicContact CB-CE2 4.25Å; R365-F418 HydrophobicContact CB-CZ 4.41Å; F407-F418 HydrophobicContact CD1-CE2 4.5Å; F407-F418 HydrophobicContact CE1-CD2 4.31Å; F407-F418 HydrophobicContact CE1-CE1 4.09Å; F407-F418 AromaticContact CE1-CE2 3.65Å; F407-F418 HydrophobicContact CE1-CE2 3.65Å; F407-F418 AromaticContact CE1-CZ 3.53Å; F407-F418 HydrophobicContact CE1-CZ 3.53Å; F407-F418 HydrophobicContact CZ-CE1 4.38Å; F407-F418 HydrophobicContact CZ-CE2 4.19Å; F407-F418 AromaticContact CZ-CZ 3.73Å; F407-F418 HydrophobicContact CZ-CZ 3.73Å; L415-F418 CarbonylContact O-C 3.48Å; L415-F418 PolarHBondContact O-N 2.86Å; E416-F418 PolarHBondContact O-N 3.43Å; E416-F418 VanDerWaalsContact O-N 3.14Å; F418-K420 PolarHBondContact O-N 3.17Å; F418-V422 HydrophobicContact CD1-CB 4.27Å; F418-V422 HydrophobicContact CD1-CG2 3.47Å; F418-V422 VanDerWaalsContact CD1-CG2 3.47Å; F418-V422 HydrophobicContact CE1-CB 4.17Å; F418-V422 HydrophobicContact CE1-CG1 4.49Å; F418-V422 HydrophobicContact CE1-CG2 3.71Å; F418-V422 HydrophobicContact CG-CG2 4.16Å; F418-F427 AromaticContact CE1-CD1 3.68Å; F418-F427 HydrophobicContact CE1-CD1 3.68Å; F418-F427 AromaticContact CE1-CE1 3.71Å; F418-F427 HydrophobicContact CE1-CE1 3.71Å; F418-F427 HydrophobicContact CE1-CG 4.31Å; F418-F427 HydrophobicContact CE1-CZ 4.37Å; F418-F427 AromaticContact CZ-CD1 3.79Å; F418-F427 HydrophobicContact CZ-CD1 3.79Å; F418-F427 HydrophobicContact CZ-CD2 4.28Å; F418-F427 AromaticContact CZ-CE1 3.6Å; F418-F427 HydrophobicContact CZ-CE1 3.6Å; F418-F427 HydrophobicContact CZ-CE2 4.14Å; F418-F427 HydrophobicContact CZ-CG 4.12Å; F418-F427 AromaticContact CZ-CZ 3.79Å; F418-F427 HydrophobicContact CZ-CZ 3.79Å
419	A	96.2	Very high	97.7	Very high	81 Å²	81	64.4 Å²	64.4	67%	0.669	32%	0.32	S	S	*	.	S	Bend	trans	-66.5	-29	175.9	0	0	0	0	0	112.3	L415 E416	L415-A419 PolarHBondContact O-N 3.32Å; L415-A419 VanDerWaalsContact O-N 3.16Å; E416-A419 WeakPolarHBondContact O-CB 3.27Å; E416-A419 PolarHBondContact O-N 2.89Å; E416-A419 VanDerWaalsContact O-N 3.11Å
420	K	96.1	Very high	97.8	Very high	179 Å²	179	62.9 Å²	62.9	78%	0.778	31%	0.313	S	S	*	.	S	Bend	trans	-105.9	153.2	169.6	-67.6	-178.9	-178.9	177.1	0	109.7	F418 V422	F418-K420 PolarHBondContact O-N 3.17Å; K420-V422 PolarHBondContact O-N 3.24Å; K420-V422 VanDerWaalsContact O-N 3.1Å
421	N	96.1	Very high	97.8	Very high	150 Å²	150	61.6 Å²	61.6	80%	0.802	31%	0.306	S	S	*	.	P	Polyproline II helix	trans	-59.7	116.9	175.4	-176.1	64.5	0	0	0	110.7
422	V	97.9	Very high	97.8	Very high	19 Å²	19	57.6 Å²	57.6	12%	0.115	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-83	121.8	-178	179.2	0	0	0	0	109.2	F406 F407 F418 K420 Y424 F427	F406-V422 HydrophobicContact CD1-CG1 3.89Å; F406-V422 HydrophobicContact CE1-CB 4.04Å; F406-V422 HydrophobicContact CE1-CG1 3.6Å; F406-V422 HydrophobicContact CE1-CG2 3.92Å; F406-V422 HydrophobicContact CZ-CG1 4.35Å; F407-V422 HydrophobicContact CE1-CG1 4.09Å; F407-V422 HydrophobicContact CE1-CG2 4.06Å; F407-V422 HydrophobicContact CZ-CG1 4.05Å; F418-V422 HydrophobicContact CD1-CB 4.27Å; F418-V422 HydrophobicContact CD1-CG2 3.47Å; F418-V422 VanDerWaalsContact CD1-CG2 3.47Å; F418-V422 HydrophobicContact CE1-CB 4.17Å; F418-V422 HydrophobicContact CE1-CG1 4.49Å; F418-V422 HydrophobicContact CE1-CG2 3.71Å; F418-V422 HydrophobicContact CG-CG2 4.16Å; K420-V422 PolarHBondContact O-N 3.24Å; K420-V422 VanDerWaalsContact O-N 3.1Å; V422-Y424 PolarHBondContact O-N 2.85Å; V422-F427 HydrophobicContact CG1-CB 3.66Å
423	P	98.1	Very high	97.8	Very high	47 Å²	47	53.8 Å²	53.8	31%	0.305	28%	0.275	S	S	.	.	P	Polyproline II helix	trans	-61.6	125.2	173.8	-19.6	31.9	0	0	0	109.8	F406 R425 Y426	F406-P423 HydrophobicContact CE2-CG 3.81Å; F406-P423 HydrophobicContact CZ-CG 4.12Å; P423-R425 HydrophobicContact CB-CG 4.05Å; P423-R425 PolarHBondContact O-N 3Å; P423-Y426 HydrophobicContact CB-CD2 3.9Å; P423-Y426 HydrophobicContact CB-CE2 4.4Å; P423-Y426 HydrophobicContact CG-CD2 4.03Å; P423-Y426 HydrophobicContact CG-CE2 4.4Å; P423-Y426 PolarHBondContact O-N 3.34Å
424	Y	96.2	Very high	97.8	Very high	134 Å²	134	54.7 Å²	54.7	53%	0.525	28%	0.283	S	S	.	.	G	3₁₀ helix	trans	-55.5	-29.3	-177	78	-89.8	0	0	0	112.4	F104 V422 Y426 F427 Q428 F432	F104-Y424 HydrophobicContact CD2-CE2 4.38Å; F104-Y424 HydrophobicContact CE2-CD2 4.41Å; F104-Y424 AromaticContact CE2-CE2 3.53Å; F104-Y424 HydrophobicContact CE2-CE2 3.53Å; F104-Y424 AromaticContact CE2-CZ 3.77Å; F104-Y424 HydrophobicContact CZ-CE2 4.38Å; V422-Y424 PolarHBondContact O-N 2.85Å; Y424-Y426 PolarHBondContact O-N 3.23Å; Y424-Y426 VanDerWaalsContact O-N 3.07Å; Y424-F427 CarbonylContact O-C 3.59Å; Y424-F427 VanDerWaalsContact O-C 3.3Å; Y424-F427 PolarHBondContact O-N 3.33Å; Y424-F427 VanDerWaalsContact O-N 3.07Å; Y424-Q428 WeakPolarHBondContact O-CG 3.28Å; Y424-Q428 PolarHBondContact O-NE2 2.93Å; Y424-F432 HydrophobicContact CE2-CD2 4.01Å; Y424-F432 HydrophobicContact CE2-CE2 4.13Å; Y424-F432 HydrophobicContact CE2-CG 4.22Å; Y424-F432 HydrophobicContact CE2-CZ 4.41Å
425	R	97.3	Very high	97.8	Very high	101 Å²	101	53.9 Å²	53.9	38%	0.381	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-57.3	-23.5	175.8	67.4	174.9	-70.3	165.8	0.1	114.9	M103 F104 P423	M103-R425 VanDerWaalsContact CE-O 3.26Å; M103-R425 WeakPolarHBondContact CE-O 3.4Å; F104-R425 HydrophobicContact CD2-CB 3.45Å; F104-R425 VanDerWaalsContact CD2-CB 3.45Å; F104-R425 HydrophobicContact CE2-CB 3.61Å; F104-R425 HydrophobicContact CG-CB 4.26Å; P423-R425 HydrophobicContact CB-CG 4.05Å; P423-R425 PolarHBondContact O-N 3Å
426	Y	98.2	Very high	97.8	Very high	68 Å²	68	52.4 Å²	52.4	27%	0.267	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	-100.6	-14.5	178	-63.1	-62.4	0	0	0	113.3	S100 F406 P423 Y424	S100-Y426 WeakPolarHBondContact OG-CD1 3.36Å; S100-Y426 WeakPolarHBondContact OG-CE1 3.31Å; F406-Y426 HydrophobicContact CB-CD1 4.19Å; F406-Y426 HydrophobicContact CB-CD2 4.19Å; F406-Y426 HydrophobicContact CB-CG 3.73Å; F406-Y426 AromaticContact CD2-CD2 3.32Å; F406-Y426 HydrophobicContact CD2-CD2 3.32Å; F406-Y426 AromaticContact CD2-CE2 3.89Å; F406-Y426 HydrophobicContact CD2-CE2 3.89Å; F406-Y426 AromaticContact CD2-CG 3.79Å; F406-Y426 HydrophobicContact CD2-CG 3.79Å; F406-Y426 AromaticContact CE2-CD2 3.96Å; F406-Y426 HydrophobicContact CE2-CD2 3.96Å; F406-Y426 HydrophobicContact CE2-CE2 4.44Å; F406-Y426 AromaticContact CG-CD2 3.9Å; F406-Y426 HydrophobicContact CG-CD2 3.9Å; F406-Y426 AromaticContact CG-CG 3.9Å; F406-Y426 HydrophobicContact CG-CG 3.9Å; P423-Y426 HydrophobicContact CB-CD2 3.9Å; P423-Y426 HydrophobicContact CB-CE2 4.4Å; P423-Y426 HydrophobicContact CG-CD2 4.03Å; P423-Y426 HydrophobicContact CG-CE2 4.4Å; P423-Y426 PolarHBondContact O-N 3.34Å; Y424-Y426 PolarHBondContact O-N 3.23Å; Y424-Y426 VanDerWaalsContact O-N 3.07Å
427	F	98.7	Very high	97.8	Very high	14 Å²	14	49.9 Å²	49.9	6%	0.061	26%	0.264	C	S	.	.			trans	-133.3	107.5	179.3	-178.3	-121.9	0	0	0	111.2	Y361 R365 H402 F407 F418 V422 Y424 P429	Y361-F427 AromaticContact CD1-CE1 3.77Å; Y361-F427 HydrophobicContact CD1-CE1 3.77Å; Y361-F427 HydrophobicContact CD1-CZ 4.4Å; Y361-F427 AromaticContact CG-CE1 3.89Å; Y361-F427 HydrophobicContact CG-CE1 3.89Å; Y361-F427 WeakPolarHBondContact O-CZ 3.49Å; R365-F427 HydrophobicContact CB-CD2 4.39Å; R365-F427 HydrophobicContact CB-CE2 3.61Å; R365-F427 HydrophobicContact CB-CZ 4.17Å; R365-F427 HydrophobicContact CG-CD2 4.28Å; R365-F427 HydrophobicContact CG-CE2 3.98Å; H402-F427 AromaticContact CD2-CD2 3.84Å; H402-F427 AromaticContact CE1-CD2 3.7Å; H402-F427 AromaticContact CE1-CE2 3.67Å; H402-F427 AromaticContact CG-CD2 3.93Å; H402-F427 AromaticContact ND1-CD2 3.82Å; H402-F427 AromaticContact ND1-CE2 3.65Å; H402-F427 AromaticContact NE2-CD2 3.72Å; F407-F427 HydrophobicContact CE2-CB 4.27Å; F407-F427 HydrophobicContact CE2-CD2 4.08Å; F407-F427 HydrophobicContact CE2-CG 4.46Å; F407-F427 HydrophobicContact CZ-CB 3.79Å; F407-F427 AromaticContact CZ-CD2 3.7Å; F407-F427 HydrophobicContact CZ-CD2 3.7Å; F407-F427 AromaticContact CZ-CG 3.81Å; F407-F427 HydrophobicContact CZ-CG 3.81Å; F418-F427 AromaticContact CE1-CD1 3.68Å; F418-F427 HydrophobicContact CE1-CD1 3.68Å; F418-F427 AromaticContact CE1-CE1 3.71Å; F418-F427 HydrophobicContact CE1-CE1 3.71Å; F418-F427 HydrophobicContact CE1-CG 4.31Å; F418-F427 HydrophobicContact CE1-CZ 4.37Å; F418-F427 AromaticContact CZ-CD1 3.79Å; F418-F427 HydrophobicContact CZ-CD1 3.79Å; F418-F427 HydrophobicContact CZ-CD2 4.28Å; F418-F427 AromaticContact CZ-CE1 3.6Å; F418-F427 HydrophobicContact CZ-CE1 3.6Å; F418-F427 HydrophobicContact CZ-CE2 4.14Å; F418-F427 HydrophobicContact CZ-CG 4.12Å; F418-F427 AromaticContact CZ-CZ 3.79Å; F418-F427 HydrophobicContact CZ-CZ 3.79Å; V422-F427 HydrophobicContact CG1-CB 3.66Å; Y424-F427 CarbonylContact O-C 3.59Å; Y424-F427 VanDerWaalsContact O-C 3.3Å; Y424-F427 PolarHBondContact O-N 3.33Å; Y424-F427 VanDerWaalsContact O-N 3.07Å; F427-P429 HydrophobicContact CD1-CG 4.18Å; F427-P429 HydrophobicContact CE1-CB 4.33Å; F427-P429 HydrophobicContact CE1-CG 3.55Å; F427-P429 HydrophobicContact CE2-CB 4.13Å; F427-P429 HydrophobicContact CE2-CG 4.14Å; F427-P429 HydrophobicContact CZ-CB 3.78Å; F427-P429 HydrophobicContact CZ-CG 3.53Å
428	Q	98.6	Very high	97.8	Very high	11 Å²	11	50.4 Å²	50.4	5%	0.051	27%	0.269	C	S	.	.			trans	-127	68.5	-175	-75.3	-57.4	-57.6	0	0	112.5	M103 I398 M401 H402 Y424 F430 G431 F432	M103-Q428 HydrophobicContact CE-CB 4.05Å; M103-Q428 HydrophobicContact CE-CG 3.5Å; M103-Q428 HydrophobicContact SD-CB 3.99Å; M103-Q428 HydrophobicContact SD-CG 3.69Å; I398-Q428 WeakPolarHBondContact CD1-O 3.23Å; M401-Q428 HydrophobicContact CE-CB 4.46Å; H402-Q428 PolarHBondContact NE2-N 3.44Å; Y424-Q428 WeakPolarHBondContact O-CG 3.28Å; Y424-Q428 PolarHBondContact O-NE2 2.93Å; Q428-F430 PolarHBondContact O-N 3.21Å; Q428-G431 VanDerWaalsContact OE1-CA 3.26Å; Q428-G431 PolarHBondContact OE1-O 3.46Å; Q428-F432 HydrophobicContact CG-CD1 4.09Å; Q428-F432 VanDerWaalsContact OE1-CD1 3.24Å
429	P	98.3	Very high	97.8	Very high	18 Å²	18	50.5 Å²	50.5	12%	0.117	27%	0.274	C	S	.	.	S	Bend	trans	-68.5	-24.2	179.7	29.6	-37	0	0	0	113.1	M364 F427	M364-P429 HydrophobicContact CB-CB 4.22Å; M364-P429 HydrophobicContact CE-CB 3.73Å; M364-P429 HydrophobicContact SD-CB 4.14Å; F427-P429 HydrophobicContact CD1-CG 4.18Å; F427-P429 HydrophobicContact CE1-CB 4.33Å; F427-P429 HydrophobicContact CE1-CG 3.55Å; F427-P429 HydrophobicContact CE2-CB 4.13Å; F427-P429 HydrophobicContact CE2-CG 4.14Å; F427-P429 HydrophobicContact CZ-CB 3.78Å; F427-P429 HydrophobicContact CZ-CG 3.53Å
430	F	98.6	Very high	97.9	Very high	40 Å²	40	49.4 Å²	49.4	18%	0.175	25%	0.254	C	S	.	.	S	Bend	trans	-114.2	-3	-179.2	-64	-67.9	0	0	0	113.2	M364 Q428 C437 K440 A443 M444 M447	M364-F430 HydrophobicContact CE-CD1 4.23Å; M364-F430 HydrophobicContact CE-CE1 3.57Å; M364-F430 HydrophobicContact CE-CE2 4.01Å; M364-F430 HydrophobicContact CE-CZ 3.45Å; M364-F430 VanDerWaalsContact CE-CZ 3.45Å; M364-F430 HydrophobicContact SD-CE1 4.4Å; M364-F430 HydrophobicContact SD-CE2 4.01Å; M364-F430 HydrophobicContact SD-CZ 3.68Å; Q428-F430 PolarHBondContact O-N 3.21Å; F430-C437 HydrophobicContact CB-CB 3.95Å; F430-C437 HydrophobicContact CD1-CB 4.37Å; F430-C437 WeakPolarHBondContact O-CB 3.31Å; F430-C437 PolarHBondContact O-N 3.06Å; F430-K440 HydrophobicContact CB-CB 3.6Å; F430-K440 HydrophobicContact CD1-CB 4.21Å; F430-K440 HydrophobicContact CD2-CB 4.15Å; F430-K440 HydrophobicContact CG-CB 3.74Å; F430-A443 HydrophobicContact CE1-CB 3.96Å; F430-A443 HydrophobicContact CZ-CB 4.17Å; F430-M444 HydrophobicContact CE2-CG 4Å; F430-M444 HydrophobicContact CE2-SD 3.85Å; F430-M444 HydrophobicContact CZ-CG 4.3Å; F430-M444 HydrophobicContact CZ-SD 4.08Å; F430-M447 HydrophobicContact CZ-CE 3.92Å
431	G	98.1	Very high	97.9	Very high	5 Å²	5	47.8 Å²	47.8	5%	0.052	24%	0.244	C	C	.	.			trans	58.8	177.2	-161.2	0	0	0	0	0	113.9	M107 Q428	M107-G431 WeakPolarHBondContact SD-CA 2.94Å; Q428-G431 VanDerWaalsContact OE1-CA 3.26Å; Q428-G431 PolarHBondContact OE1-O 3.46Å
432	F	98.4	Very high	98	Very high	25 Å²	25	40.8 Å²	40.8	11%	0.11	21%	0.206	C	C	.	.			trans	-143	-174.9	178.1	78.1	-74.3	0	0	0	111.7	M103 F104 M107 K108 Y424 Q428 G436	M103-F432 HydrophobicContact SD-CE1 4.42Å; F104-F432 HydrophobicContact CD1-CZ 4.37Å; F104-F432 AromaticContact CD2-CE1 3.62Å; F104-F432 HydrophobicContact CD2-CE1 3.62Å; F104-F432 HydrophobicContact CD2-CE2 4.26Å; F104-F432 AromaticContact CD2-CZ 3.3Å; F104-F432 HydrophobicContact CD2-CZ 3.3Å; F104-F432 HydrophobicContact CE1-CZ 4.47Å; F104-F432 HydrophobicContact CE2-CE1 4.08Å; F104-F432 AromaticContact CE2-CE2 3.96Å; F104-F432 HydrophobicContact CE2-CE2 3.96Å; F104-F432 AromaticContact CE2-CZ 3.45Å; F104-F432 HydrophobicContact CE2-CZ 3.45Å; F104-F432 VanDerWaalsContact CE2-CZ 3.45Å; F104-F432 HydrophobicContact CG-CE1 4.26Å; F104-F432 AromaticContact CG-CZ 3.83Å; F104-F432 HydrophobicContact CG-CZ 3.83Å; F104-F432 HydrophobicContact CZ-CE2 4.33Å; F104-F432 HydrophobicContact CZ-CZ 4.05Å; F104-F432 WeakPolarHBondContact O-CZ 3.23Å; M107-F432 HydrophobicContact CB-CD1 3.7Å; M107-F432 HydrophobicContact CB-CE1 3.47Å; M107-F432 VanDerWaalsContact CB-CE1 3.47Å; M107-F432 HydrophobicContact CB-CG 4.46Å; M107-F432 HydrophobicContact CB-CZ 4.02Å; M107-F432 HydrophobicContact CG-CD1 4.49Å; M107-F432 HydrophobicContact CG-CE1 4.41Å; M107-F432 HydrophobicContact SD-CD1 4.05Å; M107-F432 HydrophobicContact SD-CE1 4.42Å; K108-F432 HydrophobicContact CB-CE2 4.01Å; K108-F432 HydrophobicContact CB-CZ 4.02Å; Y424-F432 HydrophobicContact CE2-CD2 4.01Å; Y424-F432 HydrophobicContact CE2-CE2 4.13Å; Y424-F432 HydrophobicContact CE2-CG 4.22Å; Y424-F432 HydrophobicContact CE2-CZ 4.41Å; Q428-F432 HydrophobicContact CG-CD1 4.09Å; Q428-F432 VanDerWaalsContact OE1-CD1 3.24Å; F432-G436 PolarHBondContact O-N 3.48Å
433	G	97.7	Very high	98	Very high	37 Å²	37	40.2 Å²	40.2	38%	0.381	20%	0.204	S	C	.	.	S	Bend	trans	76.4	-162.9	177.9	0	0	0	0	0	113.1	R435 G436	G433-R435 PolarHBondContact O-N 3.35Å; G433-R435 VanDerWaalsContact O-N 3.15Å; G433-G436 PolarHBondContact O-N 3.41Å
434	P	97.9	Very high	98.1	Very high	36 Å²	36	38.8 Å²	38.8	23%	0.234	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-37.1	-169.7	-23.2	31	0	0	0	113.1	M107 N110 W141 R145	M107-P434 WeakPolarHBondContact O-CD 3.43Å; N110-P434 WeakPolarHBondContact OD1-CB 3.32Å; N110-P434 WeakPolarHBondContact OD1-CG 3.24Å; W141-P434 HydrophobicContact CH2-CB 4.41Å; W141-P434 WeakPolarHBondContact CH2-O 3.29Å; R145-P434 VanDerWaalsContact CZ-O 3.24Å; R145-P434 PolarHBondContact NE-O 2.66Å; R145-P434 PolarHBondContact NH2-O 3.47Å; R145-P434 VanDerWaalsContact NH2-O 3.09Å
435	R	98.5	Very high	98.2	Very high	7 Å²	7	33.1 Å²	33.1	3%	0.026	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.2	26.8	-177	-162.6	158.8	-178.7	153.1	3.8	113.8	S113 I132 N135 W141 G433	S113-R435 WeakPolarHBondContact O-CD 3.41Å; S113-R435 PolarHBondContact O-NH1 3.32Å; I132-R435 PolarHBondContact O-NH2 3.4Å; N135-R435 PolarHBondContact O-NH1 2.76Å; N135-R435 PolarHBondContact O-NH2 2.87Å; W141-R435 HydrophobicContact CH2-CB 3.97Å; W141-R435 HydrophobicContact CH2-CG 4.29Å; W141-R435 HydrophobicContact CZ2-CB 3.6Å; W141-R435 HydrophobicContact CZ2-CG 3.48Å; W141-R435 VanDerWaalsContact CZ2-CG 3.48Å; G433-R435 PolarHBondContact O-N 3.35Å; G433-R435 VanDerWaalsContact O-N 3.15Å
436	G	98.2	Very high	98.2	Very high	6 Å²	6	28.9 Å²	28.9	6%	0.062	16%	0.157	C	C	.	.	S	Bend	trans	-64.9	170.1	167.2	0	0	0	0	0	112.5	R145 F432 G433 A438	R145-G436 PolarHBondContact NH1-O 3.3Å; R145-G436 PolarHBondContact NH2-O 3.32Å; F432-G436 PolarHBondContact O-N 3.48Å; G433-G436 PolarHBondContact O-N 3.41Å; G436-A438 PolarHBondContact O-N 2.85Å
437	C	98.7	Very high	98.2	Very high	53 Å²	53	25.7 Å²	25.7	36%	0.358	15%	0.145	S	C	.	.			trans	-55.6	127.2	176.9	178.3	0	0	0	0	111.1	F430 G439 K440	F430-C437 HydrophobicContact CB-CB 3.95Å; F430-C437 HydrophobicContact CD1-CB 4.37Å; F430-C437 WeakPolarHBondContact O-CB 3.31Å; F430-C437 PolarHBondContact O-N 3.06Å; C437-G439 VanDerWaalsContact C-N 3.29Å; C437-G439 PolarHBondContact SG-N 2.61Å; C437-G439 VanDerWaalsContact SG-N 3.37Å; C437-K440 HydrophobicContact CB-CB 4.17Å; C437-K440 PolarHBondContact O-N 3.41Å
438	A	98.4	Very high	98.3	Very high	15 Å²	15	25.2 Å²	25.2	12%	0.124	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-33.3	178.4	0	0	0	0	0	111.4	I132 F148 M149 L152 G436	I132-A438 HydrophobicContact CD1-CB 4.41Å; F148-A438 HydrophobicContact CB-CB 4.36Å; M149-A438 HydrophobicContact SD-CB 3.88Å; L152-A438 HydrophobicContact CD1-CB 3.7Å; G436-A438 PolarHBondContact O-N 2.85Å
439	G	98	Very high	98.2	Very high	15 Å²	15	24.7 Å²	24.7	16%	0.155	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	10.3	-179.4	0	0	0	0	0	115.2	C437 Y441 I442 A443	C437-G439 VanDerWaalsContact C-N 3.29Å; C437-G439 PolarHBondContact SG-N 2.61Å; C437-G439 VanDerWaalsContact SG-N 3.37Å; G439-Y441 VanDerWaalsContact C-N 3.27Å; G439-Y441 PolarHBondContact O-N 3.41Å; G439-Y441 VanDerWaalsContact O-N 3.12Å; G439-I442 VanDerWaalsContact O-CG2 3.32Å; G439-I442 WeakPolarHBondContact O-CG2 3.42Å; G439-I442 PolarHBondContact O-N 3.44Å; G439-A443 WeakPolarHBondContact O-CB 3.42Å; G439-A443 PolarHBondContact O-N 3.05Å
440	K	97.3	Very high	98.3	Very high	57 Å²	57	23.9 Å²	23.9	25%	0.248	14%	0.135	C	C	.	.	H	α-helix	trans	-56.6	-35.6	-168.7	71.8	-178.1	-165	170.2	0	114.8	F430 C437	F430-K440 HydrophobicContact CB-CB 3.6Å; F430-K440 HydrophobicContact CD1-CB 4.21Å; F430-K440 HydrophobicContact CD2-CB 4.15Å; F430-K440 HydrophobicContact CG-CB 3.74Å; C437-K440 HydrophobicContact CB-CB 4.17Å; C437-K440 PolarHBondContact O-N 3.41Å
441	Y	97.6	Very high	98.3	Very high	146 Å²	146	22 Å²	22	57%	0.573	13%	0.127	S	C	*	.	H	α-helix	trans	-83.9	-45.9	-179.3	-60.9	-60	0	0	0	111.6	G439 A443 M444 V445	G439-Y441 VanDerWaalsContact C-N 3.27Å; G439-Y441 PolarHBondContact O-N 3.41Å; G439-Y441 VanDerWaalsContact O-N 3.12Å; Y441-A443 VanDerWaalsContact C-N 3.29Å; Y441-A443 PolarHBondContact O-N 3.19Å; Y441-M444 PolarHBondContact O-N 2.91Å; Y441-V445 PolarHBondContact O-N 3.05Å
442	I	97.8	Very high	98.3	Very high	2 Å²	2	21.8 Å²	21.8	1%	0.01	12%	0.124	C	C	.	.	H	α-helix	trans	-65.9	-33.5	179.2	-162.9	166.4	0	0	0	111.6	L152 L157 M160 L202 F203 G439 M444 V445 M446	L152-I442 HydrophobicContact CB-CG2 4.2Å; L152-I442 HydrophobicContact CD2-CD1 4.36Å; L152-I442 HydrophobicContact CD2-CG2 3.81Å; L157-I442 HydrophobicContact CD1-CB 4.31Å; M160-I442 HydrophobicContact CB-CD1 3.9Å; M160-I442 HydrophobicContact CB-CG1 3.97Å; M160-I442 HydrophobicContact CE-CD1 3.7Å; M160-I442 HydrophobicContact CE-CG1 4.21Å; M160-I442 HydrophobicContact CG-CD1 3.87Å; M160-I442 HydrophobicContact CG-CG1 3.69Å; L202-I442 HydrophobicContact CD2-CD1 3.99Å; F203-I442 HydrophobicContact CZ-CD1 4.43Å; G439-I442 VanDerWaalsContact O-CG2 3.32Å; G439-I442 WeakPolarHBondContact O-CG2 3.42Å; G439-I442 PolarHBondContact O-N 3.44Å; I442-M444 PolarHBondContact O-N 3.32Å; I442-V445 WeakPolarHBondContact O-CB 3.17Å; I442-V445 PolarHBondContact O-N 2.94Å; I442-M446 HydrophobicContact CG1-CG 4.41Å; I442-M446 HydrophobicContact CG2-CE 4.39Å; I442-M446 VanDerWaalsContact O-CG 3.27Å; I442-M446 WeakPolarHBondContact O-CG 3.4Å; I442-M446 PolarHBondContact O-N 3.38Å
443	A	98.4	Very high	98.2	Very high	8 Å²	8	21 Å²	21	7%	0.066	12%	0.121	C	C	.	.	H	α-helix	trans	-58.7	-45.7	173.8	0	0	0	0	0	112.4	M311 F430 G439 Y441 V445 M446 M447	M311-A443 HydrophobicContact SD-CB 3.76Å; F430-A443 HydrophobicContact CE1-CB 3.96Å; F430-A443 HydrophobicContact CZ-CB 4.17Å; G439-A443 WeakPolarHBondContact O-CB 3.42Å; G439-A443 PolarHBondContact O-N 3.05Å; Y441-A443 VanDerWaalsContact C-N 3.29Å; Y441-A443 PolarHBondContact O-N 3.19Å; A443-V445 VanDerWaalsContact C-N 3.29Å; A443-V445 PolarHBondContact O-N 3.23Å; A443-M446 HydrophobicContact CB-CE 4.48Å; A443-M446 PolarHBondContact O-N 2.92Å; A443-M447 HydrophobicContact CB-CE 4.41Å; A443-M447 WeakPolarHBondContact O-CE 3.36Å; A443-M447 WeakPolarHBondContact O-CG 3.46Å; A443-M447 PolarHBondContact O-N 3.3Å
444	M	98.6	Very high	98.3	Very high	17 Å²	17	19.3 Å²	19.3	8%	0.084	10%	0.104	C	C	.	.	H	α-helix	trans	-61.2	-40.1	175.9	-71.7	-60.3	-60.1	0	0	112	E357 I360 Y361 F430 Y441 I442 M447 K448	E357-M444 HydrophobicContact CG-CE 4.02Å; I360-M444 HydrophobicContact CB-CE 4.07Å; I360-M444 HydrophobicContact CD1-CE 4.3Å; I360-M444 HydrophobicContact CG2-CE 3.61Å; I360-M444 HydrophobicContact CG2-SD 3.61Å; Y361-M444 HydrophobicContact CD1-CE 4Å; Y361-M444 HydrophobicContact CD1-SD 4.11Å; Y361-M444 HydrophobicContact CE1-CE 3.46Å; Y361-M444 VanDerWaalsContact CE1-CE 3.46Å; Y361-M444 HydrophobicContact CE1-CG 4.4Å; Y361-M444 HydrophobicContact CE1-SD 3.51Å; Y361-M444 VanDerWaalsContact CE1-SD 3.51Å; Y361-M444 HydrophobicContact CE2-CE 4.37Å; F430-M444 HydrophobicContact CE2-CG 4Å; F430-M444 HydrophobicContact CE2-SD 3.85Å; F430-M444 HydrophobicContact CZ-CG 4.3Å; F430-M444 HydrophobicContact CZ-SD 4.08Å; Y441-M444 PolarHBondContact O-N 2.91Å; I442-M444 PolarHBondContact O-N 3.32Å; M444-M447 HydrophobicContact SD-CE 3.66Å; M444-K448 WeakPolarHBondContact O-CG 3.36Å; M444-K448 PolarHBondContact O-N 3.5Å; M444-K448 VanDerWaalsContact O-N 3.1Å
445	V	98.3	Very high	98.3	Very high	14 Å²	14	17.6 Å²	17.6	9%	0.085	9%	0.092	C	C	.	.	H	α-helix	trans	-64.3	-48.2	176.6	172.5	0	0	0	0	111.2	L157 V161 M350 Y441 I442 A443 K448 A449	L157-V445 HydrophobicContact CD1-CG2 4.48Å; L157-V445 HydrophobicContact CD2-CG2 4.05Å; L157-V445 HydrophobicContact CG-CG2 4.24Å; V161-V445 HydrophobicContact CB-CG1 4.4Å; V161-V445 HydrophobicContact CG2-CG1 3.3Å; M350-V445 HydrophobicContact CG-CG1 4.23Å; M350-V445 HydrophobicContact CG-CG2 4.45Å; M350-V445 HydrophobicContact SD-CG1 4.16Å; Y441-V445 PolarHBondContact O-N 3.05Å; I442-V445 WeakPolarHBondContact O-CB 3.17Å; I442-V445 PolarHBondContact O-N 2.94Å; A443-V445 VanDerWaalsContact C-N 3.29Å; A443-V445 PolarHBondContact O-N 3.23Å; V445-K448 PolarHBondContact O-N 2.82Å; V445-A449 WeakPolarHBondContact O-CB 3.37Å; V445-A449 PolarHBondContact O-N 3.48Å
446	M	98.4	Very high	98.1	Very high	12 Å²	12	19.7 Å²	19.7	6%	0.059	10%	0.1	C	C	.	.	H	α-helix	trans	-61.1	-46.3	178.6	-69	-169.4	-68.8	0	0	111.9	M160 C164 T198 M311 I442 A443 K448 A449 I450	M160-M446 HydrophobicContact CE-CG 4.33Å; M160-M446 HydrophobicContact CE-SD 3.6Å; M160-M446 VanDerWaalsContact CE-SD 3.6Å; M160-M446 HydrophobicContact CG-CG 3.45Å; M160-M446 VanDerWaalsContact CG-CG 3.45Å; M160-M446 HydrophobicContact CG-SD 4.04Å; M160-M446 HydrophobicContact SD-CG 4.03Å; M160-M446 HydrophobicContact SD-SD 3.92Å; C164-M446 VanDerWaalsContact SG-CG 3.5Å; T198-M446 HydrophobicContact CG2-SD 4.24Å; M311-M446 HydrophobicContact CE-CB 3.55Å; M311-M446 HydrophobicContact CE-CE 3.86Å; M311-M446 HydrophobicContact CG-CE 4.27Å; M311-M446 HydrophobicContact SD-CE 4.18Å; I442-M446 HydrophobicContact CG1-CG 4.41Å; I442-M446 HydrophobicContact CG2-CE 4.39Å; I442-M446 VanDerWaalsContact O-CG 3.27Å; I442-M446 WeakPolarHBondContact O-CG 3.4Å; I442-M446 PolarHBondContact O-N 3.38Å; A443-M446 HydrophobicContact CB-CE 4.48Å; A443-M446 PolarHBondContact O-N 2.92Å; M446-K448 PolarHBondContact O-N 2.85Å; M446-A449 PolarHBondContact O-N 3.1Å; M446-I450 WeakPolarHBondContact O-CB 3.27Å; M446-I450 WeakPolarHBondContact O-CG1 3.31Å; M446-I450 PolarHBondContact O-N 3.09Å
447	M	98.8	Very high	98	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	12%	0.115	C	C	.	.	H	α-helix	trans	-60.6	-45.4	178.5	-71.1	-176.2	-74.1	0	0	111.4	M311 L315 M318 I360 M364 F430 A443 M444 L451	M311-M447 HydrophobicContact CE-CB 4.37Å; M311-M447 HydrophobicContact CE-CG 3.32Å; M311-M447 HydrophobicContact CE-SD 4.4Å; M311-M447 HydrophobicContact SD-CG 4.01Å; M311-M447 HydrophobicContact SD-SD 4.36Å; L315-M447 HydrophobicContact CD2-CB 4.25Å; L315-M447 HydrophobicContact CD2-CG 4.19Å; L315-M447 HydrophobicContact CG-CG 4.3Å; M318-M447 HydrophobicContact CE-SD 3.6Å; M318-M447 HydrophobicContact SD-SD 4.07Å; I360-M447 HydrophobicContact CD1-CB 3.84Å; I360-M447 HydrophobicContact CG1-CB 4.36Å; I360-M447 HydrophobicContact CG2-CE 3.61Å; I360-M447 HydrophobicContact CG2-SD 3.91Å; M364-M447 HydrophobicContact SD-CE 4.07Å; F430-M447 HydrophobicContact CZ-CE 3.92Å; A443-M447 HydrophobicContact CB-CE 4.41Å; A443-M447 WeakPolarHBondContact O-CE 3.36Å; A443-M447 WeakPolarHBondContact O-CG 3.46Å; A443-M447 PolarHBondContact O-N 3.3Å; M444-M447 HydrophobicContact SD-CE 3.66Å; M447-L451 VanDerWaalsContact O-CB 3.32Å; M447-L451 WeakPolarHBondContact O-CB 3.41Å; M447-L451 VanDerWaalsContact O-CG 3.23Å; M447-L451 WeakPolarHBondContact O-CG 3.46Å; M447-L451 PolarHBondContact O-N 3.39Å
448	K	98.8	Very high	98	Very high	5 Å²	5	22.2 Å²	22.2	2%	0.022	10%	0.101	C	C	.	.	H	α-helix	trans	-61.2	-49.6	175.5	-72.5	-174.3	-173.7	-164	0	111.4	M350 L353 M356 E357 I360 M444 V445 M446 I450 L451 V452	M350-K448 PolarHBondContact O-NZ 3.22Å; M350-K448 HydrophobicContact SD-CB 3.71Å; M350-K448 HydrophobicContact SD-CD 4.26Å; L353-K448 HydrophobicContact CB-CD 4.29Å; L353-K448 HydrophobicContact CD1-CB 4.5Å; L353-K448 PolarHBondContact O-NZ 3.33Å; M356-K448 HydrophobicContact CG-CG 4.01Å; E357-K448 IonicContact OE2-NZ 3.08Å; E357-K448 PolarHBondContact OE2-NZ 2.93Å; I360-K448 HydrophobicContact CD1-CB 4.48Å; I360-K448 HydrophobicContact CD1-CG 3.55Å; M444-K448 WeakPolarHBondContact O-CG 3.36Å; M444-K448 PolarHBondContact O-N 3.5Å; M444-K448 VanDerWaalsContact O-N 3.1Å; V445-K448 PolarHBondContact O-N 2.82Å; M446-K448 PolarHBondContact O-N 2.85Å; K448-I450 VanDerWaalsContact C-N 3.31Å; K448-I450 PolarHBondContact O-N 3.12Å; K448-L451 PolarHBondContact O-N 3.44Å; K448-V452 WeakPolarHBondContact O-CB 3.4Å; K448-V452 WeakPolarHBondContact O-CG2 3.22Å; K448-V452 PolarHBondContact O-N 2.83Å
449	A	98.4	Very high	98	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.3	-43.4	-178.2	0	0	0	0	0	112.2	C164 V445 M446 T453	C164-A449 HydrophobicContact CB-CB 4.06Å; V445-A449 WeakPolarHBondContact O-CB 3.37Å; V445-A449 PolarHBondContact O-N 3.48Å; M446-A449 PolarHBondContact O-N 3.1Å; A449-T453 VanDerWaalsContact O-CB 3.32Å; A449-T453 WeakPolarHBondContact O-CB 3.27Å; A449-T453 PolarHBondContact O-N 2.9Å; A449-T453 VanDerWaalsContact O-N 3.08Å; A449-T453 PolarHBondContact O-OG1 3.24Å
450	I	98.5	Very high	97.9	Very high	1 Å²	1	23.3 Å²	23.3	1%	0.005	10%	0.099	C	C	.	.	H	α-helix	trans	-72.9	-45.5	-178.6	-70.2	170.6	0	0	0	111.5	C164 L168 L191 V194 M195 L315 M446 K448 V452 T453 L454	C164-I450 HydrophobicContact CB-CD1 4.45Å; C164-I450 HydrophobicContact CB-CG1 4.17Å; L168-I450 HydrophobicContact CD2-CB 4.22Å; L168-I450 HydrophobicContact CD2-CG1 4.41Å; L168-I450 HydrophobicContact CD2-CG2 3.76Å; L168-I450 WeakPolarHBondContact CD2-O 3.15Å; L191-I450 HydrophobicContact CD2-CG2 4.31Å; V194-I450 HydrophobicContact CG1-CD1 4.22Å; M195-I450 HydrophobicContact CE-CD1 3.15Å; M195-I450 HydrophobicContact SD-CD1 4.25Å; L315-I450 HydrophobicContact CD1-CB 4.36Å; L315-I450 HydrophobicContact CD1-CD1 4.16Å; L315-I450 HydrophobicContact CD1-CG2 3.97Å; L315-I450 HydrophobicContact CD2-CG2 4.39Å; M446-I450 WeakPolarHBondContact O-CB 3.27Å; M446-I450 WeakPolarHBondContact O-CG1 3.31Å; M446-I450 PolarHBondContact O-N 3.09Å; K448-I450 VanDerWaalsContact C-N 3.31Å; K448-I450 PolarHBondContact O-N 3.12Å; I450-V452 PolarHBondContact O-N 3.4Å; I450-T453 PolarHBondContact O-N 3.11Å; I450-L454 VanDerWaalsContact O-CB 3.27Å; I450-L454 WeakPolarHBondContact O-CB 3.45Å; I450-L454 PolarHBondContact O-N 3.17Å
451	L	98.8	Very high	97.9	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.005	11%	0.108	C	C	.	.	H	α-helix	trans	-62.3	-43.3	177.2	-70.8	170.1	0	0	0	111.7	L315 M318 L319 I322 M356 F359 I360 M447 K448 L455	L315-L451 HydrophobicContact CD2-CD1 4.07Å; L315-L451 HydrophobicContact CD2-CD2 3.81Å; L315-L451 HydrophobicContact CD2-CG 3.62Å; M318-L451 HydrophobicContact CB-CD2 4.47Å; M318-L451 HydrophobicContact SD-CD1 4.11Å; L319-L451 HydrophobicContact CD2-CD2 4.17Å; I322-L451 HydrophobicContact CD1-CD2 4.12Å; M356-L451 HydrophobicContact CE-CB 3.65Å; M356-L451 HydrophobicContact SD-CB 3.73Å; M356-L451 HydrophobicContact SD-CD1 3.66Å; M356-L451 HydrophobicContact SD-CG 4.34Å; F359-L451 HydrophobicContact CD1-CD1 4.25Å; F359-L451 HydrophobicContact CE1-CD1 3.87Å; I360-L451 HydrophobicContact CD1-CD1 4.13Å; I360-L451 HydrophobicContact CG1-CD1 3.88Å; M447-L451 VanDerWaalsContact O-CB 3.32Å; M447-L451 WeakPolarHBondContact O-CB 3.41Å; M447-L451 VanDerWaalsContact O-CG 3.23Å; M447-L451 WeakPolarHBondContact O-CG 3.46Å; M447-L451 PolarHBondContact O-N 3.39Å; K448-L451 PolarHBondContact O-N 3.44Å; L451-L455 HydrophobicContact CB-CD1 4.34Å; L451-L455 WeakPolarHBondContact O-CB 3.32Å; L451-L455 WeakPolarHBondContact O-CD1 3.33Å; L451-L455 WeakPolarHBondContact O-CG 3Å; L451-L455 PolarHBondContact O-N 2.98Å
452	V	98.3	Very high	97.8	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-59.2	-50.3	175.7	170.3	0	0	0	0	110.7	I336 V345 L353 M356 K448 I450 L454 R456	I336-V452 HydrophobicContact CD1-CG2 4.3Å; I336-V452 HydrophobicContact CG1-CG1 4.42Å; I336-V452 HydrophobicContact CG1-CG2 4.15Å; I336-V452 HydrophobicContact CG2-CG1 4.26Å; V345-V452 HydrophobicContact CG2-CG1 4.49Å; L353-V452 HydrophobicContact CD1-CG2 3.65Å; L353-V452 HydrophobicContact CD2-CG2 4.38Å; M356-V452 HydrophobicContact CE-CG2 3.96Å; K448-V452 WeakPolarHBondContact O-CB 3.4Å; K448-V452 WeakPolarHBondContact O-CG2 3.22Å; K448-V452 PolarHBondContact O-N 2.83Å; I450-V452 PolarHBondContact O-N 3.4Å; V452-L454 PolarHBondContact O-N 2.88Å; V452-R456 WeakPolarHBondContact O-CB 3.29Å; V452-R456 PolarHBondContact O-N 3.46Å; V452-R456 VanDerWaalsContact O-N 3.07Å
453	T	97.6	Very high	97.6	Very high	7 Å²	7	19.4 Å²	19.4	4%	0.043	9%	0.087	C	C	.	.	H	α-helix	trans	-66.2	-40.6	-175.2	-55.7	0	0	0	0	111.7	L168 K169 A449 I450	L168-T453 HydrophobicContact CD2-CG2 4Å; L168-T453 HydrophobicContact CG-CG2 4.48Å; K169-T453 HydrophobicContact CG-CG2 3.96Å; A449-T453 VanDerWaalsContact O-CB 3.32Å; A449-T453 WeakPolarHBondContact O-CB 3.27Å; A449-T453 PolarHBondContact O-N 2.9Å; A449-T453 VanDerWaalsContact O-N 3.08Å; A449-T453 PolarHBondContact O-OG1 3.24Å; I450-T453 PolarHBondContact O-N 3.11Å
454	L	98.5	Very high	96.9	Very high	2 Å²	2	26.8 Å²	26.8	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-69.6	-54.7	178.6	-168.9	158	0	0	0	111.6	L168 L319 I450 V452 R456 R457 F458 V460 F492	L168-L454 HydrophobicContact CD2-CB 4.02Å; L319-L454 HydrophobicContact CD1-CD1 4.04Å; L319-L454 HydrophobicContact CD2-CD1 4.11Å; L319-L454 HydrophobicContact CD2-CD2 3.86Å; I450-L454 VanDerWaalsContact O-CB 3.27Å; I450-L454 WeakPolarHBondContact O-CB 3.45Å; I450-L454 PolarHBondContact O-N 3.17Å; V452-L454 PolarHBondContact O-N 2.88Å; L454-R456 PolarHBondContact O-N 3.32Å; L454-R457 PolarHBondContact O-N 3.08Å; L454-R457 VanDerWaalsContact O-N 3.07Å; L454-F458 PolarHBondContact O-N 3.5Å; L454-V460 HydrophobicContact CD2-CG1 3.59Å; L454-F492 HydrophobicContact CD1-CE2 4.16Å; L454-F492 HydrophobicContact CD1-CZ 4.07Å; L454-F492 HydrophobicContact CG-CE2 4.49Å
455	L	97.9	Very high	96.1	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-67.6	-26.9	-173.6	-63.8	171.6	0	0	0	112.5	L319 I322 I332 M333 I336 M356 L451 R457 F458 V460 R495	L319-L455 HydrophobicContact CD2-CD2 4.43Å; I322-L455 HydrophobicContact CD1-CD1 3.69Å; I322-L455 HydrophobicContact CD1-CD2 4.09Å; I322-L455 HydrophobicContact CD1-CG 4.43Å; I322-L455 HydrophobicContact CG2-CD2 4.04Å; I332-L455 HydrophobicContact CG2-CD1 3.93Å; M333-L455 HydrophobicContact SD-CB 3.95Å; M333-L455 VanDerWaalsContact SD-O 3.39Å; I336-L455 HydrophobicContact CD1-CB 4.45Å; M356-L455 HydrophobicContact CE-CD1 4.17Å; L451-L455 HydrophobicContact CB-CD1 4.34Å; L451-L455 WeakPolarHBondContact O-CB 3.32Å; L451-L455 WeakPolarHBondContact O-CD1 3.33Å; L451-L455 WeakPolarHBondContact O-CG 3Å; L451-L455 PolarHBondContact O-N 2.98Å; L455-R457 VanDerWaalsContact C-N 3.3Å; L455-R457 PolarHBondContact O-N 2.98Å; L455-F458 WeakPolarHBondContact CA-O 3.49Å; L455-F458 VanDerWaalsContact O-O 3.12Å; L455-V460 HydrophobicContact CD2-CG2 4.36Å; L455-R495 WeakPolarHBondContact O-CD 3.28Å; L455-R495 PolarHBondContact O-NE 3.24Å
456	R	95.7	Very high	95.8	Very high	52 Å²	52	29.2 Å²	29.2	20%	0.196	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-38.1	172.9	-174.1	168.1	66.5	179.7	6.2	112	G341 R343 V452 L454	G341-R456 PolarHBondContact O-NH1 3.11Å; G341-R456 VanDerWaalsContact O-NH1 3.15Å; R343-R456 PolarHBondContact O-NH1 2.78Å; V452-R456 WeakPolarHBondContact O-CB 3.29Å; V452-R456 PolarHBondContact O-N 3.46Å; V452-R456 VanDerWaalsContact O-N 3.07Å; L454-R456 PolarHBondContact O-N 3.32Å
457	R	96.3	Very high	95.7	Very high	99 Å²	99	29.6 Å²	29.6	37%	0.374	14%	0.144	S	C	.	.	H	α-helix	trans	-89.4	-34.4	-177.5	-170.5	173.1	176.6	170.8	2.7	112.9	D173 L454 L455 P494 R495	D173-R457 IonicContact OD1-CZ 3.89Å; D173-R457 IonicContact OD1-NH1 3.9Å; D173-R457 PolarHBondContact OD1-NH1 3.27Å; D173-R457 IonicContact OD1-NH2 2.64Å; D173-R457 PolarHBondContact OD1-NH2 3.24Å; L454-R457 PolarHBondContact O-N 3.08Å; L454-R457 VanDerWaalsContact O-N 3.07Å; L455-R457 VanDerWaalsContact C-N 3.3Å; L455-R457 PolarHBondContact O-N 2.98Å; R457-P494 WeakPolarHBondContact O-CA 3.48Å; R457-R495 PolarHBondContact O-N 2.99Å
458	F	97.9	Very high	95.5	Very high	13 Å²	13	29.7 Å²	29.7	6%	0.057	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	141	-171	-63.7	-75.2	0	0	0	112.6	L172 L175 L454 L455 F492 T493 P494 R495	L172-F458 HydrophobicContact CB-CE2 4.28Å; L172-F458 HydrophobicContact CD1-CD2 4.39Å; L172-F458 HydrophobicContact CD1-CE2 4.18Å; L172-F458 HydrophobicContact CD2-CD2 4.33Å; L172-F458 HydrophobicContact CD2-CE2 3.96Å; L172-F458 HydrophobicContact CG-CE2 4.36Å; L175-F458 HydrophobicContact CD2-CZ 4.27Å; L454-F458 PolarHBondContact O-N 3.5Å; L455-F458 WeakPolarHBondContact CA-O 3.49Å; L455-F458 VanDerWaalsContact O-O 3.12Å; F458-F492 HydrophobicContact CB-CB 4.2Å; F458-F492 HydrophobicContact CB-CG 4.45Å; F458-F492 HydrophobicContact CD1-CB 3.77Å; F458-F492 HydrophobicContact CD2-CD2 4.26Å; F458-F492 HydrophobicContact CE1-CB 4.26Å; F458-F492 HydrophobicContact CG-CB 3.96Å; F458-F492 HydrophobicContact CG-CD2 4.36Å; F458-F492 HydrophobicContact CG-CG 4.41Å; F458-T493 CarbonylContact C-O 3.55Å; F458-T493 WeakPolarHBondContact CA-O 3.45Å; F458-P494 HydrophobicContact CD1-CG 4.39Å; F458-P494 HydrophobicContact CE1-CG 4.07Å; F458-R495 PolarHBondContact O-NE 3.08Å
459	H	97.5	Very high	95.4	Very high	52 Å²	52	33.7 Å²	33.7	24%	0.241	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	136	154.5	171.8	62.3	0	0	0	108.5	E329 K461 T493 R495	E329-H459 IonicContact OE1-CE1 3.16Å; E329-H459 IonicContact OE1-CG 3.9Å; E329-H459 IonicContact OE1-ND1 2.71Å; E329-H459 PolarHBondContact OE1-ND1 2.87Å; E329-H459 IonicContact OE2-CE1 2.65Å; E329-H459 PolarHBondContact OE2-CE1 2.74Å; E329-H459 IonicContact OE2-ND1 3.7Å; E329-H459 PolarHBondContact OE2-ND1 3.03Å; E329-H459 VanDerWaalsContact OE2-ND1 3.08Å; H459-K461 WeakPolarHBondContact CD2-CE 3.44Å; H459-K461 VanDerWaalsContact NE2-CE 3.34Å; H459-K461 WeakPolarHBondContact NE2-CE 3.47Å; H459-T493 PolarHBondContact N-O 3Å; H459-T493 PolarHBondContact O-N 3.42Å; H459-T493 PolarHBondContact O-OG1 3.03Å; H459-R495 HydrophobicContact CB-CG 4.34Å
460	V	97.1	Very high	95.2	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	134.6	-173.7	-64.2	0	0	0	0	111.1	L319 I322 A323 L454 L455 M490 F492	L319-V460 HydrophobicContact CD2-CG1 4.21Å; L319-V460 HydrophobicContact CD2-CG2 4.37Å; I322-V460 HydrophobicContact CG2-CG2 4.02Å; A323-V460 HydrophobicContact CB-CG2 4.27Å; A323-V460 WeakPolarHBondContact CB-O 2.97Å; L454-V460 HydrophobicContact CD2-CG1 3.59Å; L455-V460 HydrophobicContact CD2-CG2 4.36Å; V460-M490 HydrophobicContact CB-CE 3.92Å; V460-M490 HydrophobicContact CG2-CE 4.19Å; V460-F492 HydrophobicContact CB-CD1 4.4Å; V460-F492 HydrophobicContact CB-CE1 4.39Å; V460-F492 HydrophobicContact CG1-CD1 3.75Å; V460-F492 HydrophobicContact CG1-CE1 3.67Å; V460-F492 HydrophobicContact CG1-CZ 4.42Å
461	K	96.2	Very high	95	Very high	98 Å²	98	42.7 Å²	42.7	43%	0.426	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	138.2	178.2	-62.5	-178.3	-177.3	179.8	0	111.5	H459 M490 I491	H459-K461 WeakPolarHBondContact CD2-CE 3.44Å; H459-K461 VanDerWaalsContact NE2-CE 3.34Å; H459-K461 WeakPolarHBondContact NE2-CE 3.47Å; K461-M490 CarbonylContact O-C 3.43Å; K461-M490 WeakPolarHBondContact O-CA 3.37Å; K461-M490 WeakPolarHBondContact O-CB 3.44Å; K461-I491 HydrophobicContact CB-CB 4.3Å; K461-I491 PolarHBondContact N-O 3.23Å; K461-I491 PolarHBondContact O-N 3.05Å
462	T	96.3	Very high	94.9	Very high	17 Å²	17	47.9 Å²	47.9	10%	0.104	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	148.1	170.4	57.9	0	0	0	0	111.2	F320 A323 K324 Q466 M490	F320-T462 HydrophobicContact CD1-CG2 3.5Å; F320-T462 HydrophobicContact CE1-CG2 3.74Å; F320-T462 HydrophobicContact CG-CG2 4.02Å; F320-T462 HydrophobicContact CZ-CG2 4.4Å; A323-T462 HydrophobicContact CB-CG2 3.72Å; K324-T462 VanDerWaalsContact CE-OG1 3.24Å; K324-T462 WeakPolarHBondContact CE-OG1 3.47Å; K324-T462 PolarHBondContact NZ-OG1 3.02Å; T462-Q466 VanDerWaalsContact CB-O 3.31Å; T462-Q466 WeakPolarHBondContact CB-O 3.45Å; T462-Q466 WeakPolarHBondContact CG2-O 3.25Å; T462-Q466 PolarHBondContact OG1-O 3.1Å; T462-M490 HydrophobicContact CG2-CE 4.22Å
463	L	93.6	Very high	94.8	Very high	8 Å²	8	51.1 Å²	51.1	4%	0.042	24%	0.236	C	C	.	.	G	3₁₀ helix	trans	-69.8	142.7	171.7	-61.3	179.7	0	0	0	112.5	Y184 G465 Q466 M487 E489 I491	Y184-L463 HydrophobicContact CD1-CD2 3.63Å; Y184-L463 HydrophobicContact CD2-CD1 3.83Å; Y184-L463 HydrophobicContact CD2-CD2 4.3Å; Y184-L463 HydrophobicContact CE1-CD2 3.46Å; Y184-L463 VanDerWaalsContact CE1-CD2 3.46Å; Y184-L463 HydrophobicContact CE2-CD1 4.05Å; Y184-L463 HydrophobicContact CE2-CD2 4.18Å; Y184-L463 HydrophobicContact CG-CD1 4.09Å; Y184-L463 HydrophobicContact CG-CD2 4.06Å; L463-G465 PolarHBondContact O-N 3.24Å; L463-Q466 VanDerWaalsContact O-CB 3.25Å; L463-Q466 WeakPolarHBondContact O-CB 3.35Å; L463-Q466 VanDerWaalsContact O-CG 3.22Å; L463-Q466 WeakPolarHBondContact O-CG 3.41Å; L463-Q466 PolarHBondContact O-N 3.24Å; L463-M487 HydrophobicContact CB-CE 4.16Å; L463-M487 HydrophobicContact CD1-SD 4.28Å; L463-E489 HydrophobicContact CD1-CB 3.99Å; L463-E489 WeakPolarHBondContact CG-O 3.31Å; L463-I491 HydrophobicContact CD2-CD1 3.81Å; L463-I491 HydrophobicContact CD2-CG1 3.88Å
464	Q	84.4	Confident	94.8	Very high	163 Å²	163	53.8 Å²	53.8	76%	0.762	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	43	36.3	165.8	-61.3	-174.1	0.6	0	0	116.7	Q466 M487	Q464-Q466 VanDerWaalsContact C-N 3.27Å; Q464-Q466 PolarHBondContact O-N 2.78Å; Q464-M487 HydrophobicContact CB-CE 3.91Å; Q464-M487 HydrophobicContact CG-CE 3.57Å
465	G	81.2	Confident	94.8	Very high	36 Å²	36	55.7 Å²	55.7	37%	0.371	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	74.6	11.1	-179.9	0	0	0	0	0	115.2	L463	L463-G465 PolarHBondContact O-N 3.24Å
466	Q	92.6	Very high	94.8	Very high	47 Å²	47	57.1 Å²	57.1	22%	0.22	27%	0.265	C	S	.	.			trans	-56.7	139.9	173.8	-70.6	-62.7	-20.6	0	0	111.4	F320 K324 T462 L463 Q464 M487	F320-Q466 HydrophobicContact CE1-CB 4.03Å; K324-Q466 WeakPolarHBondContact CE-O 3.34Å; K324-Q466 PolarHBondContact NZ-O 2.93Å; T462-Q466 VanDerWaalsContact CB-O 3.31Å; T462-Q466 WeakPolarHBondContact CB-O 3.45Å; T462-Q466 WeakPolarHBondContact CG2-O 3.25Å; T462-Q466 PolarHBondContact OG1-O 3.1Å; L463-Q466 VanDerWaalsContact O-CB 3.25Å; L463-Q466 WeakPolarHBondContact O-CB 3.35Å; L463-Q466 VanDerWaalsContact O-CG 3.22Å; L463-Q466 WeakPolarHBondContact O-CG 3.41Å; L463-Q466 PolarHBondContact O-N 3.24Å; Q464-Q466 VanDerWaalsContact C-N 3.27Å; Q464-Q466 PolarHBondContact O-N 2.78Å; Q466-M487 HydrophobicContact CG-CB 4.1Å
467	C	95	Very high	94.9	Very high	20 Å²	20	55.5 Å²	55.5	14%	0.135	26%	0.26	C	S	.	.			trans	-144.9	164.1	178.3	66.7	0	0	0	0	109.7	K324 E469 R470 I471	K324-C467 HydrophobicContact CD-CB 4.47Å; K324-C467 HydrophobicContact CG-CB 3.93Å; C467-E469 WeakPolarHBondContact CB-OE2 3.22Å; C467-E469 PolarHBondContact O-N 3.39Å; C467-E469 PolarHBondContact SG-OE2 2.68Å; C467-R470 PolarHBondContact O-N 3.11Å; C467-I471 WeakPolarHBondContact O-CG1 3.47Å; C467-I471 PolarHBondContact O-N 2.6Å; C467-I471 VanDerWaalsContact O-N 3.11Å
468	V	96.1	Very high	94.9	Very high	2 Å²	2	51.3 Å²	51.3	1%	0.012	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60	-22.9	-172.9	-62.2	0	0	0	0	114.4	F317 F320 L321 Y366 Q367 K473	F317-V468 HydrophobicContact CB-CG1 4.44Å; F317-V468 HydrophobicContact CD1-CG1 4.15Å; F320-V468 HydrophobicContact CB-CG1 3.47Å; F320-V468 VanDerWaalsContact CB-CG1 3.47Å; F320-V468 HydrophobicContact CG-CG1 4.43Å; L321-V468 HydrophobicContact CD2-CG1 4.38Å; L321-V468 HydrophobicContact CD2-CG2 3.74Å; L321-V468 HydrophobicContact CG-CG1 3.99Å; L321-V468 HydrophobicContact CG-CG2 4.24Å; Y366-V468 HydrophobicContact CE1-CG2 4.17Å; Q367-V468 HydrophobicContact CG-CB 4.35Å; Q367-V468 PolarHBondContact NE2-O 3.13Å; V468-K473 PolarHBondContact O-NZ 3.08Å
469	E	94.8	Very high	94.9	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.421	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-32.2	174.8	-60.5	79.2	-173.5	0	0	112.6	Y366 C467	Y366-E469 WeakPolarHBondContact CE1-OE1 3.3Å; Y366-E469 PolarHBondContact OH-OE1 3.32Å; C467-E469 WeakPolarHBondContact CB-OE2 3.22Å; C467-E469 PolarHBondContact O-N 3.39Å; C467-E469 PolarHBondContact SG-OE2 2.68Å
470	R	94.7	Very high	95	Very high	182 Å²	182	49.3 Å²	49.3	69%	0.687	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.1	-18.4	-177.9	-69.3	178.5	-175.1	-170.3	0.7	113.3	C467 Q472	C467-R470 PolarHBondContact O-N 3.11Å; R470-Q472 PolarHBondContact O-N 3.4Å
471	I	95.7	Very high	95	Very high	8 Å²	8	49.4 Å²	49.4	4%	0.041	24%	0.239	C	C	.	.	S	Bend	trans	-60.5	126.8	173.5	-66.2	172.5	0	0	0	109.2	F316 F317 F320 C467 K473 P481 L488	F316-I471 HydrophobicContact CE1-CD1 3.85Å; F316-I471 HydrophobicContact CZ-CD1 4.12Å; F317-I471 HydrophobicContact CE1-CD1 4.38Å; F320-I471 HydrophobicContact CD1-CD1 3.7Å; F320-I471 HydrophobicContact CE1-CD1 3.71Å; F320-I471 HydrophobicContact CE1-CG1 4.32Å; F320-I471 HydrophobicContact CG-CD1 4.13Å; F320-I471 HydrophobicContact CZ-CD1 4.19Å; C467-I471 WeakPolarHBondContact O-CG1 3.47Å; C467-I471 PolarHBondContact O-N 2.6Å; C467-I471 VanDerWaalsContact O-N 3.11Å; I471-K473 HydrophobicContact CG2-CG 4.11Å; I471-K473 WeakPolarHBondContact O-CE 3.42Å; I471-K473 PolarHBondContact O-N 2.76Å; I471-P481 HydrophobicContact CG2-CB 4.02Å; I471-P481 HydrophobicContact CG2-CG 4.43Å; I471-L488 HydrophobicContact CG1-CD2 4.45Å; I471-L488 HydrophobicContact CG2-CD2 3.88Å
472	Q	95.6	Very high	95	Very high	109 Å²	109	45.7 Å²	45.7	51%	0.509	22%	0.224	S	C	.	.			trans	-68.3	127.4	169.1	-174.5	164.7	3.3	0	0	108.9	R470 D482 K485	R470-Q472 PolarHBondContact O-N 3.4Å; Q472-D482 HydrophobicContact CB-CB 4.38Å; Q472-D482 HydrophobicContact CG-CB 4.06Å; Q472-D482 PolarHBondContact O-N 3.1Å; Q472-K485 HydrophobicContact CB-CG 4.31Å
473	K	96.9	Very high	95	Very high	69 Å²	69	48.7 Å²	48.7	30%	0.3	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	139.7	-173	-70.1	165	-65.5	-161.6	0	110.1	F317 Q367 V468 I471 H480	F317-K473 HydrophobicContact CE1-CD 4.43Å; F317-K473 HydrophobicContact CZ-CD 4.15Å; F317-K473 HydrophobicContact CZ-CG 4.35Å; Q367-K473 VanDerWaalsContact NE2-NZ 3.17Å; V468-K473 PolarHBondContact O-NZ 3.08Å; I471-K473 HydrophobicContact CG2-CG 4.11Å; I471-K473 WeakPolarHBondContact O-CE 3.42Å; I471-K473 PolarHBondContact O-N 2.76Å; K473-H480 CarbonylContact C-O 3.27Å; K473-H480 VanDerWaalsContact CA-O 3.25Å; K473-H480 WeakPolarHBondContact CA-O 3.08Å
474	I	97.8	Very high	94.9	Very high	62 Å²	62	53.8 Å²	53.8	32%	0.318	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	125.8	163	-61	175.5	0	0	0	106.4	D476 S479 H480 D482	I474-D476 HydrophobicContact CG2-CB 4.15Å; I474-S479 WeakPolarHBondContact O-CA 3.25Å; I474-H480 PolarHBondContact N-O 2.77Å; I474-H480 PolarHBondContact O-N 2.94Å; I474-H480 VanDerWaalsContact O-N 3.12Å; I474-D482 HydrophobicContact CD1-CB 4.43Å; I474-D482 HydrophobicContact CG1-CB 4.04Å
475	H	97.6	Very high	95.2	Very high	42 Å²	42	50.8 Å²	50.8	19%	0.194	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	73.1	-177.6	-171.1	-174.6	0	0	0	110.3	G71 S72 N75 D371	G71-H475 PolarHBondContact N-O 3.45Å; S72-H475 PolarHBondContact N-O 2.91Å; S72-H475 WeakPolarHBondContact OG-CB 3.3Å; S72-H475 PolarHBondContact OG-O 2.86Å; N75-H475 PolarHBondContact ND2-CE1 3.21Å; D371-H475 IonicContact OD1-CD2 2.75Å; D371-H475 IonicContact OD1-NE2 3.62Å; D371-H475 PolarHBondContact OD1-NE2 3.07Å; D371-H475 IonicContact OD2-CD2 3.63Å; D371-H475 IonicContact OD2-CE1 3.19Å; D371-H475 PolarHBondContact OD2-CE1 3.42Å; D371-H475 VanDerWaalsContact OD2-CE1 3.27Å; D371-H475 IonicContact OD2-NE2 2.75Å; D371-H475 PolarHBondContact OD2-NE2 3.4Å
476	D	97.9	Very high	95.4	Very high	30 Å²	30	55 Å²	55	16%	0.16	27%	0.267	C	S	.	.	S	Bend	trans	-115.9	-107.8	-176.9	-172.1	14.3	0	0	0	111	G69 I70 G71 Q225 I474 S478	G69-D476 VanDerWaalsContact CA-OD1 3.24Å; G69-D476 WeakPolarHBondContact CA-OD1 3.48Å; I70-D476 WeakPolarHBondContact CB-O 3.18Å; I70-D476 VanDerWaalsContact CG1-OD1 3.3Å; I70-D476 WeakPolarHBondContact CG1-OD1 3.22Å; I70-D476 PolarHBondContact N-OD1 3.35Å; G71-D476 PolarHBondContact N-O 2.85Å; Q225-D476 HydrophobicContact CG-CB 4.19Å; Q225-D476 WeakPolarHBondContact CG-OD2 3.36Å; I474-D476 HydrophobicContact CG2-CB 4.15Å; D476-S478 VanDerWaalsContact C-N 3.33Å; D476-S478 PolarHBondContact N-O 3.25Å
477	L	97.1	Very high	95.3	Very high	18 Å²	18	54.5 Å²	54.5	9%	0.094	27%	0.265	C	S	.	.	S	Bend	trans	-70.4	-34	177.7	179.7	59.7	0	0	0	111.8	I70 F221 W224 Q225 L228 M374	I70-L477 HydrophobicContact CD1-CD1 4.39Å; F221-L477 HydrophobicContact CE2-CD2 4.42Å; W224-L477 HydrophobicContact CD2-CD2 3.87Å; W224-L477 HydrophobicContact CE3-CD2 4.35Å; W224-L477 HydrophobicContact CG-CD2 4.22Å; W224-L477 HydrophobicContact CZ2-CD2 4.13Å; Q225-L477 HydrophobicContact CB-CB 4.1Å; Q225-L477 HydrophobicContact CB-CD2 4.23Å; Q225-L477 HydrophobicContact CG-CB 3.77Å; L228-L477 HydrophobicContact CD2-CD1 3.48Å; L228-L477 VanDerWaalsContact CD2-CD1 3.48Å; L228-L477 HydrophobicContact CD2-CD2 4.19Å; L228-L477 HydrophobicContact CD2-CG 4.44Å; M374-L477 HydrophobicContact SD-CD1 4.4Å
478	S	97.7	Very high	95.3	Very high	12 Å²	12	54.7 Å²	54.7	8%	0.084	26%	0.264	C	S	.	.	S	Bend	trans	-133.3	168.8	169.1	68.4	0	0	0	0	109.5	F221 V369 D476 H480	F221-S478 WeakPolarHBondContact CZ-OG 3.22Å; V369-S478 CarbonylContact O-C 3.3Å; V369-S478 WeakPolarHBondContact O-CA 3.36Å; V369-S478 WeakPolarHBondContact O-CB 3.26Å; D476-S478 VanDerWaalsContact C-N 3.33Å; D476-S478 PolarHBondContact N-O 3.25Å; S478-H480 PolarHBondContact O-ND1 2.67Å; S478-H480 PolarHBondContact OG-ND1 3.16Å
479	S	97.9	Very high	95.3	Very high	9 Å²	9	57.2 Å²	57.2	6%	0.063	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	108.3	168.8	165.6	0	0	0	0	109	P368 V369 I474	P368-S479 WeakPolarHBondContact O-CB 3.3Å; P368-S479 PolarHBondContact O-OG 2.96Å; V369-S479 WeakPolarHBondContact CA-O 3.24Å; V369-S479 PolarHBondContact O-N 2.79Å; I474-S479 WeakPolarHBondContact O-CA 3.25Å
480	H	98.2	Very high	95.5	Very high	14 Å²	14	53 Å²	53	7%	0.065	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	157.2	-178.1	53.6	-84.9	0	0	0	111	Q225 V313 K473 I474 S478	Q225-H480 PolarHBondContact OE1-CE1 2.9Å; V313-H480 HydrophobicContact CG1-CB 3.93Å; V313-H480 HydrophobicContact CG2-CB 4.46Å; K473-H480 CarbonylContact C-O 3.27Å; K473-H480 VanDerWaalsContact CA-O 3.25Å; K473-H480 WeakPolarHBondContact CA-O 3.08Å; I474-H480 PolarHBondContact N-O 2.77Å; I474-H480 PolarHBondContact O-N 2.94Å; I474-H480 VanDerWaalsContact O-N 3.12Å; S478-H480 PolarHBondContact O-ND1 2.67Å; S478-H480 PolarHBondContact OG-ND1 3.16Å
481	P	97.9	Very high	95.6	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.006	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.1	142.8	175.6	-22.9	34.1	0	0	0	111.8	L188 F316 F317 I471 E483 L488	L188-P481 HydrophobicContact CD1-CG 4.36Å; F316-P481 HydrophobicContact CD1-CG 3.78Å; F316-P481 HydrophobicContact CE1-CB 4.38Å; F316-P481 HydrophobicContact CE1-CG 3.42Å; F316-P481 VanDerWaalsContact CE1-CG 3.42Å; F316-P481 HydrophobicContact CZ-CG 4.2Å; F317-P481 HydrophobicContact CE1-CG 3.87Å; F317-P481 HydrophobicContact CZ-CG 3.93Å; I471-P481 HydrophobicContact CG2-CB 4.02Å; I471-P481 HydrophobicContact CG2-CG 4.43Å; P481-E483 PolarHBondContact O-N 3.48Å; P481-E483 VanDerWaalsContact O-N 3.14Å; P481-L488 HydrophobicContact CB-CD1 3.88Å; P481-L488 HydrophobicContact CB-CD2 4Å
482	D	97.1	Very high	95.7	Very high	20 Å²	20	47.3 Å²	47.3	11%	0.107	24%	0.238	C	C	.	.			trans	-75.4	96.4	167.2	-177.4	-5.4	0	0	0	109.1	Q472 I474 T484 K485	Q472-D482 HydrophobicContact CB-CB 4.38Å; Q472-D482 HydrophobicContact CG-CB 4.06Å; Q472-D482 PolarHBondContact O-N 3.1Å; I474-D482 HydrophobicContact CD1-CB 4.43Å; I474-D482 HydrophobicContact CG1-CB 4.04Å; D482-T484 PolarHBondContact O-N 2.78Å; D482-T484 VanDerWaalsContact O-N 3.15Å; D482-T484 WeakPolarHBondContact OD1-CB 3.35Å; D482-T484 PolarHBondContact OD1-N 3.2Å; D482-T484 VanDerWaalsContact OD1-N 3.09Å; D482-T484 PolarHBondContact OD1-OG1 3.09Å; D482-T484 PolarHBondContact OD2-OG1 3.37Å; D482-K485 HydrophobicContact CB-CG 4.16Å; D482-K485 WeakPolarHBondContact O-CB 3.34Å; D482-K485 PolarHBondContact O-N 3.38Å
483	E	95.3	Very high	95.7	Very high	80 Å²	80	44.2 Å²	44.2	37%	0.374	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-2.3	-178	-69.3	175.7	-123.2	0	0	113.8	L188 R192 Q218 P481 L488	L188-E483 HydrophobicContact CD1-CG 3.88Å; R192-E483 IonicContact CZ-OE1 2.7Å; R192-E483 IonicContact CZ-OE2 3.7Å; R192-E483 VanDerWaalsContact NH1-CD 3.31Å; R192-E483 IonicContact NH1-OE1 2.71Å; R192-E483 PolarHBondContact NH1-OE1 2.96Å; R192-E483 VanDerWaalsContact NH1-OE1 3.15Å; R192-E483 IonicContact NH1-OE2 3.43Å; R192-E483 PolarHBondContact NH1-OE2 3.43Å; R192-E483 IonicContact NH2-OE1 2.74Å; R192-E483 PolarHBondContact NH2-OE1 3.36Å; R192-E483 IonicContact NH2-OE2 3.63Å; Q218-E483 PolarHBondContact NE2-OE2 3.02Å; P481-E483 PolarHBondContact O-N 3.48Å; P481-E483 VanDerWaalsContact O-N 3.14Å; E483-L488 HydrophobicContact CG-CD1 4.16Å
484	T	92.4	Very high	95.6	Very high	116 Å²	116	45.4 Å²	45.4	71%	0.712	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-13	166.6	73.2	0	0	0	0	112.4	D482	D482-T484 PolarHBondContact O-N 2.78Å; D482-T484 VanDerWaalsContact O-N 3.15Å; D482-T484 WeakPolarHBondContact OD1-CB 3.35Å; D482-T484 PolarHBondContact OD1-N 3.2Å; D482-T484 VanDerWaalsContact OD1-N 3.09Å; D482-T484 PolarHBondContact OD1-OG1 3.09Å; D482-T484 PolarHBondContact OD2-OG1 3.37Å
485	K	89.4	Confident	95.3	Very high	100 Å²	100	46.3 Å²	46.3	44%	0.435	24%	0.241	S	C	.	.	S	Bend	trans	-96.7	152.7	174.7	-52.2	-60.8	171.1	-176.2	0	110.2	Q472 D482	Q472-K485 HydrophobicContact CB-CG 4.31Å; D482-K485 HydrophobicContact CB-CG 4.16Å; D482-K485 WeakPolarHBondContact O-CB 3.34Å; D482-K485 PolarHBondContact O-N 3.38Å
486	N	85.6	Confident	93.9	Very high	125 Å²	125	50 Å²	50	67%	0.668	26%	0.262	S	S	*	.	S	Bend	trans	-92.8	-177.6	178.1	57.2	6.3	0	0	0	111.5	L488	N486-L488 VanDerWaalsContact C-N 3.33Å
487	M	89.9	Confident	91.8	Very high	36 Å²	36	53.1 Å²	53.1	18%	0.177	29%	0.286	C	S	.	.			trans	71.4	27.7	177.4	-46.2	-64.7	-88.3	0	0	113.6	L463 Q464 Q466 E489	L463-M487 HydrophobicContact CB-CE 4.16Å; L463-M487 HydrophobicContact CD1-SD 4.28Å; Q464-M487 HydrophobicContact CB-CE 3.91Å; Q464-M487 HydrophobicContact CG-CE 3.57Å; Q466-M487 HydrophobicContact CG-CB 4.1Å; M487-E489 VanDerWaalsContact CA-OE2 3.27Å; M487-E489 WeakPolarHBondContact CA-OE2 3.4Å; M487-E489 PolarHBondContact N-OE2 3.16Å; M487-E489 VanDerWaalsContact N-OE2 3.12Å
488	L	95.3	Very high	89.2	Confident	23 Å²	23	58.4 Å²	58.4	12%	0.12	32%	0.315	C	S	.	.			trans	-91.5	-13.5	171.3	-59.6	179.9	0	0	0	111.2	L188 F316 I471 P481 E483 N486	L188-L488 HydrophobicContact CD1-CD1 4.27Å; F316-L488 HydrophobicContact CE2-CB 4.35Å; F316-L488 VanDerWaalsContact CE2-O 3.25Å; F316-L488 WeakPolarHBondContact CE2-O 3.45Å; F316-L488 HydrophobicContact CZ-CB 4.15Å; F316-L488 HydrophobicContact CZ-CD2 4.11Å; I471-L488 HydrophobicContact CG1-CD2 4.45Å; I471-L488 HydrophobicContact CG2-CD2 3.88Å; P481-L488 HydrophobicContact CB-CD1 3.88Å; P481-L488 HydrophobicContact CB-CD2 4Å; E483-L488 HydrophobicContact CG-CD1 4.16Å; N486-L488 VanDerWaalsContact C-N 3.33Å
489	E	97	Very high	86.5	Confident	56 Å²	56	68.1 Å²	68.1	26%	0.262	35%	0.349	S	S	.	.			trans	-68.9	158.4	179.4	-52.2	89.2	154.4	0	0	111.7	V185 L463 M487	V185-E489 WeakPolarHBondContact O-CA 3.26Å; V185-E489 WeakPolarHBondContact O-CB 3.3Å; L463-E489 HydrophobicContact CD1-CB 3.99Å; L463-E489 WeakPolarHBondContact CG-O 3.31Å; M487-E489 VanDerWaalsContact CA-OE2 3.27Å; M487-E489 WeakPolarHBondContact CA-OE2 3.4Å; M487-E489 PolarHBondContact N-OE2 3.16Å; M487-E489 VanDerWaalsContact N-OE2 3.12Å
490	M	97.8	Very high	83.7	Confident	0 Å²	0	72.3 Å²	72.3	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	162.6	176.3	-58.7	-173.7	76.6	0	0	111	V185 V187 L319 F320 A323 V460 K461 T462 F492	V185-M490 PolarHBondContact N-O 2.9Å; V185-M490 PolarHBondContact O-N 3.05Å; V185-M490 VanDerWaalsContact O-N 3.07Å; V187-M490 HydrophobicContact CG1-SD 4.45Å; V187-M490 HydrophobicContact CG2-CB 3.63Å; V187-M490 HydrophobicContact CG2-CG 3.67Å; V187-M490 HydrophobicContact CG2-SD 3.9Å; L319-M490 HydrophobicContact CB-CE 4.05Å; L319-M490 HydrophobicContact CB-SD 3.76Å; F320-M490 HydrophobicContact CD2-CE 4.21Å; F320-M490 HydrophobicContact CD2-CG 4.25Å; F320-M490 HydrophobicContact CD2-SD 3.73Å; F320-M490 HydrophobicContact CE2-CE 4.45Å; F320-M490 HydrophobicContact CE2-CG 3.61Å; F320-M490 HydrophobicContact CE2-SD 3.7Å; F320-M490 HydrophobicContact CZ-CG 4.19Å; A323-M490 HydrophobicContact CB-CE 3.99Å; V460-M490 HydrophobicContact CB-CE 3.92Å; V460-M490 HydrophobicContact CG2-CE 4.19Å; K461-M490 CarbonylContact O-C 3.43Å; K461-M490 WeakPolarHBondContact O-CA 3.37Å; K461-M490 WeakPolarHBondContact O-CB 3.44Å; T462-M490 HydrophobicContact CG2-CE 4.22Å; M490-F492 HydrophobicContact CB-CD1 4.39Å; M490-F492 HydrophobicContact CB-CE1 4.05Å
491	I	97.3	Very high	80.7	Confident	54 Å²	54	79.3 Å²	79.3	28%	0.277	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	125.8	173.2	-57	169.3	0	0	0	108.1	Y184 K461 L463 T493	Y184-I491 HydrophobicContact CD1-CD1 4.23Å; Y184-I491 HydrophobicContact CD1-CG1 3.84Å; Y184-I491 HydrophobicContact CE1-CD1 4.02Å; Y184-I491 HydrophobicContact CE1-CG1 4.16Å; K461-I491 HydrophobicContact CB-CB 4.3Å; K461-I491 PolarHBondContact N-O 3.23Å; K461-I491 PolarHBondContact O-N 3.05Å; L463-I491 HydrophobicContact CD2-CD1 3.81Å; L463-I491 HydrophobicContact CD2-CG1 3.88Å; I491-T493 HydrophobicContact CG2-CG2 4.05Å
492	F	97.5	Very high	77.6	Confident	18 Å²	18	87.3 Å²	87.3	8%	0.079	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	111.2	175.3	-72.5	7.1	0	0	0	109.1	L172 L175 V185 V187 L190 L454 F458 V460 M490	L172-F492 HydrophobicContact CD2-CE2 4.3Å; L175-F492 HydrophobicContact CD1-CD2 4.26Å; L175-F492 HydrophobicContact CD1-CE2 4.49Å; L175-F492 HydrophobicContact CD2-CB 4.43Å; L175-F492 HydrophobicContact CD2-CD2 4.21Å; V185-F492 HydrophobicContact CG1-CD2 4.46Å; V185-F492 HydrophobicContact CG1-CE2 4.22Å; V185-F492 HydrophobicContact CG1-CZ 4.43Å; V185-F492 HydrophobicContact CG2-CB 4.25Å; V185-F492 HydrophobicContact CG2-CD1 4.44Å; V185-F492 HydrophobicContact CG2-CD2 4.21Å; V185-F492 HydrophobicContact CG2-CG 4.05Å; V187-F492 HydrophobicContact CG2-CE1 3.83Å; V187-F492 HydrophobicContact CG2-CZ 3.82Å; L190-F492 HydrophobicContact CD2-CE2 3.85Å; L190-F492 HydrophobicContact CD2-CZ 4.37Å; L454-F492 HydrophobicContact CD1-CE2 4.16Å; L454-F492 HydrophobicContact CD1-CZ 4.07Å; L454-F492 HydrophobicContact CG-CE2 4.49Å; F458-F492 HydrophobicContact CB-CB 4.2Å; F458-F492 HydrophobicContact CB-CG 4.45Å; F458-F492 HydrophobicContact CD1-CB 3.77Å; F458-F492 HydrophobicContact CD2-CD2 4.26Å; F458-F492 HydrophobicContact CE1-CB 4.26Å; F458-F492 HydrophobicContact CG-CB 3.96Å; F458-F492 HydrophobicContact CG-CD2 4.36Å; F458-F492 HydrophobicContact CG-CG 4.41Å; V460-F492 HydrophobicContact CB-CD1 4.4Å; V460-F492 HydrophobicContact CB-CE1 4.39Å; V460-F492 HydrophobicContact CG1-CD1 3.75Å; V460-F492 HydrophobicContact CG1-CE1 3.67Å; V460-F492 HydrophobicContact CG1-CZ 4.42Å; M490-F492 HydrophobicContact CB-CD1 4.39Å; M490-F492 HydrophobicContact CB-CE1 4.05Å
493	T	95.9	Very high	74.6	Confident	44 Å²	44	99.1 Å²	99.1	27%	0.27	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	125.2	177	52.4	0	0	0	0	109.7	F458 H459 I491	F458-T493 CarbonylContact C-O 3.55Å; F458-T493 WeakPolarHBondContact CA-O 3.45Å; H459-T493 PolarHBondContact N-O 3Å; H459-T493 PolarHBondContact O-N 3.42Å; H459-T493 PolarHBondContact O-OG1 3.03Å; I491-T493 HydrophobicContact CG2-CG2 4.05Å
494	P	95.1	Very high	73.6	Confident	93 Å²	93	100.1 Å²	100.1	60%	0.604	51%	0.513	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-54.4	142.5	179.5	-26.2	33.8	0	0	0	112.4	R457 F458	R457-P494 WeakPolarHBondContact O-CA 3.48Å; F458-P494 HydrophobicContact CD1-CG 4.39Å; F458-P494 HydrophobicContact CE1-CG 4.07Å
495	R	91.8	Very high	72.6	Confident	81 Å²	81	99.3 Å²	99.3	31%	0.306	50%	0.502	S	S	.	.			trans	-86.3	125.4	167	-67.2	-175.5	176.2	-85	-0.1	108.3	E329 L455 R457 F458 H459 S497	E329-R495 IonicContact OE1-CZ 3.32Å; E329-R495 IonicContact OE1-NH2 2.64Å; E329-R495 PolarHBondContact OE1-NH2 3.32Å; E329-R495 IonicContact OE2-NH2 3.34Å; L455-R495 WeakPolarHBondContact O-CD 3.28Å; L455-R495 PolarHBondContact O-NE 3.24Å; R457-R495 PolarHBondContact O-N 2.99Å; F458-R495 PolarHBondContact O-NE 3.08Å; H459-R495 HydrophobicContact CB-CG 4.34Å; R495-S497 PolarHBondContact O-N 3.28Å; R495-S497 VanDerWaalsContact O-N 3.15Å
496	N	68.8	Low	71.6	Confident	120 Å²	120	99.2 Å²	99.2	64%	0.642	51%	0.506	S	S	*	.			trans	-65.5	115.2	174.7	-72.4	-4.4	0	0	0	109	D498	N496-D498 PolarHBondContact O-N 3.25Å; N496-D498 VanDerWaalsContact O-N 3.11Å
497	S	53.1	Low	70.8	Confident	95 Å²	95	97.7 Å²	97.7	66%	0.664	50%	0.496	S	S	*	.	G	3₁₀ helix	trans	-57.9	-16.3	170.9	45.3	0	0	0	0	113.3	R495	R495-S497 PolarHBondContact O-N 3.28Å; R495-S497 VanDerWaalsContact O-N 3.15Å
498	D	41.9	Very low	69.6	Low	129 Å²	129	101.6 Å²	101.6	69%	0.69	52%	0.516	S	S	*	.	G	3₁₀ helix	trans	-95.9	-1.8	-165.7	-57.8	-14.8	0	0	0	114.8	N496	N496-D498 PolarHBondContact O-N 3.25Å; N496-D498 VanDerWaalsContact O-N 3.11Å
499	R	42	Very low	67.9	Low	217 Å²	217	106.8 Å²	106.8	82%	0.819	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-97.7	7.6	-178.4	-88.9	-168.1	179.1	-173.2	0.2	115.9
500	C	38.5	Very low	65.8	Low	96 Å²	96	110.4 Å²	110.4	65%	0.649	56%	0.563	S	S	*	*	S	Bend	trans	-98	15.9	174.7	-70.2	0	0	0	0	114
501	L	34.7	Very low	63.4	Low	161 Å²	161	118.9 Å²	118.9	84%	0.843	61%	0.606	S	S	*	*	S	Bend	trans	-104.7	7.4	178.7	-78.4	172	0	0	0	115.2
502	E	33.3	Very low	60.5	Low	170 Å²	170	124.3 Å²	124.3	79%	0.794	63%	0.633	S	S	*	*			trans	-132.9	89.5	172.3	-69.9	-175.9	170.5	0	0	109.8
503	H	34	Very low	57.2	Low	268 Å²	268	134 Å²	134	100%	1.241	68%	0.684	S	S	*	*				-176.9	0	127.4	-89.2	-48.2	0	0	0	112.2

Retrieved 503 of 503 residues in 428.9 ms (Link to these results)

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