A0A096NN23_PAPAN Loading...

Protein-L-isoaspartate (D-aspartate) O-methyltransferase domain containing 2

AlphaFold DB , UniProt , Accession A0A096NN23, Species PAPAN (Papio anubis, Olive baboon), Gene PCMTD2, Length 409 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	36.1	Very low	55	Low	126 Å²	126	53.3 Å²	53.3	62%	0.621	33%	0.328	S	S	*	.				0	119.7	0	175.4	-173.2	-94.3	0	0	104.2	K105 A265	M1-K105 VanDerWaalsContact CG-NZ 3.27Å; M1-K105 PolarHBondContact SD-NZ 2.67Å; M1-A265 WeakPolarHBondContact O-CB 3.34Å
2	F	49.3	Very low	52.8	Low	5 Å²	5	58.4 Å²	58.4	2%	0.022	36%	0.363	C	S	.	.			trans	-68.8	138.7	173	-71.3	-92.2	0	0	0	108.2	H110 L161 A215 L267	F2-H110 WeakPolarHBondContact CB-CE1 3.5Å; F2-L161 HydrophobicContact CD2-CB 4.17Å; F2-L161 HydrophobicContact CE2-CB 3.73Å; F2-L161 HydrophobicContact CE2-CD2 4.2Å; F2-A215 HydrophobicContact CD1-CB 3.58Å; F2-A215 HydrophobicContact CE1-CB 3.43Å; F2-A215 VanDerWaalsContact CE1-CB 3.43Å; F2-L267 HydrophobicContact CE1-CD1 3.77Å; F2-L267 HydrophobicContact CZ-CD1 3.69Å
3	T	50.9	Low	50.9	Low	40 Å²	40	61.6 Å²	61.6	25%	0.245	40%	0.398	C	S	.	.			trans	-128.1	149.4	175.6	55.4	0	0	0	0	110	K105 A265	T3-K105 HydrophobicContact CG2-CD 3.96Å; T3-A265 HydrophobicContact CG2-CB 3.84Å; T3-A265 WeakPolarHBondContact OG1-CA 3.42Å; T3-A265 WeakPolarHBondContact OG1-CB 3.16Å; T3-A265 PolarHBondContact OG1-N 3.18Å
4	A	62.2	Low	49.3	Very low	16 Å²	16	64.2 Å²	64.2	13%	0.132	43%	0.428	C	S	.	.			trans	-52.7	137.2	169.4	0	0	0	0	0	111.5	A103 W104 H110 L111	A4-A103 HydrophobicContact CB-CB 3.62Å; A4-W104 VanDerWaalsContact CB-O 3.26Å; A4-W104 WeakPolarHBondContact CB-O 3.39Å; A4-H110 HydrophobicContact CB-CB 4.01Å; A4-L111 WeakPolarHBondContact CB-O 3.41Å
5	A	73.6	Confident	47.9	Very low	0 Å²	0	67 Å²	67	0%	0	44%	0.437	C	S	.	.			trans	-98.6	146.6	-177.4	0	0	0	0	0	113.5	A103 S112 A113 I116 S263 F264	A5-A103 WeakPolarHBondContact O-CB 3.25Å; A5-S112 WeakPolarHBondContact CB-OG 3.45Å; A5-S112 PolarHBondContact N-OG 2.9Å; A5-S112 VanDerWaalsContact N-OG 3.11Å; A5-S112 WeakPolarHBondContact O-CA 2.98Å; A5-A113 PolarHBondContact O-N 2.86Å; A5-I116 HydrophobicContact CB-CG2 4.2Å; A5-S263 WeakPolarHBondContact CA-O 3.38Å; A5-F264 HydrophobicContact CB-CD1 3.49Å; A5-F264 VanDerWaalsContact CB-CD1 3.49Å; A5-F264 HydrophobicContact CB-CD2 3.7Å; A5-F264 HydrophobicContact CB-CE1 3.19Å; A5-F264 HydrophobicContact CB-CE2 3.4Å; A5-F264 VanDerWaalsContact CB-CE2 3.4Å; A5-F264 HydrophobicContact CB-CG 3.75Å; A5-F264 HydrophobicContact CB-CZ 3.15Å
6	Q	81.3	Confident	46.9	Very low	53 Å²	53	69.1 Å²	69.1	25%	0.248	46%	0.461	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	165.1	176.7	-164.1	160.9	-25.3	0	0	110.7	G8 A103 A113 S263	Q6-G8 PolarHBondContact O-N 2.93Å; Q6-A103 HydrophobicContact CB-CB 4Å; Q6-A113 HydrophobicContact CG-CB 4.26Å; Q6-S263 PolarHBondContact N-O 2.95Å; Q6-S263 PolarHBondContact O-N 3.42Å
7	V	75.8	Confident	46	Very low	27 Å²	27	77 Å²	77	16%	0.164	48%	0.479	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	128.8	173.7	-173.3	0	0	0	0	109.6	L47 A52 I116 L260	V7-L47 HydrophobicContact CB-CD2 3.99Å; V7-L47 HydrophobicContact CG1-CD1 3.95Å; V7-L47 HydrophobicContact CG1-CD2 3.66Å; V7-L47 HydrophobicContact CG1-CG 4.37Å; V7-A52 HydrophobicContact CG2-CB 4.32Å; V7-I116 HydrophobicContact CG2-CD1 4.01Å; V7-L260 HydrophobicContact CG1-CD1 4.41Å; V7-L260 HydrophobicContact CG2-CD1 4.46Å
8	G	62.3	Low	45.1	Very low	10 Å²	10	76.8 Å²	76.8	10%	0.103	50%	0.495	C	S	.	.	P	Polyproline II helix	trans	-78.4	140.1	-179	0	0	0	0	0	111.1	Q6 A10 L47 A261	Q6-G8 PolarHBondContact O-N 2.93Å; G8-A10 PolarHBondContact O-N 2.69Å; G8-L47 VanDerWaalsContact O-CD1 3.28Å; G8-L47 WeakPolarHBondContact O-CD1 3.48Å; G8-A261 PolarHBondContact N-O 3.26Å
9	A	47.8	Very low	44.2	Very low	68 Å²	68	79.5 Å²	79.5	56%	0.562	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-63.3	120.1	169.5	0	0	0	0	0	109.1	L11	A9-L11 PolarHBondContact O-N 3.4Å
10	A	37.5	Very low	43.5	Very low	81 Å²	81	87 Å²	87	67%	0.669	53%	0.528	S	S	*	.			trans	-67.4	97.2	168.8	0	0	0	0	0	108.1	G8 P12	G8-A10 PolarHBondContact O-N 2.69Å; A10-P12 WeakPolarHBondContact O-CD 3.42Å
11	L	28.2	Very low	43.1	Very low	160 Å²	160	88 Å²	88	84%	0.838	54%	0.536	S	S	*	.			trans	-62.6	123.9	167.2	-80.1	163.8	0	0	0	107.5	A9 A13	A9-L11 PolarHBondContact O-N 3.4Å; L11-A13 PolarHBondContact O-N 3.18Å
12	P	28.2	Very low	42.7	Very low	115 Å²	115	93.5 Å²	93.5	75%	0.747	55%	0.55	S	S	*	.			trans	-61.7	125.6	172.9	24.4	-30.1	0	0	0	107.8	A10 A14	A10-P12 WeakPolarHBondContact O-CD 3.42Å; P12-A14 PolarHBondContact O-N 3.16Å
13	A	28.4	Very low	41.6	Very low	100 Å²	100	98.5 Å²	98.5	83%	0.826	59%	0.586	S	S	*	*			trans	-58.5	108	172.2	0	0	0	0	0	108.2	L11 D15	L11-A13 PolarHBondContact O-N 3.18Å; A13-D15 PolarHBondContact O-N 3.11Å
14	A	28.2	Very low	40.5	Very low	98 Å²	98	102.1 Å²	102.1	81%	0.81	61%	0.611	S	S	*	*			trans	-68.2	99.4	171.1	0	0	0	0	0	107.8	P12 A16	P12-A14 PolarHBondContact O-N 3.16Å; A14-A16 VanDerWaalsContact C-N 3.34Å; A14-A16 PolarHBondContact O-N 2.63Å
15	D	29.1	Very low	38.8	Very low	106 Å²	106	112.8 Å²	112.8	57%	0.567	65%	0.648	S	S	*	*			trans	-69.7	90.9	173	-168.7	11.9	0	0	0	108.9	A13 R17	A13-D15 PolarHBondContact O-N 3.11Å; D15-R17 VanDerWaalsContact C-N 3.3Å; D15-R17 PolarHBondContact O-N 3.09Å; D15-R17 IonicContact OD1-NE 2.74Å; D15-R17 PolarHBondContact OD1-NE 3.05Å; D15-R17 IonicContact OD2-CZ 2.68Å; D15-R17 IonicContact OD2-NE 3.46Å; D15-R17 PolarHBondContact OD2-NE 3.49Å; D15-R17 IonicContact OD2-NH2 3.52Å; D15-R17 PolarHBondContact OD2-NH2 2.8Å
16	A	31.6	Very low	36.6	Very low	100 Å²	100	118.8 Å²	118.8	83%	0.826	69%	0.689	S	S	*	*			trans	-75	83.3	171.9	0	0	0	0	0	109.3	A14	A14-A16 VanDerWaalsContact C-N 3.34Å; A14-A16 PolarHBondContact O-N 2.63Å
17	R	32	Very low	34	Very low	204 Å²	204	125 Å²	125	77%	0.77	72%	0.719	S	S	*	*			trans	-101.3	116.9	169.1	-86.3	-170.8	-91.3	-163.9	-1.6	111.6	D15	D15-R17 VanDerWaalsContact C-N 3.3Å; D15-R17 PolarHBondContact O-N 3.09Å; D15-R17 IonicContact OD1-NE 2.74Å; D15-R17 PolarHBondContact OD1-NE 3.05Å; D15-R17 IonicContact OD2-CZ 2.68Å; D15-R17 IonicContact OD2-NE 3.46Å; D15-R17 PolarHBondContact OD2-NE 3.49Å; D15-R17 IonicContact OD2-NH2 3.52Å; D15-R17 PolarHBondContact OD2-NH2 2.8Å
18	G	30	Very low	32.3	Very low	73 Å²	73	128.8 Å²	128.8	75%	0.753	74%	0.744	S	S	*	*			trans	-61.6	141.6	173	0	0	0	0	0	113.6
19	T	28.2	Very low	30.6	Very low	129 Å²	129	140.5 Å²	140.5	79%	0.791	79%	0.785	S	S	*	*			trans	-37.4	141.2	151	34.2	0	0	0	0	111.7
20	R	29.8	Very low	29.6	Very low	229 Å²	229	149.1 Å²	149.1	86%	0.864	80%	0.803	S	S	*	*			cis	179	-172.8	32.3	-107	174.9	-167.1	-161.7	6.9	106.2
21	P	35.2	Very low	29.2	Very low	107 Å²	107	151.2 Å²	151.2	70%	0.695	81%	0.812	S	S	*	*				-130	159.9	-67.5	36.6	-16.5	0	0	0	115.4
22	R	26.8	Very low	29.2	Very low	243 Å²	243	152.6 Å²	152.6	92%	0.917	82%	0.815	S	S	*	*			trans	39.5	127.2	143.3	-61.9	-179.3	177.2	-174.3	-1	121.5
23	S	26.6	Very low	29.4	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	82%	0.816	S	S	*	*				178.3	151.9	89.5	70.8	0	0	0	0	115.7
24	C	26.7	Very low	29.6	Very low	115 Å²	115	154.8 Å²	154.8	78%	0.777	82%	0.818	S	S	*	*			trans	79	99.7	149.2	-74.8	0	0	0	0	124.5
25	R	26.5	Very low	29.7	Very low	241 Å²	241	153.5 Å²	153.5	91%	0.909	81%	0.814	S	S	*	*				36.7	119	126	-77.4	-176.8	175	-170.3	-1.3	120.5
26	S	28.3	Very low	29.7	Very low	125 Å²	125	159.5 Å²	159.5	87%	0.874	83%	0.829	S	S	*	*				174.2	143.1	100.2	46.4	0	0	0	0	111.7
27	Q	26	Very low	29.7	Very low	185 Å²	185	160.2 Å²	160.2	86%	0.864	83%	0.825	S	S	*	*			trans	-116.3	178.3	173.7	-106	-170.7	16.2	0	0	107.6
28	P	40.3	Very low	29.4	Very low	106 Å²	106	154.3 Å²	154.3	69%	0.688	82%	0.815	S	S	*	*			cis	-137.5	170.7	-16	30.2	-9.8	0	0	0	113.6
29	R	27.7	Very low	29.5	Very low	256 Å²	256	157.7 Å²	157.7	97%	0.966	82%	0.815	S	S	*	*			trans	-145.4	142.7	142.4	-80.5	-159.8	-177.4	-161	0.4	111.6
30	R	27.3	Very low	29.5	Very low	248 Å²	248	159.9 Å²	159.9	94%	0.936	82%	0.816	S	S	*	*			trans	-70.9	144.7	-170.7	-65.4	172.3	171.8	-171.9	-4.6	113.5
31	S	27.5	Very low	29.7	Very low	125 Å²	125	159 Å²	159	87%	0.874	81%	0.814	S	S	*	*			trans	-157.8	142.3	137.1	47.1	0	0	0	0	109.5
32	E	29.8	Very low	29.3	Very low	189 Å²	189	159.5 Å²	159.5	88%	0.883	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.7	171.2	-167.5	-96.8	-172.1	177.4	0	0	114.2
33	P	31.7	Very low	29.4	Very low	118 Å²	118	153.9 Å²	153.9	77%	0.766	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-96.7	144.5	-145.1	36.8	-32.9	0	0	0	114
34	V	32.4	Very low	29.7	Very low	144 Å²	144	154 Å²	154	87%	0.873	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.6	125.8	159.9	179.4	0	0	0	0	107.8	R36	V34-R36 PolarHBondContact O-N 3.03Å
35	G	29.8	Very low	30.2	Very low	71 Å²	71	153 Å²	153	73%	0.732	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-52.1	127.5	-169.2	0	0	0	0	0	114.1
36	R	29.8	Very low	30.6	Very low	231 Å²	231	148 Å²	148	87%	0.872	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.8	134	162	-66.1	-176.8	-178.9	-158.5	-0	108	V34	V34-R36 PolarHBondContact O-N 3.03Å
37	P	30.6	Very low	30.8	Very low	116 Å²	116	145.1 Å²	145.1	75%	0.753	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-62.8	143	163	26.5	-29	0	0	0	109
38	S	27.3	Very low	30.9	Very low	79 Å²	79	143 Å²	143	55%	0.552	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-56.8	143.9	-176	44.1	0	0	0	0	112.4	E40 Y41	S38-E40 PolarHBondContact O-N 3.3Å; S38-Y41 PolarHBondContact O-N 3.17Å
39	L	30.5	Very low	30.8	Very low	145 Å²	145	146.9 Å²	146.9	76%	0.759	77%	0.768	S	S	*	*	G	3₁₀ helix	trans	-62.2	-0.7	177.5	-105.1	93.7	0	0	0	114.6	Y41	L39-Y41 VanDerWaalsContact C-N 3.31Å
40	E	28.4	Very low	31.7	Very low	175 Å²	175	136.9 Å²	136.9	82%	0.818	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-78	-11.1	174	-80	-175.7	145.3	0	0	113.7	S38	S38-E40 PolarHBondContact O-N 3.3Å
41	Y	34.1	Very low	33.3	Very low	209 Å²	209	126.4 Å²	126.4	82%	0.82	71%	0.714	S	S	*	*	G	3₁₀ helix	trans	-90.7	-2.8	178.8	-118.3	-94.6	0	0	0	114.8	S38 L39	S38-Y41 PolarHBondContact O-N 3.17Å; L39-Y41 VanDerWaalsContact C-N 3.31Å
42	C	28.2	Very low	35.5	Very low	119 Å²	119	122.3 Å²	122.3	80%	0.804	69%	0.688	S	S	*	*	S	Bend	trans	-112.3	15.2	-175.5	-108.8	0	0	0	0	114.1
43	L	28.8	Very low	38.1	Very low	124 Å²	124	114.4 Å²	114.4	65%	0.649	65%	0.652	S	S	*	*			trans	-128.3	46	-172.8	-111.6	123.5	0	0	0	113.4	I46	L43-I46 HydrophobicContact CD2-CD1 3.78Å
44	S	32.4	Very low	40.6	Very low	112 Å²	112	112.3 Å²	112.3	78%	0.783	64%	0.64	S	S	*	*	S	Bend	trans	-116.8	6.5	166.9	65.4	0	0	0	0	114.7
45	V	36.5	Very low	43.4	Very low	96 Å²	96	108.1 Å²	108.1	58%	0.582	62%	0.621	S	S	*	*			trans	-128.5	71.5	173.6	-167.5	0	0	0	0	109.5	L47	V45-L47 HydrophobicContact CG1-CD1 4.08Å; V45-L47 HydrophobicContact CG1-CG 4.13Å
46	I	35	Very low	46.3	Very low	135 Å²	135	105.4 Å²	105.4	69%	0.692	59%	0.593	S	S	*	*			trans	-100.2	97.6	159	-63.5	-179.3	0	0	0	106.2	L43 N48	L43-I46 HydrophobicContact CD2-CD1 3.78Å; I46-N48 PolarHBondContact O-N 3.1Å
47	L	32.8	Very low	49.3	Very low	64 Å²	64	102.7 Å²	102.7	34%	0.335	59%	0.59	S	S	.	*			trans	-69.3	117.2	172.6	-77.6	149.4	0	0	0	109.5	V7 G8 V45	V7-L47 HydrophobicContact CB-CD2 3.99Å; V7-L47 HydrophobicContact CG1-CD1 3.95Å; V7-L47 HydrophobicContact CG1-CD2 3.66Å; V7-L47 HydrophobicContact CG1-CG 4.37Å; G8-L47 VanDerWaalsContact O-CD1 3.28Å; G8-L47 WeakPolarHBondContact O-CD1 3.48Å; V45-L47 HydrophobicContact CG1-CD1 4.08Å; V45-L47 HydrophobicContact CG1-CG 4.13Å
48	N	28	Very low	52.5	Low	142 Å²	142	100.9 Å²	100.9	76%	0.759	57%	0.574	S	S	*	*			trans	-120.7	126.7	153.5	-104	-7.4	0	0	0	107.4	I46 G50	I46-N48 PolarHBondContact O-N 3.1Å; N48-G50 PolarHBondContact O-N 2.96Å
49	M	38.3	Very low	55.8	Low	187 Å²	187	97.5 Å²	97.5	92%	0.921	55%	0.549	S	S	*	.	S	Bend	trans	-4.9	90	172.4	-66.6	-73	157.9	0	0	115.9
50	G	47	Very low	58.9	Low	46 Å²	46	94.3 Å²	94.3	47%	0.474	53%	0.533	S	S	.	.	S	Bend	trans	116.8	114.9	167.6	0	0	0	0	0	115	N48	N48-G50 PolarHBondContact O-N 2.96Å
51	G	59.8	Low	62.2	Low	28 Å²	28	89.3 Å²	89.3	29%	0.289	51%	0.51	S	S	.	.			trans	75.2	119.3	172.5	0	0	0	0	0	115.3	D101	G51-D101 VanDerWaalsContact CA-O 3.29Å; G51-D101 WeakPolarHBondContact CA-O 3.48Å
52	A	74.3	Confident	65.2	Low	39 Å²	39	79.4 Å²	79.4	32%	0.322	47%	0.471	S	S	.	.	S	Bend	trans	-75.1	-21	163.3	0	0	0	0	0	111.7	V7 Y71 D101 C115	V7-A52 HydrophobicContact CG2-CB 4.32Å; A52-Y71 HydrophobicContact CB-CE2 3.78Å; A52-Y71 WeakPolarHBondContact CB-OH 3.46Å; A52-D101 WeakPolarHBondContact CA-OD2 3.11Å; A52-D101 VanDerWaalsContact CB-OD2 3.26Å; A52-D101 WeakPolarHBondContact CB-OD2 3.48Å; A52-D101 PolarHBondContact N-OD2 2.92Å; A52-C115 HydrophobicContact CB-CB 4.32Å
53	V	84.9	Confident	68.6	Low	22 Å²	22	73.8 Å²	73.8	13%	0.133	43%	0.433	C	S	.	.	S	Bend	trans	-132.2	163.5	174.8	-58.1	0	0	0	0	111.6	N65 L66 A69 Y71 D101	V53-N65 HydrophobicContact CB-CB 4.26Å; V53-N65 HydrophobicContact CG2-CB 4.34Å; V53-L66 HydrophobicContact CG1-CD2 4.23Å; V53-L66 HydrophobicContact CG2-CD2 3.74Å; V53-L66 HydrophobicContact CG2-CG 4.16Å; V53-A69 HydrophobicContact CG1-CB 3.4Å; V53-Y71 HydrophobicContact CG1-CD2 3.98Å; V53-Y71 HydrophobicContact CG1-CE2 4.02Å; V53-D101 HydrophobicContact CG2-CB 3.54Å; V53-D101 PolarHBondContact N-OD2 2.73Å
54	S	84.6	Confident	71.8	Confident	74 Å²	74	71.1 Å²	71.1	52%	0.517	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-64.4	150.7	173.4	44.5	0	0	0	0	112.2	N65	S54-N65 PolarHBondContact O-ND2 2.79Å; S54-N65 VanDerWaalsContact O-ND2 3.07Å; S54-N65 PolarHBondContact OG-ND2 3.44Å; S54-N65 VanDerWaalsContact OG-ND2 3.13Å
55	A	89.6	Confident	74.9	Confident	56 Å²	56	66.8 Å²	66.8	46%	0.463	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-64.9	143.6	171	0	0	0	0	0	110.9	Y99 K100	A55-Y99 WeakPolarHBondContact CA-O 3.45Å; A55-K100 HydrophobicContact CB-CB 4.46Å; A55-K100 HydrophobicContact CB-CG 3.89Å
56	G	91.9	Very high	77.8	Confident	14 Å²	14	62.2 Å²	62.2	14%	0.144	36%	0.36	C	S	.	.	P	Polyproline II helix	trans	-93.6	157.6	168.3	0	0	0	0	0	111.9	D58 Y99	G56-D58 VanDerWaalsContact C-N 3.31Å; G56-Y99 PolarHBondContact N-O 3.25Å; G56-Y99 WeakPolarHBondContact O-CB 3.34Å
57	E	93.2	Very high	80.7	Confident	175 Å²	175	59 Å²	59	82%	0.818	34%	0.341	S	S	*	.	S	Bend	trans	-69.9	-32	167.7	-66	-178.6	172	0	0	111	E61 Y99	E57-E61 VanDerWaalsContact CB-OE2 3.25Å; E57-E61 WeakPolarHBondContact CB-OE2 3.3Å; E57-E61 WeakPolarHBondContact CG-OE2 3.4Å; E57-E61 PolarHBondContact N-OE2 2.86Å; E57-Y99 WeakPolarHBondContact O-CD2 3.34Å
58	D	96.2	Very high	83.8	Confident	77 Å²	77	63.4 Å²	63.4	41%	0.412	36%	0.36	S	S	.	.	S	Bend	trans	-140.6	-177.7	176.1	64	32.5	0	0	0	112.6	G56 D60 E61 L62	G56-D58 VanDerWaalsContact C-N 3.31Å; D58-D60 VanDerWaalsContact C-N 3.32Å; D58-D60 PolarHBondContact O-N 3.3Å; D58-D60 WeakPolarHBondContact OD1-CA 3.47Å; D58-D60 PolarHBondContact OD1-N 3.28Å; D58-E61 PolarHBondContact OD1-N 3.47Å; D58-L62 PolarHBondContact O-N 2.81Å; D58-L62 VanDerWaalsContact O-N 3.15Å
59	N	96.6	Very high	86.9	Confident	8 Å²	8	58.9 Å²	58.9	4%	0.043	34%	0.342	C	S	.	.	H	α-helix	trans	-62.4	-39.1	178.7	-170	74	0	0	0	111.8	L62 I63 F81 R86 Y99	N59-L62 WeakPolarHBondContact O-CB 3Å; N59-L62 PolarHBondContact O-N 3.03Å; N59-I63 WeakPolarHBondContact O-CG1 3.34Å; N59-I63 PolarHBondContact O-N 3.18Å; N59-F81 PolarHBondContact ND2-O 3.09Å; N59-R86 PolarHBondContact OD1-N 2.86Å; N59-Y99 HydrophobicContact CB-CD1 4.26Å; N59-Y99 HydrophobicContact CB-CE1 3.86Å
60	D	96.9	Very high	89.6	Confident	79 Å²	79	56 Å²	56	42%	0.422	33%	0.326	S	S	.	.	H	α-helix	trans	-68.9	-40.2	-176.1	-85.6	-36.3	0	0	0	112.1	D58 I63 D64 R82	D58-D60 VanDerWaalsContact C-N 3.32Å; D58-D60 PolarHBondContact O-N 3.3Å; D58-D60 WeakPolarHBondContact OD1-CA 3.47Å; D58-D60 PolarHBondContact OD1-N 3.28Å; D60-I63 PolarHBondContact O-N 3.36Å; D60-D64 PolarHBondContact O-N 2.69Å; D60-R82 PolarHBondContact O-NH1 2.86Å; D60-R82 WeakPolarHBondContact OD1-CD 3.43Å; D60-R82 WeakPolarHBondContact OD1-CG 3.41Å; D60-R82 IonicContact OD1-CZ 3.75Å; D60-R82 IonicContact OD1-NE 2.96Å; D60-R82 IonicContact OD1-NH1 2.66Å; D60-R82 PolarHBondContact OD1-NH1 3.34Å
61	E	97.5	Very high	91.9	Very high	70 Å²	70	55.5 Å²	55.5	33%	0.327	31%	0.31	S	S	.	.	H	α-helix	trans	-67.8	-37.1	174.3	-171.5	178.4	-167.3	0	0	111.7	E57 D58 I63 D64 N65	E57-E61 VanDerWaalsContact CB-OE2 3.25Å; E57-E61 WeakPolarHBondContact CB-OE2 3.3Å; E57-E61 WeakPolarHBondContact CG-OE2 3.4Å; E57-E61 PolarHBondContact N-OE2 2.86Å; D58-E61 PolarHBondContact OD1-N 3.47Å; E61-I63 VanDerWaalsContact C-N 3.29Å; E61-I63 PolarHBondContact O-N 3.48Å; E61-D64 PolarHBondContact O-N 3.38Å; E61-N65 VanDerWaalsContact O-CG 3.26Å; E61-N65 PolarHBondContact O-N 2.76Å; E61-N65 PolarHBondContact O-ND2 2.99Å
62	L	97.4	Very high	93.7	Very high	1 Å²	1	54.4 Å²	54.4	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-58.2	-44	170.8	172.8	66.5	0	0	0	111	D58 N59 N65 L66 P114	D58-L62 PolarHBondContact O-N 2.81Å; D58-L62 VanDerWaalsContact O-N 3.15Å; N59-L62 WeakPolarHBondContact O-CB 3Å; N59-L62 PolarHBondContact O-N 3.03Å; L62-N65 PolarHBondContact O-N 3.28Å; L62-L66 HydrophobicContact CD1-CD1 4.31Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CG 3.39Å; L62-L66 PolarHBondContact O-N 3.01Å; L62-L66 VanDerWaalsContact O-N 3.08Å; L62-P114 HydrophobicContact CD1-CB 4.41Å; L62-P114 HydrophobicContact CD1-CG 4.26Å; L62-P114 HydrophobicContact CD2-CB 4.23Å; L62-P114 HydrophobicContact CD2-CG 3.87Å
63	I	97.9	Very high	94.8	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-66.7	-40.5	179.2	-58.8	-28.5	0	0	0	110.6	N59 D60 E61 N65 L66 K67 I72 E78 F81 R82	N59-I63 WeakPolarHBondContact O-CG1 3.34Å; N59-I63 PolarHBondContact O-N 3.18Å; D60-I63 PolarHBondContact O-N 3.36Å; E61-I63 VanDerWaalsContact C-N 3.29Å; E61-I63 PolarHBondContact O-N 3.48Å; I63-N65 PolarHBondContact O-N 3Å; I63-L66 HydrophobicContact CD1-CD1 4.22Å; I63-L66 PolarHBondContact O-N 3.13Å; I63-K67 HydrophobicContact CG2-CD 4.31Å; I63-K67 HydrophobicContact CG2-CG 4.46Å; I63-K67 WeakPolarHBondContact O-CG 2.94Å; I63-K67 PolarHBondContact O-N 3.28Å; I63-I72 HydrophobicContact CG2-CD1 3.88Å; I63-E78 HydrophobicContact CG2-CG 4.2Å; I63-F81 HydrophobicContact CD1-CB 3.69Å; I63-F81 HydrophobicContact CD1-CD1 3.63Å; I63-F81 HydrophobicContact CD1-CG 4.07Å; I63-F81 HydrophobicContact CG1-CB 3.97Å; I63-F81 HydrophobicContact CG2-CB 4.48Å; I63-R82 HydrophobicContact CB-CG 4.25Å; I63-R82 HydrophobicContact CG1-CG 4.07Å; I63-R82 HydrophobicContact CG2-CG 4Å
64	D	97.7	Very high	95.4	Very high	68 Å²	68	60.3 Å²	60.3	36%	0.364	32%	0.316	S	S	.	.	H	α-helix	trans	-57.9	-47.9	174.9	-75.5	-23.8	0	0	0	111.3	D60 E61 L66 K67 E68 R82	D60-D64 PolarHBondContact O-N 2.69Å; E61-D64 PolarHBondContact O-N 3.38Å; D64-L66 VanDerWaalsContact C-N 3.32Å; D64-L66 PolarHBondContact O-N 3.29Å; D64-K67 WeakPolarHBondContact O-CB 3.15Å; D64-K67 PolarHBondContact O-N 3.06Å; D64-K67 VanDerWaalsContact O-N 3.13Å; D64-E68 WeakPolarHBondContact O-CG 3.29Å; D64-E68 PolarHBondContact O-N 3.48Å; D64-R82 IonicContact OD1-CZ 3.7Å; D64-R82 IonicContact OD1-NH1 3.94Å; D64-R82 IonicContact OD1-NH2 3.95Å; D64-R82 PolarHBondContact OD1-NH2 2.83Å
65	N	96.6	Very high	96	Very high	22 Å²	22	62.3 Å²	62.3	12%	0.118	32%	0.317	C	S	.	.	H	α-helix	trans	-59.3	-41.3	177	-68.8	-20.2	0	0	0	112.1	V53 S54 E61 L62 I63 E68 A69	V53-N65 HydrophobicContact CB-CB 4.26Å; V53-N65 HydrophobicContact CG2-CB 4.34Å; S54-N65 PolarHBondContact O-ND2 2.79Å; S54-N65 VanDerWaalsContact O-ND2 3.07Å; S54-N65 PolarHBondContact OG-ND2 3.44Å; S54-N65 VanDerWaalsContact OG-ND2 3.13Å; E61-N65 VanDerWaalsContact O-CG 3.26Å; E61-N65 PolarHBondContact O-N 2.76Å; E61-N65 PolarHBondContact O-ND2 2.99Å; L62-N65 PolarHBondContact O-N 3.28Å; I63-N65 PolarHBondContact O-N 3Å; N65-E68 PolarHBondContact O-N 3.04Å; N65-A69 WeakPolarHBondContact O-CB 3.3Å; N65-A69 PolarHBondContact O-N 3.14Å
66	L	96.9	Very high	96.3	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-66.9	-34.4	177.1	-70.9	166.8	0	0	0	112.7	V53 L62 I63 D64 Q70 Y71 I72 P114 C115	V53-L66 HydrophobicContact CG1-CD2 4.23Å; V53-L66 HydrophobicContact CG2-CD2 3.74Å; V53-L66 HydrophobicContact CG2-CG 4.16Å; L62-L66 HydrophobicContact CD1-CD1 4.31Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 WeakPolarHBondContact O-CG 3.39Å; L62-L66 PolarHBondContact O-N 3.01Å; L62-L66 VanDerWaalsContact O-N 3.08Å; I63-L66 HydrophobicContact CD1-CD1 4.22Å; I63-L66 PolarHBondContact O-N 3.13Å; D64-L66 VanDerWaalsContact C-N 3.32Å; D64-L66 PolarHBondContact O-N 3.29Å; L66-Q70 PolarHBondContact O-N 3.41Å; L66-Y71 HydrophobicContact CD2-CD2 4.21Å; L66-Y71 HydrophobicContact CD2-CG 4.42Å; L66-Y71 WeakPolarHBondContact O-CB 3.42Å; L66-Y71 PolarHBondContact O-N 3.32Å; L66-I72 HydrophobicContact CB-CD1 3.83Å; L66-I72 HydrophobicContact CB-CG1 4.09Å; L66-I72 HydrophobicContact CD1-CD1 4.06Å; L66-I72 PolarHBondContact O-N 3.37Å; L66-P114 HydrophobicContact CD1-CB 3.68Å; L66-P114 HydrophobicContact CD2-CB 4.37Å; L66-C115 HydrophobicContact CD2-CB 3.98Å
67	K	96.9	Very high	96.6	Very high	66 Å²	66	62.7 Å²	62.7	29%	0.287	31%	0.308	S	S	.	.	H	α-helix	trans	-71.2	-45.9	174.7	-73.9	177.5	68.7	-174.6	0	112	I63 D64 A69 Q70 I72 E78	I63-K67 HydrophobicContact CG2-CD 4.31Å; I63-K67 HydrophobicContact CG2-CG 4.46Å; I63-K67 WeakPolarHBondContact O-CG 2.94Å; I63-K67 PolarHBondContact O-N 3.28Å; D64-K67 WeakPolarHBondContact O-CB 3.15Å; D64-K67 PolarHBondContact O-N 3.06Å; D64-K67 VanDerWaalsContact O-N 3.13Å; K67-A69 PolarHBondContact O-N 3.32Å; K67-Q70 PolarHBondContact O-N 3.01Å; K67-Q70 PolarHBondContact O-NE2 2.66Å; K67-I72 HydrophobicContact CG-CB 3.83Å; K67-I72 HydrophobicContact CG-CG2 3.89Å; K67-E78 HydrophobicContact CD-CG 4Å; K67-E78 VanDerWaalsContact CD-OE1 3.32Å; K67-E78 WeakPolarHBondContact CD-OE1 3.4Å; K67-E78 WeakPolarHBondContact CD-OE2 3.31Å; K67-E78 VanDerWaalsContact CE-CD 3.43Å; K67-E78 WeakPolarHBondContact CE-OE1 3.42Å; K67-E78 WeakPolarHBondContact CE-OE2 3.24Å; K67-E78 IonicContact NZ-OE1 3Å; K67-E78 PolarHBondContact NZ-OE1 2.75Å; K67-E78 IonicContact NZ-OE2 3.74Å; K67-E78 PolarHBondContact NZ-OE2 2.9Å
68	E	96.4	Very high	96.8	Very high	158 Å²	158	55.3 Å²	55.3	74%	0.738	27%	0.274	S	S	*	.	H	α-helix	trans	-58.1	-39.6	176.7	-72.6	-170.9	171.7	0	0	110.8	D64 N65 Q70	D64-E68 WeakPolarHBondContact O-CG 3.29Å; D64-E68 PolarHBondContact O-N 3.48Å; N65-E68 PolarHBondContact O-N 3.04Å; E68-Q70 PolarHBondContact O-N 3.46Å
69	A	93.8	Very high	96.9	Very high	46 Å²	46	55.2 Å²	55.2	38%	0.38	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.5	3.9	175	0	0	0	0	0	115.2	V53 N65 K67 Y71	V53-A69 HydrophobicContact CG1-CB 3.4Å; N65-A69 WeakPolarHBondContact O-CB 3.3Å; N65-A69 PolarHBondContact O-N 3.14Å; K67-A69 PolarHBondContact O-N 3.32Å; A69-Y71 VanDerWaalsContact C-N 3.26Å; A69-Y71 HydrophobicContact CB-CD2 3.74Å; A69-Y71 HydrophobicContact CB-CE2 4.03Å; A69-Y71 PolarHBondContact O-N 3.15Å
70	Q	95.1	Very high	96.9	Very high	126 Å²	126	54.9 Å²	54.9	59%	0.589	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.6	21.3	177.4	-58.6	-66.6	-70.4	0	0	115.7	L66 K67 E68 R73	L66-Q70 PolarHBondContact O-N 3.41Å; K67-Q70 PolarHBondContact O-N 3.01Å; K67-Q70 PolarHBondContact O-NE2 2.66Å; E68-Q70 PolarHBondContact O-N 3.46Å; Q70-R73 WeakPolarHBondContact O-CG 3.44Å; Q70-R73 PolarHBondContact O-NE 3.24Å
71	Y	95.8	Very high	96.9	Very high	37 Å²	37	51.2 Å²	51.2	15%	0.145	25%	0.249	C	C	.	.	S	Bend	trans	-77.1	-39	170	-74.7	-69.9	0	0	0	111.8	A52 V53 L66 A69 C115 S118 E119	A52-Y71 HydrophobicContact CB-CE2 3.78Å; A52-Y71 WeakPolarHBondContact CB-OH 3.46Å; V53-Y71 HydrophobicContact CG1-CD2 3.98Å; V53-Y71 HydrophobicContact CG1-CE2 4.02Å; L66-Y71 HydrophobicContact CD2-CD2 4.21Å; L66-Y71 HydrophobicContact CD2-CG 4.42Å; L66-Y71 WeakPolarHBondContact O-CB 3.42Å; L66-Y71 PolarHBondContact O-N 3.32Å; A69-Y71 VanDerWaalsContact C-N 3.26Å; A69-Y71 HydrophobicContact CB-CD2 3.74Å; A69-Y71 HydrophobicContact CB-CE2 4.03Å; A69-Y71 PolarHBondContact O-N 3.15Å; Y71-C115 HydrophobicContact CD1-CB 3.97Å; Y71-C115 HydrophobicContact CD2-CB 4.17Å; Y71-C115 HydrophobicContact CE1-CB 4.02Å; Y71-C115 HydrophobicContact CE2-CB 4.24Å; Y71-C115 HydrophobicContact CG-CB 4.05Å; Y71-S118 WeakPolarHBondContact O-CB 3.3Å; Y71-E119 HydrophobicContact CD1-CG 3.75Å; Y71-E119 WeakPolarHBondContact CD1-OE1 3.37Å; Y71-E119 HydrophobicContact CE1-CG 4.22Å
72	I	97.8	Very high	96.9	Very high	4 Å²	4	51 Å²	51	2%	0.021	25%	0.245	C	C	.	.			trans	-103.3	125.5	171.5	-63.5	173.9	0	0	0	108	I63 L66 K67 V77 E78 F81 S118	I63-I72 HydrophobicContact CG2-CD1 3.88Å; L66-I72 HydrophobicContact CB-CD1 3.83Å; L66-I72 HydrophobicContact CB-CG1 4.09Å; L66-I72 HydrophobicContact CD1-CD1 4.06Å; L66-I72 PolarHBondContact O-N 3.37Å; K67-I72 HydrophobicContact CG-CB 3.83Å; K67-I72 HydrophobicContact CG-CG2 3.89Å; I72-V77 HydrophobicContact CG1-CG1 4.32Å; I72-V77 HydrophobicContact CG2-CB 4.44Å; I72-V77 HydrophobicContact CG2-CG1 4.14Å; I72-E78 HydrophobicContact CG2-CB 3.81Å; I72-F81 HydrophobicContact CD1-CB 4.26Å; I72-F81 HydrophobicContact CD1-CD1 4.32Å; I72-F81 HydrophobicContact CD1-CD2 4.09Å; I72-F81 HydrophobicContact CD1-CE2 4.48Å; I72-F81 HydrophobicContact CD1-CG 3.98Å; I72-S118 WeakPolarHBondContact CG1-OG 3.37Å
73	R	97.1	Very high	96.8	Very high	124 Å²	124	51.2 Å²	51.2	47%	0.468	25%	0.247	S	C	.	.			trans	-127.8	-29.7	-169.9	-49.5	178.8	-153.9	111.1	-0.2	112.2	Q70 E119 E122	Q70-R73 WeakPolarHBondContact O-CG 3.44Å; Q70-R73 PolarHBondContact O-NE 3.24Å; R73-E119 IonicContact CZ-OE1 3.3Å; R73-E119 IonicContact CZ-OE2 3.29Å; R73-E119 IonicContact NH2-OE1 3.13Å; R73-E119 PolarHBondContact NH2-OE1 3.23Å; R73-E119 IonicContact NH2-OE2 2.65Å; R73-E119 PolarHBondContact NH2-OE2 3.41Å; R73-E122 PolarHBondContact N-OE1 3.29Å; R73-E122 IonicContact NH1-OE2 2.78Å
74	T	97.8	Very high	96.8	Very high	62 Å²	62	51.2 Å²	51.2	38%	0.38	25%	0.247	S	C	.	.	S	Bend	trans	-103.6	143.1	-177.6	59.5	0	0	0	0	111.7	L76 V77 E78 E122	T74-L76 VanDerWaalsContact C-N 3.28Å; T74-L76 PolarHBondContact O-N 2.88Å; T74-V77 PolarHBondContact O-N 2.88Å; T74-V77 WeakPolarHBondContact OG1-CB 3.17Å; T74-V77 WeakPolarHBondContact OG1-CG2 3.5Å; T74-E78 PolarHBondContact O-N 3.34Å; T74-E122 WeakPolarHBondContact CG2-OE2 3.13Å; T74-E122 PolarHBondContact N-OE1 3.18Å; T74-E122 PolarHBondContact OG1-OE1 2.93Å
75	E	96.6	Very high	96.7	Very high	115 Å²	115	50.3 Å²	50.3	54%	0.537	24%	0.243	S	C	.	.	H	α-helix	trans	-59	-39	178.9	-176	67	-150.6	0	0	112	V77 E78 Q79	E75-V77 PolarHBondContact O-N 3.31Å; E75-E78 PolarHBondContact O-N 2.95Å; E75-Q79 HydrophobicContact CG-CG 4.37Å; E75-Q79 VanDerWaalsContact CG-NE2 3.35Å; E75-Q79 WeakPolarHBondContact O-CB 3.49Å; E75-Q79 VanDerWaalsContact O-CG 3.25Å; E75-Q79 WeakPolarHBondContact O-CG 3.2Å; E75-Q79 PolarHBondContact O-N 3.16Å; E75-Q79 PolarHBondContact OE1-NE2 2.85Å
76	L	96.1	Very high	96.7	Very high	73 Å²	73	49.3 Å²	49.3	38%	0.382	24%	0.237	S	C	.	.	H	α-helix	trans	-62.5	-41.6	178.6	-70.7	176.2	0	0	0	112.1	T74 A80	T74-L76 VanDerWaalsContact C-N 3.28Å; T74-L76 PolarHBondContact O-N 2.88Å; L76-A80 WeakPolarHBondContact O-CB 3.35Å; L76-A80 PolarHBondContact O-N 2.56Å; L76-A80 VanDerWaalsContact O-N 3.16Å
77	V	98.1	Very high	96.7	Very high	5 Å²	5	49.5 Å²	49.5	3%	0.03	24%	0.239	C	C	.	.	H	α-helix	trans	-69.7	-45.9	178.1	174.4	0	0	0	0	110.1	I72 T74 E75 Q79 A80 F81 M121 I149	I72-V77 HydrophobicContact CG1-CG1 4.32Å; I72-V77 HydrophobicContact CG2-CB 4.44Å; I72-V77 HydrophobicContact CG2-CG1 4.14Å; T74-V77 PolarHBondContact O-N 2.88Å; T74-V77 WeakPolarHBondContact OG1-CB 3.17Å; T74-V77 WeakPolarHBondContact OG1-CG2 3.5Å; E75-V77 PolarHBondContact O-N 3.31Å; V77-Q79 PolarHBondContact O-N 3.27Å; V77-A80 PolarHBondContact O-N 2.97Å; V77-F81 HydrophobicContact CG1-CD2 3.73Å; V77-F81 HydrophobicContact CG1-CE2 3.81Å; V77-F81 WeakPolarHBondContact O-CD2 3.42Å; V77-F81 PolarHBondContact O-N 3.43Å; V77-M121 HydrophobicContact CG1-CB 4.03Å; V77-M121 HydrophobicContact CG1-CE 4.45Å; V77-M121 HydrophobicContact CG2-CB 3.99Å; V77-I149 HydrophobicContact CG2-CD1 4.49Å
78	E	98.1	Very high	96.7	Very high	21 Å²	21	48.3 Å²	48.3	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-54.4	-51.8	175	172.1	174.5	-166.3	0	0	111.9	I63 K67 I72 T74 E75 A80 F81 R82	I63-E78 HydrophobicContact CG2-CG 4.2Å; K67-E78 HydrophobicContact CD-CG 4Å; K67-E78 VanDerWaalsContact CD-OE1 3.32Å; K67-E78 WeakPolarHBondContact CD-OE1 3.4Å; K67-E78 WeakPolarHBondContact CD-OE2 3.31Å; K67-E78 VanDerWaalsContact CE-CD 3.43Å; K67-E78 WeakPolarHBondContact CE-OE1 3.42Å; K67-E78 WeakPolarHBondContact CE-OE2 3.24Å; K67-E78 IonicContact NZ-OE1 3Å; K67-E78 PolarHBondContact NZ-OE1 2.75Å; K67-E78 IonicContact NZ-OE2 3.74Å; K67-E78 PolarHBondContact NZ-OE2 2.9Å; I72-E78 HydrophobicContact CG2-CB 3.81Å; T74-E78 PolarHBondContact O-N 3.34Å; E75-E78 PolarHBondContact O-N 2.95Å; E78-A80 VanDerWaalsContact C-N 3.27Å; E78-A80 PolarHBondContact O-N 2.86Å; E78-F81 PolarHBondContact O-N 2.94Å; E78-R82 HydrophobicContact CG-CG 4.41Å; E78-R82 WeakPolarHBondContact O-CG 3.4Å; E78-R82 PolarHBondContact O-N 3.45Å; E78-R82 IonicContact OE1-CZ 2.67Å; E78-R82 IonicContact OE1-NE 3.65Å; E78-R82 PolarHBondContact OE1-NE 3.26Å; E78-R82 IonicContact OE1-NH2 3.82Å; E78-R82 PolarHBondContact OE1-NH2 3.33Å
79	Q	96.9	Very high	96.7	Very high	75 Å²	75	41 Å²	41	35%	0.35	20%	0.201	S	C	.	.	H	α-helix	trans	-59.9	-39.8	-178	-74.4	179.1	10	0	0	111.7	E75 V77 A83 F186	E75-Q79 HydrophobicContact CG-CG 4.37Å; E75-Q79 VanDerWaalsContact CG-NE2 3.35Å; E75-Q79 WeakPolarHBondContact O-CB 3.49Å; E75-Q79 VanDerWaalsContact O-CG 3.25Å; E75-Q79 WeakPolarHBondContact O-CG 3.2Å; E75-Q79 PolarHBondContact O-N 3.16Å; E75-Q79 PolarHBondContact OE1-NE2 2.85Å; V77-Q79 PolarHBondContact O-N 3.27Å; Q79-A83 WeakPolarHBondContact O-CB 3.41Å; Q79-A83 PolarHBondContact O-N 3.09Å; Q79-F186 HydrophobicContact CB-CE1 4.11Å; Q79-F186 HydrophobicContact CB-CZ 4.14Å
80	A	97.4	Very high	96.9	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.008	18%	0.183	C	C	.	.	H	α-helix	trans	-65.1	-42.8	176.9	0	0	0	0	0	112.4	L76 V77 E78 A83 I84 M121 M145 I149	L76-A80 WeakPolarHBondContact O-CB 3.35Å; L76-A80 PolarHBondContact O-N 2.56Å; L76-A80 VanDerWaalsContact O-N 3.16Å; V77-A80 PolarHBondContact O-N 2.97Å; E78-A80 VanDerWaalsContact C-N 3.27Å; E78-A80 PolarHBondContact O-N 2.86Å; A80-A83 PolarHBondContact O-N 2.94Å; A80-I84 PolarHBondContact O-N 2.9Å; A80-M121 HydrophobicContact CB-CE 3.96Å; A80-M145 HydrophobicContact CB-CB 4.29Å; A80-I149 HydrophobicContact CB-CD1 4.02Å; A80-I149 HydrophobicContact CB-CG1 3.96Å
81	F	97.8	Very high	96.8	Very high	1 Å²	1	34.5 Å²	34.5	0%	0.004	16%	0.164	C	C	.	.	H	α-helix	trans	-66	-37.5	177.6	-96.3	-91.9	0	0	0	113.1	N59 I63 I72 V77 E78 S118 M121 M145	N59-F81 PolarHBondContact ND2-O 3.09Å; I63-F81 HydrophobicContact CD1-CB 3.69Å; I63-F81 HydrophobicContact CD1-CD1 3.63Å; I63-F81 HydrophobicContact CD1-CG 4.07Å; I63-F81 HydrophobicContact CG1-CB 3.97Å; I63-F81 HydrophobicContact CG2-CB 4.48Å; I72-F81 HydrophobicContact CD1-CB 4.26Å; I72-F81 HydrophobicContact CD1-CD1 4.32Å; I72-F81 HydrophobicContact CD1-CD2 4.09Å; I72-F81 HydrophobicContact CD1-CE2 4.48Å; I72-F81 HydrophobicContact CD1-CG 3.98Å; V77-F81 HydrophobicContact CG1-CD2 3.73Å; V77-F81 HydrophobicContact CG1-CE2 3.81Å; V77-F81 WeakPolarHBondContact O-CD2 3.42Å; V77-F81 PolarHBondContact O-N 3.43Å; E78-F81 PolarHBondContact O-N 2.94Å; F81-S118 WeakPolarHBondContact CZ-OG 3.32Å; F81-M121 HydrophobicContact CD2-SD 3.98Å; F81-M121 HydrophobicContact CE2-CE 4.49Å; F81-M121 HydrophobicContact CE2-CG 4.46Å; F81-M121 HydrophobicContact CE2-SD 3.4Å; F81-M121 WeakPolarHBondContact CE2-SD 3.44Å; F81-M121 HydrophobicContact CZ-SD 4.22Å; F81-M145 HydrophobicContact CD1-SD 3.92Å; F81-M145 HydrophobicContact CD2-SD 3.91Å; F81-M145 HydrophobicContact CE1-CE 4.28Å; F81-M145 HydrophobicContact CE1-SD 4.09Å; F81-M145 HydrophobicContact CE2-CE 4.32Å; F81-M145 HydrophobicContact CE2-SD 4.09Å; F81-M145 HydrophobicContact CG-SD 3.85Å; F81-M145 HydrophobicContact CZ-CE 4.09Å; F81-M145 HydrophobicContact CZ-SD 4.17Å
82	R	97.1	Very high	96.7	Very high	66 Å²	66	39.1 Å²	39.1	25%	0.249	19%	0.187	C	C	.	.	H	α-helix	trans	-72.5	-31.7	174.7	-66.7	-169.8	-173.8	-76.5	-2	112.8	D60 I63 D64 E78 I84	D60-R82 PolarHBondContact O-NH1 2.86Å; D60-R82 WeakPolarHBondContact OD1-CD 3.43Å; D60-R82 WeakPolarHBondContact OD1-CG 3.41Å; D60-R82 IonicContact OD1-CZ 3.75Å; D60-R82 IonicContact OD1-NE 2.96Å; D60-R82 IonicContact OD1-NH1 2.66Å; D60-R82 PolarHBondContact OD1-NH1 3.34Å; I63-R82 HydrophobicContact CB-CG 4.25Å; I63-R82 HydrophobicContact CG1-CG 4.07Å; I63-R82 HydrophobicContact CG2-CG 4Å; D64-R82 IonicContact OD1-CZ 3.7Å; D64-R82 IonicContact OD1-NH1 3.94Å; D64-R82 IonicContact OD1-NH2 3.95Å; D64-R82 PolarHBondContact OD1-NH2 2.83Å; E78-R82 HydrophobicContact CG-CG 4.41Å; E78-R82 WeakPolarHBondContact O-CG 3.4Å; E78-R82 PolarHBondContact O-N 3.45Å; E78-R82 IonicContact OE1-CZ 2.67Å; E78-R82 IonicContact OE1-NE 3.65Å; E78-R82 PolarHBondContact OE1-NE 3.26Å; E78-R82 IonicContact OE1-NH2 3.82Å; E78-R82 PolarHBondContact OE1-NH2 3.33Å; R82-I84 VanDerWaalsContact C-N 3.32Å; R82-I84 PolarHBondContact O-N 2.93Å
83	A	95.8	Very high	96.5	Very high	5 Å²	5	44.6 Å²	44.6	4%	0.041	21%	0.213	C	C	.	.	H	α-helix	trans	-72.2	-26.8	-176.3	0	0	0	0	0	113.6	Q79 A80 L148 S182 F186	Q79-A83 WeakPolarHBondContact O-CB 3.41Å; Q79-A83 PolarHBondContact O-N 3.09Å; A80-A83 PolarHBondContact O-N 2.94Å; A83-L148 HydrophobicContact CB-CD1 3.43Å; A83-L148 VanDerWaalsContact CB-CD1 3.43Å; A83-S182 WeakPolarHBondContact O-CB 3.39Å; A83-S182 PolarHBondContact O-OG 2.99Å; A83-F186 HydrophobicContact CB-CD2 3.89Å; A83-F186 HydrophobicContact CB-CE2 3.3Å; A83-F186 HydrophobicContact CB-CZ 3.77Å
84	I	96.4	Very high	96.4	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.005	20%	0.201	C	C	.	.	S	Bend	trans	-117.7	106.2	-178.1	-53.1	-162.4	0	0	0	108.8	A80 R82 R86 Y89 Y141 S144 M145 L148 F176	A80-I84 PolarHBondContact O-N 2.9Å; R82-I84 VanDerWaalsContact C-N 3.32Å; R82-I84 PolarHBondContact O-N 2.93Å; I84-R86 PolarHBondContact O-N 2.78Å; I84-Y89 HydrophobicContact CG2-CD2 4.07Å; I84-Y89 HydrophobicContact CG2-CE2 3.31Å; I84-Y141 HydrophobicContact CB-CE2 4.36Å; I84-Y141 HydrophobicContact CG2-CD2 3.92Å; I84-Y141 HydrophobicContact CG2-CE2 3.76Å; I84-S144 WeakPolarHBondContact CD1-O 3.49Å; I84-M145 HydrophobicContact CB-CG 4.03Å; I84-M145 HydrophobicContact CD1-CB 4.34Å; I84-M145 HydrophobicContact CD1-CG 3.84Å; I84-M145 VanDerWaalsContact CD1-N 3.3Å; I84-M145 HydrophobicContact CG1-CG 4.14Å; I84-L148 HydrophobicContact CD1-CD1 3.7Å; I84-L148 HydrophobicContact CD1-CG 4.21Å; I84-L148 HydrophobicContact CG1-CD1 3.52Å; I84-F176 HydrophobicContact CD1-CE2 4.43Å; I84-F176 HydrophobicContact CD1-CZ 4.33Å; I84-F176 HydrophobicContact CG1-CE2 4.03Å; I84-F176 HydrophobicContact CG1-CZ 4.26Å
85	D	96.8	Very high	96.2	Very high	49 Å²	49	41 Å²	41	26%	0.262	20%	0.195	S	C	.	.			trans	-65.4	123.5	176.8	-166.1	-38.7	0	0	0	110.1	A87 D88 Y99	D85-A87 VanDerWaalsContact C-N 3.26Å; D85-A87 PolarHBondContact O-N 2.91Å; D85-A87 WeakPolarHBondContact OD1-CB 3.47Å; D85-A87 PolarHBondContact OD1-N 3.08Å; D85-D88 WeakPolarHBondContact O-CB 3.45Å; D85-D88 PolarHBondContact O-N 2.81Å; D85-Y99 WeakPolarHBondContact OD1-CE1 3.44Å; D85-Y99 PolarHBondContact OD1-OH 2.83Å; D85-Y99 PolarHBondContact OD2-OH 3.09Å
86	R	97.1	Very high	96	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	20%	0.203	C	C	.	.	G	3₁₀ helix	trans	-60.5	-34.6	177.6	-176.7	170	169.4	95.4	1.1	112.8	N59 I84 D88 Y89 Y90 A98 L102 L111 S112 Y141	N59-R86 PolarHBondContact OD1-N 2.86Å; I84-R86 PolarHBondContact O-N 2.78Å; R86-D88 PolarHBondContact O-N 2.88Å; R86-Y89 PolarHBondContact O-N 3.47Å; R86-Y89 VanDerWaalsContact O-N 3.14Å; R86-Y90 HydrophobicContact CG-CE2 4.08Å; R86-Y90 PolarHBondContact NH2-OH 3.49Å; R86-Y90 WeakPolarHBondContact O-CD2 3.07Å; R86-A98 WeakPolarHBondContact CD-O 3.36Å; R86-A98 PolarHBondContact NE-O 2.85Å; R86-A98 VanDerWaalsContact NE-O 3.09Å; R86-L102 PolarHBondContact NH2-O 2.89Å; R86-L111 HydrophobicContact CG-CD2 4.4Å; R86-S112 VanDerWaalsContact CZ-O 3.28Å; R86-S112 PolarHBondContact NH1-O 3.04Å; R86-S112 PolarHBondContact NH2-O 3.2Å; R86-Y141 HydrophobicContact CB-CE2 4.1Å; R86-Y141 HydrophobicContact CG-CE1 4.5Å; R86-Y141 HydrophobicContact CG-CE2 4.46Å
87	A	96.9	Very high	95.8	Very high	5 Å²	5	41.1 Å²	41.1	4%	0.041	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-65.7	-27.9	-179.5	0	0	0	0	0	112.6	D85 Y89 Y90 K95 A98 Y99	D85-A87 VanDerWaalsContact C-N 3.26Å; D85-A87 PolarHBondContact O-N 2.91Å; D85-A87 WeakPolarHBondContact OD1-CB 3.47Å; D85-A87 PolarHBondContact OD1-N 3.08Å; A87-Y89 PolarHBondContact O-N 3.44Å; A87-Y90 PolarHBondContact O-N 3.16Å; A87-Y90 VanDerWaalsContact O-N 3.12Å; A87-K95 HydrophobicContact CB-CD 4.48Å; A87-K95 HydrophobicContact CB-CG 4.34Å; A87-K95 WeakPolarHBondContact O-CE 3.43Å; A87-A98 VanDerWaalsContact CA-CB 3.48Å; A87-A98 HydrophobicContact CB-CB 3.58Å; A87-Y99 HydrophobicContact CB-CE1 3.82Å; A87-Y99 VanDerWaalsContact CB-OH 3.24Å; A87-Y99 WeakPolarHBondContact CB-OH 3.42Å
88	D	96.6	Very high	95.6	Very high	41 Å²	41	40.9 Å²	40.9	22%	0.219	19%	0.194	C	C	.	.	G	3₁₀ helix	trans	-63.7	-22.5	176	-75.8	-21.1	0	0	0	112.2	D85 R86 K172 F175	D85-D88 WeakPolarHBondContact O-CB 3.45Å; D85-D88 PolarHBondContact O-N 2.81Å; R86-D88 PolarHBondContact O-N 2.88Å; D88-K172 WeakPolarHBondContact O-CD 3.35Å; D88-K172 WeakPolarHBondContact O-CE 3.37Å; D88-K172 PolarHBondContact O-NZ 3.43Å; D88-F175 HydrophobicContact CB-CE1 4.31Å
89	Y	96.8	Very high	95.6	Very high	3 Å²	3	42.1 Å²	42.1	1%	0.012	20%	0.198	C	C	.	.	G	3₁₀ helix	trans	-94.5	-2.8	179.4	-72.2	-104.1	0	0	0	113.5	I84 R86 A87 T139 Y141 S144 Y168 K172	I84-Y89 HydrophobicContact CG2-CD2 4.07Å; I84-Y89 HydrophobicContact CG2-CE2 3.31Å; R86-Y89 PolarHBondContact O-N 3.47Å; R86-Y89 VanDerWaalsContact O-N 3.14Å; A87-Y89 PolarHBondContact O-N 3.44Å; Y89-T139 WeakPolarHBondContact CD1-O 3.34Å; Y89-Y141 HydrophobicContact CD1-CD2 4.21Å; Y89-Y141 HydrophobicContact CD1-CG 4.41Å; Y89-Y141 AromaticContact CD2-CD2 3.53Å; Y89-Y141 HydrophobicContact CD2-CD2 3.53Å; Y89-Y141 HydrophobicContact CD2-CE2 4.27Å; Y89-Y141 HydrophobicContact CD2-CG 4.45Å; Y89-Y141 VanDerWaalsContact CE1-CA 3.46Å; Y89-Y141 AromaticContact CE2-CD2 3.93Å; Y89-Y141 HydrophobicContact CE2-CD2 3.93Å; Y89-Y141 AromaticContact CG-CD2 3.69Å; Y89-Y141 HydrophobicContact CG-CD2 3.69Å; Y89-Y141 HydrophobicContact CG-CG 4.18Å; Y89-S144 WeakPolarHBondContact OH-CB 3.4Å; Y89-S144 PolarHBondContact OH-OG 2.97Å; Y89-Y168 WeakPolarHBondContact O-CE1 3.28Å; Y89-Y168 PolarHBondContact O-OH 2.91Å; Y89-K172 HydrophobicContact CD1-CB 3.84Å; Y89-K172 HydrophobicContact CD1-CG 4.21Å; Y89-K172 HydrophobicContact CE1-CB 3.75Å; Y89-K172 HydrophobicContact CG-CB 4.49Å
90	Y	96.1	Very high	95.4	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	20%	0.196	C	C	.	.	S	Bend	trans	-83.7	160.6	170.5	-86	-116.7	0	0	0	111.6	R86 A87 F94 N97 A98 W104 L111 Y168 K172	R86-Y90 HydrophobicContact CG-CE2 4.08Å; R86-Y90 PolarHBondContact NH2-OH 3.49Å; R86-Y90 WeakPolarHBondContact O-CD2 3.07Å; A87-Y90 PolarHBondContact O-N 3.16Å; A87-Y90 VanDerWaalsContact O-N 3.12Å; Y90-F94 HydrophobicContact CD1-CB 3.97Å; Y90-F94 VanDerWaalsContact CD1-O 3.31Å; Y90-F94 WeakPolarHBondContact CD1-O 3.43Å; Y90-N97 HydrophobicContact CE1-CB 4.23Å; Y90-N97 PolarHBondContact OH-O 2.68Å; Y90-A98 HydrophobicContact CD2-CB 3.93Å; Y90-A98 HydrophobicContact CE2-CB 3.99Å; Y90-A98 HydrophobicContact CG-CB 4.27Å; Y90-W104 AromaticContact CD1-CD2 3.77Å; Y90-W104 HydrophobicContact CD1-CD2 3.77Å; Y90-W104 AromaticContact CD1-CE2 3.97Å; Y90-W104 HydrophobicContact CD1-CE3 4.08Å; Y90-W104 HydrophobicContact CD1-CG 4.04Å; Y90-W104 HydrophobicContact CD1-CZ2 4.48Å; Y90-W104 HydrophobicContact CE1-CB 3.62Å; Y90-W104 AromaticContact CE1-CD1 3.69Å; Y90-W104 AromaticContact CE1-CD2 3.51Å; Y90-W104 HydrophobicContact CE1-CD2 3.51Å; Y90-W104 HydrophobicContact CE1-CE3 4.01Å; Y90-W104 AromaticContact CE1-CG 3.29Å; Y90-W104 HydrophobicContact CE1-CG 3.29Å; Y90-W104 HydrophobicContact CG-CE3 4.43Å; Y90-W104 AromaticContact CZ-CG 3.79Å; Y90-W104 WeakPolarHBondContact OH-CB 3.3Å; Y90-L111 HydrophobicContact CD2-CD2 4.17Å; Y90-L111 HydrophobicContact CE2-CD2 3.9Å; Y90-Y168 PolarHBondContact O-OH 2.95Å; Y90-K172 PolarHBondContact O-NZ 2.65Å
91	L	94.6	Very high	95.3	Very high	36 Å²	36	42.2 Å²	42.2	19%	0.188	20%	0.197	C	C	.	.			trans	-70.4	148.7	160.7	-62.5	169.4	0	0	0	108.8	E93 F94 K95 W104 H106 I109 Y168	L91-E93 VanDerWaalsContact C-N 3.27Å; L91-E93 PolarHBondContact O-N 3.45Å; L91-F94 HydrophobicContact CB-CD2 4.02Å; L91-F94 HydrophobicContact CD1-CD2 4.19Å; L91-F94 HydrophobicContact CD1-CE2 4.21Å; L91-F94 PolarHBondContact O-N 3.33Å; L91-K95 PolarHBondContact O-N 3.44Å; L91-W104 HydrophobicContact CB-CH2 4.38Å; L91-W104 HydrophobicContact CB-CZ2 4.43Å; L91-W104 HydrophobicContact CD1-CH2 3.98Å; L91-W104 HydrophobicContact CD1-CZ2 4.05Å; L91-W104 HydrophobicContact CG-CH2 3.87Å; L91-W104 HydrophobicContact CG-CZ2 4.23Å; L91-H106 HydrophobicContact CD1-CB 4.2Å; L91-I109 HydrophobicContact CD2-CD1 4.37Å; L91-Y168 HydrophobicContact CD2-CE2 3.67Å; L91-Y168 PolarHBondContact N-OH 3.22Å
92	E	92.4	Very high	95	Very high	134 Å²	134	44.8 Å²	44.8	63%	0.626	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-57	-42.2	-171.1	-159.7	63.5	-143.9	0	0	111.8	F94 K95	E92-F94 PolarHBondContact O-N 2.87Å; E92-F94 VanDerWaalsContact O-N 3.16Å; E92-K95 PolarHBondContact O-N 2.87Å; E92-K95 WeakPolarHBondContact OE1-CD 3.46Å; E92-K95 WeakPolarHBondContact OE1-CE 3.38Å; E92-K95 IonicContact OE1-NZ 2.8Å; E92-K95 PolarHBondContact OE1-NZ 3.08Å; E92-K95 WeakPolarHBondContact OE2-CE 3.35Å; E92-K95 IonicContact OE2-NZ 3.38Å; E92-K95 PolarHBondContact OE2-NZ 3.21Å
93	E	94.4	Very high	94.8	Very high	119 Å²	119	43 Å²	43	56%	0.556	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-68.5	-10.7	-179.2	65.9	-102.6	-144.7	0	0	115	L91	L91-E93 VanDerWaalsContact C-N 3.27Å; L91-E93 PolarHBondContact O-N 3.45Å
94	F	94	Very high	94.7	Very high	53 Å²	53	43.8 Å²	43.8	23%	0.232	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-117.6	5.9	-176.2	-60.5	-64.7	0	0	0	114	Y90 L91 E92 E96 N97 W104 H106	Y90-F94 HydrophobicContact CD1-CB 3.97Å; Y90-F94 VanDerWaalsContact CD1-O 3.31Å; Y90-F94 WeakPolarHBondContact CD1-O 3.43Å; L91-F94 HydrophobicContact CB-CD2 4.02Å; L91-F94 HydrophobicContact CD1-CD2 4.19Å; L91-F94 HydrophobicContact CD1-CE2 4.21Å; L91-F94 PolarHBondContact O-N 3.33Å; E92-F94 PolarHBondContact O-N 2.87Å; E92-F94 VanDerWaalsContact O-N 3.16Å; F94-E96 PolarHBondContact O-N 2.75Å; F94-E96 VanDerWaalsContact O-N 3.15Å; F94-N97 PolarHBondContact O-N 3.09Å; F94-W104 HydrophobicContact CB-CZ2 4.17Å; F94-W104 AromaticContact CD2-CZ2 3.62Å; F94-W104 HydrophobicContact CD2-CZ2 3.62Å; F94-W104 AromaticContact CD2-NE1 3.94Å; F94-W104 HydrophobicContact CE2-CZ2 4.4Å; F94-W104 HydrophobicContact CG-CZ2 4.14Å; F94-W104 AromaticContact CG-NE1 3.66Å; F94-H106 HydrophobicContact CE2-CB 4.39Å; F94-H106 AromaticContact CE2-CE1 3.95Å; F94-H106 AromaticContact CE2-CG 3.92Å; F94-H106 AromaticContact CE2-ND1 3.5Å; F94-H106 AromaticContact CZ-ND1 3.66Å
95	K	94.7	Very high	94.4	Very high	57 Å²	57	47.2 Å²	47.2	25%	0.248	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-58.6	-27.3	-176.6	-78.1	-175.1	174.2	172.6	0	114.5	A87 L91 E92 N97 A98	A87-K95 HydrophobicContact CB-CD 4.48Å; A87-K95 HydrophobicContact CB-CG 4.34Å; A87-K95 WeakPolarHBondContact O-CE 3.43Å; L91-K95 PolarHBondContact O-N 3.44Å; E92-K95 PolarHBondContact O-N 2.87Å; E92-K95 WeakPolarHBondContact OE1-CD 3.46Å; E92-K95 WeakPolarHBondContact OE1-CE 3.38Å; E92-K95 IonicContact OE1-NZ 2.8Å; E92-K95 PolarHBondContact OE1-NZ 3.08Å; E92-K95 WeakPolarHBondContact OE2-CE 3.35Å; E92-K95 IonicContact OE2-NZ 3.38Å; E92-K95 PolarHBondContact OE2-NZ 3.21Å; K95-N97 PolarHBondContact O-N 3.03Å; K95-A98 WeakPolarHBondContact O-CB 3.28Å; K95-A98 PolarHBondContact O-N 2.7Å
96	E	91.5	Very high	94.2	Very high	150 Å²	150	49.1 Å²	49.1	70%	0.701	23%	0.234	S	C	*	.	G	3₁₀ helix	trans	-57	-17.8	173.8	65.4	-170.9	-152.1	0	0	114.4	F94 K100	F94-E96 PolarHBondContact O-N 2.75Å; F94-E96 VanDerWaalsContact O-N 3.15Å; E96-K100 WeakPolarHBondContact O-CE 3.41Å
97	N	91.8	Very high	94	Very high	41 Å²	41	51.7 Å²	51.7	22%	0.219	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-100.9	-1	177.6	-62.8	-55.8	0	0	0	113.1	Y90 F94 K95 Y99 K100	Y90-N97 HydrophobicContact CE1-CB 4.23Å; Y90-N97 PolarHBondContact OH-O 2.68Å; F94-N97 PolarHBondContact O-N 3.09Å; K95-N97 PolarHBondContact O-N 3.03Å; N97-Y99 PolarHBondContact O-N 3.3Å; N97-K100 PolarHBondContact O-N 3.35Å; N97-K100 PolarHBondContact OD1-NZ 2.98Å
98	A	95	Very high	93.8	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-38.7	-173.4	0	0	0	0	0	112.8	R86 A87 Y90 K95 K100	R86-A98 WeakPolarHBondContact CD-O 3.36Å; R86-A98 PolarHBondContact NE-O 2.85Å; R86-A98 VanDerWaalsContact NE-O 3.09Å; A87-A98 VanDerWaalsContact CA-CB 3.48Å; A87-A98 HydrophobicContact CB-CB 3.58Å; Y90-A98 HydrophobicContact CD2-CB 3.93Å; Y90-A98 HydrophobicContact CE2-CB 3.99Å; Y90-A98 HydrophobicContact CG-CB 4.27Å; K95-A98 WeakPolarHBondContact O-CB 3.28Å; K95-A98 PolarHBondContact O-N 2.7Å; A98-K100 VanDerWaalsContact C-N 3.32Å; A98-K100 PolarHBondContact O-N 3.07Å
99	Y	96.9	Very high	93.6	Very high	47 Å²	47	52.8 Å²	52.8	18%	0.184	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	15.7	-175.4	-44.4	-48	0	0	0	114.1	A55 G56 E57 N59 D85 A87 N97	A55-Y99 WeakPolarHBondContact CA-O 3.45Å; G56-Y99 PolarHBondContact N-O 3.25Å; G56-Y99 WeakPolarHBondContact O-CB 3.34Å; E57-Y99 WeakPolarHBondContact O-CD2 3.34Å; N59-Y99 HydrophobicContact CB-CD1 4.26Å; N59-Y99 HydrophobicContact CB-CE1 3.86Å; D85-Y99 WeakPolarHBondContact OD1-CE1 3.44Å; D85-Y99 PolarHBondContact OD1-OH 2.83Å; D85-Y99 PolarHBondContact OD2-OH 3.09Å; A87-Y99 HydrophobicContact CB-CE1 3.82Å; A87-Y99 VanDerWaalsContact CB-OH 3.24Å; A87-Y99 WeakPolarHBondContact CB-OH 3.42Å; N97-Y99 PolarHBondContact O-N 3.3Å
100	K	94.3	Very high	93.4	Very high	74 Å²	74	52.9 Å²	52.9	32%	0.322	27%	0.266	S	S	.	.	S	Bend	trans	-94	143.3	170.5	-58	178.9	-174.1	167.5	0	107.9	A55 E96 N97 A98 L102	A55-K100 HydrophobicContact CB-CB 4.46Å; A55-K100 HydrophobicContact CB-CG 3.89Å; E96-K100 WeakPolarHBondContact O-CE 3.41Å; N97-K100 PolarHBondContact O-N 3.35Å; N97-K100 PolarHBondContact OD1-NZ 2.98Å; A98-K100 VanDerWaalsContact C-N 3.32Å; A98-K100 PolarHBondContact O-N 3.07Å; K100-L102 HydrophobicContact CB-CB 4.34Å; K100-L102 HydrophobicContact CB-CD1 3.93Å; K100-L102 HydrophobicContact CB-CG 4.06Å; K100-L102 HydrophobicContact CD-CD1 4.2Å; K100-L102 PolarHBondContact O-N 2.92Å
101	D	94.3	Very high	93.3	Very high	3 Å²	3	52.9 Å²	52.9	2%	0.016	27%	0.266	C	S	.	.	S	Bend	trans	-75.8	61.6	174.2	-175.2	40.7	0	0	0	111.9	G51 A52 V53 P114 C115	G51-D101 VanDerWaalsContact CA-O 3.29Å; G51-D101 WeakPolarHBondContact CA-O 3.48Å; A52-D101 WeakPolarHBondContact CA-OD2 3.11Å; A52-D101 VanDerWaalsContact CB-OD2 3.26Å; A52-D101 WeakPolarHBondContact CB-OD2 3.48Å; A52-D101 PolarHBondContact N-OD2 2.92Å; V53-D101 HydrophobicContact CG2-CB 3.54Å; V53-D101 PolarHBondContact N-OD2 2.73Å; D101-P114 VanDerWaalsContact OD1-CD 3.26Å; D101-P114 WeakPolarHBondContact OD1-CD 3.4Å; D101-C115 VanDerWaalsContact CG-SG 3.58Å; D101-C115 WeakPolarHBondContact OD1-CB 3.27Å; D101-C115 PolarHBondContact OD1-N 2.79Å; D101-C115 PolarHBondContact OD1-SG 2.83Å; D101-C115 PolarHBondContact OD2-SG 2.88Å
102	L	92.2	Very high	93.3	Very high	56 Å²	56	51.3 Å²	51.3	29%	0.293	26%	0.258	S	S	.	.			trans	-132.3	142.5	-173.2	-66	175.9	0	0	0	110.2	R86 K100	R86-L102 PolarHBondContact NH2-O 2.89Å; K100-L102 HydrophobicContact CB-CB 4.34Å; K100-L102 HydrophobicContact CB-CD1 3.93Å; K100-L102 HydrophobicContact CB-CG 4.06Å; K100-L102 HydrophobicContact CD-CD1 4.2Å; K100-L102 PolarHBondContact O-N 2.92Å
103	A	92.3	Very high	93.4	Very high	29 Å²	29	45 Å²	45	24%	0.24	23%	0.228	C	C	.	.			trans	-66.3	138.7	165.4	0	0	0	0	0	109.1	A4 A5 Q6 L111	A4-A103 HydrophobicContact CB-CB 3.62Å; A5-A103 WeakPolarHBondContact O-CB 3.25Å; Q6-A103 HydrophobicContact CB-CB 4Å; A103-L111 WeakPolarHBondContact CA-O 3.49Å
104	W	93	Very high	93.5	Very high	21 Å²	21	39.3 Å²	39.3	8%	0.08	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	140	177.1	172.1	79.9	0	0	0	111.1	A4 Y90 L91 F94 H106 I109 H110 L111	A4-W104 VanDerWaalsContact CB-O 3.26Å; A4-W104 WeakPolarHBondContact CB-O 3.39Å; Y90-W104 AromaticContact CD1-CD2 3.77Å; Y90-W104 HydrophobicContact CD1-CD2 3.77Å; Y90-W104 AromaticContact CD1-CE2 3.97Å; Y90-W104 HydrophobicContact CD1-CE3 4.08Å; Y90-W104 HydrophobicContact CD1-CG 4.04Å; Y90-W104 HydrophobicContact CD1-CZ2 4.48Å; Y90-W104 HydrophobicContact CE1-CB 3.62Å; Y90-W104 AromaticContact CE1-CD1 3.69Å; Y90-W104 AromaticContact CE1-CD2 3.51Å; Y90-W104 HydrophobicContact CE1-CD2 3.51Å; Y90-W104 HydrophobicContact CE1-CE3 4.01Å; Y90-W104 AromaticContact CE1-CG 3.29Å; Y90-W104 HydrophobicContact CE1-CG 3.29Å; Y90-W104 HydrophobicContact CG-CE3 4.43Å; Y90-W104 AromaticContact CZ-CG 3.79Å; Y90-W104 WeakPolarHBondContact OH-CB 3.3Å; L91-W104 HydrophobicContact CB-CH2 4.38Å; L91-W104 HydrophobicContact CB-CZ2 4.43Å; L91-W104 HydrophobicContact CD1-CH2 3.98Å; L91-W104 HydrophobicContact CD1-CZ2 4.05Å; L91-W104 HydrophobicContact CG-CH2 3.87Å; L91-W104 HydrophobicContact CG-CZ2 4.23Å; F94-W104 HydrophobicContact CB-CZ2 4.17Å; F94-W104 AromaticContact CD2-CZ2 3.62Å; F94-W104 HydrophobicContact CD2-CZ2 3.62Å; F94-W104 AromaticContact CD2-NE1 3.94Å; F94-W104 HydrophobicContact CE2-CZ2 4.4Å; F94-W104 HydrophobicContact CG-CZ2 4.14Å; F94-W104 AromaticContact CG-NE1 3.66Å; W104-H106 HydrophobicContact CH2-CB 4.05Å; W104-H106 HydrophobicContact CZ2-CB 3.51Å; W104-I109 HydrophobicContact CH2-CB 4.5Å; W104-I109 HydrophobicContact CH2-CG2 3.76Å; W104-I109 HydrophobicContact CZ3-CG2 3.51Å; W104-H110 CarbonylContact O-C 3.53Å; W104-H110 VanDerWaalsContact O-CA 3.29Å; W104-H110 WeakPolarHBondContact O-CA 3.48Å; W104-L111 HydrophobicContact CE3-CB 4.43Å; W104-L111 HydrophobicContact CE3-CD1 3.59Å; W104-L111 HydrophobicContact CZ3-CD1 3.63Å; W104-L111 PolarHBondContact N-O 2.92Å; W104-L111 PolarHBondContact O-N 2.76Å
105	K	91.5	Very high	93.5	Very high	73 Å²	73	36.9 Å²	36.9	32%	0.317	19%	0.191	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	137	179	-178.9	179	177.5	-175.8	0	111	M1 T3 G107 I109 H110	M1-K105 VanDerWaalsContact CG-NZ 3.27Å; M1-K105 PolarHBondContact SD-NZ 2.67Å; T3-K105 HydrophobicContact CG2-CD 3.96Å; K105-G107 WeakPolarHBondContact CE-O 3.17Å; K105-I109 WeakPolarHBondContact CA-O 3.25Å; K105-I109 WeakPolarHBondContact CG-O 3.46Å; K105-H110 HydrophobicContact CB-CB 4.31Å; K105-H110 HydrophobicContact CG-CB 4.22Å
106	H	92.4	Very high	93.6	Very high	89 Å²	89	34.1 Å²	34.1	41%	0.412	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	116.1	170	-173.8	88.4	0	0	0	109.5	L91 F94 W104 N108 I109	L91-H106 HydrophobicContact CD1-CB 4.2Å; F94-H106 HydrophobicContact CE2-CB 4.39Å; F94-H106 AromaticContact CE2-CE1 3.95Å; F94-H106 AromaticContact CE2-CG 3.92Å; F94-H106 AromaticContact CE2-ND1 3.5Å; F94-H106 AromaticContact CZ-ND1 3.66Å; W104-H106 HydrophobicContact CH2-CB 4.05Å; W104-H106 HydrophobicContact CZ2-CB 3.51Å; H106-N108 PolarHBondContact O-N 3.09Å; H106-I109 PolarHBondContact N-O 2.68Å; H106-I109 WeakPolarHBondContact O-CB 3.44Å; H106-I109 PolarHBondContact O-N 2.81Å
107	G	92.5	Very high	93.9	Very high	54 Å²	54	27.6 Å²	27.6	56%	0.557	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.5	-125.4	-171.3	0	0	0	0	0	112	K105	K105-G107 WeakPolarHBondContact CE-O 3.17Å
108	N	92.9	Very high	94.1	Very high	48 Å²	48	25.7 Å²	25.7	26%	0.257	14%	0.138	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-19	174.9	-62.4	-35	0	0	0	113	H106 H110 H162 D164 V165	H106-N108 PolarHBondContact O-N 3.09Å; N108-H110 PolarHBondContact O-ND1 3.46Å; N108-H162 HydrophobicContact CB-CB 4.15Å; N108-D164 PolarHBondContact ND2-OD1 3.1Å; N108-D164 PolarHBondContact ND2-OD2 2.81Å; N108-V165 HydrophobicContact CB-CG2 3.46Å; N108-V165 VanDerWaalsContact CB-CG2 3.46Å
109	I	92.6	Very high	94.2	Very high	21 Å²	21	26.6 Å²	26.6	11%	0.108	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	131.6	-178.7	-61.1	178.8	0	0	0	109	L91 W104 K105 H106 T139 V165 Y168	L91-I109 HydrophobicContact CD2-CD1 4.37Å; W104-I109 HydrophobicContact CH2-CB 4.5Å; W104-I109 HydrophobicContact CH2-CG2 3.76Å; W104-I109 HydrophobicContact CZ3-CG2 3.51Å; K105-I109 WeakPolarHBondContact CA-O 3.25Å; K105-I109 WeakPolarHBondContact CG-O 3.46Å; H106-I109 PolarHBondContact N-O 2.68Å; H106-I109 WeakPolarHBondContact O-CB 3.44Å; H106-I109 PolarHBondContact O-N 2.81Å; I109-T139 HydrophobicContact CG2-CG2 3.48Å; I109-T139 VanDerWaalsContact CG2-CG2 3.48Å; I109-V165 HydrophobicContact CG1-CG2 4.36Å; I109-Y168 HydrophobicContact CD1-CD1 4.09Å; I109-Y168 HydrophobicContact CD1-CD2 3.79Å; I109-Y168 HydrophobicContact CD1-CE1 4.32Å; I109-Y168 HydrophobicContact CD1-CE2 4.03Å; I109-Y168 HydrophobicContact CD1-CG 3.79Å; I109-Y168 HydrophobicContact CG2-CD1 4.29Å; I109-Y168 HydrophobicContact CG2-CE1 4.02Å
110	H	91.6	Very high	94.3	Very high	5 Å²	5	24.4 Å²	24.4	2%	0.023	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	145.4	-179.4	61.1	-80.5	0	0	0	111.9	F2 A4 W104 K105 N108	F2-H110 WeakPolarHBondContact CB-CE1 3.5Å; A4-H110 HydrophobicContact CB-CB 4.01Å; W104-H110 CarbonylContact O-C 3.53Å; W104-H110 VanDerWaalsContact O-CA 3.29Å; W104-H110 WeakPolarHBondContact O-CA 3.48Å; K105-H110 HydrophobicContact CB-CB 4.31Å; K105-H110 HydrophobicContact CG-CB 4.22Å; N108-H110 PolarHBondContact O-ND1 3.46Å
111	L	93.5	Very high	94.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	125	170.9	-84	90.4	0	0	0	109.2	A4 R86 Y90 A103 W104 T139 Y141	A4-L111 WeakPolarHBondContact CB-O 3.41Å; R86-L111 HydrophobicContact CG-CD2 4.4Å; Y90-L111 HydrophobicContact CD2-CD2 4.17Å; Y90-L111 HydrophobicContact CE2-CD2 3.9Å; A103-L111 WeakPolarHBondContact CA-O 3.49Å; W104-L111 HydrophobicContact CE3-CB 4.43Å; W104-L111 HydrophobicContact CE3-CD1 3.59Å; W104-L111 HydrophobicContact CZ3-CD1 3.63Å; W104-L111 PolarHBondContact N-O 2.92Å; W104-L111 PolarHBondContact O-N 2.76Å; L111-T139 HydrophobicContact CD1-CG2 3.36Å; L111-T139 HydrophobicContact CG-CG2 4.24Å; L111-Y141 HydrophobicContact CD2-CD1 4.31Å; L111-Y141 HydrophobicContact CD2-CG 4.21Å
112	S	94.5	Very high	94.7	Very high	4 Å²	4	21.9 Å²	21.9	3%	0.028	12%	0.123	C	C	.	.			trans	-65.9	158.3	173	-57.3	0	0	0	0	111.6	A5 R86 Y117	A5-S112 WeakPolarHBondContact CB-OG 3.45Å; A5-S112 PolarHBondContact N-OG 2.9Å; A5-S112 VanDerWaalsContact N-OG 3.11Å; A5-S112 WeakPolarHBondContact O-CA 2.98Å; R86-S112 VanDerWaalsContact CZ-O 3.28Å; R86-S112 PolarHBondContact NH1-O 3.04Å; R86-S112 PolarHBondContact NH2-O 3.2Å; S112-Y117 PolarHBondContact N-OH 3.02Å; S112-Y117 VanDerWaalsContact N-OH 3.15Å; S112-Y117 WeakPolarHBondContact O-CE2 3.34Å
113	A	95.1	Very high	95	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	11%	0.113	C	C	.	.			trans	-57.1	140.6	176.1	0	0	0	0	0	110.7	A5 Q6 C115 I116 Y117	A5-A113 PolarHBondContact O-N 2.86Å; Q6-A113 HydrophobicContact CG-CB 4.26Å; A113-C115 VanDerWaalsContact C-N 3.29Å; A113-C115 PolarHBondContact O-N 2.78Å; A113-I116 HydrophobicContact CB-CG1 4.22Å; A113-I116 WeakPolarHBondContact O-CB 3.29Å; A113-I116 PolarHBondContact O-N 2.93Å; A113-Y117 PolarHBondContact O-N 2.99Å
114	P	96.4	Very high	95.3	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.006	10%	0.101	C	C	.	.	H	α-helix	trans	-46.7	-47.4	176.2	-27.2	31.7	0	0	0	113.8	L62 L66 D101 I116 Y117 S118	L62-P114 HydrophobicContact CD1-CB 4.41Å; L62-P114 HydrophobicContact CD1-CG 4.26Å; L62-P114 HydrophobicContact CD2-CB 4.23Å; L62-P114 HydrophobicContact CD2-CG 3.87Å; L66-P114 HydrophobicContact CD1-CB 3.68Å; L66-P114 HydrophobicContact CD2-CB 4.37Å; D101-P114 VanDerWaalsContact OD1-CD 3.26Å; D101-P114 WeakPolarHBondContact OD1-CD 3.4Å; P114-I116 VanDerWaalsContact C-N 3.25Å; P114-I116 PolarHBondContact O-N 2.89Å; P114-Y117 PolarHBondContact O-N 2.81Å; P114-Y117 VanDerWaalsContact O-N 3.09Å; P114-S118 PolarHBondContact O-N 3.46Å; P114-S118 PolarHBondContact O-OG 3.2Å
115	C	95.6	Very high	95.5	Very high	1 Å²	1	21.1 Å²	21.1	1%	0.007	12%	0.118	C	C	.	.	H	α-helix	trans	-58	-35.2	179.2	60.5	0	0	0	0	113.5	A52 L66 Y71 D101 A113 S118 E119	A52-C115 HydrophobicContact CB-CB 4.32Å; L66-C115 HydrophobicContact CD2-CB 3.98Å; Y71-C115 HydrophobicContact CD1-CB 3.97Å; Y71-C115 HydrophobicContact CD2-CB 4.17Å; Y71-C115 HydrophobicContact CE1-CB 4.02Å; Y71-C115 HydrophobicContact CE2-CB 4.24Å; Y71-C115 HydrophobicContact CG-CB 4.05Å; D101-C115 VanDerWaalsContact CG-SG 3.58Å; D101-C115 WeakPolarHBondContact OD1-CB 3.27Å; D101-C115 PolarHBondContact OD1-N 2.79Å; D101-C115 PolarHBondContact OD1-SG 2.83Å; D101-C115 PolarHBondContact OD2-SG 2.88Å; A113-C115 VanDerWaalsContact C-N 3.29Å; A113-C115 PolarHBondContact O-N 2.78Å; C115-S118 PolarHBondContact O-N 2.84Å; C115-E119 WeakPolarHBondContact O-CG 3.42Å; C115-E119 PolarHBondContact O-N 2.89Å; C115-E119 VanDerWaalsContact O-N 3.08Å
116	I	95.4	Very high	95.8	Very high	0 Å²	0	18 Å²	18	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-68.9	-44.3	176.9	-60.5	-58.6	0	0	0	110.5	A5 V7 A113 P114 S118 E119 V120 L260 V262 F264	A5-I116 HydrophobicContact CB-CG2 4.2Å; V7-I116 HydrophobicContact CG2-CD1 4.01Å; A113-I116 HydrophobicContact CB-CG1 4.22Å; A113-I116 WeakPolarHBondContact O-CB 3.29Å; A113-I116 PolarHBondContact O-N 2.93Å; P114-I116 VanDerWaalsContact C-N 3.25Å; P114-I116 PolarHBondContact O-N 2.89Å; I116-S118 VanDerWaalsContact C-N 3.3Å; I116-S118 PolarHBondContact O-N 2.99Å; I116-E119 PolarHBondContact O-N 3.07Å; I116-V120 HydrophobicContact CG2-CG2 4.41Å; I116-V120 WeakPolarHBondContact O-CB 3.3Å; I116-V120 VanDerWaalsContact O-CG2 3.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.33Å; I116-V120 PolarHBondContact O-N 3.44Å; I116-L260 HydrophobicContact CD1-CD1 3.96Å; I116-V262 HydrophobicContact CD1-CG1 3.76Å; I116-F264 HydrophobicContact CG2-CE2 4.34Å; I116-F264 HydrophobicContact CG2-CZ 3.87Å
117	Y	97.5	Very high	96.1	Very high	13 Å²	13	17.6 Å²	17.6	5%	0.051	10%	0.103	C	C	.	.	H	α-helix	trans	-64.1	-37	175.9	-72.3	-39.7	0	0	0	111.9	S112 A113 P114 V120 M121 Y141 L142	S112-Y117 PolarHBondContact N-OH 3.02Å; S112-Y117 VanDerWaalsContact N-OH 3.15Å; S112-Y117 WeakPolarHBondContact O-CE2 3.34Å; A113-Y117 PolarHBondContact O-N 2.99Å; P114-Y117 PolarHBondContact O-N 2.81Å; P114-Y117 VanDerWaalsContact O-N 3.09Å; Y117-V120 PolarHBondContact O-N 3.11Å; Y117-M121 WeakPolarHBondContact O-CB 3.33Å; Y117-M121 VanDerWaalsContact O-CG 3.32Å; Y117-M121 WeakPolarHBondContact O-CG 3.39Å; Y117-M121 PolarHBondContact O-N 3.07Å; Y117-Y141 AromaticContact CD2-CD1 3.78Å; Y117-Y141 HydrophobicContact CD2-CD1 3.78Å; Y117-Y141 AromaticContact CD2-CE1 3.84Å; Y117-Y141 HydrophobicContact CD2-CE1 3.84Å; Y117-Y141 AromaticContact CE2-CD1 3.63Å; Y117-Y141 HydrophobicContact CE2-CD1 3.63Å; Y117-Y141 HydrophobicContact CE2-CE1 4.14Å; Y117-L142 HydrophobicContact CD1-CB 4.13Å; Y117-L142 HydrophobicContact CD1-CD1 3.89Å; Y117-L142 HydrophobicContact CD1-CD2 4.06Å; Y117-L142 HydrophobicContact CD1-CG 4.25Å; Y117-L142 HydrophobicContact CE1-CB 3.94Å; Y117-L142 HydrophobicContact CE1-CD2 4.1Å; Y117-L142 HydrophobicContact CE1-CG 4.42Å; Y117-L142 HydrophobicContact CG-CD1 4.32Å
118	S	97.4	Very high	96.3	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.9	-49.9	175.5	-53.3	0	0	0	0	111	Y71 I72 F81 P114 C115 I116 V120 M121 E122	Y71-S118 WeakPolarHBondContact O-CB 3.3Å; I72-S118 WeakPolarHBondContact CG1-OG 3.37Å; F81-S118 WeakPolarHBondContact CZ-OG 3.32Å; P114-S118 PolarHBondContact O-N 3.46Å; P114-S118 PolarHBondContact O-OG 3.2Å; C115-S118 PolarHBondContact O-N 2.84Å; I116-S118 VanDerWaalsContact C-N 3.3Å; I116-S118 PolarHBondContact O-N 2.99Å; S118-V120 VanDerWaalsContact C-N 3.34Å; S118-V120 PolarHBondContact O-N 3.24Å; S118-M121 PolarHBondContact O-N 3.13Å; S118-E122 WeakPolarHBondContact O-CB 3.43Å; S118-E122 WeakPolarHBondContact O-CG 3.48Å; S118-E122 PolarHBondContact O-N 3.38Å
119	E	97.3	Very high	96.5	Very high	20 Å²	20	18.8 Å²	18.8	9%	0.093	11%	0.11	C	C	.	.	H	α-helix	trans	-64	-38	178.6	-72.6	-73.1	171.3	0	0	112.8	Y71 R73 C115 I116 A123 L243 L260	Y71-E119 HydrophobicContact CD1-CG 3.75Å; Y71-E119 WeakPolarHBondContact CD1-OE1 3.37Å; Y71-E119 HydrophobicContact CE1-CG 4.22Å; R73-E119 IonicContact CZ-OE1 3.3Å; R73-E119 IonicContact CZ-OE2 3.29Å; R73-E119 IonicContact NH2-OE1 3.13Å; R73-E119 PolarHBondContact NH2-OE1 3.23Å; R73-E119 IonicContact NH2-OE2 2.65Å; R73-E119 PolarHBondContact NH2-OE2 3.41Å; C115-E119 WeakPolarHBondContact O-CG 3.42Å; C115-E119 PolarHBondContact O-N 2.89Å; C115-E119 VanDerWaalsContact O-N 3.08Å; I116-E119 PolarHBondContact O-N 3.07Å; E119-A123 WeakPolarHBondContact O-CB 3.12Å; E119-A123 PolarHBondContact O-N 2.94Å; E119-L243 HydrophobicContact CB-CD2 4.2Å; E119-L260 HydrophobicContact CB-CD2 3.88Å; E119-L260 HydrophobicContact CG-CD2 3.48Å; E119-L260 VanDerWaalsContact CG-CD2 3.48Å
120	V	98.3	Very high	96.7	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62.6	-49.8	174.2	168.3	0	0	0	0	110.6	I116 Y117 S118 A123 L124 L142 Y212 V236 L243	I116-V120 HydrophobicContact CG2-CG2 4.41Å; I116-V120 WeakPolarHBondContact O-CB 3.3Å; I116-V120 VanDerWaalsContact O-CG2 3.23Å; I116-V120 WeakPolarHBondContact O-CG2 3.33Å; I116-V120 PolarHBondContact O-N 3.44Å; Y117-V120 PolarHBondContact O-N 3.11Å; S118-V120 VanDerWaalsContact C-N 3.34Å; S118-V120 PolarHBondContact O-N 3.24Å; V120-A123 PolarHBondContact O-N 2.81Å; V120-L124 HydrophobicContact CG1-CD1 3.69Å; V120-L124 HydrophobicContact CG1-CG 4.28Å; V120-L124 WeakPolarHBondContact O-CB 3.37Å; V120-L124 WeakPolarHBondContact O-CG 3.36Å; V120-L124 PolarHBondContact O-N 3.39Å; V120-L142 HydrophobicContact CG1-CD2 4.25Å; V120-Y212 HydrophobicContact CB-CD2 4.39Å; V120-Y212 HydrophobicContact CB-CE2 4.23Å; V120-Y212 HydrophobicContact CG1-CD1 4.31Å; V120-Y212 HydrophobicContact CG1-CD2 3.44Å; V120-Y212 VanDerWaalsContact CG1-CD2 3.44Å; V120-Y212 HydrophobicContact CG1-CE2 3.71Å; V120-Y212 HydrophobicContact CG1-CG 3.78Å; V120-Y212 HydrophobicContact CG2-CD2 3.96Å; V120-Y212 HydrophobicContact CG2-CE2 3.41Å; V120-Y212 VanDerWaalsContact CG2-CE2 3.41Å; V120-V236 HydrophobicContact CG1-CG1 4.43Å; V120-V236 HydrophobicContact CG2-CG1 4.08Å; V120-L243 HydrophobicContact CG2-CD1 4.22Å; V120-L243 HydrophobicContact CG2-CD2 4.02Å
121	M	98.3	Very high	97	Very high	1 Å²	1	19.4 Å²	19.4	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-64.9	-41.6	-178.3	-71.8	-176.1	67.4	0	0	112.2	V77 A80 F81 Y117 S118 D125 L126 L142 M145 I149	V77-M121 HydrophobicContact CG1-CB 4.03Å; V77-M121 HydrophobicContact CG1-CE 4.45Å; V77-M121 HydrophobicContact CG2-CB 3.99Å; A80-M121 HydrophobicContact CB-CE 3.96Å; F81-M121 HydrophobicContact CD2-SD 3.98Å; F81-M121 HydrophobicContact CE2-CE 4.49Å; F81-M121 HydrophobicContact CE2-CG 4.46Å; F81-M121 HydrophobicContact CE2-SD 3.4Å; F81-M121 WeakPolarHBondContact CE2-SD 3.44Å; F81-M121 HydrophobicContact CZ-SD 4.22Å; Y117-M121 WeakPolarHBondContact O-CB 3.33Å; Y117-M121 VanDerWaalsContact O-CG 3.32Å; Y117-M121 WeakPolarHBondContact O-CG 3.39Å; Y117-M121 PolarHBondContact O-N 3.07Å; S118-M121 PolarHBondContact O-N 3.13Å; M121-D125 PolarHBondContact O-N 3.46Å; M121-L126 HydrophobicContact CE-CD1 4.49Å; M121-L142 HydrophobicContact CG-CD1 3.65Å; M121-L142 HydrophobicContact SD-CD1 3.88Å; M121-M145 HydrophobicContact CE-CB 3.94Å; M121-M145 HydrophobicContact SD-CB 4.04Å; M121-M145 HydrophobicContact SD-CE 3.88Å; M121-M145 HydrophobicContact SD-SD 4.18Å; M121-I149 HydrophobicContact CE-CD1 3.39Å
122	E	98.3	Very high	97.3	Very high	24 Å²	24	19.4 Å²	19.4	11%	0.112	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-42.4	174.2	-72.4	-71.6	159.4	0	0	112	R73 T74 S118 D125	R73-E122 PolarHBondContact N-OE1 3.29Å; R73-E122 IonicContact NH1-OE2 2.78Å; T74-E122 WeakPolarHBondContact CG2-OE2 3.13Å; T74-E122 PolarHBondContact N-OE1 3.18Å; T74-E122 PolarHBondContact OG1-OE1 2.93Å; S118-E122 WeakPolarHBondContact O-CB 3.43Å; S118-E122 WeakPolarHBondContact O-CG 3.48Å; S118-E122 PolarHBondContact O-N 3.38Å; E122-D125 PolarHBondContact O-N 3.28Å
123	A	98.4	Very high	97.5	Very high	9 Å²	9	19.2 Å²	19.2	7%	0.074	11%	0.113	C	C	.	.	H	α-helix	trans	-70.2	-35.2	-179.9	0	0	0	0	0	112.8	E119 V120 D125 V236 K245 I259	E119-A123 WeakPolarHBondContact O-CB 3.12Å; E119-A123 PolarHBondContact O-N 2.94Å; V120-A123 PolarHBondContact O-N 2.81Å; A123-D125 PolarHBondContact O-N 2.86Å; A123-V236 HydrophobicContact CB-CG2 3.78Å; A123-K245 HydrophobicContact CB-CD 4.4Å; A123-K245 WeakPolarHBondContact O-CD 3.38Å; A123-K245 WeakPolarHBondContact O-CE 3.41Å; A123-K245 PolarHBondContact O-NZ 3.29Å; A123-I259 HydrophobicContact CB-CD1 3.52Å
124	L	98.6	Very high	97.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-65.8	-25.5	177.7	-75	168.6	0	0	0	111.9	V120 L126 F132 R210 I234 V236	V120-L124 HydrophobicContact CG1-CD1 3.69Å; V120-L124 HydrophobicContact CG1-CG 4.28Å; V120-L124 WeakPolarHBondContact O-CB 3.37Å; V120-L124 WeakPolarHBondContact O-CG 3.36Å; V120-L124 PolarHBondContact O-N 3.39Å; L124-L126 HydrophobicContact CB-CD1 4.36Å; L124-L126 HydrophobicContact CB-CD2 4.26Å; L124-L126 HydrophobicContact CB-CG 3.89Å; L124-L126 HydrophobicContact CD1-CD1 4.41Å; L124-L126 PolarHBondContact O-N 3.44Å; L124-F132 HydrophobicContact CD1-CE2 3.73Å; L124-F132 HydrophobicContact CD1-CZ 4.38Å; L124-R210 HydrophobicContact CD2-CB 4.26Å; L124-R210 WeakPolarHBondContact O-CD 3.48Å; L124-R210 PolarHBondContact O-NE 2.89Å; L124-I234 WeakPolarHBondContact O-CD1 3.37Å; L124-V236 HydrophobicContact CD2-CB 4.09Å; L124-V236 HydrophobicContact CD2-CG2 3.7Å; L124-V236 HydrophobicContact CG-CB 4.35Å; L124-V236 HydrophobicContact CG-CG2 3.86Å
125	D	97.9	Very high	97.7	Very high	80 Å²	80	19.2 Å²	19.2	43%	0.428	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	49.7	61	-178.4	-178.6	28	0	0	0	111.3	M121 E122 A123 Q127 R210 I234	M121-D125 PolarHBondContact O-N 3.46Å; E122-D125 PolarHBondContact O-N 3.28Å; A123-D125 PolarHBondContact O-N 2.86Å; D125-Q127 PolarHBondContact OD1-NE2 3.01Å; D125-R210 PolarHBondContact O-NE 3.42Å; D125-R210 VanDerWaalsContact O-NE 3.09Å; D125-R210 PolarHBondContact O-NH2 2.98Å; D125-I234 HydrophobicContact CB-CD1 4.06Å
126	L	98.3	Very high	97.7	Very high	8 Å²	8	19.5 Å²	19.5	4%	0.042	12%	0.116	C	C	.	.			trans	-73.9	140.1	-176.4	-67.7	160.5	0	0	0	110.6	M121 L124 F132 V146 I149 L150 R210	M121-L126 HydrophobicContact CE-CD1 4.49Å; L124-L126 HydrophobicContact CB-CD1 4.36Å; L124-L126 HydrophobicContact CB-CD2 4.26Å; L124-L126 HydrophobicContact CB-CG 3.89Å; L124-L126 HydrophobicContact CD1-CD1 4.41Å; L124-L126 PolarHBondContact O-N 3.44Å; L126-F132 HydrophobicContact CD2-CD2 4.44Å; L126-V146 HydrophobicContact CD1-CB 4.33Å; L126-V146 HydrophobicContact CD1-CG1 4.09Å; L126-V146 HydrophobicContact CD1-CG2 3.69Å; L126-V146 HydrophobicContact CD2-CG1 3.88Å; L126-I149 HydrophobicContact CB-CB 4.38Å; L126-I149 HydrophobicContact CB-CD1 4.41Å; L126-I149 HydrophobicContact CB-CG2 3.69Å; L126-I149 HydrophobicContact CD1-CD1 4.16Å; L126-L150 HydrophobicContact CD2-CD2 4.27Å; L126-R210 HydrophobicContact CD2-CB 4.23Å; L126-R210 HydrophobicContact CD2-CG 4.01Å
127	Q	97.4	Very high	97.7	Very high	81 Å²	81	19.7 Å²	19.7	38%	0.379	12%	0.118	S	C	.	.			trans	-138.5	155.2	179.3	-60.4	-61.4	-31.8	0	0	110.3	D125 G129 L130 L150	D125-Q127 PolarHBondContact OD1-NE2 3.01Å; Q127-G129 PolarHBondContact O-N 3.25Å; Q127-L130 HydrophobicContact CB-CD1 3.87Å; Q127-L130 HydrophobicContact CB-CG 4.08Å; Q127-L130 HydrophobicContact CG-CD1 4.39Å; Q127-L130 WeakPolarHBondContact O-CG 3.36Å; Q127-L130 PolarHBondContact O-N 3.2Å; Q127-L150 WeakPolarHBondContact O-CD2 3.43Å
128	P	97.3	Very high	97.6	Very high	89 Å²	89	19.2 Å²	19.2	58%	0.578	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.6	138.2	175	-26.5	34.8	0	0	0	112.8	L130 I149 L150	P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.49Å; P128-I149 WeakPolarHBondContact CA-O 3.49Å; P128-L150 CarbonylContact C-O 3.58Å; P128-L150 VanDerWaalsContact CA-O 3.31Å; P128-L150 WeakPolarHBondContact CA-O 3.47Å
129	G	96.1	Very high	97.5	Very high	37 Å²	37	19.2 Å²	19.2	38%	0.381	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.7	177.3	0	0	0	0	0	115.9	Q127 L150	Q127-G129 PolarHBondContact O-N 3.25Å; G129-L150 PolarHBondContact N-O 2.84Å
130	L	97.9	Very high	97.5	Very high	31 Å²	31	18.3 Å²	18.3	16%	0.162	11%	0.112	C	C	.	.			trans	-71.4	157.8	176	-64.1	-174.4	0	0	0	112.3	Q127 P128 L150 G154 V155 D209 R210	Q127-L130 HydrophobicContact CB-CD1 3.87Å; Q127-L130 HydrophobicContact CB-CG 4.08Å; Q127-L130 HydrophobicContact CG-CD1 4.39Å; Q127-L130 WeakPolarHBondContact O-CG 3.36Å; Q127-L130 PolarHBondContact O-N 3.2Å; P128-L130 VanDerWaalsContact C-N 3.31Å; P128-L130 PolarHBondContact O-N 3.49Å; L130-L150 HydrophobicContact CB-CD2 3.78Å; L130-L150 WeakPolarHBondContact O-CD2 3.43Å; L130-G154 VanDerWaalsContact O-CA 3.25Å; L130-G154 WeakPolarHBondContact O-CA 3.31Å; L130-V155 PolarHBondContact O-N 2.91Å; L130-D209 HydrophobicContact CB-CB 4.06Å; L130-D209 HydrophobicContact CD1-CB 4.45Å; L130-D209 HydrophobicContact CD2-CB 3.93Å; L130-D209 HydrophobicContact CG-CB 4.38Å; L130-R210 HydrophobicContact CD1-CG 4.02Å; L130-R210 VanDerWaalsContact CD1-CZ 3.48Å
131	S	98.4	Very high	97.5	Very high	8 Å²	8	18.3 Å²	18.3	6%	0.056	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	130.8	169.3	58.9	0	0	0	0	111.7	V155 Y208 D209 R210 K230	S131-V155 CarbonylContact C-O 3.51Å; S131-V155 WeakPolarHBondContact CA-O 3.32Å; S131-Y208 WeakPolarHBondContact OG-CA 3.48Å; S131-D209 WeakPolarHBondContact CB-OD2 3.34Å; S131-D209 PolarHBondContact N-OD2 3.11Å; S131-D209 WeakPolarHBondContact O-CB 3.29Å; S131-D209 PolarHBondContact O-N 3.11Å; S131-D209 VanDerWaalsContact O-N 3.09Å; S131-D209 PolarHBondContact OG-N 3.41Å; S131-D209 PolarHBondContact OG-OD2 3.12Å; S131-R210 PolarHBondContact O-N 3.26Å; S131-K230 PolarHBondContact OG-NZ 3.49Å; S131-K230 VanDerWaalsContact OG-NZ 3.09Å
132	F	98.7	Very high	97.5	Very high	0 Å²	0	18.4 Å²	18.4	0%	0	11%	0.112	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	135.1	-177.5	176.6	-116.7	0	0	0	111.9	L124 L126 N134 V146 L150 V155 H157 R210	L124-F132 HydrophobicContact CD1-CE2 3.73Å; L124-F132 HydrophobicContact CD1-CZ 4.38Å; L126-F132 HydrophobicContact CD2-CD2 4.44Å; F132-N134 HydrophobicContact CD1-CB 4.49Å; F132-N134 HydrophobicContact CE1-CB 3.65Å; F132-N134 HydrophobicContact CZ-CB 3.85Å; F132-V146 HydrophobicContact CB-CG1 4.09Å; F132-V146 HydrophobicContact CD1-CB 4.05Å; F132-V146 HydrophobicContact CD1-CG1 3.44Å; F132-V146 VanDerWaalsContact CD1-CG1 3.44Å; F132-V146 HydrophobicContact CD1-CG2 4.29Å; F132-V146 HydrophobicContact CD2-CG1 4.41Å; F132-V146 HydrophobicContact CE1-CB 4Å; F132-V146 HydrophobicContact CE1-CG1 3.87Å; F132-V146 HydrophobicContact CE1-CG2 3.82Å; F132-V146 HydrophobicContact CG-CG1 3.73Å; F132-V146 HydrophobicContact CZ-CG2 4.04Å; F132-L150 HydrophobicContact CB-CD1 3.76Å; F132-V155 PolarHBondContact N-O 3.03Å; F132-H157 PolarHBondContact O-N 2.8Å; F132-R210 CarbonylContact C-O 3.55Å; F132-R210 VanDerWaalsContact CA-O 3.27Å; F132-R210 WeakPolarHBondContact CA-O 3.35Å; F132-R210 HydrophobicContact CB-CB 4.43Å; F132-R210 HydrophobicContact CD2-CB 3.79Å
133	L	98.6	Very high	97.5	Very high	0 Å²	0	17.2 Å²	17.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	123.2	172.1	179.4	63.6	0	0	0	110.5	L135 H157 V159 I201 Y208 R210 V211 Y212 L228 L283	L133-L135 HydrophobicContact CD1-CD2 4.19Å; L133-L135 HydrophobicContact CD2-CD2 3.82Å; L133-L135 HydrophobicContact CD2-CG 4.45Å; L133-L135 HydrophobicContact CG-CD2 3.81Å; L133-L135 HydrophobicContact CG-CG 4.3Å; L133-H157 CarbonylContact C-O 3.55Å; L133-H157 WeakPolarHBondContact CA-O 3.36Å; L133-H157 HydrophobicContact CD1-CB 3.96Å; L133-V159 HydrophobicContact CD1-CG2 4.2Å; L133-I201 HydrophobicContact CD2-CD1 4.25Å; L133-Y208 HydrophobicContact CB-CD1 3.77Å; L133-Y208 HydrophobicContact CB-CD2 3.72Å; L133-Y208 HydrophobicContact CB-CE1 3.99Å; L133-Y208 HydrophobicContact CB-CE2 3.94Å; L133-Y208 HydrophobicContact CB-CG 3.64Å; L133-Y208 HydrophobicContact CD1-CE2 4.36Å; L133-Y208 HydrophobicContact CD2-CD2 3.78Å; L133-Y208 HydrophobicContact CD2-CE2 3.71Å; L133-Y208 HydrophobicContact CG-CD2 4.33Å; L133-Y208 HydrophobicContact CG-CE2 4.23Å; L133-R210 PolarHBondContact N-O 2.99Å; L133-V211 HydrophobicContact CB-CG2 4.27Å; L133-V211 CarbonylContact O-C 3.55Å; L133-V211 WeakPolarHBondContact O-CA 3.48Å; L133-Y212 PolarHBondContact O-N 3.03Å; L133-L228 HydrophobicContact CD2-CD1 4.04Å; L133-L283 HydrophobicContact CD1-CD1 4.06Å; L133-L283 HydrophobicContact CD1-CD2 4.47Å
134	N	98.3	Very high	97.5	Very high	2 Å²	2	16.8 Å²	16.8	1%	0.011	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	109.1	176.7	-170.2	-0.3	0	0	0	110.5	F132 S143 H157 G158 V159 Y212	F132-N134 HydrophobicContact CD1-CB 4.49Å; F132-N134 HydrophobicContact CE1-CB 3.65Å; F132-N134 HydrophobicContact CZ-CB 3.85Å; N134-S143 PolarHBondContact ND2-OG 3.34Å; N134-H157 PolarHBondContact N-O 2.9Å; N134-G158 CarbonylContact O-C 3.49Å; N134-G158 WeakPolarHBondContact O-CA 3.15Å; N134-V159 PolarHBondContact O-N 3.3Å; N134-Y212 WeakPolarHBondContact OD1-CD1 3.4Å
135	L	97.4	Very high	97.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	116.3	178.3	-54.6	176.6	0	0	0	109.4	L133 V159 C198 I201 V211 Y212 C213 G214 M225 L228	L133-L135 HydrophobicContact CD1-CD2 4.19Å; L133-L135 HydrophobicContact CD2-CD2 3.82Å; L133-L135 HydrophobicContact CD2-CG 4.45Å; L133-L135 HydrophobicContact CG-CD2 3.81Å; L133-L135 HydrophobicContact CG-CG 4.3Å; L135-V159 HydrophobicContact CD2-CB 4.37Å; L135-V159 HydrophobicContact CD2-CG2 4.37Å; L135-C198 HydrophobicContact CB-CB 4.02Å; L135-C198 HydrophobicContact CD1-CB 4.46Å; L135-C198 HydrophobicContact CD2-CB 3.94Å; L135-C198 HydrophobicContact CG-CB 4.37Å; L135-I201 HydrophobicContact CD2-CD1 3.58Å; L135-V211 HydrophobicContact CD1-CG1 4.11Å; L135-V211 HydrophobicContact CG-CG1 4.42Å; L135-Y212 PolarHBondContact N-O 2.96Å; L135-C213 HydrophobicContact CB-CB 4.28Å; L135-C213 HydrophobicContact CD1-CB 4.32Å; L135-G214 PolarHBondContact O-N 3.08Å; L135-M225 HydrophobicContact CD1-CE 4.22Å; L135-M225 HydrophobicContact CD1-SD 3.49Å; L135-M225 WeakPolarHBondContact CD1-SD 3.44Å; L135-L228 HydrophobicContact CD1-CD1 3.91Å
136	G	95.8	Very high	97.5	Very high	6 Å²	6	13 Å²	13	6%	0.062	8%	0.083	C	C	.	.	S	Bend	trans	79	55.9	-166	0	0	0	0	0	110.8	G138 V159	G136-G138 PolarHBondContact O-N 3Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G136-V159 WeakPolarHBondContact CA-O 3.31Å; G136-V159 PolarHBondContact N-O 2.79Å
137	S	95.6	Very high	97.5	Very high	5 Å²	5	12.6 Å²	12.6	4%	0.035	8%	0.081	C	C	.	.			trans	-65.1	-15.6	-172.5	61.4	0	0	0	0	114.6	T139 G140 V159 E160 F193	S137-T139 PolarHBondContact O-N 3.06Å; S137-G140 PolarHBondContact O-N 3.31Å; S137-G140 VanDerWaalsContact O-N 3.07Å; S137-V159 PolarHBondContact N-O 2.89Å; S137-E160 WeakPolarHBondContact OG-CB 3.4Å; S137-F193 WeakPolarHBondContact OG-CD1 3.44Å
138	G	94.8	Very high	97.5	Very high	2 Å²	2	9.3 Å²	9.3	2%	0.021	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.6	-135.3	175.6	0	0	0	0	0	111.6	G136 G140 E160 V165	G136-G138 PolarHBondContact O-N 3Å; G136-G138 VanDerWaalsContact O-N 3.11Å; G138-G140 PolarHBondContact O-N 3Å; G138-E160 PolarHBondContact N-OE2 3.34Å; G138-E160 VanDerWaalsContact N-OE2 3.12Å; G138-V165 VanDerWaalsContact C-CG1 3.49Å; G138-V165 WeakPolarHBondContact O-CG1 3.43Å
139	T	96.3	Very high	97.6	Very high	1 Å²	1	5.6 Å²	5.6	1%	0.006	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-1.1	-179.5	62.9	0	0	0	0	114.9	Y89 I109 L111 S137 Y141 Y168 A169	Y89-T139 WeakPolarHBondContact CD1-O 3.34Å; I109-T139 HydrophobicContact CG2-CG2 3.48Å; I109-T139 VanDerWaalsContact CG2-CG2 3.48Å; L111-T139 HydrophobicContact CD1-CG2 3.36Å; L111-T139 HydrophobicContact CG-CG2 4.24Å; S137-T139 PolarHBondContact O-N 3.06Å; T139-Y141 PolarHBondContact O-N 2.9Å; T139-Y168 HydrophobicContact CG2-CD1 3.82Å; T139-Y168 HydrophobicContact CG2-CE1 3.57Å; T139-A169 WeakPolarHBondContact O-CA 3.24Å; T139-A169 WeakPolarHBondContact O-CB 3.49Å
140	G	97.4	Very high	97.6	Very high	0 Å²	0	3.9 Å²	3.9	0%	0	2%	0.023	C	C	.	.	S	Bend	trans	79.2	-2.1	-175.2	0	0	0	0	0	114.2	S137 G138 L142 S143 S144	S137-G140 PolarHBondContact O-N 3.31Å; S137-G140 VanDerWaalsContact O-N 3.07Å; G138-G140 PolarHBondContact O-N 3Å; G140-L142 PolarHBondContact O-N 3.43Å; G140-S143 CarbonylContact O-C 3.59Å; G140-S143 WeakPolarHBondContact O-CB 2.9Å; G140-S143 PolarHBondContact O-N 3.44Å; G140-S143 VanDerWaalsContact O-N 3.1Å; G140-S144 PolarHBondContact O-N 3.44Å; G140-S144 PolarHBondContact O-OG 3.12Å; G140-S144 VanDerWaalsContact O-OG 3.12Å
141	Y	98.2	Very high	97.5	Very high	1 Å²	1	2.7 Å²	2.7	0%	0.004	2%	0.018	C	C	.	.	H	α-helix	trans	-52.5	-53.8	-177.9	178.2	-113.8	0	0	0	113.1	I84 R86 Y89 L111 Y117 T139 S143 S144 M145	I84-Y141 HydrophobicContact CB-CE2 4.36Å; I84-Y141 HydrophobicContact CG2-CD2 3.92Å; I84-Y141 HydrophobicContact CG2-CE2 3.76Å; R86-Y141 HydrophobicContact CB-CE2 4.1Å; R86-Y141 HydrophobicContact CG-CE1 4.5Å; R86-Y141 HydrophobicContact CG-CE2 4.46Å; Y89-Y141 HydrophobicContact CD1-CD2 4.21Å; Y89-Y141 HydrophobicContact CD1-CG 4.41Å; Y89-Y141 AromaticContact CD2-CD2 3.53Å; Y89-Y141 HydrophobicContact CD2-CD2 3.53Å; Y89-Y141 HydrophobicContact CD2-CE2 4.27Å; Y89-Y141 HydrophobicContact CD2-CG 4.45Å; Y89-Y141 VanDerWaalsContact CE1-CA 3.46Å; Y89-Y141 AromaticContact CE2-CD2 3.93Å; Y89-Y141 HydrophobicContact CE2-CD2 3.93Å; Y89-Y141 AromaticContact CG-CD2 3.69Å; Y89-Y141 HydrophobicContact CG-CD2 3.69Å; Y89-Y141 HydrophobicContact CG-CG 4.18Å; L111-Y141 HydrophobicContact CD2-CD1 4.31Å; L111-Y141 HydrophobicContact CD2-CG 4.21Å; Y117-Y141 AromaticContact CD2-CD1 3.78Å; Y117-Y141 HydrophobicContact CD2-CD1 3.78Å; Y117-Y141 AromaticContact CD2-CE1 3.84Å; Y117-Y141 HydrophobicContact CD2-CE1 3.84Å; Y117-Y141 AromaticContact CE2-CD1 3.63Å; Y117-Y141 HydrophobicContact CE2-CD1 3.63Å; Y117-Y141 HydrophobicContact CE2-CE1 4.14Å; T139-Y141 PolarHBondContact O-N 2.9Å; Y141-S143 PolarHBondContact O-N 2.93Å; Y141-S144 PolarHBondContact O-N 3.02Å; Y141-M145 HydrophobicContact CD1-CE 3.6Å; Y141-M145 HydrophobicContact CE1-CE 3.23Å; Y141-M145 HydrophobicContact CE1-SD 3.86Å; Y141-M145 HydrophobicContact CE2-CE 4.4Å; Y141-M145 HydrophobicContact CE2-SD 4.22Å; Y141-M145 HydrophobicContact CG-CE 4.32Å; Y141-M145 PolarHBondContact O-N 3.42Å; Y141-M145 VanDerWaalsContact O-N 3.11Å
142	L	98.4	Very high	97.2	Very high	2 Å²	2	2.9 Å²	2.9	1%	0.01	2%	0.02	C	C	.	.	H	α-helix	trans	-62	-45.3	176.4	-178.8	68.3	0	0	0	111.4	Y117 V120 M121 G140 S144 M145 V146 Y212	Y117-L142 HydrophobicContact CD1-CB 4.13Å; Y117-L142 HydrophobicContact CD1-CD1 3.89Å; Y117-L142 HydrophobicContact CD1-CD2 4.06Å; Y117-L142 HydrophobicContact CD1-CG 4.25Å; Y117-L142 HydrophobicContact CE1-CB 3.94Å; Y117-L142 HydrophobicContact CE1-CD2 4.1Å; Y117-L142 HydrophobicContact CE1-CG 4.42Å; Y117-L142 HydrophobicContact CG-CD1 4.32Å; V120-L142 HydrophobicContact CG1-CD2 4.25Å; M121-L142 HydrophobicContact CG-CD1 3.65Å; M121-L142 HydrophobicContact SD-CD1 3.88Å; G140-L142 PolarHBondContact O-N 3.43Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.13Å; L142-M145 HydrophobicContact CD1-CE 4.1Å; L142-M145 PolarHBondContact O-N 3.32Å; L142-M145 VanDerWaalsContact O-N 3.15Å; L142-V146 HydrophobicContact CD1-CG2 4.31Å; L142-V146 HydrophobicContact CG-CG2 4.28Å; L142-V146 VanDerWaalsContact O-CG2 3.27Å; L142-V146 WeakPolarHBondContact O-CG2 3.49Å; L142-V146 PolarHBondContact O-N 3.25Å; L142-Y212 HydrophobicContact CD2-CD1 3.31Å; L142-Y212 HydrophobicContact CD2-CE1 3.45Å; L142-Y212 VanDerWaalsContact CD2-CE1 3.45Å; L142-Y212 HydrophobicContact CD2-CG 4.15Å
143	S	98.4	Very high	97	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-60.4	-37	179.6	-74.9	0	0	0	0	112.3	N134 G140 Y141 G147 N156	N134-S143 PolarHBondContact ND2-OG 3.34Å; G140-S143 CarbonylContact O-C 3.59Å; G140-S143 WeakPolarHBondContact O-CB 2.9Å; G140-S143 PolarHBondContact O-N 3.44Å; G140-S143 VanDerWaalsContact O-N 3.1Å; Y141-S143 PolarHBondContact O-N 2.93Å; S143-G147 PolarHBondContact O-N 3.47Å; S143-N156 PolarHBondContact O-ND2 3.26Å
144	S	98.2	Very high	96.9	Very high	0 Å²	0	10.1 Å²	10.1	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-67.4	-44.2	174.4	-59.2	0	0	0	0	111.4	I84 Y89 G140 Y141 L142 V146 G147 L148 F188	I84-S144 WeakPolarHBondContact CD1-O 3.49Å; Y89-S144 WeakPolarHBondContact OH-CB 3.4Å; Y89-S144 PolarHBondContact OH-OG 2.97Å; G140-S144 PolarHBondContact O-N 3.44Å; G140-S144 PolarHBondContact O-OG 3.12Å; G140-S144 VanDerWaalsContact O-OG 3.12Å; Y141-S144 PolarHBondContact O-N 3.02Å; L142-S144 VanDerWaalsContact C-N 3.28Å; L142-S144 PolarHBondContact O-N 3.13Å; S144-V146 VanDerWaalsContact C-N 3.34Å; S144-V146 PolarHBondContact O-N 3.37Å; S144-G147 WeakPolarHBondContact O-CA 3.03Å; S144-G147 PolarHBondContact O-N 3.47Å; S144-L148 PolarHBondContact O-N 3.4Å; S144-F188 WeakPolarHBondContact O-CE2 3.44Å
145	M	98.4	Very high	96.8	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-62.4	-43.7	177.6	-71.7	-172.6	-65.6	0	0	111.3	A80 F81 I84 M121 Y141 L142 G147 L148	A80-M145 HydrophobicContact CB-CB 4.29Å; F81-M145 HydrophobicContact CD1-SD 3.92Å; F81-M145 HydrophobicContact CD2-SD 3.91Å; F81-M145 HydrophobicContact CE1-CE 4.28Å; F81-M145 HydrophobicContact CE1-SD 4.09Å; F81-M145 HydrophobicContact CE2-CE 4.32Å; F81-M145 HydrophobicContact CE2-SD 4.09Å; F81-M145 HydrophobicContact CG-SD 3.85Å; F81-M145 HydrophobicContact CZ-CE 4.09Å; F81-M145 HydrophobicContact CZ-SD 4.17Å; I84-M145 HydrophobicContact CB-CG 4.03Å; I84-M145 HydrophobicContact CD1-CB 4.34Å; I84-M145 HydrophobicContact CD1-CG 3.84Å; I84-M145 VanDerWaalsContact CD1-N 3.3Å; I84-M145 HydrophobicContact CG1-CG 4.14Å; M121-M145 HydrophobicContact CE-CB 3.94Å; M121-M145 HydrophobicContact SD-CB 4.04Å; M121-M145 HydrophobicContact SD-CE 3.88Å; M121-M145 HydrophobicContact SD-SD 4.18Å; Y141-M145 HydrophobicContact CD1-CE 3.6Å; Y141-M145 HydrophobicContact CE1-CE 3.23Å; Y141-M145 HydrophobicContact CE1-SD 3.86Å; Y141-M145 HydrophobicContact CE2-CE 4.4Å; Y141-M145 HydrophobicContact CE2-SD 4.22Å; Y141-M145 HydrophobicContact CG-CE 4.32Å; Y141-M145 PolarHBondContact O-N 3.42Å; Y141-M145 VanDerWaalsContact O-N 3.11Å; L142-M145 HydrophobicContact CD1-CE 4.1Å; L142-M145 PolarHBondContact O-N 3.32Å; L142-M145 VanDerWaalsContact O-N 3.15Å; M145-G147 PolarHBondContact O-N 2.87Å; M145-L148 PolarHBondContact O-N 3.43Å
146	V	98.6	Very high	96.9	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-60.1	-38.7	173.7	174.6	0	0	0	0	110.9	L126 F132 L142 S144 L148 I149 L150	L126-V146 HydrophobicContact CD1-CB 4.33Å; L126-V146 HydrophobicContact CD1-CG1 4.09Å; L126-V146 HydrophobicContact CD1-CG2 3.69Å; L126-V146 HydrophobicContact CD2-CG1 3.88Å; F132-V146 HydrophobicContact CB-CG1 4.09Å; F132-V146 HydrophobicContact CD1-CB 4.05Å; F132-V146 HydrophobicContact CD1-CG1 3.44Å; F132-V146 VanDerWaalsContact CD1-CG1 3.44Å; F132-V146 HydrophobicContact CD1-CG2 4.29Å; F132-V146 HydrophobicContact CD2-CG1 4.41Å; F132-V146 HydrophobicContact CE1-CB 4Å; F132-V146 HydrophobicContact CE1-CG1 3.87Å; F132-V146 HydrophobicContact CE1-CG2 3.82Å; F132-V146 HydrophobicContact CG-CG1 3.73Å; F132-V146 HydrophobicContact CZ-CG2 4.04Å; L142-V146 HydrophobicContact CD1-CG2 4.31Å; L142-V146 HydrophobicContact CG-CG2 4.28Å; L142-V146 VanDerWaalsContact O-CG2 3.27Å; L142-V146 WeakPolarHBondContact O-CG2 3.49Å; L142-V146 PolarHBondContact O-N 3.25Å; S144-V146 VanDerWaalsContact C-N 3.34Å; S144-V146 PolarHBondContact O-N 3.37Å; V146-L148 VanDerWaalsContact C-N 3.25Å; V146-L148 PolarHBondContact O-N 2.84Å; V146-I149 PolarHBondContact O-N 2.94Å; V146-L150 HydrophobicContact CG1-CD1 3.66Å; V146-L150 HydrophobicContact CG1-CD2 4.45Å; V146-L150 HydrophobicContact CG1-CG 3.77Å; V146-L150 WeakPolarHBondContact O-CG 3.21Å; V146-L150 PolarHBondContact O-N 3.39Å
147	G	98.1	Very high	97	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-56.4	-36.5	176.7	0	0	0	0	0	113.9	S143 S144 M145 I149 G151 C189	S143-G147 PolarHBondContact O-N 3.47Å; S144-G147 WeakPolarHBondContact O-CA 3.03Å; S144-G147 PolarHBondContact O-N 3.47Å; M145-G147 PolarHBondContact O-N 2.87Å; G147-I149 VanDerWaalsContact C-N 3.35Å; G147-G151 PolarHBondContact O-N 2.84Å; G147-C189 VanDerWaalsContact CA-O 3.24Å; G147-C189 WeakPolarHBondContact CA-O 3.29Å; G147-C189 PolarHBondContact O-N 2.93Å
148	L	97.4	Very high	97.1	Very high	11 Å²	11	11.4 Å²	11.4	6%	0.058	6%	0.061	C	C	.	.	H	α-helix	trans	-69	-32.1	176.3	-59.7	175.2	0	0	0	112.9	A83 I84 S144 M145 V146 F176 F186 F188	A83-L148 HydrophobicContact CB-CD1 3.43Å; A83-L148 VanDerWaalsContact CB-CD1 3.43Å; I84-L148 HydrophobicContact CD1-CD1 3.7Å; I84-L148 HydrophobicContact CD1-CG 4.21Å; I84-L148 HydrophobicContact CG1-CD1 3.52Å; S144-L148 PolarHBondContact O-N 3.4Å; M145-L148 PolarHBondContact O-N 3.43Å; V146-L148 VanDerWaalsContact C-N 3.25Å; V146-L148 PolarHBondContact O-N 2.84Å; L148-F176 HydrophobicContact CD2-CE1 4.26Å; L148-F176 HydrophobicContact CD2-CZ 3.92Å; L148-F186 HydrophobicContact CB-CB 4.43Å; L148-F186 HydrophobicContact CB-CD1 4.22Å; L148-F186 HydrophobicContact CB-CG 4.29Å; L148-F186 HydrophobicContact CD1-CD2 4.38Å; L148-F186 HydrophobicContact CD1-CG 4.43Å; L148-F186 HydrophobicContact CD2-CB 3.5Å; L148-F186 VanDerWaalsContact CD2-CB 3.5Å; L148-F186 HydrophobicContact CD2-CD2 4.15Å; L148-F186 HydrophobicContact CD2-CG 3.82Å; L148-F186 HydrophobicContact CG-CB 4.47Å; L148-F186 HydrophobicContact CG-CG 4.41Å; L148-F188 HydrophobicContact CD2-CD2 3.52Å; L148-F188 HydrophobicContact CD2-CE2 4.03Å; L148-F188 HydrophobicContact CD2-CG 4.44Å; L148-F188 HydrophobicContact CG-CD2 4.1Å; L148-F188 HydrophobicContact CG-CE2 4.3Å
149	I	97.9	Very high	97.2	Very high	11 Å²	11	11.3 Å²	11.3	6%	0.056	6%	0.06	C	C	.	.	H	α-helix	trans	-79.8	-42.8	179.4	-59.1	177.5	0	0	0	110.9	V77 A80 M121 L126 P128 V146 G147 G151	V77-I149 HydrophobicContact CG2-CD1 4.49Å; A80-I149 HydrophobicContact CB-CD1 4.02Å; A80-I149 HydrophobicContact CB-CG1 3.96Å; M121-I149 HydrophobicContact CE-CD1 3.39Å; L126-I149 HydrophobicContact CB-CB 4.38Å; L126-I149 HydrophobicContact CB-CD1 4.41Å; L126-I149 HydrophobicContact CB-CG2 3.69Å; L126-I149 HydrophobicContact CD1-CD1 4.16Å; P128-I149 WeakPolarHBondContact CA-O 3.49Å; V146-I149 PolarHBondContact O-N 2.94Å; G147-I149 VanDerWaalsContact C-N 3.35Å; I149-G151 VanDerWaalsContact C-N 3.26Å; I149-G151 PolarHBondContact O-N 3.31Å
150	L	97.8	Very high	97.2	Very high	1 Å²	1	11.3 Å²	11.3	1%	0.005	6%	0.059	C	C	.	.	H	α-helix	trans	-66.4	-29.9	-178.7	-67.2	-176	0	0	0	112.7	L126 Q127 P128 G129 L130 F132 V146 V155 N156 C189	L126-L150 HydrophobicContact CD2-CD2 4.27Å; Q127-L150 WeakPolarHBondContact O-CD2 3.43Å; P128-L150 CarbonylContact C-O 3.58Å; P128-L150 VanDerWaalsContact CA-O 3.31Å; P128-L150 WeakPolarHBondContact CA-O 3.47Å; G129-L150 PolarHBondContact N-O 2.84Å; L130-L150 HydrophobicContact CB-CD2 3.78Å; L130-L150 WeakPolarHBondContact O-CD2 3.43Å; F132-L150 HydrophobicContact CB-CD1 3.76Å; V146-L150 HydrophobicContact CG1-CD1 3.66Å; V146-L150 HydrophobicContact CG1-CD2 4.45Å; V146-L150 HydrophobicContact CG1-CG 3.77Å; V146-L150 WeakPolarHBondContact O-CG 3.21Å; V146-L150 PolarHBondContact O-N 3.39Å; L150-V155 WeakPolarHBondContact CD1-O 3.47Å; L150-N156 HydrophobicContact CD1-CB 4.13Å; L150-C189 HydrophobicContact CB-CB 3.82Å; L150-C189 HydrophobicContact CD1-CB 4.47Å
151	G	94.8	Very high	97.1	Very high	6 Å²	6	13.6 Å²	13.6	6%	0.062	7%	0.072	C	C	.	.			trans	63.6	-169.9	-179.1	0	0	0	0	0	113.1	G147 I149 F153 G154 C189	G147-G151 PolarHBondContact O-N 2.84Å; I149-G151 VanDerWaalsContact C-N 3.26Å; I149-G151 PolarHBondContact O-N 3.31Å; G151-F153 PolarHBondContact O-N 2.84Å; G151-F153 VanDerWaalsContact O-N 3.12Å; G151-G154 PolarHBondContact O-N 3.37Å; G151-C189 WeakPolarHBondContact O-CB 3.4Å; G151-C189 PolarHBondContact O-N 3.37Å
152	P	92.6	Very high	96.9	Very high	13 Å²	13	15.6 Å²	15.6	8%	0.084	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-17.7	-162.8	27.6	-25.6	0	0	0	113.1	D187 R289 I297	P152-D187 HydrophobicContact CG-CB 4.05Å; P152-R289 PolarHBondContact O-NE 2.97Å; P152-R289 PolarHBondContact O-NH2 3.22Å; P152-I297 HydrophobicContact CB-CD1 3.58Å; P152-I297 HydrophobicContact CB-CG1 4.13Å; P152-I297 HydrophobicContact CB-CG2 4.38Å; P152-I297 HydrophobicContact CG-CD1 4.27Å; P152-I297 HydrophobicContact CG-CG2 3.88Å
153	F	93.8	Very high	96.8	Very high	139 Å²	139	19.2 Å²	19.2	61%	0.61	11%	0.106	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98.1	1.5	-177.9	-54.8	-67	0	0	0	113.6	G151 L294	G151-F153 PolarHBondContact O-N 2.84Å; G151-F153 VanDerWaalsContact O-N 3.12Å; F153-L294 HydrophobicContact CE1-CD2 3.77Å
154	G	96.1	Very high	96.7	Very high	13 Å²	13	22.6 Å²	22.6	13%	0.134	13%	0.125	C	C	.	.	S	Bend	trans	-78.7	176.6	174.9	0	0	0	0	0	113.5	L130 G151 C189	L130-G154 VanDerWaalsContact O-CA 3.25Å; L130-G154 WeakPolarHBondContact O-CA 3.31Å; G151-G154 PolarHBondContact O-N 3.37Å; G154-C189 PolarHBondContact O-SG 3.06Å
155	V	97.4	Very high	96.6	Very high	24 Å²	24	22.6 Å²	22.6	15%	0.145	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	132.8	169.2	177.8	0	0	0	0	107.7	L130 S131 F132 L150 Y208 V286	L130-V155 PolarHBondContact O-N 2.91Å; S131-V155 CarbonylContact C-O 3.51Å; S131-V155 WeakPolarHBondContact CA-O 3.32Å; F132-V155 PolarHBondContact N-O 3.03Å; L150-V155 WeakPolarHBondContact CD1-O 3.47Å; V155-Y208 HydrophobicContact CG1-CE1 4.28Å; V155-V286 HydrophobicContact CG1-CG2 4.07Å; V155-V286 HydrophobicContact CG2-CB 4.5Å; V155-V286 HydrophobicContact CG2-CG1 3.69Å; V155-V286 HydrophobicContact CG2-CG2 4.01Å
156	N	98.1	Very high	96.5	Very high	4 Å²	4	22.8 Å²	22.8	2%	0.021	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	98.9	-174.9	-173.4	-2.7	0	0	0	109.6	S143 L150 C189 P191 S192	S143-N156 PolarHBondContact O-ND2 3.26Å; L150-N156 HydrophobicContact CD1-CB 4.13Å; N156-C189 HydrophobicContact CB-CB 4.29Å; N156-C189 VanDerWaalsContact CB-SG 3.54Å; N156-C189 PolarHBondContact ND2-O 3.1Å; N156-P191 HydrophobicContact CB-CB 4.45Å; N156-P191 WeakPolarHBondContact O-CA 3.48Å; N156-S192 PolarHBondContact O-N 3.2Å
157	H	98.3	Very high	96.4	Very high	12 Å²	12	28.6 Å²	28.6	6%	0.056	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	138.6	-178.8	-66.5	162	0	0	0	110.7	F132 L133 N134 S192 Y208 P284	F132-H157 PolarHBondContact O-N 2.8Å; L133-H157 CarbonylContact C-O 3.55Å; L133-H157 WeakPolarHBondContact CA-O 3.36Å; L133-H157 HydrophobicContact CD1-CB 3.96Å; N134-H157 PolarHBondContact N-O 2.9Å; H157-S192 WeakPolarHBondContact CA-O 3.26Å; H157-Y208 HydrophobicContact CB-CE1 4.37Å; H157-Y208 AromaticContact ND1-CE1 3.72Å; H157-Y208 AromaticContact ND1-CZ 3.67Å; H157-Y208 PolarHBondContact ND1-OH 3.5Å; H157-P284 PolarHBondContact CE1-O 3.49Å
158	G	97.5	Very high	96.4	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	133.9	173.6	0	0	0	0	0	111.2	N134 S192 F193 V194	N134-G158 CarbonylContact O-C 3.49Å; N134-G158 WeakPolarHBondContact O-CA 3.15Å; G158-S192 PolarHBondContact N-O 2.96Å; G158-F193 CarbonylContact O-C 3.57Å; G158-F193 WeakPolarHBondContact O-CA 3.36Å; G158-V194 PolarHBondContact O-N 3.18Å
159	V	97.3	Very high	96.4	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	127.8	170.7	-177.6	0	0	0	0	107.9	L133 N134 L135 G136 S137 V194 G196 I201 V281 L283	L133-V159 HydrophobicContact CD1-CG2 4.2Å; N134-V159 PolarHBondContact O-N 3.3Å; L135-V159 HydrophobicContact CD2-CB 4.37Å; L135-V159 HydrophobicContact CD2-CG2 4.37Å; G136-V159 WeakPolarHBondContact CA-O 3.31Å; G136-V159 PolarHBondContact N-O 2.79Å; S137-V159 PolarHBondContact N-O 2.89Å; V159-V194 WeakPolarHBondContact CA-O 3.49Å; V159-G196 WeakPolarHBondContact CG1-O 3.36Å; V159-I201 HydrophobicContact CG2-CD1 4.22Å; V159-V281 HydrophobicContact CG1-CG1 4.34Å; V159-L283 HydrophobicContact CG2-CD2 3.54Å
160	E	96.5	Very high	96.4	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	139.6	176.6	168.8	57.2	-118.4	0	0	109.3	S137 G138 H162 V165 I166 V194 T195 G196	S137-E160 WeakPolarHBondContact OG-CB 3.4Å; G138-E160 PolarHBondContact N-OE2 3.34Å; G138-E160 VanDerWaalsContact N-OE2 3.12Å; E160-H162 IonicContact OE1-CD2 3.13Å; E160-H162 IonicContact OE1-CG 2.69Å; E160-H162 PolarHBondContact OE1-N 3.44Å; E160-H162 VanDerWaalsContact OE1-N 3.08Å; E160-V165 HydrophobicContact CG-CB 3.85Å; E160-V165 HydrophobicContact CG-CG1 3.82Å; E160-I166 HydrophobicContact CB-CD1 3.9Å; E160-I166 HydrophobicContact CB-CG1 3.68Å; E160-I166 HydrophobicContact CG-CD1 4.48Å; E160-I166 HydrophobicContact CG-CG1 3.93Å; E160-V194 PolarHBondContact N-O 2.98Å; E160-V194 VanDerWaalsContact N-O 3.09Å; E160-T195 CarbonylContact O-C 3.58Å; E160-T195 VanDerWaalsContact O-CA 3.24Å; E160-T195 WeakPolarHBondContact O-CA 3.37Å; E160-G196 CarbonylContact C-O 3.53Å; E160-G196 PolarHBondContact O-N 2.74Å
161	L	94.6	Very high	96.4	Very high	49 Å²	49	38.9 Å²	38.9	26%	0.257	20%	0.198	S	C	.	.	S	Bend	trans	-74.2	-37.2	-174.1	179.5	69.8	0	0	0	112	F2 G196 N197 I268	F2-L161 HydrophobicContact CD2-CB 4.17Å; F2-L161 HydrophobicContact CE2-CB 3.73Å; F2-L161 HydrophobicContact CE2-CD2 4.2Å; L161-G196 WeakPolarHBondContact CA-O 3.36Å; L161-N197 HydrophobicContact CD1-CB 4.25Å; L161-I268 HydrophobicContact CD2-CB 4.39Å; L161-I268 HydrophobicContact CD2-CD1 3.3Å; L161-I268 HydrophobicContact CD2-CG1 4.27Å
162	H	94.8	Very high	96.5	Very high	42 Å²	42	40.3 Å²	40.3	19%	0.194	20%	0.202	C	C	.	.			trans	-94.1	118.9	-171.2	-67.3	-72	0	0	0	111	N108 E160 D164 V165 I166	N108-H162 HydrophobicContact CB-CB 4.15Å; E160-H162 IonicContact OE1-CD2 3.13Å; E160-H162 IonicContact OE1-CG 2.69Å; E160-H162 PolarHBondContact OE1-N 3.44Å; E160-H162 VanDerWaalsContact OE1-N 3.08Å; H162-D164 VanDerWaalsContact C-N 3.34Å; H162-D164 WeakPolarHBondContact CB-OD1 3.48Å; H162-D164 PolarHBondContact O-N 3.49Å; H162-V165 HydrophobicContact CB-CB 4.03Å; H162-V165 HydrophobicContact CB-CG2 3.58Å; H162-V165 WeakPolarHBondContact O-CB 3.5Å; H162-V165 PolarHBondContact O-N 3.34Å; H162-V165 VanDerWaalsContact O-N 3.16Å; H162-I166 PolarHBondContact O-N 2.8Å
163	S	95.4	Very high	96.7	Very high	79 Å²	79	40 Å²	40	55%	0.552	20%	0.2	S	C	*	.	H	α-helix	trans	-65.2	-35.6	-176.6	54.3	0	0	0	0	113.3	V165 I166 E167	S163-V165 VanDerWaalsContact C-N 3.29Å; S163-V165 PolarHBondContact O-N 2.81Å; S163-I166 PolarHBondContact O-N 2.85Å; S163-E167 PolarHBondContact O-N 3.45Å
164	D	96.3	Very high	96.7	Very high	71 Å²	71	36.7 Å²	36.7	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-60.7	-37.6	173.1	55.1	-46.3	0	0	0	111.7	N108 H162 E167 Y168	N108-D164 PolarHBondContact ND2-OD1 3.1Å; N108-D164 PolarHBondContact ND2-OD2 2.81Å; H162-D164 VanDerWaalsContact C-N 3.34Å; H162-D164 WeakPolarHBondContact CB-OD1 3.48Å; H162-D164 PolarHBondContact O-N 3.49Å; D164-E167 PolarHBondContact O-N 2.81Å; D164-Y168 WeakPolarHBondContact O-CB 3.25Å; D164-Y168 PolarHBondContact O-N 3.45Å
165	V	96.6	Very high	96.6	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-69.9	-36	176.9	-178.3	0	0	0	0	111.3	N108 I109 G138 E160 H162 S163 Y168 A169	N108-V165 HydrophobicContact CB-CG2 3.46Å; N108-V165 VanDerWaalsContact CB-CG2 3.46Å; I109-V165 HydrophobicContact CG1-CG2 4.36Å; G138-V165 VanDerWaalsContact C-CG1 3.49Å; G138-V165 WeakPolarHBondContact O-CG1 3.43Å; E160-V165 HydrophobicContact CG-CB 3.85Å; E160-V165 HydrophobicContact CG-CG1 3.82Å; H162-V165 HydrophobicContact CB-CB 4.03Å; H162-V165 HydrophobicContact CB-CG2 3.58Å; H162-V165 WeakPolarHBondContact O-CB 3.5Å; H162-V165 PolarHBondContact O-N 3.34Å; H162-V165 VanDerWaalsContact O-N 3.16Å; S163-V165 VanDerWaalsContact C-N 3.29Å; S163-V165 PolarHBondContact O-N 2.81Å; V165-Y168 WeakPolarHBondContact O-CB 3.33Å; V165-Y168 PolarHBondContact O-N 3.15Å; V165-A169 WeakPolarHBondContact O-CB 3.44Å; V165-A169 PolarHBondContact O-N 3.44Å
166	I	96.4	Very high	96.5	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-67.8	-41.3	174.7	-74.9	-179.6	0	0	0	112	E160 H162 S163 Y168 A169 K170 F193 V194 T195	E160-I166 HydrophobicContact CB-CD1 3.9Å; E160-I166 HydrophobicContact CB-CG1 3.68Å; E160-I166 HydrophobicContact CG-CD1 4.48Å; E160-I166 HydrophobicContact CG-CG1 3.93Å; H162-I166 PolarHBondContact O-N 2.8Å; S163-I166 PolarHBondContact O-N 2.85Å; I166-Y168 VanDerWaalsContact C-N 3.29Å; I166-Y168 PolarHBondContact O-N 2.94Å; I166-A169 PolarHBondContact O-N 2.94Å; I166-K170 HydrophobicContact CG2-CD 4.09Å; I166-K170 HydrophobicContact CG2-CG 4.48Å; I166-K170 WeakPolarHBondContact O-CG 3.36Å; I166-K170 PolarHBondContact O-N 2.81Å; I166-F193 HydrophobicContact CG1-CB 4.38Å; I166-F193 HydrophobicContact CG2-CB 4.05Å; I166-V194 VanDerWaalsContact CD1-O 3.28Å; I166-V194 WeakPolarHBondContact CD1-O 3.29Å; I166-T195 HydrophobicContact CD1-CG2 4.37Å; I166-T195 VanDerWaalsContact CD1-OG1 3.31Å; I166-T195 WeakPolarHBondContact CD1-OG1 3.3Å
167	E	97.6	Very high	96.1	Very high	121 Å²	121	40.4 Å²	40.4	57%	0.565	20%	0.2	S	C	*	.	H	α-helix	trans	-59.2	-46.2	174.7	-176.8	172.3	-167.1	0	0	110.4	S163 D164 A169 K170 Q171	S163-E167 PolarHBondContact O-N 3.45Å; D164-E167 PolarHBondContact O-N 2.81Å; E167-A169 PolarHBondContact O-N 3.41Å; E167-K170 PolarHBondContact O-N 3.12Å; E167-Q171 VanDerWaalsContact O-CG 3.32Å; E167-Q171 WeakPolarHBondContact O-CG 3.33Å; E167-Q171 PolarHBondContact O-N 2.92Å
168	Y	97.8	Very high	95.6	Very high	19 Å²	19	46.9 Å²	46.9	8%	0.075	22%	0.224	C	C	.	.	H	α-helix	trans	-58.6	-46.4	174.1	-174.7	-98.2	0	0	0	112.5	Y89 Y90 L91 I109 T139 D164 V165 I166 K170 Q171 K172	Y89-Y168 WeakPolarHBondContact O-CE1 3.28Å; Y89-Y168 PolarHBondContact O-OH 2.91Å; Y90-Y168 PolarHBondContact O-OH 2.95Å; L91-Y168 HydrophobicContact CD2-CE2 3.67Å; L91-Y168 PolarHBondContact N-OH 3.22Å; I109-Y168 HydrophobicContact CD1-CD1 4.09Å; I109-Y168 HydrophobicContact CD1-CD2 3.79Å; I109-Y168 HydrophobicContact CD1-CE1 4.32Å; I109-Y168 HydrophobicContact CD1-CE2 4.03Å; I109-Y168 HydrophobicContact CD1-CG 3.79Å; I109-Y168 HydrophobicContact CG2-CD1 4.29Å; I109-Y168 HydrophobicContact CG2-CE1 4.02Å; T139-Y168 HydrophobicContact CG2-CD1 3.82Å; T139-Y168 HydrophobicContact CG2-CE1 3.57Å; D164-Y168 WeakPolarHBondContact O-CB 3.25Å; D164-Y168 PolarHBondContact O-N 3.45Å; V165-Y168 WeakPolarHBondContact O-CB 3.33Å; V165-Y168 PolarHBondContact O-N 3.15Å; I166-Y168 VanDerWaalsContact C-N 3.29Å; I166-Y168 PolarHBondContact O-N 2.94Å; Y168-K170 VanDerWaalsContact C-N 3.33Å; Y168-K170 PolarHBondContact O-N 3.38Å; Y168-Q171 WeakPolarHBondContact O-CB 3.18Å; Y168-Q171 PolarHBondContact O-N 3.37Å; Y168-K172 HydrophobicContact CD1-CG 4.15Å; Y168-K172 HydrophobicContact CE1-CD 4.46Å; Y168-K172 HydrophobicContact CE1-CG 3.81Å; Y168-K172 VanDerWaalsContact CE2-CE 3.47Å; Y168-K172 WeakPolarHBondContact O-CG 3.09Å; Y168-K172 PolarHBondContact O-N 3.15Å; Y168-K172 WeakPolarHBondContact OH-CE 3.41Å; Y168-K172 PolarHBondContact OH-NZ 2.84Å
169	A	97.8	Very high	95	Very high	1 Å²	1	49.4 Å²	49.4	1%	0.008	24%	0.239	C	C	.	.	H	α-helix	trans	-60.2	-41.5	178.2	0	0	0	0	0	112.5	T139 V165 I166 E167 K172 L173 F193	T139-A169 WeakPolarHBondContact O-CA 3.24Å; T139-A169 WeakPolarHBondContact O-CB 3.49Å; V165-A169 WeakPolarHBondContact O-CB 3.44Å; V165-A169 PolarHBondContact O-N 3.44Å; I166-A169 PolarHBondContact O-N 2.94Å; E167-A169 PolarHBondContact O-N 3.41Å; A169-K172 PolarHBondContact O-N 2.96Å; A169-L173 WeakPolarHBondContact O-CB 3.16Å; A169-L173 PolarHBondContact O-N 2.92Å; A169-F193 HydrophobicContact CB-CD2 4.2Å; A169-F193 HydrophobicContact CB-CE2 4.02Å; A169-F193 HydrophobicContact CB-CZ 4.25Å
170	K	97.8	Very high	94.5	Very high	113 Å²	113	50.3 Å²	50.3	49%	0.491	25%	0.246	S	C	.	.	H	α-helix	trans	-64.9	-40.5	175.6	-73	173.9	178.8	177.4	0	112	I166 E167 Y168 L173 D174 F193	I166-K170 HydrophobicContact CG2-CD 4.09Å; I166-K170 HydrophobicContact CG2-CG 4.48Å; I166-K170 WeakPolarHBondContact O-CG 3.36Å; I166-K170 PolarHBondContact O-N 2.81Å; E167-K170 PolarHBondContact O-N 3.12Å; Y168-K170 VanDerWaalsContact C-N 3.33Å; Y168-K170 PolarHBondContact O-N 3.38Å; K170-L173 PolarHBondContact O-N 3.19Å; K170-D174 WeakPolarHBondContact O-CB 3.5Å; K170-D174 PolarHBondContact O-N 3.11Å; K170-F193 HydrophobicContact CG-CD2 4.22Å
171	Q	97.5	Very high	93.8	Very high	107 Å²	107	53.1 Å²	53.1	50%	0.5	26%	0.261	S	S	.	.	H	α-helix	trans	-62.9	-44.2	175.6	-70.7	171.8	6	0	0	111.7	E167 Y168 D174 F175	E167-Q171 VanDerWaalsContact O-CG 3.32Å; E167-Q171 WeakPolarHBondContact O-CG 3.33Å; E167-Q171 PolarHBondContact O-N 2.92Å; Y168-Q171 WeakPolarHBondContact O-CB 3.18Å; Y168-Q171 PolarHBondContact O-N 3.37Å; Q171-D174 PolarHBondContact O-N 3.38Å; Q171-F175 WeakPolarHBondContact O-CB 3.38Å; Q171-F175 PolarHBondContact O-N 3.05Å
172	K	97.1	Very high	93.3	Very high	35 Å²	35	51.8 Å²	51.8	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-66.4	-37.2	177.1	-64.3	-49.1	-167.1	161.9	0	112.7	D88 Y89 Y90 Y168 A169 F175 F176	D88-K172 WeakPolarHBondContact O-CD 3.35Å; D88-K172 WeakPolarHBondContact O-CE 3.37Å; D88-K172 PolarHBondContact O-NZ 3.43Å; Y89-K172 HydrophobicContact CD1-CB 3.84Å; Y89-K172 HydrophobicContact CD1-CG 4.21Å; Y89-K172 HydrophobicContact CE1-CB 3.75Å; Y89-K172 HydrophobicContact CG-CB 4.49Å; Y90-K172 PolarHBondContact O-NZ 2.65Å; Y168-K172 HydrophobicContact CD1-CG 4.15Å; Y168-K172 HydrophobicContact CE1-CD 4.46Å; Y168-K172 HydrophobicContact CE1-CG 3.81Å; Y168-K172 VanDerWaalsContact CE2-CE 3.47Å; Y168-K172 WeakPolarHBondContact O-CG 3.09Å; Y168-K172 PolarHBondContact O-N 3.15Å; Y168-K172 WeakPolarHBondContact OH-CE 3.41Å; Y168-K172 PolarHBondContact OH-NZ 2.84Å; A169-K172 PolarHBondContact O-N 2.96Å; K172-F175 PolarHBondContact O-N 3.29Å; K172-F176 WeakPolarHBondContact O-CB 3.23Å; K172-F176 PolarHBondContact O-N 2.99Å
173	L	96.1	Very high	92.8	Very high	8 Å²	8	50.2 Å²	50.2	4%	0.042	25%	0.248	C	C	.	.	H	α-helix	trans	-64.1	-48.8	173.8	179.4	64.5	0	0	0	112.2	A169 K170 F175 F176 I177 F188 E190 P191 F193	A169-L173 WeakPolarHBondContact O-CB 3.16Å; A169-L173 PolarHBondContact O-N 2.92Å; K170-L173 PolarHBondContact O-N 3.19Å; L173-F175 VanDerWaalsContact C-N 3.3Å; L173-F175 PolarHBondContact O-N 3.4Å; L173-F176 PolarHBondContact O-N 2.96Å; L173-I177 HydrophobicContact CD1-CD1 4.1Å; L173-I177 HydrophobicContact CD1-CG1 4.42Å; L173-I177 HydrophobicContact CG-CD1 3.96Å; L173-I177 WeakPolarHBondContact O-CG1 3.45Å; L173-I177 PolarHBondContact O-N 2.83Å; L173-F188 HydrophobicContact CD1-CE1 3.77Å; L173-F188 HydrophobicContact CD1-CZ 3.64Å; L173-E190 HydrophobicContact CD2-CG 3.82Å; L173-P191 HydrophobicContact CD1-CG 3.92Å; L173-P191 HydrophobicContact CD2-CG 3.84Å; L173-P191 HydrophobicContact CG-CG 4.48Å; L173-F193 HydrophobicContact CD2-CE2 4.2Å
174	D	94.7	Very high	92.3	Very high	68 Å²	68	46.6 Å²	46.6	36%	0.364	22%	0.222	S	C	.	.	H	α-helix	trans	-61.4	-40.7	177.2	-179.9	77	0	0	0	111	K170 Q171 I177 R178	K170-D174 WeakPolarHBondContact O-CB 3.5Å; K170-D174 PolarHBondContact O-N 3.11Å; Q171-D174 PolarHBondContact O-N 3.38Å; D174-I177 PolarHBondContact O-N 2.99Å; D174-R178 WeakPolarHBondContact O-CB 3.36Å; D174-R178 VanDerWaalsContact O-CG 3.27Å; D174-R178 WeakPolarHBondContact O-CG 3.49Å; D174-R178 PolarHBondContact O-N 2.88Å; D174-R178 IonicContact OD1-CZ 2.66Å; D174-R178 VanDerWaalsContact OD1-CZ 3.3Å; D174-R178 IonicContact OD1-NE 3.51Å; D174-R178 PolarHBondContact OD1-NE 3.37Å; D174-R178 IonicContact OD1-NH2 2.85Å; D174-R178 PolarHBondContact OD1-NH2 3.47Å; D174-R178 WeakPolarHBondContact OD2-CD 3.41Å; D174-R178 IonicContact OD2-CZ 2.94Å; D174-R178 IonicContact OD2-NE 3.97Å; D174-R178 PolarHBondContact OD2-NE 3.44Å; D174-R178 IonicContact OD2-NH2 3.81Å; D174-R178 PolarHBondContact OD2-NH2 2.83Å
175	F	93.9	Very high	91.7	Very high	90 Å²	90	49.3 Å²	49.3	40%	0.395	23%	0.231	S	C	.	.	H	α-helix	trans	-56.5	-54.2	172	-179.2	-95.4	0	0	0	111.1	D88 Q171 K172 L173 I177 R178 T179	D88-F175 HydrophobicContact CB-CE1 4.31Å; Q171-F175 WeakPolarHBondContact O-CB 3.38Å; Q171-F175 PolarHBondContact O-N 3.05Å; K172-F175 PolarHBondContact O-N 3.29Å; L173-F175 VanDerWaalsContact C-N 3.3Å; L173-F175 PolarHBondContact O-N 3.4Å; F175-I177 PolarHBondContact O-N 2.9Å; F175-R178 PolarHBondContact O-N 2.96Å; F175-R178 VanDerWaalsContact O-N 3.13Å; F175-T179 HydrophobicContact CD2-CG2 3.87Å; F175-T179 VanDerWaalsContact CE1-OG1 3.29Å; F175-T179 WeakPolarHBondContact CE1-OG1 3.38Å; F175-T179 HydrophobicContact CE2-CG2 3.76Å; F175-T179 HydrophobicContact CG-CG2 4.43Å; F175-T179 HydrophobicContact CZ-CG2 4.22Å; F175-T179 WeakPolarHBondContact CZ-OG1 3.48Å; F175-T179 WeakPolarHBondContact O-CB 3.27Å; F175-T179 PolarHBondContact O-N 2.94Å; F175-T179 PolarHBondContact O-OG1 2.98Å
176	F	93.6	Very high	91.3	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.018	24%	0.24	C	C	.	.	H	α-helix	trans	-54.5	-48.6	178.7	170.5	-107.4	0	0	0	112.4	I84 L148 K172 L173 R178 S180 F183 F188	I84-F176 HydrophobicContact CD1-CE2 4.43Å; I84-F176 HydrophobicContact CD1-CZ 4.33Å; I84-F176 HydrophobicContact CG1-CE2 4.03Å; I84-F176 HydrophobicContact CG1-CZ 4.26Å; L148-F176 HydrophobicContact CD2-CE1 4.26Å; L148-F176 HydrophobicContact CD2-CZ 3.92Å; K172-F176 WeakPolarHBondContact O-CB 3.23Å; K172-F176 PolarHBondContact O-N 2.99Å; L173-F176 PolarHBondContact O-N 2.96Å; F176-R178 VanDerWaalsContact C-N 3.29Å; F176-R178 PolarHBondContact O-N 3.13Å; F176-S180 VanDerWaalsContact CD2-CB 3.46Å; F176-S180 WeakPolarHBondContact CE2-OG 3.37Å; F176-S180 WeakPolarHBondContact O-CB 3.48Å; F176-S180 PolarHBondContact O-N 3.01Å; F176-F183 HydrophobicContact CD1-CD2 4.49Å; F176-F183 HydrophobicContact CE1-CB 4.38Å; F176-F183 AromaticContact CE1-CD2 3.9Å; F176-F183 HydrophobicContact CE1-CD2 3.9Å; F176-F183 HydrophobicContact CZ-CB 4.23Å; F176-F183 HydrophobicContact CZ-CD2 4.46Å; F176-F188 HydrophobicContact CD1-CZ 4.16Å; F176-F188 HydrophobicContact CE1-CD2 4.3Å; F176-F188 HydrophobicContact CE1-CE1 4.4Å; F176-F188 AromaticContact CE1-CE2 3.9Å; F176-F188 HydrophobicContact CE1-CE2 3.9Å; F176-F188 AromaticContact CE1-CZ 3.94Å; F176-F188 HydrophobicContact CE1-CZ 3.94Å
177	I	90.3	Very high	91	Very high	25 Å²	25	54.1 Å²	54.1	13%	0.128	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-40.1	-179.5	-69	168.2	0	0	0	111	L173 D174 F175 F183 F188 E190 R407	L173-I177 HydrophobicContact CD1-CD1 4.1Å; L173-I177 HydrophobicContact CD1-CG1 4.42Å; L173-I177 HydrophobicContact CG-CD1 3.96Å; L173-I177 WeakPolarHBondContact O-CG1 3.45Å; L173-I177 PolarHBondContact O-N 2.83Å; D174-I177 PolarHBondContact O-N 2.99Å; F175-I177 PolarHBondContact O-N 2.9Å; I177-F183 HydrophobicContact CG1-CD2 4.36Å; I177-F183 HydrophobicContact CG1-CE2 4.06Å; I177-F183 HydrophobicContact CG1-CZ 4.47Å; I177-F183 HydrophobicContact CG2-CE1 4.11Å; I177-F183 HydrophobicContact CG2-CE2 4.4Å; I177-F183 HydrophobicContact CG2-CZ 4.01Å; I177-F188 HydrophobicContact CD1-CE1 4.3Å; I177-F188 HydrophobicContact CG1-CE1 4.25Å; I177-E190 HydrophobicContact CD1-CG 4.25Å; I177-R407 VanDerWaalsContact O-CD 3.29Å; I177-R407 WeakPolarHBondContact O-CD 3.32Å
178	R	86.9	Confident	90.7	Very high	149 Å²	149	48.9 Å²	48.9	56%	0.562	23%	0.23	S	C	*	.	H	α-helix	trans	-82.6	-35.1	-174.6	-71	-178.4	-169.2	-145.1	10.6	114.3	D174 F175 F176 R407	D174-R178 WeakPolarHBondContact O-CB 3.36Å; D174-R178 VanDerWaalsContact O-CG 3.27Å; D174-R178 WeakPolarHBondContact O-CG 3.49Å; D174-R178 PolarHBondContact O-N 2.88Å; D174-R178 IonicContact OD1-CZ 2.66Å; D174-R178 VanDerWaalsContact OD1-CZ 3.3Å; D174-R178 IonicContact OD1-NE 3.51Å; D174-R178 PolarHBondContact OD1-NE 3.37Å; D174-R178 IonicContact OD1-NH2 2.85Å; D174-R178 PolarHBondContact OD1-NH2 3.47Å; D174-R178 WeakPolarHBondContact OD2-CD 3.41Å; D174-R178 IonicContact OD2-CZ 2.94Å; D174-R178 IonicContact OD2-NE 3.97Å; D174-R178 PolarHBondContact OD2-NE 3.44Å; D174-R178 IonicContact OD2-NH2 3.81Å; D174-R178 PolarHBondContact OD2-NH2 2.83Å; F175-R178 PolarHBondContact O-N 2.96Å; F175-R178 VanDerWaalsContact O-N 3.13Å; F176-R178 VanDerWaalsContact C-N 3.29Å; F176-R178 PolarHBondContact O-N 3.13Å; R178-R407 WeakPolarHBondContact O-CD 3.33Å
179	T	85.5	Confident	90.6	Very high	53 Å²	53	48.2 Å²	48.2	33%	0.325	23%	0.228	S	C	.	.	H	α-helix	trans	-112.2	-23.7	-165.9	67.4	0	0	0	0	113.8	F175	F175-T179 HydrophobicContact CD2-CG2 3.87Å; F175-T179 VanDerWaalsContact CE1-OG1 3.29Å; F175-T179 WeakPolarHBondContact CE1-OG1 3.38Å; F175-T179 HydrophobicContact CE2-CG2 3.76Å; F175-T179 HydrophobicContact CG-CG2 4.43Å; F175-T179 HydrophobicContact CZ-CG2 4.22Å; F175-T179 WeakPolarHBondContact CZ-OG1 3.48Å; F175-T179 WeakPolarHBondContact O-CB 3.27Å; F175-T179 PolarHBondContact O-N 2.94Å; F175-T179 PolarHBondContact O-OG1 2.98Å
180	S	86.9	Confident	90.5	Very high	19 Å²	19	53.8 Å²	53.8	13%	0.133	25%	0.254	C	S	.	.			trans	-82.3	125.3	-174.9	-172.1	0	0	0	0	111.9	F176 S182 F183	F176-S180 VanDerWaalsContact CD2-CB 3.46Å; F176-S180 WeakPolarHBondContact CE2-OG 3.37Å; F176-S180 WeakPolarHBondContact O-CB 3.48Å; F176-S180 PolarHBondContact O-N 3.01Å; S180-S182 PolarHBondContact O-N 3.43Å; S180-S182 WeakPolarHBondContact OG-CB 3.43Å; S180-S182 PolarHBondContact OG-N 2.92Å; S180-F183 WeakPolarHBondContact O-CB 3.44Å; S180-F183 PolarHBondContact O-N 3.22Å
181	D	82.6	Confident	90.5	Very high	59 Å²	59	48.7 Å²	48.7	32%	0.316	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-25.1	169.7	-75.6	-46.7	0	0	0	112.5	F183 D184 N384	D181-F183 PolarHBondContact O-N 2.81Å; D181-D184 PolarHBondContact O-N 3.15Å; D181-N384 PolarHBondContact OD1-ND2 3.46Å
182	S	83.9	Confident	90.4	Very high	21 Å²	21	46 Å²	46	15%	0.147	23%	0.225	C	C	.	.	H	α-helix	trans	-61.4	-34.1	175.7	-63.7	0	0	0	0	111.1	A83 S180 D184 K185 F186	A83-S182 WeakPolarHBondContact O-CB 3.39Å; A83-S182 PolarHBondContact O-OG 2.99Å; S180-S182 PolarHBondContact O-N 3.43Å; S180-S182 WeakPolarHBondContact OG-CB 3.43Å; S180-S182 PolarHBondContact OG-N 2.92Å; S182-D184 PolarHBondContact O-N 3Å; S182-D184 VanDerWaalsContact O-N 3.07Å; S182-K185 WeakPolarHBondContact O-CB 3.45Å; S182-K185 PolarHBondContact O-N 3.17Å; S182-F186 WeakPolarHBondContact O-CD2 3.38Å; S182-F186 PolarHBondContact O-N 3.44Å
183	F	83.8	Confident	90.5	Very high	8 Å²	8	45 Å²	45	4%	0.035	22%	0.221	C	C	.	.	H	α-helix	trans	-54.6	-32.5	178	-179.5	-107.4	0	0	0	113.2	F176 I177 S180 D181 F188 Y405	F176-F183 HydrophobicContact CD1-CD2 4.49Å; F176-F183 HydrophobicContact CE1-CB 4.38Å; F176-F183 AromaticContact CE1-CD2 3.9Å; F176-F183 HydrophobicContact CE1-CD2 3.9Å; F176-F183 HydrophobicContact CZ-CB 4.23Å; F176-F183 HydrophobicContact CZ-CD2 4.46Å; I177-F183 HydrophobicContact CG1-CD2 4.36Å; I177-F183 HydrophobicContact CG1-CE2 4.06Å; I177-F183 HydrophobicContact CG1-CZ 4.47Å; I177-F183 HydrophobicContact CG2-CE1 4.11Å; I177-F183 HydrophobicContact CG2-CE2 4.4Å; I177-F183 HydrophobicContact CG2-CZ 4.01Å; S180-F183 WeakPolarHBondContact O-CB 3.44Å; S180-F183 PolarHBondContact O-N 3.22Å; D181-F183 PolarHBondContact O-N 2.81Å; F183-F188 HydrophobicContact CD2-CB 4.31Å; F183-F188 HydrophobicContact CD2-CD1 4.24Å; F183-F188 HydrophobicContact CD2-CG 4.31Å; F183-F188 HydrophobicContact CE2-CB 3.83Å; F183-F188 AromaticContact CE2-CD1 3.63Å; F183-F188 HydrophobicContact CE2-CD1 3.63Å; F183-F188 HydrophobicContact CE2-CE1 4.41Å; F183-F188 AromaticContact CE2-CG 3.95Å; F183-F188 HydrophobicContact CE2-CG 3.95Å; F183-Y405 HydrophobicContact CD1-CD2 4.45Å; F183-Y405 HydrophobicContact CE1-CD1 4.37Å; F183-Y405 AromaticContact CE1-CD2 3.38Å; F183-Y405 HydrophobicContact CE1-CD2 3.38Å; F183-Y405 AromaticContact CE1-CE2 3.7Å; F183-Y405 HydrophobicContact CE1-CE2 3.7Å; F183-Y405 AromaticContact CE1-CG 3.74Å; F183-Y405 HydrophobicContact CE1-CG 3.74Å; F183-Y405 HydrophobicContact CZ-CD1 4.27Å; F183-Y405 AromaticContact CZ-CD2 3.9Å; F183-Y405 HydrophobicContact CZ-CD2 3.9Å; F183-Y405 HydrophobicContact CZ-CE1 4.26Å; F183-Y405 AromaticContact CZ-CE2 3.85Å; F183-Y405 HydrophobicContact CZ-CE2 3.85Å; F183-Y405 HydrophobicContact CZ-CG 4.09Å
184	D	84.3	Confident	90.4	Very high	3 Å²	3	46 Å²	46	2%	0.016	23%	0.228	C	C	.	.	H	α-helix	trans	-76.5	-26.9	175.7	-82.6	-50.6	0	0	0	114.8	D181 S182 R300 K304 N384 L386 R407	D181-D184 PolarHBondContact O-N 3.15Å; S182-D184 PolarHBondContact O-N 3Å; S182-D184 VanDerWaalsContact O-N 3.07Å; D184-R300 IonicContact OD1-CZ 3.45Å; D184-R300 IonicContact OD1-NH1 2.92Å; D184-R300 PolarHBondContact OD1-NH1 3.5Å; D184-R300 IonicContact OD1-NH2 2.81Å; D184-R300 PolarHBondContact OD1-NH2 3.16Å; D184-K304 WeakPolarHBondContact O-CE 3.36Å; D184-K304 PolarHBondContact O-NZ 3.37Å; D184-N384 PolarHBondContact OD2-ND2 3.05Å; D184-L386 HydrophobicContact CB-CB 4.4Å; D184-L386 HydrophobicContact CB-CD2 4.03Å; D184-L386 WeakPolarHBondContact O-CD2 3.4Å; D184-R407 IonicContact OD1-CZ 2.95Å; D184-R407 IonicContact OD1-NH1 3.96Å; D184-R407 IonicContact OD1-NH2 2.99Å; D184-R407 PolarHBondContact OD1-NH2 2.89Å; D184-R407 IonicContact OD2-CZ 2.84Å; D184-R407 IonicContact OD2-NH1 2.81Å; D184-R407 PolarHBondContact OD2-NH1 2.85Å; D184-R407 IonicContact OD2-NH2 3.37Å; D184-R407 PolarHBondContact OD2-NH2 2.92Å
185	K	84.6	Confident	90.5	Very high	128 Å²	128	46.2 Å²	46.2	56%	0.557	23%	0.232	S	C	*	.	H	α-helix	trans	-72.5	-38.2	-180	-60.1	177.3	-173.4	169.1	0	110.2	S182 K304	S182-K185 WeakPolarHBondContact O-CB 3.45Å; S182-K185 PolarHBondContact O-N 3.17Å; K185-K304 PolarHBondContact O-NZ 3.48Å; K185-K304 VanDerWaalsContact O-NZ 3.08Å
186	F	88.6	Confident	90.5	Very high	43 Å²	43	42.6 Å²	42.6	19%	0.189	22%	0.22	C	C	.	.	S	Bend	trans	-93.7	160.9	-177.6	-64.2	-85.7	0	0	0	112.6	Q79 A83 L148 S182 K304	Q79-F186 HydrophobicContact CB-CE1 4.11Å; Q79-F186 HydrophobicContact CB-CZ 4.14Å; A83-F186 HydrophobicContact CB-CD2 3.89Å; A83-F186 HydrophobicContact CB-CE2 3.3Å; A83-F186 HydrophobicContact CB-CZ 3.77Å; L148-F186 HydrophobicContact CB-CB 4.43Å; L148-F186 HydrophobicContact CB-CD1 4.22Å; L148-F186 HydrophobicContact CB-CG 4.29Å; L148-F186 HydrophobicContact CD1-CD2 4.38Å; L148-F186 HydrophobicContact CD1-CG 4.43Å; L148-F186 HydrophobicContact CD2-CB 3.5Å; L148-F186 VanDerWaalsContact CD2-CB 3.5Å; L148-F186 HydrophobicContact CD2-CD2 4.15Å; L148-F186 HydrophobicContact CD2-CG 3.82Å; L148-F186 HydrophobicContact CG-CB 4.47Å; L148-F186 HydrophobicContact CG-CG 4.41Å; S182-F186 WeakPolarHBondContact O-CD2 3.38Å; S182-F186 PolarHBondContact O-N 3.44Å; F186-K304 PolarHBondContact O-NZ 3.19Å
187	D	88.9	Confident	90.5	Very high	62 Å²	62	43 Å²	43	33%	0.332	22%	0.222	S	C	.	.			trans	-95.2	148.4	155.1	-58.4	-29.6	0	0	0	107.2	P152 K304	P152-D187 HydrophobicContact CG-CB 4.05Å; D187-K304 IonicContact OD1-NZ 3.46Å; D187-K304 PolarHBondContact OD1-NZ 3.39Å
188	F	93	Very high	90.6	Very high	12 Å²	12	41.8 Å²	41.8	5%	0.053	22%	0.215	C	C	.	.			trans	-132.6	127.2	-163.6	-171.4	-121.5	0	0	0	112.6	S144 L148 L173 F176 I177 F183 E190	S144-F188 WeakPolarHBondContact O-CE2 3.44Å; L148-F188 HydrophobicContact CD2-CD2 3.52Å; L148-F188 HydrophobicContact CD2-CE2 4.03Å; L148-F188 HydrophobicContact CD2-CG 4.44Å; L148-F188 HydrophobicContact CG-CD2 4.1Å; L148-F188 HydrophobicContact CG-CE2 4.3Å; L173-F188 HydrophobicContact CD1-CE1 3.77Å; L173-F188 HydrophobicContact CD1-CZ 3.64Å; F176-F188 HydrophobicContact CD1-CZ 4.16Å; F176-F188 HydrophobicContact CE1-CD2 4.3Å; F176-F188 HydrophobicContact CE1-CE1 4.4Å; F176-F188 AromaticContact CE1-CE2 3.9Å; F176-F188 HydrophobicContact CE1-CE2 3.9Å; F176-F188 AromaticContact CE1-CZ 3.94Å; F176-F188 HydrophobicContact CE1-CZ 3.94Å; I177-F188 HydrophobicContact CD1-CE1 4.3Å; I177-F188 HydrophobicContact CG1-CE1 4.25Å; F183-F188 HydrophobicContact CD2-CB 4.31Å; F183-F188 HydrophobicContact CD2-CD1 4.24Å; F183-F188 HydrophobicContact CD2-CG 4.31Å; F183-F188 HydrophobicContact CE2-CB 3.83Å; F183-F188 AromaticContact CE2-CD1 3.63Å; F183-F188 HydrophobicContact CE2-CD1 3.63Å; F183-F188 HydrophobicContact CE2-CE1 4.41Å; F183-F188 AromaticContact CE2-CG 3.95Å; F183-F188 HydrophobicContact CE2-CG 3.95Å; F188-E190 HydrophobicContact CD1-CB 4.13Å; F188-E190 HydrophobicContact CE1-CB 3.99Å; F188-E190 HydrophobicContact CE1-CG 4.19Å
189	C	95.3	Very high	91	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.027	19%	0.194	C	C	.	.			trans	-88.5	95.2	162.4	-165.7	0	0	0	0	109	G147 L150 G151 G154 N156 P191	G147-C189 VanDerWaalsContact CA-O 3.24Å; G147-C189 WeakPolarHBondContact CA-O 3.29Å; G147-C189 PolarHBondContact O-N 2.93Å; L150-C189 HydrophobicContact CB-CB 3.82Å; L150-C189 HydrophobicContact CD1-CB 4.47Å; G151-C189 WeakPolarHBondContact O-CB 3.4Å; G151-C189 PolarHBondContact O-N 3.37Å; G154-C189 PolarHBondContact O-SG 3.06Å; N156-C189 HydrophobicContact CB-CB 4.29Å; N156-C189 VanDerWaalsContact CB-SG 3.54Å; N156-C189 PolarHBondContact ND2-O 3.1Å; C189-P191 WeakPolarHBondContact O-CD 3.34Å
190	E	95.1	Very high	91.3	Very high	119 Å²	119	34.8 Å²	34.8	56%	0.556	19%	0.186	S	C	*	.			trans	-56.7	125.2	175.6	-169	176.5	160.3	0	0	110.6	L173 I177 F188	L173-E190 HydrophobicContact CD2-CG 3.82Å; I177-E190 HydrophobicContact CD1-CG 4.25Å; F188-E190 HydrophobicContact CD1-CB 4.13Å; F188-E190 HydrophobicContact CE1-CB 3.99Å; F188-E190 HydrophobicContact CE1-CG 4.19Å
191	P	97.1	Very high	91.7	Very high	6 Å²	6	34.3 Å²	34.3	4%	0.039	18%	0.182	C	C	.	.			trans	-72.9	137.8	178.2	26	-30.1	0	0	0	111.7	N156 L173 C189 F193	N156-P191 HydrophobicContact CB-CB 4.45Å; N156-P191 WeakPolarHBondContact O-CA 3.48Å; L173-P191 HydrophobicContact CD1-CG 3.92Å; L173-P191 HydrophobicContact CD2-CG 3.84Å; L173-P191 HydrophobicContact CG-CG 4.48Å; C189-P191 WeakPolarHBondContact O-CD 3.34Å; P191-F193 HydrophobicContact CB-CE1 4.04Å; P191-F193 HydrophobicContact CB-CE2 4.06Å; P191-F193 HydrophobicContact CB-CZ 3.63Å; P191-F193 HydrophobicContact CG-CE1 4.48Å; P191-F193 HydrophobicContact CG-CE2 3.84Å; P191-F193 HydrophobicContact CG-CZ 3.6Å
192	S	97.1	Very high	92.1	Very high	50 Å²	50	31.6 Å²	31.6	35%	0.35	17%	0.167	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105	119.6	170.8	-175.7	0	0	0	0	110.7	N156 H157 G158 P284	N156-S192 PolarHBondContact O-N 3.2Å; H157-S192 WeakPolarHBondContact CA-O 3.26Å; G158-S192 PolarHBondContact N-O 2.96Å; S192-P284 WeakPolarHBondContact OG-CG 3.39Å
193	F	97.3	Very high	92.1	Very high	13 Å²	13	35.7 Å²	35.7	6%	0.057	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	134.6	-176.6	-57.4	-68.4	0	0	0	112.5	S137 G158 I166 A169 K170 L173 P191	S137-F193 WeakPolarHBondContact OG-CD1 3.44Å; G158-F193 CarbonylContact O-C 3.57Å; G158-F193 WeakPolarHBondContact O-CA 3.36Å; I166-F193 HydrophobicContact CG1-CB 4.38Å; I166-F193 HydrophobicContact CG2-CB 4.05Å; A169-F193 HydrophobicContact CB-CD2 4.2Å; A169-F193 HydrophobicContact CB-CE2 4.02Å; A169-F193 HydrophobicContact CB-CZ 4.25Å; K170-F193 HydrophobicContact CG-CD2 4.22Å; L173-F193 HydrophobicContact CD2-CE2 4.2Å; P191-F193 HydrophobicContact CB-CE1 4.04Å; P191-F193 HydrophobicContact CB-CE2 4.06Å; P191-F193 HydrophobicContact CB-CZ 3.63Å; P191-F193 HydrophobicContact CG-CE1 4.48Å; P191-F193 HydrophobicContact CG-CE2 3.84Å; P191-F193 HydrophobicContact CG-CZ 3.6Å
194	V	96.1	Very high	92.2	Very high	30 Å²	30	42.1 Å²	42.1	18%	0.182	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	134.3	178.2	-178	0	0	0	0	110.7	G158 V159 E160 I166 V281 P284	G158-V194 PolarHBondContact O-N 3.18Å; V159-V194 WeakPolarHBondContact CA-O 3.49Å; E160-V194 PolarHBondContact N-O 2.98Å; E160-V194 VanDerWaalsContact N-O 3.09Å; I166-V194 VanDerWaalsContact CD1-O 3.28Å; I166-V194 WeakPolarHBondContact CD1-O 3.29Å; V194-V281 HydrophobicContact CB-CG1 4.47Å; V194-V281 HydrophobicContact CG1-CG1 3.67Å; V194-P284 HydrophobicContact CG2-CG 3.8Å
195	T	95.8	Very high	92.3	Very high	73 Å²	73	43.5 Å²	43.5	45%	0.448	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	128.3	175.4	-43.9	0	0	0	0	110.8	E160 I166	E160-T195 CarbonylContact O-C 3.58Å; E160-T195 VanDerWaalsContact O-CA 3.24Å; E160-T195 WeakPolarHBondContact O-CA 3.37Å; I166-T195 HydrophobicContact CD1-CG2 4.37Å; I166-T195 VanDerWaalsContact CD1-OG1 3.31Å; I166-T195 WeakPolarHBondContact CD1-OG1 3.3Å
196	G	94.1	Very high	92.5	Very high	14 Å²	14	40.9 Å²	40.9	14%	0.144	24%	0.236	C	C	.	.	S	Bend	trans	161.7	176.7	170.6	0	0	0	0	0	114.8	V159 E160 L161	V159-G196 WeakPolarHBondContact CG1-O 3.36Å; E160-G196 CarbonylContact C-O 3.53Å; E160-G196 PolarHBondContact O-N 2.74Å; L161-G196 WeakPolarHBondContact CA-O 3.36Å
197	N	93.6	Very high	92.9	Very high	11 Å²	11	42.8 Å²	42.8	6%	0.059	25%	0.245	C	C	.	.			trans	-80.8	129.9	174.9	-165.2	-41.8	0	0	0	110.2	L161 L199 E200 I268 V281	L161-N197 HydrophobicContact CD1-CB 4.25Å; N197-L199 PolarHBondContact O-N 3.33Å; N197-L199 WeakPolarHBondContact OD1-CB 3.46Å; N197-L199 PolarHBondContact OD1-N 2.77Å; N197-E200 HydrophobicContact CB-CB 4.4Å; N197-E200 HydrophobicContact CB-CG 4.23Å; N197-E200 WeakPolarHBondContact CB-OE2 3.03Å; N197-E200 PolarHBondContact O-N 2.8Å; N197-I268 PolarHBondContact ND2-O 3.21Å; N197-V281 WeakPolarHBondContact O-CG2 3.49Å
198	C	93.2	Very high	93.3	Very high	0 Å²	0	40 Å²	40	0%	0	23%	0.23	C	C	.	.	G	3₁₀ helix	trans	-62.8	-20.8	179.2	-63.4	0	0	0	0	113.4	L135 E200 I201 Y224 L267	L135-C198 HydrophobicContact CB-CB 4.02Å; L135-C198 HydrophobicContact CD1-CB 4.46Å; L135-C198 HydrophobicContact CD2-CB 3.94Å; L135-C198 HydrophobicContact CG-CB 4.37Å; C198-E200 VanDerWaalsContact C-N 3.32Å; C198-I201 WeakPolarHBondContact O-CG1 3.36Å; C198-Y224 WeakPolarHBondContact O-CE1 3.14Å; C198-Y224 PolarHBondContact O-OH 3.09Å; C198-L267 HydrophobicContact CB-CD1 4.46Å
199	L	93.6	Very high	93.6	Very high	20 Å²	20	40.9 Å²	40.9	11%	0.105	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-84.7	-1.1	174.6	-65.1	176.5	0	0	0	114	N197 H221 Y224 M225 L267 P270	N197-L199 PolarHBondContact O-N 3.33Å; N197-L199 WeakPolarHBondContact OD1-CB 3.46Å; N197-L199 PolarHBondContact OD1-N 2.77Å; L199-H221 HydrophobicContact CD2-CB 4.15Å; L199-Y224 WeakPolarHBondContact CA-OH 3.49Å; L199-Y224 HydrophobicContact CD2-CD1 3.8Å; L199-Y224 HydrophobicContact CD2-CE1 3.94Å; L199-Y224 HydrophobicContact CD2-CG 4.48Å; L199-Y224 PolarHBondContact O-OH 3.03Å; L199-M225 HydrophobicContact CD2-CE 3.79Å; L199-L267 HydrophobicContact CD1-CD2 3.73Å; L199-L267 HydrophobicContact CD1-CG 4.19Å; L199-L267 HydrophobicContact CD2-CD2 3.55Å; L199-L267 HydrophobicContact CG-CD2 3.54Å; L199-L267 HydrophobicContact CG-CG 4.26Å; L199-P270 HydrophobicContact CB-CG 4.15Å
200	E	93.1	Very high	93.7	Very high	36 Å²	36	41.7 Å²	41.7	17%	0.168	24%	0.238	C	C	.	.	G	3₁₀ helix	trans	-120.1	27.7	-179.5	-63	-176.1	112.8	0	0	111.8	N197 C198 P270 S278 L280 V281	N197-E200 HydrophobicContact CB-CB 4.4Å; N197-E200 HydrophobicContact CB-CG 4.23Å; N197-E200 WeakPolarHBondContact CB-OE2 3.03Å; N197-E200 PolarHBondContact O-N 2.8Å; C198-E200 VanDerWaalsContact C-N 3.32Å; E200-P270 HydrophobicContact CG-CB 4.05Å; E200-P270 HydrophobicContact CG-CG 3.54Å; E200-S278 PolarHBondContact OE1-OG 2.81Å; E200-L280 CarbonylContact O-C 3.58Å; E200-L280 WeakPolarHBondContact O-CA 3.38Å; E200-V281 HydrophobicContact CB-CG2 4.44Å; E200-V281 PolarHBondContact O-N 3.27Å
201	I	93.9	Very high	93.9	Very high	9 Å²	9	36 Å²	36	5%	0.046	21%	0.211	C	C	.	.	B	Isolated β-bridge	trans	-68.6	134.9	176.3	-61.7	172.5	0	0	0	109.2	L133 L135 V159 C198 C205 Y224 V281 L283	L133-I201 HydrophobicContact CD2-CD1 4.25Å; L135-I201 HydrophobicContact CD2-CD1 3.58Å; V159-I201 HydrophobicContact CG2-CD1 4.22Å; C198-I201 WeakPolarHBondContact O-CG1 3.36Å; I201-C205 HydrophobicContact CG2-CB 3.95Å; I201-C205 VanDerWaalsContact CG2-SG 3.54Å; I201-Y224 WeakPolarHBondContact CB-OH 3.5Å; I201-Y224 PolarHBondContact N-OH 3.23Å; I201-V281 HydrophobicContact CG1-CB 4.43Å; I201-L283 HydrophobicContact CG2-CD1 3.85Å; I201-L283 HydrophobicContact CG2-CG 4.06Å
202	S	91	Very high	94	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	21%	0.21	C	C	.	.			trans	-53.7	132.8	178.7	-172.1	0	0	0	0	111.2	D204 C205 V281 Q282	S202-D204 PolarHBondContact O-N 2.96Å; S202-C205 VanDerWaalsContact O-CB 3.25Å; S202-C205 WeakPolarHBondContact O-CB 3.47Å; S202-C205 PolarHBondContact O-N 3.25Å; S202-C205 PolarHBondContact O-SG 2.88Å; S202-V281 PolarHBondContact N-O 3.38Å; S202-Q282 PolarHBondContact OG-NE2 3.33Å; S202-Q282 VanDerWaalsContact OG-NE2 3.16Å
203	P	85.2	Confident	94	Very high	107 Å²	107	33.5 Å²	33.5	70%	0.695	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-20.8	177.6	27.9	-35.3	0	0	0	112.6	C205	P203-C205 PolarHBondContact O-N 3.19Å
204	D	85.8	Confident	93.9	Very high	144 Å²	144	33.2 Å²	33.2	77%	0.77	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-1.2	175.7	-57.7	-36.3	0	0	0	113.1	S202	S202-D204 PolarHBondContact O-N 2.96Å
205	C	87	Confident	93.7	Very high	31 Å²	31	31.8 Å²	31.8	21%	0.209	19%	0.185	C	C	.	.	S	Bend	trans	-66.9	150	178.6	76.2	0	0	0	0	111.7	I201 S202 P203 L283	I201-C205 HydrophobicContact CG2-CB 3.95Å; I201-C205 VanDerWaalsContact CG2-SG 3.54Å; S202-C205 VanDerWaalsContact O-CB 3.25Å; S202-C205 WeakPolarHBondContact O-CB 3.47Å; S202-C205 PolarHBondContact O-N 3.25Å; S202-C205 PolarHBondContact O-SG 2.88Å; P203-C205 PolarHBondContact O-N 3.19Å; C205-L283 HydrophobicContact CB-CD1 4.04Å; C205-L283 HydrophobicContact CB-CG 4.49Å
206	S	88.4	Confident	93.6	Very high	74 Å²	74	29 Å²	29	52%	0.517	17%	0.17	S	C	.	.	P	Polyproline II helix	trans	-67.8	142.9	173	-62.1	0	0	0	0	110.7	Y208	S206-Y208 VanDerWaalsContact O-CD2 3.29Å; S206-Y208 WeakPolarHBondContact O-CD2 3.43Å; S206-Y208 WeakPolarHBondContact O-CE2 3.34Å
207	Q	95.7	Very high	93.6	Very high	82 Å²	82	28.6 Å²	28.6	38%	0.383	17%	0.165	S	C	.	.	P	Polyproline II helix	trans	-70	157.3	168.1	-74.5	175.9	-31.1	0	0	111.3	N227 L228 L229 K230	Q207-N227 PolarHBondContact NE2-O 2.9Å; Q207-L228 CarbonylContact C-O 3.55Å; Q207-L228 WeakPolarHBondContact CA-O 3.48Å; Q207-L229 PolarHBondContact NE2-O 3.2Å; Q207-K230 HydrophobicContact CB-CB 4.45Å; Q207-K230 HydrophobicContact CB-CG 3.58Å; Q207-K230 WeakPolarHBondContact O-CE 3.45Å
208	Y	98	Very high	93.5	Very high	5 Å²	5	31.6 Å²	31.6	2%	0.02	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	152.1	-175.6	-65.7	-94.1	0	0	0	112.6	S131 L133 V155 H157 S206 R210 L228 L229 K230 L283	S131-Y208 WeakPolarHBondContact OG-CA 3.48Å; L133-Y208 HydrophobicContact CB-CD1 3.77Å; L133-Y208 HydrophobicContact CB-CD2 3.72Å; L133-Y208 HydrophobicContact CB-CE1 3.99Å; L133-Y208 HydrophobicContact CB-CE2 3.94Å; L133-Y208 HydrophobicContact CB-CG 3.64Å; L133-Y208 HydrophobicContact CD1-CE2 4.36Å; L133-Y208 HydrophobicContact CD2-CD2 3.78Å; L133-Y208 HydrophobicContact CD2-CE2 3.71Å; L133-Y208 HydrophobicContact CG-CD2 4.33Å; L133-Y208 HydrophobicContact CG-CE2 4.23Å; V155-Y208 HydrophobicContact CG1-CE1 4.28Å; H157-Y208 HydrophobicContact CB-CE1 4.37Å; H157-Y208 AromaticContact ND1-CE1 3.72Å; H157-Y208 AromaticContact ND1-CZ 3.67Å; H157-Y208 PolarHBondContact ND1-OH 3.5Å; S206-Y208 VanDerWaalsContact O-CD2 3.29Å; S206-Y208 WeakPolarHBondContact O-CD2 3.43Å; S206-Y208 WeakPolarHBondContact O-CE2 3.34Å; Y208-R210 VanDerWaalsContact C-N 3.3Å; Y208-L228 PolarHBondContact N-O 3.11Å; Y208-L229 WeakPolarHBondContact O-CA 3.21Å; Y208-K230 PolarHBondContact O-N 3.37Å; Y208-L283 HydrophobicContact CE2-CD1 3.99Å; Y208-L283 WeakPolarHBondContact OH-CD1 3.49Å
209	D	98.7	Very high	93.5	Very high	30 Å²	30	39.4 Å²	39.4	16%	0.16	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	-31.5	171.3	-58	-69.7	0	0	0	110.6	L130 S131 K230 G233 I234	L130-D209 HydrophobicContact CB-CB 4.06Å; L130-D209 HydrophobicContact CD1-CB 4.45Å; L130-D209 HydrophobicContact CD2-CB 3.93Å; L130-D209 HydrophobicContact CG-CB 4.38Å; S131-D209 WeakPolarHBondContact CB-OD2 3.34Å; S131-D209 PolarHBondContact N-OD2 3.11Å; S131-D209 WeakPolarHBondContact O-CB 3.29Å; S131-D209 PolarHBondContact O-N 3.11Å; S131-D209 VanDerWaalsContact O-N 3.09Å; S131-D209 PolarHBondContact OG-N 3.41Å; S131-D209 PolarHBondContact OG-OD2 3.12Å; D209-K230 WeakPolarHBondContact OD1-CD 3.28Å; D209-K230 IonicContact OD1-NZ 2.74Å; D209-K230 PolarHBondContact OD1-NZ 2.96Å; D209-K230 IonicContact OD2-NZ 3.34Å; D209-K230 PolarHBondContact OD2-NZ 2.92Å; D209-G233 CarbonylContact O-C 3.57Å; D209-G233 WeakPolarHBondContact O-CA 2.96Å; D209-I234 PolarHBondContact O-N 3.25Å
210	R	98.8	Very high	93.6	Very high	20 Å²	20	45.2 Å²	45.2	8%	0.075	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	129.9	-174.2	-59.1	-63	-176	-95.2	5.2	110.1	L124 D125 L126 L130 S131 F132 L133 Y208 I234	L124-R210 HydrophobicContact CD2-CB 4.26Å; L124-R210 WeakPolarHBondContact O-CD 3.48Å; L124-R210 PolarHBondContact O-NE 2.89Å; D125-R210 PolarHBondContact O-NE 3.42Å; D125-R210 VanDerWaalsContact O-NE 3.09Å; D125-R210 PolarHBondContact O-NH2 2.98Å; L126-R210 HydrophobicContact CD2-CB 4.23Å; L126-R210 HydrophobicContact CD2-CG 4.01Å; L130-R210 HydrophobicContact CD1-CG 4.02Å; L130-R210 VanDerWaalsContact CD1-CZ 3.48Å; S131-R210 PolarHBondContact O-N 3.26Å; F132-R210 CarbonylContact C-O 3.55Å; F132-R210 VanDerWaalsContact CA-O 3.27Å; F132-R210 WeakPolarHBondContact CA-O 3.35Å; F132-R210 HydrophobicContact CB-CB 4.43Å; F132-R210 HydrophobicContact CD2-CB 3.79Å; L133-R210 PolarHBondContact N-O 2.99Å; Y208-R210 VanDerWaalsContact C-N 3.3Å; R210-I234 CarbonylContact C-O 3.6Å; R210-I234 WeakPolarHBondContact CA-O 3.33Å
211	V	98.7	Very high	93.6	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	132.6	176.6	-177.7	0	0	0	0	108.8	L133 L135 L228 L229 I234 L235 V236	L133-V211 HydrophobicContact CB-CG2 4.27Å; L133-V211 CarbonylContact O-C 3.55Å; L133-V211 WeakPolarHBondContact O-CA 3.48Å; L135-V211 HydrophobicContact CD1-CG1 4.11Å; L135-V211 HydrophobicContact CG-CG1 4.42Å; V211-L228 HydrophobicContact CG2-CB 4.18Å; V211-L229 HydrophobicContact CB-CD2 4.11Å; V211-L229 HydrophobicContact CG2-CD2 3.62Å; V211-L229 HydrophobicContact CG2-CG 4.22Å; V211-I234 PolarHBondContact N-O 3.05Å; V211-L235 HydrophobicContact CB-CD1 3.8Å; V211-L235 HydrophobicContact CG1-CD1 3.64Å; V211-L235 CarbonylContact O-C 3.52Å; V211-L235 VanDerWaalsContact O-CA 3.3Å; V211-L235 WeakPolarHBondContact O-CA 3.13Å; V211-V236 PolarHBondContact O-N 3.36Å
212	Y	98.6	Very high	93.7	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.016	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	136.1	169.5	171.7	-117.8	0	0	0	110	V120 L133 N134 L135 L142 V236 F264	V120-Y212 HydrophobicContact CB-CD2 4.39Å; V120-Y212 HydrophobicContact CB-CE2 4.23Å; V120-Y212 HydrophobicContact CG1-CD1 4.31Å; V120-Y212 HydrophobicContact CG1-CD2 3.44Å; V120-Y212 VanDerWaalsContact CG1-CD2 3.44Å; V120-Y212 HydrophobicContact CG1-CE2 3.71Å; V120-Y212 HydrophobicContact CG1-CG 3.78Å; V120-Y212 HydrophobicContact CG2-CD2 3.96Å; V120-Y212 HydrophobicContact CG2-CE2 3.41Å; V120-Y212 VanDerWaalsContact CG2-CE2 3.41Å; L133-Y212 PolarHBondContact O-N 3.03Å; N134-Y212 WeakPolarHBondContact OD1-CD1 3.4Å; L135-Y212 PolarHBondContact N-O 2.96Å; L142-Y212 HydrophobicContact CD2-CD1 3.31Å; L142-Y212 HydrophobicContact CD2-CE1 3.45Å; L142-Y212 VanDerWaalsContact CD2-CE1 3.45Å; L142-Y212 HydrophobicContact CD2-CG 4.15Å; Y212-V236 WeakPolarHBondContact CA-O 2.95Å; Y212-V236 HydrophobicContact CD2-CB 4.28Å; Y212-V236 HydrophobicContact CD2-CG1 4.24Å; Y212-V236 VanDerWaalsContact CD2-O 3.3Å; Y212-V236 WeakPolarHBondContact CD2-O 3.43Å; Y212-F264 WeakPolarHBondContact OH-CE1 3.32Å
213	C	97.4	Very high	93.9	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	115.2	168.6	-171.5	0	0	0	0	110.6	L135 A215 V217 V236 M237 P238	L135-C213 HydrophobicContact CB-CB 4.28Å; L135-C213 HydrophobicContact CD1-CB 4.32Å; C213-A215 PolarHBondContact O-N 3.46Å; C213-A215 PolarHBondContact SG-O 3.39Å; C213-V217 HydrophobicContact CB-CG2 4.12Å; C213-V217 VanDerWaalsContact SG-CG2 3.59Å; C213-V236 PolarHBondContact N-O 3.4Å; C213-M237 HydrophobicContact CB-CB 3.7Å; C213-P238 WeakPolarHBondContact O-CD 3.43Å
214	G	94.8	Very high	94.4	Very high	6 Å²	6	49 Å²	49	6%	0.062	24%	0.241	C	C	.	.			trans	-80.1	18.3	178.2	0	0	0	0	0	114.9	L135 F264	L135-G214 PolarHBondContact O-N 3.08Å; G214-F264 WeakPolarHBondContact O-CD1 3.43Å
215	A	92.4	Very high	94.9	Very high	1 Å²	1	42.1 Å²	42.1	1%	0.008	20%	0.204	C	C	.	.	S	Bend	trans	-140.8	156.1	176.2	0	0	0	0	0	112	F2 C213 V217 P238 L267	F2-A215 HydrophobicContact CD1-CB 3.58Å; F2-A215 HydrophobicContact CE1-CB 3.43Å; F2-A215 VanDerWaalsContact CE1-CB 3.43Å; C213-A215 PolarHBondContact O-N 3.46Å; C213-A215 PolarHBondContact SG-O 3.39Å; A215-V217 PolarHBondContact O-N 2.93Å; A215-P238 WeakPolarHBondContact O-CD 3.48Å; A215-L267 HydrophobicContact CB-CB 4.27Å; A215-L267 HydrophobicContact CB-CD1 3.92Å
216	G	93.3	Very high	95.4	Very high	13 Å²	13	41.6 Å²	41.6	13%	0.134	20%	0.198	C	C	.	.	B	Isolated β-bridge	trans	-61.9	115.1	175.7	0	0	0	0	0	111.6	A265 L267	G216-A265 PolarHBondContact N-O 3.02Å; G216-L267 WeakPolarHBondContact O-CB 3.42Å; G216-L267 PolarHBondContact O-N 3.02Å
217	V	94.2	Very high	95.7	Very high	6 Å²	6	42 Å²	42	4%	0.036	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-90.6	128.3	179.8	-177.5	0	0	0	0	109.3	C213 A215 H221 M225 M237 P238 L239	C213-V217 HydrophobicContact CB-CG2 4.12Å; C213-V217 VanDerWaalsContact SG-CG2 3.59Å; A215-V217 PolarHBondContact O-N 2.93Å; V217-H221 HydrophobicContact CG1-CB 3.97Å; V217-M225 HydrophobicContact CG1-CE 4.4Å; V217-M225 HydrophobicContact CG1-CG 4.04Å; V217-M225 HydrophobicContact CG2-CE 4.13Å; V217-M225 HydrophobicContact CG2-CG 4.46Å; V217-M237 HydrophobicContact CB-CE 4.47Å; V217-M237 HydrophobicContact CB-SD 3.89Å; V217-M237 HydrophobicContact CG1-CE 4.26Å; V217-M237 HydrophobicContact CG1-SD 3.96Å; V217-M237 HydrophobicContact CG2-CB 4.12Å; V217-M237 HydrophobicContact CG2-CG 4.31Å; V217-M237 HydrophobicContact CG2-SD 3.7Å; V217-P238 PolarHBondContact N-O 3.43Å; V217-L239 WeakPolarHBondContact O-CD1 3.3Å
218	Q	92.6	Very high	95.8	Very high	75 Å²	75	38.6 Å²	38.6	35%	0.35	18%	0.179	S	C	.	.			trans	-76.4	150.5	173.5	-63	171.9	-1.7	0	0	109.8	E220 H221	Q218-E220 WeakPolarHBondContact CB-OE2 3.27Å; Q218-E220 PolarHBondContact O-N 3.13Å; Q218-E220 VanDerWaalsContact O-N 3.16Å; Q218-H221 PolarHBondContact O-N 3.41Å
219	R	92.6	Very high	95.7	Very high	163 Å²	163	38.3 Å²	38.3	62%	0.615	18%	0.178	S	C	*	.	G	3₁₀ helix	trans	-60.3	-31.1	-173.2	-174.1	170.9	177.8	157.9	-6.1	112.8	H221 E222 E240	R219-H221 PolarHBondContact O-N 3.01Å; R219-E222 WeakPolarHBondContact O-CB 3.38Å; R219-E222 PolarHBondContact O-N 2.83Å; R219-E240 IonicContact NH1-OE1 3.41Å; R219-E240 PolarHBondContact NH1-OE1 3.35Å
220	E	94.5	Very high	95.7	Very high	142 Å²	142	40.1 Å²	40.1	66%	0.664	18%	0.184	S	C	*	.	G	3₁₀ helix	trans	-63.3	-24.3	177.7	-56.9	73.3	-120.4	0	0	112.4	Q218	Q218-E220 WeakPolarHBondContact CB-OE2 3.27Å; Q218-E220 PolarHBondContact O-N 3.13Å; Q218-E220 VanDerWaalsContact O-N 3.16Å
221	H	95.1	Very high	95.7	Very high	37 Å²	37	43 Å²	43	17%	0.171	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	-99.9	1.2	-178.5	-68.9	-47.7	0	0	0	114	L199 V217 Q218 R219 E223 Y224 M225 Q269	L199-H221 HydrophobicContact CD2-CB 4.15Å; V217-H221 HydrophobicContact CG1-CB 3.97Å; Q218-H221 PolarHBondContact O-N 3.41Å; R219-H221 PolarHBondContact O-N 3.01Å; H221-E223 VanDerWaalsContact C-N 3.32Å; H221-E223 PolarHBondContact O-N 2.88Å; H221-Y224 PolarHBondContact O-N 3.26Å; H221-M225 WeakPolarHBondContact O-CG 3.38Å; H221-M225 PolarHBondContact O-N 3.28Å; H221-M225 VanDerWaalsContact O-N 3.15Å; H221-Q269 PolarHBondContact CD2-NE2 3.35Å; H221-Q269 VanDerWaalsContact CD2-NE2 3.31Å; H221-Q269 PolarHBondContact NE2-NE2 3.06Å; H221-Q269 PolarHBondContact NE2-OE1 2.94Å
222	E	95.6	Very high	95.6	Very high	37 Å²	37	45.2 Å²	45.2	17%	0.173	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-44	-179.4	-176.1	-176.4	155.5	0	0	111.8	R219 M225 K226 M237 L239 I246	R219-E222 WeakPolarHBondContact O-CB 3.38Å; R219-E222 PolarHBondContact O-N 2.83Å; E222-M225 PolarHBondContact O-N 2.91Å; E222-K226 HydrophobicContact CG-CD 4.41Å; E222-K226 WeakPolarHBondContact O-CG 3.17Å; E222-K226 PolarHBondContact O-N 2.71Å; E222-K226 WeakPolarHBondContact OE1-CE 3.12Å; E222-K226 IonicContact OE1-NZ 2.66Å; E222-K226 PolarHBondContact OE1-NZ 3.46Å; E222-M237 HydrophobicContact CB-CE 4.39Å; E222-M237 HydrophobicContact CG-CE 3.92Å; E222-L239 HydrophobicContact CG-CD2 4.4Å; E222-I246 HydrophobicContact CG-CD1 4.46Å
223	E	95.6	Very high	95.6	Very high	97 Å²	97	45 Å²	45	45%	0.453	23%	0.226	S	C	.	.	H	α-helix	trans	-68.7	-37.1	-178.4	-167	60.1	-156.9	0	0	112.1	H221 M225 K226 N227	H221-E223 VanDerWaalsContact C-N 3.32Å; H221-E223 PolarHBondContact O-N 2.88Å; E223-M225 VanDerWaalsContact C-N 3.33Å; E223-M225 PolarHBondContact O-N 3.5Å; E223-K226 PolarHBondContact O-N 3.14Å; E223-N227 PolarHBondContact O-N 3.18Å; E223-N227 PolarHBondContact O-ND2 2.82Å; E223-N227 VanDerWaalsContact O-ND2 3.1Å
224	Y	95.3	Very high	95.7	Very high	62 Å²	62	45.4 Å²	45.4	24%	0.243	23%	0.228	C	C	.	.	H	α-helix	trans	-58.6	-47	173.6	173.5	-88.5	0	0	0	110.9	C198 L199 I201 H221 K226 N227 L228	C198-Y224 WeakPolarHBondContact O-CE1 3.14Å; C198-Y224 PolarHBondContact O-OH 3.09Å; L199-Y224 WeakPolarHBondContact CA-OH 3.49Å; L199-Y224 HydrophobicContact CD2-CD1 3.8Å; L199-Y224 HydrophobicContact CD2-CE1 3.94Å; L199-Y224 HydrophobicContact CD2-CG 4.48Å; L199-Y224 PolarHBondContact O-OH 3.03Å; I201-Y224 WeakPolarHBondContact CB-OH 3.5Å; I201-Y224 PolarHBondContact N-OH 3.23Å; H221-Y224 PolarHBondContact O-N 3.26Å; Y224-K226 PolarHBondContact O-N 3.18Å; Y224-N227 PolarHBondContact O-N 2.81Å; Y224-L228 HydrophobicContact CE1-CD1 4.45Å
225	M	96.3	Very high	95.9	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-65.4	-39.5	179	-62.5	-59.6	178.9	0	0	112.3	L135 L199 V217 H221 E222 E223 N227 L228 L235 M237 L267	L135-M225 HydrophobicContact CD1-CE 4.22Å; L135-M225 HydrophobicContact CD1-SD 3.49Å; L135-M225 WeakPolarHBondContact CD1-SD 3.44Å; L199-M225 HydrophobicContact CD2-CE 3.79Å; V217-M225 HydrophobicContact CG1-CE 4.4Å; V217-M225 HydrophobicContact CG1-CG 4.04Å; V217-M225 HydrophobicContact CG2-CE 4.13Å; V217-M225 HydrophobicContact CG2-CG 4.46Å; H221-M225 WeakPolarHBondContact O-CG 3.38Å; H221-M225 PolarHBondContact O-N 3.28Å; H221-M225 VanDerWaalsContact O-N 3.15Å; E222-M225 PolarHBondContact O-N 2.91Å; E223-M225 VanDerWaalsContact C-N 3.33Å; E223-M225 PolarHBondContact O-N 3.5Å; M225-N227 VanDerWaalsContact C-N 3.3Å; M225-N227 PolarHBondContact O-N 2.87Å; M225-L228 WeakPolarHBondContact O-CB 3.44Å; M225-L228 PolarHBondContact O-N 2.91Å; M225-L228 HydrophobicContact SD-CD1 4.28Å; M225-L235 HydrophobicContact CB-CD2 3.76Å; M225-M237 HydrophobicContact CB-CE 4.48Å; M225-M237 HydrophobicContact CB-SD 3.89Å; M225-M237 HydrophobicContact CG-SD 3.91Å; M225-L267 HydrophobicContact CE-CD2 3.41Å; M225-L267 VanDerWaalsContact CE-CD2 3.41Å
226	K	96.3	Very high	96.2	Very high	19 Å²	19	45 Å²	45	8%	0.083	23%	0.225	C	C	.	.	H	α-helix	trans	-59.4	-39.4	175.5	-81.9	177.5	-177.1	168.2	0	112.3	E222 E223 Y224 L228 L229 I246 W254	E222-K226 HydrophobicContact CG-CD 4.41Å; E222-K226 WeakPolarHBondContact O-CG 3.17Å; E222-K226 PolarHBondContact O-N 2.71Å; E222-K226 WeakPolarHBondContact OE1-CE 3.12Å; E222-K226 IonicContact OE1-NZ 2.66Å; E222-K226 PolarHBondContact OE1-NZ 3.46Å; E223-K226 PolarHBondContact O-N 3.14Å; Y224-K226 PolarHBondContact O-N 3.18Å; K226-L228 PolarHBondContact O-N 3.35Å; K226-L228 VanDerWaalsContact O-N 3.13Å; K226-L229 WeakPolarHBondContact O-CB 3.46Å; K226-L229 PolarHBondContact O-N 3.22Å; K226-I246 HydrophobicContact CG-CG2 4.42Å; K226-W254 HydrophobicContact CB-CH2 3.48Å; K226-W254 VanDerWaalsContact CB-CH2 3.48Å; K226-W254 HydrophobicContact CB-CZ2 3.74Å; K226-W254 HydrophobicContact CB-CZ3 3.89Å; K226-W254 HydrophobicContact CD-CD2 3.89Å; K226-W254 HydrophobicContact CD-CE3 4.1Å; K226-W254 HydrophobicContact CD-CG 4.37Å; K226-W254 HydrophobicContact CD-CH2 4.31Å; K226-W254 HydrophobicContact CD-CZ2 4.12Å; K226-W254 HydrophobicContact CD-CZ3 4.28Å; K226-W254 HydrophobicContact CG-CD2 4.3Å; K226-W254 HydrophobicContact CG-CE3 4.02Å; K226-W254 HydrophobicContact CG-CH2 3.88Å; K226-W254 HydrophobicContact CG-CZ2 4.16Å; K226-W254 HydrophobicContact CG-CZ3 3.78Å; K226-W254 VanDerWaalsContact O-CH2 3.3Å; K226-W254 WeakPolarHBondContact O-CH2 3.22Å
227	N	95.4	Very high	96.4	Very high	82 Å²	82	44.4 Å²	44.4	44%	0.439	22%	0.218	S	C	.	.	H	α-helix	trans	-65.2	-16.8	-178	-75.1	-36.1	0	0	0	114.3	Q207 E223 Y224 M225 L229	Q207-N227 PolarHBondContact NE2-O 2.9Å; E223-N227 PolarHBondContact O-N 3.18Å; E223-N227 PolarHBondContact O-ND2 2.82Å; E223-N227 VanDerWaalsContact O-ND2 3.1Å; Y224-N227 PolarHBondContact O-N 2.81Å; M225-N227 VanDerWaalsContact C-N 3.3Å; M225-N227 PolarHBondContact O-N 2.87Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 2.93Å
228	L	96.7	Very high	96.4	Very high	11 Å²	11	44.3 Å²	44.3	6%	0.058	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-12.6	173.4	-57.7	172.8	0	0	0	113.2	L133 L135 Q207 Y208 V211 Y224 M225 K226	L133-L228 HydrophobicContact CD2-CD1 4.04Å; L135-L228 HydrophobicContact CD1-CD1 3.91Å; Q207-L228 CarbonylContact C-O 3.55Å; Q207-L228 WeakPolarHBondContact CA-O 3.48Å; Y208-L228 PolarHBondContact N-O 3.11Å; V211-L228 HydrophobicContact CG2-CB 4.18Å; Y224-L228 HydrophobicContact CE1-CD1 4.45Å; M225-L228 WeakPolarHBondContact O-CB 3.44Å; M225-L228 PolarHBondContact O-N 2.91Å; M225-L228 HydrophobicContact SD-CD1 4.28Å; K226-L228 PolarHBondContact O-N 3.35Å; K226-L228 VanDerWaalsContact O-N 3.13Å
229	L	97.7	Very high	96.5	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	141	-177.2	-75.4	176	0	0	0	113.7	Q207 Y208 V211 K226 N227 I234 L235 R248 W254	Q207-L229 PolarHBondContact NE2-O 3.2Å; Y208-L229 WeakPolarHBondContact O-CA 3.21Å; V211-L229 HydrophobicContact CB-CD2 4.11Å; V211-L229 HydrophobicContact CG2-CD2 3.62Å; V211-L229 HydrophobicContact CG2-CG 4.22Å; K226-L229 WeakPolarHBondContact O-CB 3.46Å; K226-L229 PolarHBondContact O-N 3.22Å; N227-L229 VanDerWaalsContact C-N 3.26Å; N227-L229 PolarHBondContact O-N 2.93Å; L229-I234 WeakPolarHBondContact CD2-O 3.2Å; L229-L235 HydrophobicContact CD1-CB 3.4Å; L229-L235 VanDerWaalsContact CD1-CB 3.4Å; L229-L235 HydrophobicContact CD2-CB 4.27Å; L229-L235 HydrophobicContact CG-CB 4.02Å; L229-R248 HydrophobicContact CD1-CB 4.49Å; L229-R248 PolarHBondContact O-NH1 2.9Å; L229-W254 HydrophobicContact CB-CZ3 4.49Å; L229-W254 HydrophobicContact CD1-CZ3 3.84Å
230	K	97.8	Very high	96.4	Very high	67 Å²	67	38.6 Å²	38.6	29%	0.291	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	161	162.2	-63.2	176	-166.4	169.3	0	110.5	S131 Q207 Y208 D209 G232 G233 R248	S131-K230 PolarHBondContact OG-NZ 3.49Å; S131-K230 VanDerWaalsContact OG-NZ 3.09Å; Q207-K230 HydrophobicContact CB-CB 4.45Å; Q207-K230 HydrophobicContact CB-CG 3.58Å; Q207-K230 WeakPolarHBondContact O-CE 3.45Å; Y208-K230 PolarHBondContact O-N 3.37Å; D209-K230 WeakPolarHBondContact OD1-CD 3.28Å; D209-K230 IonicContact OD1-NZ 2.74Å; D209-K230 PolarHBondContact OD1-NZ 2.96Å; D209-K230 IonicContact OD2-NZ 3.34Å; D209-K230 PolarHBondContact OD2-NZ 2.92Å; K230-G232 PolarHBondContact O-N 3.04Å; K230-G233 WeakPolarHBondContact O-CA 3.21Å; K230-G233 PolarHBondContact O-N 2.75Å; K230-R248 WeakPolarHBondContact O-CB 3.47Å; K230-R248 WeakPolarHBondContact O-CD 3.46Å
231	V	98	Very high	96.2	Very high	80 Å²	80	37.4 Å²	37.4	49%	0.485	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.2	133.2	164.8	179.3	0	0	0	0	108.8	G233 R248	V231-G233 VanDerWaalsContact C-N 3.28Å; V231-R248 HydrophobicContact CG2-CG 4.5Å
232	G	98.1	Very high	96.1	Very high	47 Å²	47	40 Å²	40	49%	0.485	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	84.3	-3.5	-168.8	0	0	0	0	0	114.2	K230 R248	K230-G232 PolarHBondContact O-N 3.04Å; G232-R248 WeakPolarHBondContact CA-O 3.45Å; G232-R248 PolarHBondContact N-O 3.32Å
233	G	98.6	Very high	96.1	Very high	0 Å²	0	38.2 Å²	38.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	159.6	-178.8	0	0	0	0	0	114	D209 K230 V231 T247 R248	D209-G233 CarbonylContact O-C 3.57Å; D209-G233 WeakPolarHBondContact O-CA 2.96Å; K230-G233 WeakPolarHBondContact O-CA 3.21Å; K230-G233 PolarHBondContact O-N 2.75Å; V231-G233 VanDerWaalsContact C-N 3.28Å; G233-T247 WeakPolarHBondContact O-CA 3.48Å; G233-R248 PolarHBondContact O-N 3.12Å
234	I	98.9	Very high	96.2	Very high	8 Å²	8	33.7 Å²	33.7	4%	0.041	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	126.9	180	-60.6	168.9	0	0	0	110.4	L124 D125 D209 R210 V211 L229 V236 K245 I246 T247	L124-I234 WeakPolarHBondContact O-CD1 3.37Å; D125-I234 HydrophobicContact CB-CD1 4.06Å; D209-I234 PolarHBondContact O-N 3.25Å; R210-I234 CarbonylContact C-O 3.6Å; R210-I234 WeakPolarHBondContact CA-O 3.33Å; V211-I234 PolarHBondContact N-O 3.05Å; L229-I234 WeakPolarHBondContact CD2-O 3.2Å; I234-V236 HydrophobicContact CG2-CG2 4.19Å; I234-K245 HydrophobicContact CG2-CD 4.21Å; I234-K245 HydrophobicContact CG2-CG 3.87Å; I234-I246 WeakPolarHBondContact CA-O 3.34Å; I234-T247 HydrophobicContact CG1-CG2 4.38Å
235	L	98.7	Very high	96.4	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	127.8	173.1	166	65.3	0	0	0	108.7	V211 M225 L229 M237 K245 I246	V211-L235 HydrophobicContact CB-CD1 3.8Å; V211-L235 HydrophobicContact CG1-CD1 3.64Å; V211-L235 CarbonylContact O-C 3.52Å; V211-L235 VanDerWaalsContact O-CA 3.3Å; V211-L235 WeakPolarHBondContact O-CA 3.13Å; M225-L235 HydrophobicContact CB-CD2 3.76Å; L229-L235 HydrophobicContact CD1-CB 3.4Å; L229-L235 VanDerWaalsContact CD1-CB 3.4Å; L229-L235 HydrophobicContact CD2-CB 4.27Å; L229-L235 HydrophobicContact CG-CB 4.02Å; L235-M237 HydrophobicContact CD1-CB 4.35Å; L235-M237 HydrophobicContact CD1-CG 4.43Å; L235-M237 HydrophobicContact CD1-SD 4.24Å; L235-M237 HydrophobicContact CD2-CE 4.11Å; L235-M237 HydrophobicContact CD2-CG 4.49Å; L235-M237 HydrophobicContact CD2-SD 3.81Å; L235-M237 HydrophobicContact CG-CG 4.29Å; L235-M237 HydrophobicContact CG-SD 4.18Å; L235-K245 CarbonylContact O-C 3.58Å; L235-K245 WeakPolarHBondContact O-CA 3.25Å; L235-I246 HydrophobicContact CB-CB 4.31Å; L235-I246 HydrophobicContact CD2-CD1 4.33Å; L235-I246 PolarHBondContact N-O 3.34Å; L235-I246 PolarHBondContact O-N 2.89Å
236	V	98.6	Very high	96.5	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	120.4	171.1	179.3	0	0	0	0	108.4	V120 A123 L124 V211 Y212 C213 I234 L243 T244	V120-V236 HydrophobicContact CG1-CG1 4.43Å; V120-V236 HydrophobicContact CG2-CG1 4.08Å; A123-V236 HydrophobicContact CB-CG2 3.78Å; L124-V236 HydrophobicContact CD2-CB 4.09Å; L124-V236 HydrophobicContact CD2-CG2 3.7Å; L124-V236 HydrophobicContact CG-CB 4.35Å; L124-V236 HydrophobicContact CG-CG2 3.86Å; V211-V236 PolarHBondContact O-N 3.36Å; Y212-V236 WeakPolarHBondContact CA-O 2.95Å; Y212-V236 HydrophobicContact CD2-CB 4.28Å; Y212-V236 HydrophobicContact CD2-CG1 4.24Å; Y212-V236 VanDerWaalsContact CD2-O 3.3Å; Y212-V236 WeakPolarHBondContact CD2-O 3.43Å; C213-V236 PolarHBondContact N-O 3.4Å; I234-V236 HydrophobicContact CG2-CG2 4.19Å; V236-L243 HydrophobicContact CG1-CD1 3.83Å; V236-L243 HydrophobicContact CG1-CD2 4.45Å; V236-L243 HydrophobicContact CG1-CG 4.07Å; V236-T244 WeakPolarHBondContact CA-O 3.03Å
237	M	97.2	Very high	96.6	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	152.6	177.6	66.5	-176.4	-173.1	0	0	111.8	C213 V217 E222 M225 L235 L239 T244 I246	C213-M237 HydrophobicContact CB-CB 3.7Å; V217-M237 HydrophobicContact CB-CE 4.47Å; V217-M237 HydrophobicContact CB-SD 3.89Å; V217-M237 HydrophobicContact CG1-CE 4.26Å; V217-M237 HydrophobicContact CG1-SD 3.96Å; V217-M237 HydrophobicContact CG2-CB 4.12Å; V217-M237 HydrophobicContact CG2-CG 4.31Å; V217-M237 HydrophobicContact CG2-SD 3.7Å; E222-M237 HydrophobicContact CB-CE 4.39Å; E222-M237 HydrophobicContact CG-CE 3.92Å; M225-M237 HydrophobicContact CB-CE 4.48Å; M225-M237 HydrophobicContact CB-SD 3.89Å; M225-M237 HydrophobicContact CG-SD 3.91Å; L235-M237 HydrophobicContact CD1-CB 4.35Å; L235-M237 HydrophobicContact CD1-CG 4.43Å; L235-M237 HydrophobicContact CD1-SD 4.24Å; L235-M237 HydrophobicContact CD2-CE 4.11Å; L235-M237 HydrophobicContact CD2-CG 4.49Å; L235-M237 HydrophobicContact CD2-SD 3.81Å; L235-M237 HydrophobicContact CG-CG 4.29Å; L235-M237 HydrophobicContact CG-SD 4.18Å; M237-L239 HydrophobicContact CE-CB 4.5Å; M237-L239 HydrophobicContact CE-CD2 4.29Å; M237-L239 PolarHBondContact O-N 3.49Å; M237-T244 PolarHBondContact N-O 3.23Å; M237-T244 PolarHBondContact O-N 3.46Å; M237-I246 HydrophobicContact CE-CD1 3.84Å
238	P	95.6	Very high	96.7	Very high	3 Å²	3	30.8 Å²	30.8	2%	0.019	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	122.9	166.3	-4.6	19.2	0	0	0	109.9	C213 A215 V217 K242 L243 V262 F264	C213-P238 WeakPolarHBondContact O-CD 3.43Å; A215-P238 WeakPolarHBondContact O-CD 3.48Å; V217-P238 PolarHBondContact N-O 3.43Å; P238-K242 WeakPolarHBondContact CA-O 3.37Å; P238-L243 HydrophobicContact CG-CD1 4.47Å; P238-V262 HydrophobicContact CB-CG2 4Å; P238-F264 HydrophobicContact CB-CB 4.25Å; P238-F264 HydrophobicContact CB-CD2 3.68Å; P238-F264 HydrophobicContact CB-CE2 4.1Å; P238-F264 HydrophobicContact CB-CG 3.94Å; P238-F264 HydrophobicContact CG-CB 4Å; P238-F264 HydrophobicContact CG-CD1 3.51Å; P238-F264 HydrophobicContact CG-CD2 3.33Å; P238-F264 HydrophobicContact CG-CE1 3.65Å; P238-F264 HydrophobicContact CG-CE2 3.5Å; P238-F264 VanDerWaalsContact CG-CE2 3.5Å; P238-F264 HydrophobicContact CG-CG 3.34Å; P238-F264 HydrophobicContact CG-CZ 3.64Å
239	L	94.4	Very high	96.8	Very high	14 Å²	14	34 Å²	34	7%	0.073	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	126.5	176.2	-179	65.1	0	0	0	108.1	V217 E222 M237 E241 K242	V217-L239 WeakPolarHBondContact O-CD1 3.3Å; E222-L239 HydrophobicContact CG-CD2 4.4Å; M237-L239 HydrophobicContact CE-CB 4.5Å; M237-L239 HydrophobicContact CE-CD2 4.29Å; M237-L239 PolarHBondContact O-N 3.49Å; L239-E241 VanDerWaalsContact C-N 3.34Å; L239-E241 PolarHBondContact O-N 2.88Å; L239-K242 PolarHBondContact N-O 3.44Å; L239-K242 PolarHBondContact O-N 3.22Å; L239-K242 VanDerWaalsContact O-O 3.11Å
240	E	90.4	Very high	96.7	Very high	104 Å²	104	34.4 Å²	34.4	49%	0.486	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.2	49.9	-176.9	-58.4	175	166.8	0	0	112.4	R219 K242 K258	R219-E240 IonicContact NH1-OE1 3.41Å; R219-E240 PolarHBondContact NH1-OE1 3.35Å; E240-K242 PolarHBondContact O-N 3.09Å; E240-K242 VanDerWaalsContact O-N 3.13Å; E240-K258 IonicContact OE2-NZ 2.77Å
241	E	89.4	Confident	96.6	Very high	118 Å²	118	36.1 Å²	36.1	55%	0.551	20%	0.203	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.3	18.5	-178.1	-54	-57.2	127.8	0	0	115.2	L239 V262	L239-E241 VanDerWaalsContact C-N 3.34Å; L239-E241 PolarHBondContact O-N 2.88Å; E241-V262 PolarHBondContact O-N 2.99Å
242	K	93.4	Very high	96.4	Very high	91 Å²	91	37.6 Å²	37.6	40%	0.396	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.9	177.7	-66.6	-179.7	-179	-176.7	0	111	P238 L239 E240 T244 K258 L260	P238-K242 WeakPolarHBondContact CA-O 3.37Å; L239-K242 PolarHBondContact N-O 3.44Å; L239-K242 PolarHBondContact O-N 3.22Å; L239-K242 VanDerWaalsContact O-O 3.11Å; E240-K242 PolarHBondContact O-N 3.09Å; E240-K242 VanDerWaalsContact O-N 3.13Å; K242-T244 PolarHBondContact O-N 3.16Å; K242-T244 PolarHBondContact O-OG1 3.41Å; K242-K258 HydrophobicContact CD-CD 3.84Å; K242-L260 CarbonylContact C-O 3.51Å; K242-L260 WeakPolarHBondContact CA-O 3.43Å
243	L	96	Very high	96.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.4	120.6	170.3	-168.9	68.8	0	0	0	107.6	E119 V120 V236 P238 I259 L260 V262 F264	E119-L243 HydrophobicContact CB-CD2 4.2Å; V120-L243 HydrophobicContact CG2-CD1 4.22Å; V120-L243 HydrophobicContact CG2-CD2 4.02Å; V236-L243 HydrophobicContact CG1-CD1 3.83Å; V236-L243 HydrophobicContact CG1-CD2 4.45Å; V236-L243 HydrophobicContact CG1-CG 4.07Å; P238-L243 HydrophobicContact CG-CD1 4.47Å; L243-I259 HydrophobicContact CB-CB 4.49Å; L243-I259 HydrophobicContact CD2-CD1 4.2Å; L243-I259 HydrophobicContact CG-CD1 4.21Å; L243-I259 WeakPolarHBondContact O-CB 3.39Å; L243-I259 PolarHBondContact O-N 3.16Å; L243-L260 HydrophobicContact CB-CG 4.39Å; L243-L260 HydrophobicContact CD2-CD2 4.45Å; L243-L260 PolarHBondContact N-O 2.83Å; L243-V262 HydrophobicContact CB-CG1 3.84Å; L243-V262 HydrophobicContact CB-CG2 4.09Å; L243-F264 HydrophobicContact CD1-CZ 4.46Å
244	T	97.8	Very high	96.3	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.006	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	131.5	-169.1	-61.4	0	0	0	0	109.3	V236 M237 K242 I246 T256	V236-T244 WeakPolarHBondContact CA-O 3.03Å; M237-T244 PolarHBondContact N-O 3.23Å; M237-T244 PolarHBondContact O-N 3.46Å; K242-T244 PolarHBondContact O-N 3.16Å; K242-T244 PolarHBondContact O-OG1 3.41Å; T244-I246 HydrophobicContact CG2-CG1 4.02Å; T244-T256 HydrophobicContact CG2-CG2 3.4Å; T244-T256 VanDerWaalsContact CG2-CG2 3.4Å
245	K	98.5	Very high	96.3	Very high	45 Å²	45	45.7 Å²	45.7	20%	0.196	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	125.9	169.4	174.3	173.8	177.9	157.4	0	108.9	A123 I234 L235 T256 K257 I259	A123-K245 HydrophobicContact CB-CD 4.4Å; A123-K245 WeakPolarHBondContact O-CD 3.38Å; A123-K245 WeakPolarHBondContact O-CE 3.41Å; A123-K245 PolarHBondContact O-NZ 3.29Å; I234-K245 HydrophobicContact CG2-CD 4.21Å; I234-K245 HydrophobicContact CG2-CG 3.87Å; L235-K245 CarbonylContact O-C 3.58Å; L235-K245 WeakPolarHBondContact O-CA 3.25Å; K245-T256 CarbonylContact O-C 3.55Å; K245-T256 WeakPolarHBondContact O-CA 3.48Å; K245-K257 PolarHBondContact N-O 3.08Å; K245-K257 PolarHBondContact O-N 3.33Å; K245-I259 HydrophobicContact CB-CD1 4.09Å; K245-I259 HydrophobicContact CB-CG1 4.4Å
246	I	98.6	Very high	96.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.5	174.5	-57.7	-179.9	0	0	0	107.9	E222 K226 I234 L235 M237 T244 W254 E255 T256	E222-I246 HydrophobicContact CG-CD1 4.46Å; K226-I246 HydrophobicContact CG-CG2 4.42Å; I234-I246 WeakPolarHBondContact CA-O 3.34Å; L235-I246 HydrophobicContact CB-CB 4.31Å; L235-I246 HydrophobicContact CD2-CD1 4.33Å; L235-I246 PolarHBondContact N-O 3.34Å; L235-I246 PolarHBondContact O-N 2.89Å; M237-I246 HydrophobicContact CE-CD1 3.84Å; T244-I246 HydrophobicContact CG2-CG1 4.02Å; I246-W254 HydrophobicContact CG2-CE3 3.73Å; I246-W254 HydrophobicContact CG2-CZ3 4.37Å; I246-E255 CarbonylContact C-O 3.58Å; I246-E255 VanDerWaalsContact CA-O 3.29Å; I246-E255 WeakPolarHBondContact CA-O 3.15Å; I246-T256 HydrophobicContact CG1-CG2 4.17Å
247	T	98.7	Very high	96.2	Very high	29 Å²	29	55.9 Å²	55.9	18%	0.178	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	128.5	176.6	-52.2	0	0	0	0	109.2	G233 I234 T249 W254 E255	G233-T247 WeakPolarHBondContact O-CA 3.48Å; I234-T247 HydrophobicContact CG1-CG2 4.38Å; T247-T249 HydrophobicContact CG2-CG2 4.25Å; T247-T249 PolarHBondContact O-N 2.92Å; T247-W254 WeakPolarHBondContact O-CA 3.15Å; T247-E255 PolarHBondContact N-O 3.41Å; T247-E255 PolarHBondContact O-N 3.45Å
248	R	98.4	Very high	96.2	Very high	28 Å²	28	61.4 Å²	61.4	11%	0.106	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	102.5	172.4	-166.2	174.2	-174.9	176	2.7	109.4	L229 K230 V231 G232 G233 G250 P251 W254	L229-R248 HydrophobicContact CD1-CB 4.49Å; L229-R248 PolarHBondContact O-NH1 2.9Å; K230-R248 WeakPolarHBondContact O-CB 3.47Å; K230-R248 WeakPolarHBondContact O-CD 3.46Å; V231-R248 HydrophobicContact CG2-CG 4.5Å; G232-R248 WeakPolarHBondContact CA-O 3.45Å; G232-R248 PolarHBondContact N-O 3.32Å; G233-R248 PolarHBondContact O-N 3.12Å; R248-G250 VanDerWaalsContact CG-O 3.3Å; R248-G250 WeakPolarHBondContact CG-O 3.35Å; R248-G250 PolarHBondContact NE-O 2.73Å; R248-P251 PolarHBondContact NH2-O 2.88Å; R248-W254 HydrophobicContact CB-CE3 3.73Å; R248-W254 HydrophobicContact CB-CH2 3.86Å; R248-W254 HydrophobicContact CB-CZ3 3.33Å; R248-W254 HydrophobicContact CG-CD2 4.31Å; R248-W254 HydrophobicContact CG-CE3 3.89Å; R248-W254 HydrophobicContact CG-CH2 3.49Å; R248-W254 VanDerWaalsContact CG-CH2 3.49Å; R248-W254 HydrophobicContact CG-CZ2 3.94Å; R248-W254 HydrophobicContact CG-CZ3 3.49Å; R248-W254 VanDerWaalsContact CG-CZ3 3.49Å
249	T	97.9	Very high	96.1	Very high	79 Å²	79	63.7 Å²	63.7	49%	0.485	33%	0.333	S	S	.	.			trans	-88.9	-15	-176.2	55.5	0	0	0	0	113.3	T247 A253 E255	T247-T249 HydrophobicContact CG2-CG2 4.25Å; T247-T249 PolarHBondContact O-N 2.92Å; T249-A253 PolarHBondContact N-O 2.86Å; T249-A253 WeakPolarHBondContact OG1-CB 3.4Å; T249-A253 PolarHBondContact OG1-O 3.22Å; T249-E255 HydrophobicContact CG2-CB 4.14Å
250	G	96.6	Very high	96	Very high	9 Å²	9	64.7 Å²	64.7	9%	0.093	34%	0.338	C	S	.	.	S	Bend	trans	-163.1	-174.5	176.1	0	0	0	0	0	112.4	R248 S252 A253	R248-G250 VanDerWaalsContact CG-O 3.3Å; R248-G250 WeakPolarHBondContact CG-O 3.35Å; R248-G250 PolarHBondContact NE-O 2.73Å; G250-S252 PolarHBondContact O-N 3.07Å; G250-A253 PolarHBondContact N-O 2.94Å; G250-A253 PolarHBondContact O-N 3.21Å
251	P	93.9	Very high	96	Very high	102 Å²	102	61.7 Å²	61.7	66%	0.662	33%	0.331	S	S	*	.	S	Bend	trans	-55.1	-36.9	-178.9	-27.9	36	0	0	0	113.9	R248	R248-P251 PolarHBondContact NH2-O 2.88Å
252	S	94.2	Very high	96	Very high	112 Å²	112	56.2 Å²	56.2	78%	0.783	31%	0.306	S	S	*	.	S	Bend	trans	-133.9	21	178.1	-50.5	0	0	0	0	112.4	G250	G250-S252 PolarHBondContact O-N 3.07Å
253	A	97.2	Very high	95.8	Very high	44 Å²	44	55.1 Å²	55.1	36%	0.364	31%	0.309	S	S	.	.			trans	-115.7	135.9	-176.6	0	0	0	0	0	110.7	T249 G250	T249-A253 PolarHBondContact N-O 2.86Å; T249-A253 WeakPolarHBondContact OG1-CB 3.4Å; T249-A253 PolarHBondContact OG1-O 3.22Å; G250-A253 PolarHBondContact N-O 2.94Å; G250-A253 PolarHBondContact O-N 3.21Å
254	W	98	Very high	95.3	Very high	63 Å²	63	55.7 Å²	55.7	24%	0.239	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	141.6	-171.1	-55.9	95.3	0	0	0	111	K226 L229 I246 T247 R248	K226-W254 HydrophobicContact CB-CH2 3.48Å; K226-W254 VanDerWaalsContact CB-CH2 3.48Å; K226-W254 HydrophobicContact CB-CZ2 3.74Å; K226-W254 HydrophobicContact CB-CZ3 3.89Å; K226-W254 HydrophobicContact CD-CD2 3.89Å; K226-W254 HydrophobicContact CD-CE3 4.1Å; K226-W254 HydrophobicContact CD-CG 4.37Å; K226-W254 HydrophobicContact CD-CH2 4.31Å; K226-W254 HydrophobicContact CD-CZ2 4.12Å; K226-W254 HydrophobicContact CD-CZ3 4.28Å; K226-W254 HydrophobicContact CG-CD2 4.3Å; K226-W254 HydrophobicContact CG-CE3 4.02Å; K226-W254 HydrophobicContact CG-CH2 3.88Å; K226-W254 HydrophobicContact CG-CZ2 4.16Å; K226-W254 HydrophobicContact CG-CZ3 3.78Å; K226-W254 VanDerWaalsContact O-CH2 3.3Å; K226-W254 WeakPolarHBondContact O-CH2 3.22Å; L229-W254 HydrophobicContact CB-CZ3 4.49Å; L229-W254 HydrophobicContact CD1-CZ3 3.84Å; I246-W254 HydrophobicContact CG2-CE3 3.73Å; I246-W254 HydrophobicContact CG2-CZ3 4.37Å; T247-W254 WeakPolarHBondContact O-CA 3.15Å; R248-W254 HydrophobicContact CB-CE3 3.73Å; R248-W254 HydrophobicContact CB-CH2 3.86Å; R248-W254 HydrophobicContact CB-CZ3 3.33Å; R248-W254 HydrophobicContact CG-CD2 4.31Å; R248-W254 HydrophobicContact CG-CE3 3.89Å; R248-W254 HydrophobicContact CG-CH2 3.49Å; R248-W254 VanDerWaalsContact CG-CH2 3.49Å; R248-W254 HydrophobicContact CG-CZ2 3.94Å; R248-W254 HydrophobicContact CG-CZ3 3.49Å; R248-W254 VanDerWaalsContact CG-CZ3 3.49Å
255	E	98.2	Very high	94.8	Very high	118 Å²	118	56.1 Å²	56.1	55%	0.551	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	132.1	169.5	-176.6	-175.2	-175.9	0	0	109.1	I246 T247 T249	I246-E255 CarbonylContact C-O 3.58Å; I246-E255 VanDerWaalsContact CA-O 3.29Å; I246-E255 WeakPolarHBondContact CA-O 3.15Å; T247-E255 PolarHBondContact N-O 3.41Å; T247-E255 PolarHBondContact O-N 3.45Å; T249-E255 HydrophobicContact CG2-CB 4.14Å
256	T	97.9	Very high	94.2	Very high	74 Å²	74	57.9 Å²	57.9	45%	0.454	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	125.6	-177.4	-61.1	0	0	0	0	110.6	T244 K245 I246	T244-T256 HydrophobicContact CG2-CG2 3.4Å; T244-T256 VanDerWaalsContact CG2-CG2 3.4Å; K245-T256 CarbonylContact O-C 3.55Å; K245-T256 WeakPolarHBondContact O-CA 3.48Å; I246-T256 HydrophobicContact CG1-CG2 4.17Å
257	K	97.9	Very high	93.8	Very high	140 Å²	140	58.2 Å²	58.2	61%	0.609	33%	0.334	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.7	122	176.7	-176.9	178.4	179.1	-178.6	0	110.4	K245	K245-K257 PolarHBondContact N-O 3.08Å; K245-K257 PolarHBondContact O-N 3.33Å
258	K	96.6	Very high	93.3	Very high	115 Å²	115	59.3 Å²	59.3	50%	0.5	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	128.1	172.5	-63.4	-179.9	175.8	-166.3	0	108.6	E240 K242	E240-K258 IonicContact OE2-NZ 2.77Å; K242-K258 HydrophobicContact CD-CD 3.84Å
259	I	93.9	Very high	92.8	Very high	52 Å²	52	61.6 Å²	61.6	27%	0.267	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	-69.4	-175.1	-54.4	170.6	0	0	0	109.6	A123 L243 K245	A123-I259 HydrophobicContact CB-CD1 3.52Å; L243-I259 HydrophobicContact CB-CB 4.49Å; L243-I259 HydrophobicContact CD2-CD1 4.2Å; L243-I259 HydrophobicContact CG-CD1 4.21Å; L243-I259 WeakPolarHBondContact O-CB 3.39Å; L243-I259 PolarHBondContact O-N 3.16Å; K245-I259 HydrophobicContact CB-CD1 4.09Å; K245-I259 HydrophobicContact CB-CG1 4.4Å
260	L	92	Very high	92.1	Very high	35 Å²	35	59.2 Å²	59.2	18%	0.183	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	159.8	-176.5	67.2	105.5	0	0	0	111.8	V7 I116 E119 K242 L243 V262	V7-L260 HydrophobicContact CG1-CD1 4.41Å; V7-L260 HydrophobicContact CG2-CD1 4.46Å; I116-L260 HydrophobicContact CD1-CD1 3.96Å; E119-L260 HydrophobicContact CB-CD2 3.88Å; E119-L260 HydrophobicContact CG-CD2 3.48Å; E119-L260 VanDerWaalsContact CG-CD2 3.48Å; K242-L260 CarbonylContact C-O 3.51Å; K242-L260 WeakPolarHBondContact CA-O 3.43Å; L243-L260 HydrophobicContact CB-CG 4.39Å; L243-L260 HydrophobicContact CD2-CD2 4.45Å; L243-L260 PolarHBondContact N-O 2.83Å; L260-V262 HydrophobicContact CD1-CG1 3.27Å; L260-V262 HydrophobicContact CG-CG1 4.06Å
261	A	91.6	Very high	90.8	Very high	40 Å²	40	64.6 Å²	64.6	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	130	176.3	0	0	0	0	0	110.5	G8	G8-A261 PolarHBondContact N-O 3.26Å
262	V	89.2	Confident	89.3	Confident	3 Å²	3	66.9 Å²	66.9	2%	0.018	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	156.8	-171.9	-68.3	0	0	0	0	110.6	I116 P238 E241 L243 L260 F264	I116-V262 HydrophobicContact CD1-CG1 3.76Å; P238-V262 HydrophobicContact CB-CG2 4Å; E241-V262 PolarHBondContact O-N 2.99Å; L243-V262 HydrophobicContact CB-CG1 3.84Å; L243-V262 HydrophobicContact CB-CG2 4.09Å; L260-V262 HydrophobicContact CD1-CG1 3.27Å; L260-V262 HydrophobicContact CG-CG1 4.06Å; V262-F264 HydrophobicContact CB-CD2 3.73Å; V262-F264 HydrophobicContact CB-CE2 3.61Å; V262-F264 HydrophobicContact CG1-CE2 4.05Å; V262-F264 HydrophobicContact CG2-CD2 3.54Å; V262-F264 HydrophobicContact CG2-CE2 3.58Å
263	S	87.9	Confident	87.2	Confident	68 Å²	68	66 Å²	66	48%	0.476	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	124.4	166.2	-169.3	0	0	0	0	109.6	A5 Q6	A5-S263 WeakPolarHBondContact CA-O 3.38Å; Q6-S263 PolarHBondContact N-O 2.95Å; Q6-S263 PolarHBondContact O-N 3.42Å
264	F	86.9	Confident	84.7	Confident	12 Å²	12	73.9 Å²	73.9	5%	0.053	40%	0.395	C	S	.	.			trans	-133.2	150	176.5	-80.7	-105.8	0	0	0	108.8	A5 I116 Y212 G214 P238 L243 V262	A5-F264 HydrophobicContact CB-CD1 3.49Å; A5-F264 VanDerWaalsContact CB-CD1 3.49Å; A5-F264 HydrophobicContact CB-CD2 3.7Å; A5-F264 HydrophobicContact CB-CE1 3.19Å; A5-F264 HydrophobicContact CB-CE2 3.4Å; A5-F264 VanDerWaalsContact CB-CE2 3.4Å; A5-F264 HydrophobicContact CB-CG 3.75Å; A5-F264 HydrophobicContact CB-CZ 3.15Å; I116-F264 HydrophobicContact CG2-CE2 4.34Å; I116-F264 HydrophobicContact CG2-CZ 3.87Å; Y212-F264 WeakPolarHBondContact OH-CE1 3.32Å; G214-F264 WeakPolarHBondContact O-CD1 3.43Å; P238-F264 HydrophobicContact CB-CB 4.25Å; P238-F264 HydrophobicContact CB-CD2 3.68Å; P238-F264 HydrophobicContact CB-CE2 4.1Å; P238-F264 HydrophobicContact CB-CG 3.94Å; P238-F264 HydrophobicContact CG-CB 4Å; P238-F264 HydrophobicContact CG-CD1 3.51Å; P238-F264 HydrophobicContact CG-CD2 3.33Å; P238-F264 HydrophobicContact CG-CE1 3.65Å; P238-F264 HydrophobicContact CG-CE2 3.5Å; P238-F264 VanDerWaalsContact CG-CE2 3.5Å; P238-F264 HydrophobicContact CG-CG 3.34Å; P238-F264 HydrophobicContact CG-CZ 3.64Å; L243-F264 HydrophobicContact CD1-CZ 4.46Å; V262-F264 HydrophobicContact CB-CD2 3.73Å; V262-F264 HydrophobicContact CB-CE2 3.61Å; V262-F264 HydrophobicContact CG1-CE2 4.05Å; V262-F264 HydrophobicContact CG2-CD2 3.54Å; V262-F264 HydrophobicContact CG2-CE2 3.58Å
265	A	86.1	Confident	82.5	Confident	11 Å²	11	75.6 Å²	75.6	9%	0.091	42%	0.417	C	S	.	.	P	Polyproline II helix	trans	-65.8	145.6	166.4	0	0	0	0	0	110	M1 T3 G216	M1-A265 WeakPolarHBondContact O-CB 3.34Å; T3-A265 HydrophobicContact CG2-CB 3.84Å; T3-A265 WeakPolarHBondContact OG1-CA 3.42Å; T3-A265 WeakPolarHBondContact OG1-CB 3.16Å; T3-A265 PolarHBondContact OG1-N 3.18Å; G216-A265 PolarHBondContact N-O 3.02Å
266	P	87.1	Confident	80	Confident	82 Å²	82	73.9 Å²	73.9	53%	0.532	43%	0.431	S	S	.	.	B	Isolated β-bridge	trans	-64.3	146	174.1	28.5	-34.9	0	0	0	110.8
267	L	89.1	Confident	77.7	Confident	6 Å²	6	79.2 Å²	79.2	3%	0.031	45%	0.448	C	S	.	.	P	Polyproline II helix	trans	-58.6	135.5	172.6	-167.8	67.7	0	0	0	110.3	F2 C198 L199 A215 G216 M225 Q269	F2-L267 HydrophobicContact CE1-CD1 3.77Å; F2-L267 HydrophobicContact CZ-CD1 3.69Å; C198-L267 HydrophobicContact CB-CD1 4.46Å; L199-L267 HydrophobicContact CD1-CD2 3.73Å; L199-L267 HydrophobicContact CD1-CG 4.19Å; L199-L267 HydrophobicContact CD2-CD2 3.55Å; L199-L267 HydrophobicContact CG-CD2 3.54Å; L199-L267 HydrophobicContact CG-CG 4.26Å; A215-L267 HydrophobicContact CB-CB 4.27Å; A215-L267 HydrophobicContact CB-CD1 3.92Å; G216-L267 WeakPolarHBondContact O-CB 3.42Å; G216-L267 PolarHBondContact O-N 3.02Å; M225-L267 HydrophobicContact CE-CD2 3.41Å; M225-L267 VanDerWaalsContact CE-CD2 3.41Å; L267-Q269 PolarHBondContact O-N 2.83Å
268	I	88.3	Confident	75.8	Confident	53 Å²	53	75.3 Å²	75.3	27%	0.272	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-78.2	123.5	180	-52.9	-175.6	0	0	0	109.6	L161 N197	L161-I268 HydrophobicContact CD2-CB 4.39Å; L161-I268 HydrophobicContact CD2-CD1 3.3Å; L161-I268 HydrophobicContact CD2-CG1 4.27Å; N197-I268 PolarHBondContact ND2-O 3.21Å
269	Q	87.9	Confident	74.7	Confident	76 Å²	76	80.5 Å²	80.5	36%	0.355	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-68.5	138.9	171.1	-60.6	-70.8	-9.8	0	0	110.3	H221 L267 C271	H221-Q269 PolarHBondContact CD2-NE2 3.35Å; H221-Q269 VanDerWaalsContact CD2-NE2 3.31Å; H221-Q269 PolarHBondContact NE2-NE2 3.06Å; H221-Q269 PolarHBondContact NE2-OE1 2.94Å; L267-Q269 PolarHBondContact O-N 2.83Å; Q269-C271 PolarHBondContact O-N 2.74Å
270	P	83.9	Confident	74.5	Confident	28 Å²	28	81.8 Å²	81.8	18%	0.182	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-56.1	126.7	170.4	-23.2	33.6	0	0	0	111	L199 E200 H272	L199-P270 HydrophobicContact CB-CG 4.15Å; E200-P270 HydrophobicContact CG-CB 4.05Å; E200-P270 HydrophobicContact CG-CG 3.54Å; P270-H272 PolarHBondContact O-N 2.77Å
271	C	69.1	Low	74.6	Confident	122 Å²	122	80.5 Å²	80.5	82%	0.824	46%	0.455	S	S	*	.			trans	-86.9	108.4	169.8	-90.2	0	0	0	0	109	Q269 S273	Q269-C271 PolarHBondContact O-N 2.74Å; C271-S273 VanDerWaalsContact C-N 3.34Å; C271-S273 PolarHBondContact O-N 2.96Å; C271-S273 VanDerWaalsContact O-N 3.09Å
272	H	62.1	Low	74.7	Confident	150 Å²	150	84.1 Å²	84.1	69%	0.694	47%	0.465	S	S	*	.			trans	-80.5	79	170.9	-58.2	-58	0	0	0	110.1	P270	P270-H272 PolarHBondContact O-N 2.77Å
273	S	50.1	Low	74.9	Confident	95 Å²	95	85 Å²	85	66%	0.664	47%	0.47	S	S	*	.			trans	-92.2	115.8	168.2	57.2	0	0	0	0	110.8	C271 S275	C271-S273 VanDerWaalsContact C-N 3.34Å; C271-S273 PolarHBondContact O-N 2.96Å; C271-S273 VanDerWaalsContact O-N 3.09Å; S273-S275 PolarHBondContact O-N 2.63Å; S273-S275 PolarHBondContact O-OG 3.34Å
274	E	45.8	Very low	75.1	Confident	208 Å²	208	83.3 Å²	83.3	97%	0.972	46%	0.457	S	S	*	.	S	Bend	trans	23.6	8.2	163.2	-58.5	-147.1	158.1	0	0	123.8
275	S	50.6	Low	75.2	Confident	100 Å²	100	88.2 Å²	88.2	70%	0.699	49%	0.49	S	S	*	.	S	Bend	trans	-103.9	5.4	175.7	61.3	0	0	0	0	114.3	S273 K277	S273-S275 PolarHBondContact O-N 2.63Å; S273-S275 PolarHBondContact O-OG 3.34Å; S275-K277 PolarHBondContact O-N 2.69Å
276	G	47.1	Very low	75.2	Confident	82 Å²	82	92 Å²	92	85%	0.845	51%	0.512	S	S	*	.			trans	64.5	7.4	159.4	0	0	0	0	0	117.5
277	K	48.9	Very low	74.8	Confident	186 Å²	186	92 Å²	92	81%	0.809	52%	0.519	S	S	*	.			trans	-128.9	96.3	174.3	-68	-177.9	-178.1	177.6	0	109.6	S275 R279	S275-K277 PolarHBondContact O-N 2.69Å; K277-R279 PolarHBondContact O-N 2.76Å
278	S	57.2	Low	74.6	Confident	57 Å²	57	98.4 Å²	98.4	40%	0.399	56%	0.558	S	S	.	*			trans	-58.5	111.1	157.7	172.8	0	0	0	0	106.4	E200 L280	E200-S278 PolarHBondContact OE1-OG 2.81Å; S278-L280 VanDerWaalsContact C-N 3.34Å; S278-L280 PolarHBondContact O-N 3.34Å; S278-L280 VanDerWaalsContact O-N 3.11Å
279	R	74.4	Confident	74.6	Confident	224 Å²	224	99.6 Å²	99.6	85%	0.845	56%	0.559	S	S	*	*			trans	-82.6	90.3	177.9	-174.9	178.9	-179.8	178.1	-0.3	106.5	K277 V281	K277-R279 PolarHBondContact O-N 2.76Å; R279-V281 PolarHBondContact O-N 3.27Å
280	L	90.1	Very high	74.8	Confident	80 Å²	80	98.5 Å²	98.5	42%	0.419	56%	0.559	S	S	.	*			trans	-48.7	133.3	174.8	-64.9	176.7	0	0	0	110.3	E200 S278 Q282	E200-L280 CarbonylContact O-C 3.58Å; E200-L280 WeakPolarHBondContact O-CA 3.38Å; S278-L280 VanDerWaalsContact C-N 3.34Å; S278-L280 PolarHBondContact O-N 3.34Å; S278-L280 VanDerWaalsContact O-N 3.11Å; L280-Q282 PolarHBondContact O-N 3.17Å
281	V	92.6	Very high	75.2	Confident	7 Å²	7	104.1 Å²	104.1	4%	0.042	59%	0.587	C	S	.	*	B	Isolated β-bridge	trans	-75.3	111.3	176.8	-175.9	0	0	0	0	107.9	V159 V194 N197 E200 I201 S202 R279 L283	V159-V281 HydrophobicContact CG1-CG1 4.34Å; V194-V281 HydrophobicContact CB-CG1 4.47Å; V194-V281 HydrophobicContact CG1-CG1 3.67Å; N197-V281 WeakPolarHBondContact O-CG2 3.49Å; E200-V281 HydrophobicContact CB-CG2 4.44Å; E200-V281 PolarHBondContact O-N 3.27Å; I201-V281 HydrophobicContact CG1-CB 4.43Å; S202-V281 PolarHBondContact N-O 3.38Å; R279-V281 PolarHBondContact O-N 3.27Å; V281-L283 HydrophobicContact CG1-CD2 4.44Å
282	Q	93.7	Very high	76.3	Confident	116 Å²	116	103.9 Å²	103.9	54%	0.542	57%	0.574	S	S	.	*	P	Polyproline II helix	trans	-87.5	118.8	174.3	-63.9	-62.3	-23.5	0	0	108.8	S202 L280	S202-Q282 PolarHBondContact OG-NE2 3.33Å; S202-Q282 VanDerWaalsContact OG-NE2 3.16Å; L280-Q282 PolarHBondContact O-N 3.17Å
283	L	93.7	Very high	77.6	Confident	23 Å²	23	98.9 Å²	98.9	12%	0.12	55%	0.552	C	S	.	*	P	Polyproline II helix	trans	-77.7	152.1	175.3	-62.5	-179.5	0	0	0	110.2	L133 V159 I201 C205 Y208 V281	L133-L283 HydrophobicContact CD1-CD1 4.06Å; L133-L283 HydrophobicContact CD1-CD2 4.47Å; V159-L283 HydrophobicContact CG2-CD2 3.54Å; I201-L283 HydrophobicContact CG2-CD1 3.85Å; I201-L283 HydrophobicContact CG2-CG 4.06Å; C205-L283 HydrophobicContact CB-CD1 4.04Å; C205-L283 HydrophobicContact CB-CG 4.49Å; Y208-L283 HydrophobicContact CE2-CD1 3.99Å; Y208-L283 WeakPolarHBondContact OH-CD1 3.49Å; V281-L283 HydrophobicContact CG1-CD2 4.44Å
284	P	92.1	Very high	79.6	Confident	32 Å²	32	97.2 Å²	97.2	21%	0.208	54%	0.536	C	S	.	.	P	Polyproline II helix	trans	-59.4	142.2	178.3	-17.2	31.3	0	0	0	110.3	H157 S192 V194	H157-P284 PolarHBondContact CE1-O 3.49Å; S192-P284 WeakPolarHBondContact OG-CG 3.39Å; V194-P284 HydrophobicContact CG2-CG 3.8Å
285	P	88.8	Confident	81.9	Confident	115 Å²	115	89.2 Å²	89.2	75%	0.747	51%	0.506	S	S	*	.	P	Polyproline II helix	trans	-66.6	142.6	176.6	28.3	-34.1	0	0	0	110.3	A287	P285-A287 PolarHBondContact O-N 3.33Å
286	V	86.5	Confident	83.9	Confident	90 Å²	90	85.2 Å²	85.2	55%	0.545	48%	0.475	S	S	.	.			trans	-73.1	97	171.4	-178.4	0	0	0	0	108.2	V155	V155-V286 HydrophobicContact CG1-CG2 4.07Å; V155-V286 HydrophobicContact CG2-CB 4.5Å; V155-V286 HydrophobicContact CG2-CG1 3.69Å; V155-V286 HydrophobicContact CG2-CG2 4.01Å
287	A	79.5	Confident	86	Confident	83 Å²	83	82.1 Å²	82.1	69%	0.686	44%	0.439	S	S	*	.	P	Polyproline II helix	trans	-90.7	142.8	-179	0	0	0	0	0	111.7	P285	P285-A287 PolarHBondContact O-N 3.33Å
288	V	84.1	Confident	88.1	Confident	139 Å²	139	76 Å²	76	84%	0.842	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-71.8	133.6	168.3	-175.5	0	0	0	0	108.4
289	R	87.9	Confident	89.8	Confident	79 Å²	79	76.6 Å²	76.6	30%	0.298	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-62.3	149.6	176.9	-70.2	-172.9	178.9	-105.4	4.2	111.4	P152 D293 L294	P152-R289 PolarHBondContact O-NE 2.97Å; P152-R289 PolarHBondContact O-NH2 3.22Å; R289-D293 HydrophobicContact CB-CB 4.35Å; R289-L294 HydrophobicContact CB-CD2 4.04Å; R289-L294 HydrophobicContact CB-CG 4.05Å
290	S	91.8	Very high	90.7	Very high	52 Å²	52	66.1 Å²	66.1	36%	0.364	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-63.6	152.4	174.5	75.9	0	0	0	0	111	Q292 D293 L294	S290-Q292 PolarHBondContact O-N 2.93Å; S290-D293 PolarHBondContact O-N 3.28Å; S290-D293 VanDerWaalsContact O-N 3.08Å; S290-D293 PolarHBondContact OG-N 3.31Å; S290-D293 PolarHBondContact OG-OD2 3.03Å; S290-L294 WeakPolarHBondContact O-CG 3.42Å; S290-L294 PolarHBondContact O-N 2.95Å
291	L	93.3	Very high	90.8	Very high	147 Å²	147	63.2 Å²	63.2	77%	0.77	37%	0.371	S	S	*	.	H	α-helix	trans	-55.8	-35.2	172.6	179.2	61.5	0	0	0	111.4	L294 A295	L291-L294 PolarHBondContact O-N 3.32Å; L291-A295 VanDerWaalsContact O-CB 3.3Å; L291-A295 WeakPolarHBondContact O-CB 3.49Å; L291-A295 PolarHBondContact O-N 3.29Å
292	Q	91.8	Very high	90.8	Very high	117 Å²	117	66.9 Å²	66.9	55%	0.547	39%	0.394	S	S	.	.	H	α-helix	trans	-63.1	-43.2	177.6	-151.3	-166.2	-20.3	0	0	111.4	S290 R296 Y402	S290-Q292 PolarHBondContact O-N 2.93Å; Q292-R296 PolarHBondContact O-N 3.09Å; Q292-Y402 WeakPolarHBondContact CB-OH 3.34Å; Q292-Y402 HydrophobicContact CG-CE1 4.12Å; Q292-Y402 HydrophobicContact CG-CE2 4.07Å; Q292-Y402 WeakPolarHBondContact CG-OH 3.35Å; Q292-Y402 PolarHBondContact O-OH 2.72Å
293	D	89.9	Confident	90.7	Very high	44 Å²	44	62.1 Å²	62.1	24%	0.235	37%	0.372	C	S	.	.	H	α-helix	trans	-69.7	-42.5	178	-65.5	-46.9	0	0	0	111.4	R289 S290 A295 R296 I297 Y402	R289-D293 HydrophobicContact CB-CB 4.35Å; S290-D293 PolarHBondContact O-N 3.28Å; S290-D293 VanDerWaalsContact O-N 3.08Å; S290-D293 PolarHBondContact OG-N 3.31Å; S290-D293 PolarHBondContact OG-OD2 3.03Å; D293-A295 VanDerWaalsContact C-N 3.3Å; D293-A295 PolarHBondContact O-N 3.16Å; D293-R296 VanDerWaalsContact O-CB 3.31Å; D293-R296 WeakPolarHBondContact O-CB 3.26Å; D293-R296 PolarHBondContact O-N 3.47Å; D293-R296 VanDerWaalsContact O-N 3.13Å; D293-R296 IonicContact OD1-CZ 2.74Å; D293-R296 IonicContact OD1-NH1 2.81Å; D293-R296 PolarHBondContact OD1-NH1 3.36Å; D293-R296 IonicContact OD1-NH2 2.84Å; D293-R296 PolarHBondContact OD1-NH2 3.27Å; D293-I297 WeakPolarHBondContact O-CD1 3.34Å; D293-I297 WeakPolarHBondContact O-CG1 3.35Å; D293-I297 PolarHBondContact O-N 2.76Å; D293-Y402 PolarHBondContact N-OH 3.29Å
294	L	92.5	Very high	90.5	Very high	60 Å²	60	63.1 Å²	63.1	31%	0.314	38%	0.375	S	S	.	.	H	α-helix	trans	-59.7	-42.3	175.3	-68	174.1	0	0	0	111.3	F153 R289 S290 L291 I297 A298	F153-L294 HydrophobicContact CE1-CD2 3.77Å; R289-L294 HydrophobicContact CB-CD2 4.04Å; R289-L294 HydrophobicContact CB-CG 4.05Å; S290-L294 WeakPolarHBondContact O-CG 3.42Å; S290-L294 PolarHBondContact O-N 2.95Å; L291-L294 PolarHBondContact O-N 3.32Å; L294-I297 PolarHBondContact O-N 3.22Å; L294-A298 WeakPolarHBondContact O-CB 3.24Å; L294-A298 PolarHBondContact O-N 2.76Å
295	A	93.4	Very high	90.4	Very high	41 Å²	41	68.5 Å²	68.5	34%	0.339	40%	0.395	S	S	.	.	H	α-helix	trans	-62.5	-42.4	173.9	0	0	0	0	0	111.6	L291 D293 I297 A298 I299	L291-A295 VanDerWaalsContact O-CB 3.3Å; L291-A295 WeakPolarHBondContact O-CB 3.49Å; L291-A295 PolarHBondContact O-N 3.29Å; D293-A295 VanDerWaalsContact C-N 3.3Å; D293-A295 PolarHBondContact O-N 3.16Å; A295-I297 VanDerWaalsContact C-N 3.34Å; A295-I297 PolarHBondContact O-N 3.35Å; A295-A298 PolarHBondContact O-N 2.79Å; A295-I299 WeakPolarHBondContact O-CB 3.29Å; A295-I299 WeakPolarHBondContact O-CD1 3.45Å; A295-I299 WeakPolarHBondContact O-CG1 3.49Å; A295-I299 PolarHBondContact O-N 3.29Å
296	R	92.1	Very high	90.6	Very high	16 Å²	16	65.4 Å²	65.4	6%	0.06	37%	0.374	C	S	.	.	H	α-helix	trans	-56.2	-49.7	174.8	-163	-164.5	-71.1	108.3	-9.3	111.1	Q292 D293 I299 R300 Y402 L403	Q292-R296 PolarHBondContact O-N 3.09Å; D293-R296 VanDerWaalsContact O-CB 3.31Å; D293-R296 WeakPolarHBondContact O-CB 3.26Å; D293-R296 PolarHBondContact O-N 3.47Å; D293-R296 VanDerWaalsContact O-N 3.13Å; D293-R296 IonicContact OD1-CZ 2.74Å; D293-R296 IonicContact OD1-NH1 2.81Å; D293-R296 PolarHBondContact OD1-NH1 3.36Å; D293-R296 IonicContact OD1-NH2 2.84Å; D293-R296 PolarHBondContact OD1-NH2 3.27Å; R296-I299 PolarHBondContact O-N 2.84Å; R296-R300 WeakPolarHBondContact O-CB 3.08Å; R296-R300 VanDerWaalsContact O-CG 3.3Å; R296-R300 WeakPolarHBondContact O-CG 3.4Å; R296-R300 PolarHBondContact O-N 3.04Å; R296-Y402 HydrophobicContact CB-CD1 4.41Å; R296-Y402 HydrophobicContact CB-CE1 3.64Å; R296-Y402 VanDerWaalsContact CD-O 3.28Å; R296-Y402 WeakPolarHBondContact CD-O 3.46Å; R296-Y402 HydrophobicContact CG-CD1 4.17Å; R296-Y402 HydrophobicContact CG-CE1 3.86Å; R296-Y402 VanDerWaalsContact CZ-CE2 3.49Å; R296-Y402 PolarHBondContact NE-O 2.81Å; R296-Y402 PolarHBondContact NH1-OH 2.86Å; R296-Y402 PolarHBondContact NH2-OH 2.92Å; R296-Y402 VanDerWaalsContact NH2-OH 3.09Å; R296-L403 HydrophobicContact CG-CD2 4.06Å
297	I	91.6	Very high	90.7	Very high	16 Å²	16	62.4 Å²	62.4	8%	0.082	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-47.9	-179.9	-67.5	156.5	0	0	0	110.1	P152 D293 L294 A295 I299 R300 G301	P152-I297 HydrophobicContact CB-CD1 3.58Å; P152-I297 HydrophobicContact CB-CG1 4.13Å; P152-I297 HydrophobicContact CB-CG2 4.38Å; P152-I297 HydrophobicContact CG-CD1 4.27Å; P152-I297 HydrophobicContact CG-CG2 3.88Å; D293-I297 WeakPolarHBondContact O-CD1 3.34Å; D293-I297 WeakPolarHBondContact O-CG1 3.35Å; D293-I297 PolarHBondContact O-N 2.76Å; L294-I297 PolarHBondContact O-N 3.22Å; A295-I297 VanDerWaalsContact C-N 3.34Å; A295-I297 PolarHBondContact O-N 3.35Å; I297-I299 PolarHBondContact O-N 3.15Å; I297-R300 PolarHBondContact O-N 3.24Å; I297-G301 PolarHBondContact O-N 3.47Å
298	A	93.4	Very high	91.1	Very high	59 Å²	59	64.4 Å²	64.4	49%	0.488	35%	0.35	S	S	.	.	H	α-helix	trans	-62.7	-42.7	-179.8	0	0	0	0	0	112.9	L294 A295 T302	L294-A298 WeakPolarHBondContact O-CB 3.24Å; L294-A298 PolarHBondContact O-N 2.76Å; A295-A298 PolarHBondContact O-N 2.79Å; A298-T302 PolarHBondContact O-N 2.74Å; A298-T302 PolarHBondContact O-OG1 2.97Å
299	I	93.6	Very high	91.3	Very high	68 Å²	68	63.7 Å²	63.7	35%	0.349	34%	0.337	S	S	.	.	H	α-helix	trans	-66	-50.4	177.6	-66.8	164.5	0	0	0	110	A295 R296 I297 G301 T302 I303 L403	A295-I299 WeakPolarHBondContact O-CB 3.29Å; A295-I299 WeakPolarHBondContact O-CD1 3.45Å; A295-I299 WeakPolarHBondContact O-CG1 3.49Å; A295-I299 PolarHBondContact O-N 3.29Å; R296-I299 PolarHBondContact O-N 2.84Å; I297-I299 PolarHBondContact O-N 3.15Å; I299-G301 VanDerWaalsContact C-N 3.3Å; I299-G301 PolarHBondContact O-N 3.04Å; I299-T302 WeakPolarHBondContact O-CB 3.46Å; I299-T302 PolarHBondContact O-N 2.92Å; I299-T302 VanDerWaalsContact O-N 3.13Å; I299-I303 HydrophobicContact CG2-CD1 3.89Å; I299-I303 HydrophobicContact CG2-CG1 4.49Å; I299-I303 WeakPolarHBondContact O-CG1 3.36Å; I299-I303 PolarHBondContact O-N 3.45Å; I299-L403 HydrophobicContact CB-CD2 3.86Å; I299-L403 HydrophobicContact CD1-CD2 4.27Å; I299-L403 HydrophobicContact CG2-CD1 3.98Å; I299-L403 HydrophobicContact CG2-CD2 3.59Å; I299-L403 HydrophobicContact CG2-CG 4.47Å
300	R	92.6	Very high	91.3	Very high	4 Å²	4	63.8 Å²	63.8	2%	0.015	34%	0.341	C	S	.	.	H	α-helix	trans	-57.7	-43.8	177	-74.1	173.5	62.9	86.6	-4	111.5	D184 R296 I297 T302 I303 K304 L386 L403	D184-R300 IonicContact OD1-CZ 3.45Å; D184-R300 IonicContact OD1-NH1 2.92Å; D184-R300 PolarHBondContact OD1-NH1 3.5Å; D184-R300 IonicContact OD1-NH2 2.81Å; D184-R300 PolarHBondContact OD1-NH2 3.16Å; R296-R300 WeakPolarHBondContact O-CB 3.08Å; R296-R300 VanDerWaalsContact O-CG 3.3Å; R296-R300 WeakPolarHBondContact O-CG 3.4Å; R296-R300 PolarHBondContact O-N 3.04Å; I297-R300 PolarHBondContact O-N 3.24Å; R300-T302 VanDerWaalsContact C-N 3.33Å; R300-T302 PolarHBondContact O-N 3.01Å; R300-I303 PolarHBondContact O-N 3.34Å; R300-K304 WeakPolarHBondContact O-CG 3.26Å; R300-K304 PolarHBondContact O-N 3.32Å; R300-L386 VanDerWaalsContact CZ-CD2 3.42Å; R300-L386 VanDerWaalsContact NH2-CD2 3.34Å; R300-L403 WeakPolarHBondContact CD-O 3.29Å; R300-L403 HydrophobicContact CG-CD2 4.36Å; R300-L403 PolarHBondContact NH1-O 2.82Å
301	G	91.4	Very high	90.9	Very high	19 Å²	19	64.6 Å²	64.6	20%	0.196	34%	0.344	C	S	.	.	H	α-helix	trans	-60.5	-41	176.4	0	0	0	0	0	112.7	I297 I299 K304 K305	I297-G301 PolarHBondContact O-N 3.47Å; I299-G301 VanDerWaalsContact C-N 3.3Å; I299-G301 PolarHBondContact O-N 3.04Å; G301-K304 PolarHBondContact O-N 2.98Å; G301-K305 WeakPolarHBondContact O-CG 3.31Å; G301-K305 PolarHBondContact O-N 2.95Å
302	T	93.1	Very high	90.4	Very high	85 Å²	85	61.5 Å²	61.5	52%	0.521	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-45.5	174	-57.3	0	0	0	0	111.5	A298 I299 R300 K304 K305 V306	A298-T302 PolarHBondContact O-N 2.74Å; A298-T302 PolarHBondContact O-OG1 2.97Å; I299-T302 WeakPolarHBondContact O-CB 3.46Å; I299-T302 PolarHBondContact O-N 2.92Å; I299-T302 VanDerWaalsContact O-N 3.13Å; R300-T302 VanDerWaalsContact C-N 3.33Å; R300-T302 PolarHBondContact O-N 3.01Å; T302-K304 PolarHBondContact O-N 2.94Å; T302-K305 WeakPolarHBondContact O-CB 3.46Å; T302-K305 PolarHBondContact O-N 3.44Å; T302-V306 WeakPolarHBondContact O-CG2 3.49Å; T302-V306 PolarHBondContact O-N 2.78Å; T302-V306 VanDerWaalsContact O-N 3.09Å
303	I	92	Very high	89.7	Confident	16 Å²	16	60 Å²	60	8%	0.082	33%	0.333	C	S	.	.	H	α-helix	trans	-62.7	-44.5	178.5	-63.4	168.6	0	0	0	110.9	I299 R300 K305 V306 I307 L386 K389 V390 L393	I299-I303 HydrophobicContact CG2-CD1 3.89Å; I299-I303 HydrophobicContact CG2-CG1 4.49Å; I299-I303 WeakPolarHBondContact O-CG1 3.36Å; I299-I303 PolarHBondContact O-N 3.45Å; R300-I303 PolarHBondContact O-N 3.34Å; I303-K305 VanDerWaalsContact C-N 3.32Å; I303-K305 PolarHBondContact O-N 3.38Å; I303-V306 PolarHBondContact O-N 3.31Å; I303-I307 HydrophobicContact CG2-CD1 3.91Å; I303-I307 HydrophobicContact CG2-CG1 4.46Å; I303-I307 WeakPolarHBondContact O-CG1 3.18Å; I303-I307 PolarHBondContact O-N 3.34Å; I303-L386 HydrophobicContact CB-CD1 3.95Å; I303-L386 HydrophobicContact CG2-CD1 3.54Å; I303-K389 HydrophobicContact CG2-CB 3.88Å; I303-K389 HydrophobicContact CG2-CG 3.66Å; I303-V390 HydrophobicContact CD1-CG2 3.82Å; I303-L393 HydrophobicContact CD1-CD1 3.94Å
304	K	90.1	Very high	88.9	Confident	44 Å²	44	65.8 Å²	65.8	19%	0.191	36%	0.356	C	S	.	.	H	α-helix	trans	-57.4	-43.3	175.4	-73	178.7	-178.8	-174.3	0	111.7	D184 K185 F186 D187 R300 G301 T302 V306 I307 H308 L386	D184-K304 WeakPolarHBondContact O-CE 3.36Å; D184-K304 PolarHBondContact O-NZ 3.37Å; K185-K304 PolarHBondContact O-NZ 3.48Å; K185-K304 VanDerWaalsContact O-NZ 3.08Å; F186-K304 PolarHBondContact O-NZ 3.19Å; D187-K304 IonicContact OD1-NZ 3.46Å; D187-K304 PolarHBondContact OD1-NZ 3.39Å; R300-K304 WeakPolarHBondContact O-CG 3.26Å; R300-K304 PolarHBondContact O-N 3.32Å; G301-K304 PolarHBondContact O-N 2.98Å; T302-K304 PolarHBondContact O-N 2.94Å; K304-V306 PolarHBondContact O-N 3.07Å; K304-I307 PolarHBondContact O-N 2.97Å; K304-H308 WeakPolarHBondContact O-CB 3.45Å; K304-H308 PolarHBondContact O-N 3.25Å; K304-L386 HydrophobicContact CG-CD1 4.15Å; K304-L386 HydrophobicContact CG-CD2 4.43Å
305	K	90.2	Very high	87.5	Confident	144 Å²	144	68.7 Å²	68.7	63%	0.626	37%	0.372	S	S	*	.	H	α-helix	trans	-60.6	-43.5	176.4	-73.8	174	-176.9	179.6	0	112.1	G301 T302 I303 H308 Q309	G301-K305 WeakPolarHBondContact O-CG 3.31Å; G301-K305 PolarHBondContact O-N 2.95Å; T302-K305 WeakPolarHBondContact O-CB 3.46Å; T302-K305 PolarHBondContact O-N 3.44Å; I303-K305 VanDerWaalsContact C-N 3.32Å; I303-K305 PolarHBondContact O-N 3.38Å; K305-H308 PolarHBondContact O-N 2.8Å; K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.16Å; K305-Q309 PolarHBondContact O-N 3.19Å
306	V	91.4	Very high	85.6	Confident	50 Å²	50	69.6 Å²	69.6	30%	0.303	39%	0.386	S	S	.	.	H	α-helix	trans	-62.4	-46.5	176.6	172.9	0	0	0	0	111	T302 I303 K304 H308 Q309 E310	T302-V306 WeakPolarHBondContact O-CG2 3.49Å; T302-V306 PolarHBondContact O-N 2.78Å; T302-V306 VanDerWaalsContact O-N 3.09Å; I303-V306 PolarHBondContact O-N 3.31Å; K304-V306 PolarHBondContact O-N 3.07Å; V306-H308 VanDerWaalsContact C-N 3.3Å; V306-H308 PolarHBondContact O-N 3.42Å; V306-Q309 PolarHBondContact O-N 2.9Å; V306-E310 HydrophobicContact CG1-CG 4.44Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.31Å; V306-E310 WeakPolarHBondContact O-CG 3.47Å; V306-E310 PolarHBondContact O-N 3.23Å
307	I	89.3	Confident	83.4	Confident	27 Å²	27	76.5 Å²	76.5	14%	0.138	42%	0.424	C	S	.	.	H	α-helix	trans	-58.6	-43.8	177.1	-67.3	166.2	0	0	0	110.8	I303 K304 E310 T311 F385 L386 K389	I303-I307 HydrophobicContact CG2-CD1 3.91Å; I303-I307 HydrophobicContact CG2-CG1 4.46Å; I303-I307 WeakPolarHBondContact O-CG1 3.18Å; I303-I307 PolarHBondContact O-N 3.34Å; K304-I307 PolarHBondContact O-N 2.97Å; I307-E310 PolarHBondContact O-N 3.02Å; I307-T311 PolarHBondContact O-N 3.47Å; I307-T311 PolarHBondContact O-OG1 3.36Å; I307-F385 HydrophobicContact CD1-CB 4.31Å; I307-F385 HydrophobicContact CG2-CB 4.14Å; I307-L386 HydrophobicContact CD1-CB 4.48Å; I307-L386 HydrophobicContact CD1-CD1 4.32Å; I307-K389 HydrophobicContact CD1-CB 4.03Å; I307-K389 HydrophobicContact CD1-CG 4.41Å; I307-K389 HydrophobicContact CG1-CB 4.43Å; I307-K389 HydrophobicContact CG1-CG 4.35Å
308	H	87.1	Confident	81.1	Confident	126 Å²	126	78 Å²	78	58%	0.583	44%	0.443	S	S	*	.	H	α-helix	trans	-63.3	-44.7	178.6	-174.1	73.1	0	0	0	111.8	K304 K305 V306 E310 T311 V312	K304-H308 WeakPolarHBondContact O-CB 3.45Å; K304-H308 PolarHBondContact O-N 3.25Å; K305-H308 PolarHBondContact O-N 2.8Å; V306-H308 VanDerWaalsContact C-N 3.3Å; V306-H308 PolarHBondContact O-N 3.42Å; H308-E310 PolarHBondContact O-N 3.22Å; H308-T311 PolarHBondContact O-N 3.33Å; H308-V312 WeakPolarHBondContact O-CG2 3.49Å; H308-V312 PolarHBondContact O-N 3.06Å
309	Q	88.4	Confident	78.5	Confident	124 Å²	124	83.3 Å²	83.3	58%	0.579	46%	0.462	S	S	*	.	H	α-helix	trans	-61.7	-42.4	176.1	-73	172.3	-6.4	0	0	112.6	K305 V306 T311 V312 S313	K305-Q309 VanDerWaalsContact O-CG 3.31Å; K305-Q309 WeakPolarHBondContact O-CG 3.16Å; K305-Q309 PolarHBondContact O-N 3.19Å; V306-Q309 PolarHBondContact O-N 2.9Å; Q309-T311 VanDerWaalsContact C-N 3.31Å; Q309-T311 PolarHBondContact O-N 2.78Å; Q309-V312 PolarHBondContact O-N 3.42Å; Q309-S313 WeakPolarHBondContact O-CB 3.39Å; Q309-S313 PolarHBondContact O-N 2.92Å; Q309-S313 PolarHBondContact O-OG 3.1Å
310	E	88.3	Confident	76	Confident	81 Å²	81	89.6 Å²	89.6	38%	0.379	49%	0.487	S	S	.	.	H	α-helix	trans	-62.4	-39	175.9	-73.2	174.4	-178.8	0	0	111.5	V306 I307 H308 K314 K389	V306-E310 HydrophobicContact CG1-CG 4.44Å; V306-E310 WeakPolarHBondContact CG1-OE1 3.31Å; V306-E310 WeakPolarHBondContact O-CG 3.47Å; V306-E310 PolarHBondContact O-N 3.23Å; I307-E310 PolarHBondContact O-N 3.02Å; H308-E310 PolarHBondContact O-N 3.22Å; E310-K314 WeakPolarHBondContact O-CG 3.37Å; E310-K314 PolarHBondContact O-N 2.99Å; E310-K314 VanDerWaalsContact O-N 3.12Å; E310-K389 IonicContact OE1-NZ 2.73Å; E310-K389 PolarHBondContact OE1-NZ 3.15Å; E310-K389 IonicContact OE2-NZ 3.73Å; E310-K389 PolarHBondContact OE2-NZ 3.07Å
311	T	84.5	Confident	73.1	Confident	69 Å²	69	96.5 Å²	96.5	42%	0.423	52%	0.524	S	S	.	.	H	α-helix	trans	-69	-45.1	178.7	-52.9	0	0	0	0	111.8	I307 H308 Q309 S313 K314 N315	I307-T311 PolarHBondContact O-N 3.47Å; I307-T311 PolarHBondContact O-OG1 3.36Å; H308-T311 PolarHBondContact O-N 3.33Å; Q309-T311 VanDerWaalsContact C-N 3.31Å; Q309-T311 PolarHBondContact O-N 2.78Å; T311-S313 VanDerWaalsContact C-N 3.34Å; T311-S313 PolarHBondContact O-N 2.95Å; T311-K314 PolarHBondContact O-N 3.01Å; T311-N315 PolarHBondContact O-N 3.33Å; T311-N315 VanDerWaalsContact O-N 3.12Å
312	V	81.8	Confident	70.4	Confident	82 Å²	82	100.9 Å²	100.9	50%	0.497	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-40.7	177.1	173.8	0	0	0	0	111	H308 Q309 K314 N315 G316	H308-V312 WeakPolarHBondContact O-CG2 3.49Å; H308-V312 PolarHBondContact O-N 3.06Å; Q309-V312 PolarHBondContact O-N 3.42Å; V312-K314 PolarHBondContact O-N 2.94Å; V312-N315 PolarHBondContact O-N 2.66Å; V312-G316 PolarHBondContact O-N 2.74Å
313	S	76.6	Confident	67.7	Low	86 Å²	86	101.8 Å²	101.8	60%	0.601	56%	0.555	S	S	*	*	H	α-helix	trans	-65.5	-36	179	-57.5	0	0	0	0	112.7	Q309 T311	Q309-S313 WeakPolarHBondContact O-CB 3.39Å; Q309-S313 PolarHBondContact O-N 2.92Å; Q309-S313 PolarHBondContact O-OG 3.1Å; T311-S313 VanDerWaalsContact C-N 3.34Å; T311-S313 PolarHBondContact O-N 2.95Å
314	K	74.1	Confident	64.9	Low	164 Å²	164	112.3 Å²	112.3	71%	0.713	59%	0.593	S	S	*	*	H	α-helix	trans	-69.4	-36.6	174.4	-75.1	174	-179.3	178.8	0	112.6	E310 T311 V312	E310-K314 WeakPolarHBondContact O-CG 3.37Å; E310-K314 PolarHBondContact O-N 2.99Å; E310-K314 VanDerWaalsContact O-N 3.12Å; T311-K314 PolarHBondContact O-N 3.01Å; V312-K314 PolarHBondContact O-N 2.94Å
315	N	63.6	Low	62.3	Low	122 Å²	122	119 Å²	119	65%	0.652	62%	0.623	S	S	*	*	H	α-helix	trans	-82.4	-13.9	-179.9	-69.7	-7.6	0	0	0	113.6	T311 V312 N317	T311-N315 PolarHBondContact O-N 3.33Å; T311-N315 VanDerWaalsContact O-N 3.12Å; V312-N315 PolarHBondContact O-N 2.66Å; N315-N317 VanDerWaalsContact C-N 3.31Å; N315-N317 PolarHBondContact O-N 2.84Å
316	G	52.1	Low	59.5	Low	60 Å²	60	121.6 Å²	121.6	62%	0.619	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.6	-12.8	177.9	0	0	0	0	0	115.7	V312	V312-G316 PolarHBondContact O-N 2.74Å
317	N	47.5	Very low	56.8	Low	161 Å²	161	130.6 Å²	130.6	86%	0.861	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	8	-179	-83.2	-1.4	0	0	0	114.4	N315	N315-N317 VanDerWaalsContact C-N 3.31Å; N315-N317 PolarHBondContact O-N 2.84Å
318	G	41.6	Very low	54.3	Low	47 Å²	47	140.3 Å²	140.3	49%	0.485	70%	0.698	S	S	.	*	S	Bend	trans	-118.2	125.6	175.5	0	0	0	0	0	110.8	K320	G318-K320 PolarHBondContact O-N 3Å
319	L	39.8	Very low	51.7	Low	170 Å²	170	145.8 Å²	145.8	89%	0.89	71%	0.713	S	S	*	*			trans	-42.7	130.1	162.3	-80.8	148.7	0	0	0	109.1	N321	L319-N321 VanDerWaalsContact C-N 3.26Å; L319-N321 PolarHBondContact O-N 3.33Å
320	K	39.8	Very low	49.1	Very low	200 Å²	200	146.3 Å²	146.3	87%	0.87	72%	0.724	S	S	*	*			trans	-59.3	86.5	178.1	-72.4	-178.4	178.2	180	0	110.3	G318 T322	G318-K320 PolarHBondContact O-N 3Å; K320-T322 VanDerWaalsContact C-N 3.35Å; K320-T322 PolarHBondContact O-N 3.24Å
321	N	33	Very low	46.3	Very low	149 Å²	149	153.5 Å²	153.5	80%	0.797	75%	0.748	S	S	*	*			trans	-80.7	94.9	152.1	-74.6	-17.1	0	0	0	105.4	L319	L319-N321 VanDerWaalsContact C-N 3.26Å; L319-N321 PolarHBondContact O-N 3.33Å
322	T	34.8	Very low	43.7	Very low	111 Å²	111	161.6 Å²	161.6	68%	0.681	77%	0.771	S	S	*	*			trans	-47.2	132.2	158.4	31.9	0	0	0	0	107.7	K320 R324	K320-T322 VanDerWaalsContact C-N 3.35Å; K320-T322 PolarHBondContact O-N 3.24Å; T322-R324 PolarHBondContact O-N 2.78Å
323	P	35.4	Very low	41.6	Very low	105 Å²	105	169 Å²	169	68%	0.682	79%	0.79	S	S	*	*			trans	-58.6	111.2	169.4	22.8	-28.6	0	0	0	106.1	F325	P323-F325 PolarHBondContact O-N 3.13Å
324	R	33.6	Very low	39.3	Very low	236 Å²	236	176.5 Å²	176.5	89%	0.891	81%	0.805	S	S	*	*			trans	-62.7	90.2	163.2	-84	-176.1	172	175.4	-1.4	105.1	T322 K326	T322-R324 PolarHBondContact O-N 2.78Å; R324-K326 VanDerWaalsContact C-N 3.33Å; R324-K326 PolarHBondContact O-N 2.95Å
325	F	35.5	Very low	37.4	Very low	186 Å²	186	177.1 Å²	177.1	82%	0.816	81%	0.813	S	S	*	*			trans	-50.9	110.6	154.3	-89.7	-90.4	0	0	0	105	P323 R327	P323-F325 PolarHBondContact O-N 3.13Å; F325-R327 VanDerWaalsContact C-N 3.29Å; F325-R327 PolarHBondContact O-N 3.24Å
326	K	31.8	Very low	35.7	Very low	197 Å²	197	178.6 Å²	178.6	86%	0.857	82%	0.816	S	S	*	*			trans	-58.1	104	171.2	-74	-179.2	179.4	176.4	0	104.3	R324 R328	R324-K326 VanDerWaalsContact C-N 3.33Å; R324-K326 PolarHBondContact O-N 2.95Å; K326-R328 PolarHBondContact O-N 3.3Å
327	R	34.8	Very low	34.8	Very low	239 Å²	239	181.6 Å²	181.6	90%	0.902	82%	0.822	S	S	*	*			trans	-53.1	98.6	162.2	-83.7	-177.7	172.1	176.2	-3.1	105.3	F325 R329	F325-R327 VanDerWaalsContact C-N 3.29Å; F325-R327 PolarHBondContact O-N 3.24Å; R327-R329 PolarHBondContact O-N 3.35Å
328	R	37	Very low	34.4	Very low	231 Å²	231	179.2 Å²	179.2	87%	0.872	81%	0.808	S	S	*	*			trans	-61.4	113.2	171	-153.2	174.5	177.8	-178.7	0.3	103.3	K326 V330	K326-R328 PolarHBondContact O-N 3.3Å; R328-V330 PolarHBondContact O-N 3.5Å
329	R	32	Very low	33.9	Very low	241 Å²	241	181.6 Å²	181.6	91%	0.909	81%	0.813	S	S	*	*			trans	-55.2	108.9	178.4	-85.2	-179.5	174.1	176.4	-2.2	106.5	R327 R331	R327-R329 PolarHBondContact O-N 3.35Å; R329-R331 PolarHBondContact O-N 3.08Å
330	V	33.5	Very low	33.5	Very low	135 Å²	135	181.5 Å²	181.5	82%	0.818	81%	0.806	S	S	*	*			trans	-57.2	107.6	168.9	175.7	0	0	0	0	105.9	R328 R332	R328-V330 PolarHBondContact O-N 3.5Å; V330-R332 PolarHBondContact O-N 3.48Å
331	R	29.5	Very low	33.1	Very low	232 Å²	232	178.6 Å²	178.6	88%	0.875	80%	0.799	S	S	*	*			trans	-60.3	110	162.1	-97	-179.1	167.8	174.3	-3	104.8	R329 R333	R329-R331 PolarHBondContact O-N 3.08Å; R331-R333 VanDerWaalsContact C-N 3.31Å; R331-R333 PolarHBondContact O-N 3.04Å
332	R	30.7	Very low	33.3	Very low	240 Å²	240	179.3 Å²	179.3	91%	0.906	80%	0.803	S	S	*	*			trans	-50	99.3	164.6	-96.8	-179.4	168.3	176.9	-3.9	107.2	V330 R334	V330-R332 PolarHBondContact O-N 3.48Å; R332-R334 PolarHBondContact O-N 3.32Å
333	R	35.8	Very low	33.6	Very low	236 Å²	236	184.2 Å²	184.2	89%	0.891	82%	0.815	S	S	*	*			trans	-66.8	114	160.2	-79.5	-175.8	175.1	174.9	0	105	R331 M335	R331-R333 VanDerWaalsContact C-N 3.31Å; R331-R333 PolarHBondContact O-N 3.04Å; R333-M335 PolarHBondContact O-N 3.48Å; R333-M335 VanDerWaalsContact O-N 3.12Å
334	R	30.2	Very low	33.5	Very low	244 Å²	244	186.3 Å²	186.3	92%	0.921	82%	0.815	S	S	*	*			trans	-57.4	114.6	166.3	-86.6	-180	171	172.1	-2.5	106.3	R332 E336	R332-R334 PolarHBondContact O-N 3.32Å; R334-E336 PolarHBondContact O-N 2.96Å
335	M	32.2	Very low	33.5	Very low	177 Å²	177	180.3 Å²	180.3	87%	0.872	81%	0.805	S	S	*	*			trans	-67.6	124.6	168.6	-73.3	175.9	88.6	0	0	107.8	R333	R333-M335 PolarHBondContact O-N 3.48Å; R333-M335 VanDerWaalsContact O-N 3.12Å
336	E	29.3	Very low	33.3	Very low	154 Å²	154	179.7 Å²	179.7	72%	0.72	80%	0.802	S	S	*	*			trans	-83.4	108.1	160.2	-72.6	-175.8	159.1	0	0	107	R334 I338	R334-E336 PolarHBondContact O-N 2.96Å; E336-I338 PolarHBondContact O-N 3Å
337	T	33.3	Very low	33.3	Very low	122 Å²	122	175.1 Å²	175.1	75%	0.748	80%	0.801	S	S	*	*			trans	-74.4	108.1	172.5	-54.6	0	0	0	0	108.2	V339	T337-V339 HydrophobicContact CG2-CG2 4.05Å
338	I	38.3	Very low	33.2	Very low	111 Å²	111	168.7 Å²	168.7	57%	0.569	79%	0.793	S	S	*	*			trans	-89.7	112.7	170.7	-58.3	174.3	0	0	0	107.5	E336 F340	E336-I338 PolarHBondContact O-N 3Å; I338-F340 HydrophobicContact CG2-CD2 4.13Å; I338-F340 HydrophobicContact CG2-CE2 3.67Å; I338-F340 HydrophobicContact CG2-CZ 3.93Å
339	V	31.5	Very low	33	Very low	97 Å²	97	168.2 Å²	168.2	59%	0.588	79%	0.791	S	S	*	*			trans	-95.9	119.9	174	-177	0	0	0	0	108	T337 L341	T337-V339 HydrophobicContact CG2-CG2 4.05Å; V339-L341 HydrophobicContact CG1-CD1 4.16Å
340	F	32.4	Very low	33	Very low	169 Å²	169	164 Å²	164	74%	0.741	79%	0.785	S	S	*	*			trans	-91.3	113	171.3	-71.5	-86.6	0	0	0	109.4	I338	I338-F340 HydrophobicContact CG2-CD2 4.13Å; I338-F340 HydrophobicContact CG2-CE2 3.67Å; I338-F340 HydrophobicContact CG2-CZ 3.93Å
341	L	30.4	Very low	32.9	Very low	139 Å²	139	162.6 Å²	162.6	73%	0.728	78%	0.781	S	S	*	*	B	Isolated β-bridge	trans	-122.1	129.9	160.9	-114.4	83.6	0	0	0	107.3	V339 K343	V339-L341 HydrophobicContact CG1-CD1 4.16Å; L341-K343 PolarHBondContact O-N 3.24Å
342	D	37.5	Very low	32.8	Very low	163 Å²	163	158.8 Å²	158.8	87%	0.872	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	10.7	98.3	176.5	-73.3	-28.2	0	0	0	117.6	E344	D342-E344 VanDerWaalsContact C-N 3.32Å; D342-E344 PolarHBondContact O-N 3.43Å
343	K	41.8	Very low	32.9	Very low	215 Å²	215	153 Å²	153	94%	0.935	77%	0.772	S	S	*	*	T	Hydrogen-bonded Turn	trans	55.9	13.2	160.8	-75.2	-169.5	176.1	-177.4	0	119.9	L341	L341-K343 PolarHBondContact O-N 3.24Å
344	E	32.1	Very low	32.6	Very low	149 Å²	149	146.9 Å²	146.9	70%	0.696	77%	0.765	S	S	*	*	B	Isolated β-bridge	trans	-141.7	142.4	165	-67.6	-170.4	167.9	0	0	113.3	D342	D342-E344 VanDerWaalsContact C-N 3.32Å; D342-E344 PolarHBondContact O-N 3.43Å
345	V	33.9	Very low	32.7	Very low	109 Å²	109	143 Å²	143	66%	0.661	76%	0.762	S	S	*	*			trans	-97.6	118	-176.7	-179.6	0	0	0	0	110.1
346	F	30.4	Very low	32.6	Very low	173 Å²	173	142 Å²	142	76%	0.759	76%	0.76	S	S	*	*			trans	-113.3	120.8	169	-84.2	-91.1	0	0	0	110.5
347	A	32.7	Very low	32.7	Very low	102 Å²	102	142 Å²	142	84%	0.843	77%	0.766	S	S	*	*			trans	-101.3	103.9	168.5	0	0	0	0	0	109.1
348	S	33.2	Very low	32.5	Very low	103 Å²	103	141.4 Å²	141.4	72%	0.72	77%	0.766	S	S	*	*			trans	-102.2	120.8	172.6	57.9	0	0	0	0	110.6
349	R	32.7	Very low	32	Very low	221 Å²	221	141.9 Å²	141.9	83%	0.834	78%	0.778	S	S	*	*			trans	-86.5	111.4	171.9	-69.9	178.4	-179.2	169.9	1.7	108.3
350	I	31.5	Very low	32	Very low	153 Å²	153	145.4 Å²	145.4	79%	0.785	79%	0.788	S	S	*	*			trans	-92.8	110.8	169	-57.7	177.2	0	0	0	107.8
351	S	30.9	Very low	31.8	Very low	105 Å²	105	144.8 Å²	144.8	73%	0.734	79%	0.792	S	S	*	*			trans	-113.3	123.5	171	47.4	0	0	0	0	109.4
352	N	29	Very low	32	Very low	153 Å²	153	145.4 Å²	145.4	82%	0.818	80%	0.796	S	S	*	*			trans	-81.4	141.9	166.1	-80.9	-1	0	0	0	110.1
353	P	32.1	Very low	31.7	Very low	119 Å²	119	146.1 Å²	146.1	77%	0.773	79%	0.794	S	S	*	*			trans	-98.2	135.2	-176	35.9	-28.5	0	0	0	111.9
354	S	29.2	Very low	31.1	Very low	107 Å²	107	144.9 Å²	144.9	75%	0.748	79%	0.792	S	S	*	*			trans	163.1	102	144.6	55.8	0	0	0	0	109.4
355	D	31.6	Very low	31	Very low	161 Å²	161	144.8 Å²	144.8	86%	0.861	79%	0.791	S	S	*	*				174.9	105.7	121.1	-83.9	-13.6	0	0	0	109
356	D	30.6	Very low	31.2	Very low	156 Å²	156	151.6 Å²	151.6	83%	0.834	81%	0.805	S	S	*	*			trans	-64.8	132.9	163.9	-87.6	-40.1	0	0	0	109.8
357	N	31.4	Very low	31.1	Very low	155 Å²	155	153 Å²	153	83%	0.829	81%	0.805	S	S	*	*				-170.6	139.4	118	-107.5	-32.6	0	0	0	114.3
358	S	29.9	Very low	31.3	Very low	109 Å²	109	157 Å²	157	76%	0.762	81%	0.806	S	S	*	*			trans	65.1	98.8	159.5	61.9	0	0	0	0	119.4
359	C	28.2	Very low	31.1	Very low	121 Å²	121	161.3 Å²	161.3	82%	0.818	82%	0.815	S	S	*	*			trans	-62.4	133.9	146.3	178	0	0	0	0	110.3
360	E	30.5	Very low	31	Very low	172 Å²	172	159.4 Å²	159.4	80%	0.804	82%	0.816	S	S	*	*				-175.6	147.6	122.6	-99.4	174.9	-162.5	0	0	111.5
361	D	29.1	Very low	31	Very low	155 Å²	155	160.8 Å²	160.8	83%	0.829	82%	0.819	S	S	*	*			trans	93.6	121.4	164.5	-68.7	-23.1	0	0	0	122.4
362	L	32.8	Very low	31	Very low	153 Å²	153	164.6 Å²	164.6	80%	0.801	82%	0.822	S	S	*	*			trans	-85.9	149.1	-171.6	-71	155.3	0	0	0	110.7
363	E	32.6	Very low	31	Very low	177 Å²	177	163.4 Å²	163.4	83%	0.827	82%	0.821	S	S	*	*			trans	23.2	103	140.4	-58.8	-175.9	152.6	0	0	117.6
364	E	28.3	Very low	31.1	Very low	190 Å²	190	163 Å²	163	89%	0.888	82%	0.818	S	S	*	*			trans	-164.7	148	132.6	-113	170.7	-173.8	0	0	112.7
365	E	29.6	Very low	31.4	Very low	147 Å²	147	163.3 Å²	163.3	69%	0.687	82%	0.818	S	S	*	*			trans	78.8	77.9	168.8	-55.7	-154.3	136.1	0	0	119.7	R367	E365-R367 PolarHBondContact O-N 3.34Å; E365-R367 IonicContact OE1-NH1 3.85Å
366	R	39.8	Very low	31.7	Very low	252 Å²	252	164.7 Å²	164.7	95%	0.951	82%	0.819	S	S	*	*			trans	-57.8	109	136	-96.4	-179.7	-84.5	-103	-5.7	109
367	R	28.3	Very low	32	Very low	201 Å²	201	163.6 Å²	163.6	76%	0.758	82%	0.818	S	S	*	*			trans	-156.3	111.7	156.3	-103	162.6	-168	176.3	3.7	110.3	E365	E365-R367 PolarHBondContact O-N 3.34Å; E365-R367 IonicContact OE1-NH1 3.85Å
368	E	36.4	Very low	32.2	Very low	187 Å²	187	165 Å²	165	87%	0.874	82%	0.817	S	S	*	*			trans	21.9	101.6	146.9	-63.9	170.5	-178.3	0	0	118.4
369	E	29.1	Very low	32.7	Very low	193 Å²	193	165.6 Å²	165.6	90%	0.902	82%	0.818	S	S	*	*			trans	-128.2	100.5	138	-80.7	-169.7	158.3	0	0	108	E371	E369-E371 PolarHBondContact O-N 3.41Å
370	E	30.4	Very low	33.3	Very low	181 Å²	181	166.9 Å²	166.9	85%	0.846	82%	0.817	S	S	*	*			trans	-63.5	86	161.1	-75.7	-175.3	149.9	0	0	108.5	K372	E370-K372 VanDerWaalsContact C-N 3.28Å; E370-K372 PolarHBondContact O-N 3.39Å
371	E	30.6	Very low	34.4	Very low	183 Å²	183	163.6 Å²	163.6	86%	0.855	81%	0.81	S	S	*	*			trans	-70.6	92.8	165.7	-155.9	-179.6	-166	0	0	107.4	E369 T373	E369-E371 PolarHBondContact O-N 3.41Å; E371-T373 PolarHBondContact O-N 3.35Å
372	K	32	Very low	35.9	Very low	185 Å²	185	159.9 Å²	159.9	80%	0.804	80%	0.795	S	S	*	*			trans	-50.8	101.2	168.5	-81.8	177.4	177	172.3	0	108.6	E370 P374	E370-K372 VanDerWaalsContact C-N 3.28Å; E370-K372 PolarHBondContact O-N 3.39Å; K372-P374 WeakPolarHBondContact O-CD 3.36Å
373	T	28.6	Very low	37.6	Very low	128 Å²	128	155.9 Å²	155.9	79%	0.785	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-55.9	120.7	162.4	15.2	0	0	0	0	106.8	E371	E371-T373 PolarHBondContact O-N 3.35Å
374	P	34.4	Very low	40	Very low	109 Å²	109	148.5 Å²	148.5	71%	0.708	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-61.7	140.9	175.1	25.2	-30.4	0	0	0	107.7	K372 E376	K372-P374 WeakPolarHBondContact O-CD 3.36Å; P374-E376 PolarHBondContact O-N 3.42Å; P374-E376 VanDerWaalsContact O-N 3.15Å
375	P	36.1	Very low	42.7	Very low	115 Å²	115	145.5 Å²	145.5	75%	0.747	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-56.5	127.2	176.8	23.6	-31.1	0	0	0	107.9	T377	P375-T377 VanDerWaalsContact C-N 3.34Å; P375-T377 PolarHBondContact O-N 3.01Å
376	E	36.2	Very low	45.5	Very low	189 Å²	189	139 Å²	139	88%	0.883	70%	0.697	S	S	*	*			trans	-50.7	105.3	168.5	-78.5	179.9	159	0	0	107	P374 K378	P374-E376 PolarHBondContact O-N 3.42Å; P374-E376 VanDerWaalsContact O-N 3.15Å; E376-K378 PolarHBondContact O-N 3.43Å
377	T	38.5	Very low	47.8	Very low	133 Å²	133	130.2 Å²	130.2	82%	0.816	66%	0.663	S	S	*	*			trans	-65.2	108.7	173.1	11	0	0	0	0	104.3	P375 P379	P375-T377 VanDerWaalsContact C-N 3.34Å; P375-T377 PolarHBondContact O-N 3.01Å; T377-P379 VanDerWaalsContact O-N 3.15Å
378	K	35.4	Very low	50.7	Low	185 Å²	185	125.8 Å²	125.8	80%	0.804	65%	0.652	S	S	*	*	P	Polyproline II helix	trans	-46.5	126.6	167.2	-68.7	-178.1	178.7	-178.2	0	106.2	E376 D380	E376-K378 PolarHBondContact O-N 3.43Å; K378-D380 PolarHBondContact O-N 3.46Å
379	P	39.9	Very low	53.3	Low	122 Å²	122	119.7 Å²	119.7	79%	0.792	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-53.1	131.8	177.3	20.5	-30	0	0	0	107.9	T377	T377-P379 VanDerWaalsContact O-N 3.15Å
380	D	40.9	Very low	56.3	Low	148 Å²	148	110.5 Å²	110.5	79%	0.791	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-50.4	139	176.1	-75.4	-44.2	0	0	0	108.8	K378	K378-D380 PolarHBondContact O-N 3.46Å
381	P	53.5	Low	59.2	Low	102 Å²	102	104.8 Å²	104.8	66%	0.662	55%	0.554	S	S	*	*	P	Polyproline II helix	trans	-54.7	136.6	-179.5	21.5	-31.3	0	0	0	109.3	V383	P381-V383 PolarHBondContact O-N 3.02Å; P381-V383 VanDerWaalsContact O-N 3.15Å
382	P	60.2	Low	62.2	Low	78 Å²	78	100.1 Å²	100.1	51%	0.506	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-55.5	124.3	-174.5	20.5	-31.4	0	0	0	110.4	N384	P382-N384 PolarHBondContact O-N 2.75Å; P382-N384 VanDerWaalsContact O-N 3.17Å
383	V	68.9	Low	65.1	Low	68 Å²	68	93.9 Å²	93.9	41%	0.412	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-68.8	117.4	-176.2	179.4	0	0	0	0	110.2	P381 F385 Q388	P381-V383 PolarHBondContact O-N 3.02Å; P381-V383 VanDerWaalsContact O-N 3.15Å; V383-F385 HydrophobicContact CB-CE1 4.33Å; V383-F385 HydrophobicContact CB-CE2 4.34Å; V383-F385 HydrophobicContact CB-CZ 4.09Å; V383-F385 HydrophobicContact CG1-CD1 4.05Å; V383-F385 HydrophobicContact CG1-CE1 3.88Å; V383-F385 HydrophobicContact CG1-CG 4.47Å; V383-F385 HydrophobicContact CG1-CZ 4.16Å; V383-F385 WeakPolarHBondContact O-CD2 3.37Å; V383-F385 PolarHBondContact O-N 2.96Å; V383-Q388 VanDerWaalsContact CG1-NE2 3.29Å
384	N	82.3	Confident	68.2	Low	22 Å²	22	93.9 Å²	93.9	12%	0.118	52%	0.519	C	S	.	.			trans	-79.2	86.9	174	-168.8	-34.1	0	0	0	110.7	D181 D184 P382 L386 R387 Q388	D181-N384 PolarHBondContact OD1-ND2 3.46Å; D184-N384 PolarHBondContact OD2-ND2 3.05Å; P382-N384 PolarHBondContact O-N 2.75Å; P382-N384 VanDerWaalsContact O-N 3.17Å; N384-L386 VanDerWaalsContact C-N 3.28Å; N384-L386 PolarHBondContact O-N 3.46Å; N384-L386 PolarHBondContact OD1-N 3Å; N384-R387 HydrophobicContact CB-CB 4.01Å; N384-R387 WeakPolarHBondContact O-CB 3.48Å; N384-R387 PolarHBondContact O-N 2.67Å; N384-R387 WeakPolarHBondContact OD1-CB 3.42Å; N384-R387 PolarHBondContact OD1-N 3.01Å; N384-Q388 PolarHBondContact O-N 2.78Å; N384-Q388 VanDerWaalsContact O-N 3.1Å
385	F	85.9	Confident	71	Confident	128 Å²	128	91.3 Å²	91.3	56%	0.561	50%	0.499	S	S	*	.	H	α-helix	trans	-61.3	-33.7	-177.5	-65	-73	0	0	0	113.5	I307 V383 K389	I307-F385 HydrophobicContact CD1-CB 4.31Å; I307-F385 HydrophobicContact CG2-CB 4.14Å; V383-F385 HydrophobicContact CB-CE1 4.33Å; V383-F385 HydrophobicContact CB-CE2 4.34Å; V383-F385 HydrophobicContact CB-CZ 4.09Å; V383-F385 HydrophobicContact CG1-CD1 4.05Å; V383-F385 HydrophobicContact CG1-CE1 3.88Å; V383-F385 HydrophobicContact CG1-CG 4.47Å; V383-F385 HydrophobicContact CG1-CZ 4.16Å; V383-F385 WeakPolarHBondContact O-CD2 3.37Å; V383-F385 PolarHBondContact O-N 2.96Å; F385-K389 WeakPolarHBondContact O-CB 2.98Å; F385-K389 PolarHBondContact O-N 2.95Å
386	L	88.2	Confident	73.8	Confident	10 Å²	10	90.1 Å²	90.1	5%	0.052	49%	0.491	C	S	.	.	H	α-helix	trans	-63.1	-46.7	177.2	-177.1	60.9	0	0	0	110.3	D184 R300 I303 K304 I307 N384 K389 V390	D184-L386 HydrophobicContact CB-CB 4.4Å; D184-L386 HydrophobicContact CB-CD2 4.03Å; D184-L386 WeakPolarHBondContact O-CD2 3.4Å; R300-L386 VanDerWaalsContact CZ-CD2 3.42Å; R300-L386 VanDerWaalsContact NH2-CD2 3.34Å; I303-L386 HydrophobicContact CB-CD1 3.95Å; I303-L386 HydrophobicContact CG2-CD1 3.54Å; K304-L386 HydrophobicContact CG-CD1 4.15Å; K304-L386 HydrophobicContact CG-CD2 4.43Å; I307-L386 HydrophobicContact CD1-CB 4.48Å; I307-L386 HydrophobicContact CD1-CD1 4.32Å; N384-L386 VanDerWaalsContact C-N 3.28Å; N384-L386 PolarHBondContact O-N 3.46Å; N384-L386 PolarHBondContact OD1-N 3Å; L386-K389 PolarHBondContact O-N 3.29Å; L386-V390 HydrophobicContact CD1-CG2 4.38Å; L386-V390 VanDerWaalsContact O-CG2 3.3Å; L386-V390 WeakPolarHBondContact O-CG2 3.32Å; L386-V390 PolarHBondContact O-N 2.66Å
387	R	88.1	Confident	76.5	Confident	67 Å²	67	85.8 Å²	85.8	25%	0.253	47%	0.474	S	S	.	.	H	α-helix	trans	-59.1	-51.1	176.7	-175.9	-178.4	-174.5	-87	2.7	112.2	N384 K389 V390 L391 L404 E408 K409	N384-R387 HydrophobicContact CB-CB 4.01Å; N384-R387 WeakPolarHBondContact O-CB 3.48Å; N384-R387 PolarHBondContact O-N 2.67Å; N384-R387 WeakPolarHBondContact OD1-CB 3.42Å; N384-R387 PolarHBondContact OD1-N 3.01Å; R387-K389 VanDerWaalsContact C-N 3.29Å; R387-K389 PolarHBondContact O-N 2.96Å; R387-V390 PolarHBondContact O-N 3.3Å; R387-L391 HydrophobicContact CG-CD1 3.95Å; R387-L391 HydrophobicContact CG-CG 4.35Å; R387-L391 VanDerWaalsContact NH1-CD1 3.3Å; R387-L391 WeakPolarHBondContact O-CG 3.47Å; R387-L391 PolarHBondContact O-N 2.86Å; R387-L404 HydrophobicContact CB-CD2 4.12Å; R387-L404 HydrophobicContact CG-CD1 4.03Å; R387-L404 HydrophobicContact CG-CD2 4.11Å; R387-E408 PolarHBondContact NH2-O 3.4Å; R387-K409 WeakPolarHBondContact CD-O 3.48Å; R387-K409 VanDerWaalsContact CZ-C 3.43Å; R387-K409 VanDerWaalsContact CZ-O 3.25Å; R387-K409 VanDerWaalsContact NE-C 3.27Å; R387-K409 PolarHBondContact NE-O 2.91Å; R387-K409 PolarHBondContact NE-OXT 3.23Å; R387-K409 VanDerWaalsContact NH2-C 3.25Å; R387-K409 PolarHBondContact NH2-O 3.3Å; R387-K409 PolarHBondContact NH2-OXT 3.49Å
388	Q	89.4	Confident	79	Confident	109 Å²	109	84.1 Å²	84.1	51%	0.509	47%	0.466	S	S	.	.	H	α-helix	trans	-56.9	-45.1	178.3	-71	-176	-13.9	0	0	111.7	V383 N384 L391 S392	V383-Q388 VanDerWaalsContact CG1-NE2 3.29Å; N384-Q388 PolarHBondContact O-N 2.78Å; N384-Q388 VanDerWaalsContact O-N 3.1Å; Q388-L391 PolarHBondContact O-N 3.15Å; Q388-S392 PolarHBondContact O-N 3.45Å; Q388-S392 VanDerWaalsContact O-N 3.07Å; Q388-S392 PolarHBondContact O-OG 3.07Å
389	K	91.6	Very high	81.7	Confident	58 Å²	58	78.4 Å²	78.4	25%	0.252	44%	0.444	S	S	.	.	H	α-helix	trans	-62.6	-47.8	177.9	-159.2	70.2	165.1	-160.4	0	111.1	I303 I307 E310 F385 L386 R387 L391 S392 L393	I303-K389 HydrophobicContact CG2-CB 3.88Å; I303-K389 HydrophobicContact CG2-CG 3.66Å; I307-K389 HydrophobicContact CD1-CB 4.03Å; I307-K389 HydrophobicContact CD1-CG 4.41Å; I307-K389 HydrophobicContact CG1-CB 4.43Å; I307-K389 HydrophobicContact CG1-CG 4.35Å; E310-K389 IonicContact OE1-NZ 2.73Å; E310-K389 PolarHBondContact OE1-NZ 3.15Å; E310-K389 IonicContact OE2-NZ 3.73Å; E310-K389 PolarHBondContact OE2-NZ 3.07Å; F385-K389 WeakPolarHBondContact O-CB 2.98Å; F385-K389 PolarHBondContact O-N 2.95Å; L386-K389 PolarHBondContact O-N 3.29Å; R387-K389 VanDerWaalsContact C-N 3.29Å; R387-K389 PolarHBondContact O-N 2.96Å; K389-L391 PolarHBondContact O-N 3.17Å; K389-S392 PolarHBondContact O-N 2.96Å; K389-S392 PolarHBondContact O-OG 3.13Å; K389-L393 WeakPolarHBondContact O-CG 3.39Å; K389-L393 PolarHBondContact O-N 2.74Å
390	V	91.9	Very high	84.2	Confident	0 Å²	0	74.2 Å²	74.2	0%	0	41%	0.413	C	S	.	.	H	α-helix	trans	-58.7	-45.3	177.5	170.7	0	0	0	0	112	I303 L386 R387 S392 L393 K400 L403 L404	I303-V390 HydrophobicContact CD1-CG2 3.82Å; L386-V390 HydrophobicContact CD1-CG2 4.38Å; L386-V390 VanDerWaalsContact O-CG2 3.3Å; L386-V390 WeakPolarHBondContact O-CG2 3.32Å; L386-V390 PolarHBondContact O-N 2.66Å; R387-V390 PolarHBondContact O-N 3.3Å; V390-S392 VanDerWaalsContact C-N 3.31Å; V390-S392 PolarHBondContact O-N 2.92Å; V390-L393 WeakPolarHBondContact O-CB 3.38Å; V390-L393 PolarHBondContact O-N 2.88Å; V390-K400 HydrophobicContact CG1-CB 4.22Å; V390-K400 HydrophobicContact CG1-CG 4.43Å; V390-L403 HydrophobicContact CG1-CB 3.93Å; V390-L403 HydrophobicContact CG1-CD1 4.17Å; V390-L403 HydrophobicContact CG2-CB 4.4Å; V390-L404 HydrophobicContact CB-CD2 4.12Å; V390-L404 HydrophobicContact CB-CG 4.48Å; V390-L404 HydrophobicContact CG1-CD1 4.31Å; V390-L404 HydrophobicContact CG1-CD2 4.16Å; V390-L404 HydrophobicContact CG1-CG 3.99Å; V390-L404 HydrophobicContact CG2-CD2 4.27Å
391	L	91.7	Very high	86.5	Confident	61 Å²	61	71.9 Å²	71.9	32%	0.319	39%	0.394	S	S	.	.	H	α-helix	trans	-68	-30.3	-177.8	-69.5	178.9	0	0	0	113.3	R387 Q388 K389 L393 K400 L404	R387-L391 HydrophobicContact CG-CD1 3.95Å; R387-L391 HydrophobicContact CG-CG 4.35Å; R387-L391 VanDerWaalsContact NH1-CD1 3.3Å; R387-L391 WeakPolarHBondContact O-CG 3.47Å; R387-L391 PolarHBondContact O-N 2.86Å; Q388-L391 PolarHBondContact O-N 3.15Å; K389-L391 PolarHBondContact O-N 3.17Å; L391-L393 VanDerWaalsContact C-N 3.32Å; L391-K400 HydrophobicContact CD2-CB 4.43Å; L391-K400 HydrophobicContact CD2-CD 4.34Å; L391-K400 WeakPolarHBondContact O-CE 3.46Å; L391-K400 PolarHBondContact O-NZ 3.27Å; L391-L404 HydrophobicContact CD2-CD1 3.98Å; L391-L404 HydrophobicContact CG-CD1 4.25Å
392	S	93	Very high	88.2	Confident	86 Å²	86	67.8 Å²	67.8	60%	0.601	37%	0.365	S	S	*	.	H	α-helix	trans	-76.7	-13	175.9	63.6	0	0	0	0	114.5	Q388 K389 V390	Q388-S392 PolarHBondContact O-N 3.45Å; Q388-S392 VanDerWaalsContact O-N 3.07Å; Q388-S392 PolarHBondContact O-OG 3.07Å; K389-S392 PolarHBondContact O-N 2.96Å; K389-S392 PolarHBondContact O-OG 3.13Å; V390-S392 VanDerWaalsContact C-N 3.31Å; V390-S392 PolarHBondContact O-N 2.92Å
393	L	92.6	Very high	89.7	Confident	53 Å²	53	64.1 Å²	64.1	28%	0.277	34%	0.341	S	S	.	.	S	Bend	trans	-69	146.9	177.8	-65	173.1	0	0	0	111	I303 K389 V390 L391 L395 K400	I303-L393 HydrophobicContact CD1-CD1 3.94Å; K389-L393 WeakPolarHBondContact O-CG 3.39Å; K389-L393 PolarHBondContact O-N 2.74Å; V390-L393 WeakPolarHBondContact O-CB 3.38Å; V390-L393 PolarHBondContact O-N 2.88Å; L391-L393 VanDerWaalsContact C-N 3.32Å; L393-L395 HydrophobicContact CB-CD1 3.98Å; L393-L395 HydrophobicContact CB-CG 3.84Å; L393-L395 HydrophobicContact CD1-CD1 3.83Å; L393-L395 PolarHBondContact O-N 3.03Å; L393-K400 WeakPolarHBondContact O-CE 3.38Å; L393-K400 PolarHBondContact O-NZ 3.44Å; L393-K400 VanDerWaalsContact O-NZ 3.16Å
394	P	94.4	Very high	90.6	Very high	129 Å²	129	61 Å²	61	84%	0.838	32%	0.322	S	S	*	.	S	Bend	trans	-77.8	54.5	175.7	35	-37.1	0	0	0	111.2
395	L	93.3	Very high	90.8	Very high	55 Å²	55	62.9 Å²	62.9	29%	0.288	33%	0.328	S	S	.	.			trans	-106.9	151.6	178.7	-60.1	177.8	0	0	0	110.6	L393 L399 K400 L403	L393-L395 HydrophobicContact CB-CD1 3.98Å; L393-L395 HydrophobicContact CB-CG 3.84Å; L393-L395 HydrophobicContact CD1-CD1 3.83Å; L393-L395 PolarHBondContact O-N 3.03Å; L395-L399 HydrophobicContact CB-CD2 4.31Å; L395-L399 HydrophobicContact CD1-CD2 4.02Å; L395-L399 HydrophobicContact CD1-CG 4.29Å; L395-L399 HydrophobicContact CD2-CD2 4Å; L395-L399 HydrophobicContact CG-CD2 4.32Å; L395-K400 HydrophobicContact CB-CG 4.11Å; L395-K400 WeakPolarHBondContact O-CE 3.2Å; L395-L403 HydrophobicContact CD1-CD1 3.92Å
396	P	94.4	Very high	90.5	Very high	89 Å²	89	64 Å²	64	58%	0.578	33%	0.33	S	S	*	.			trans	-58.8	146.2	168.9	-22.2	33.4	0	0	0	111.8	P398 L399 K400	P396-P398 VanDerWaalsContact C-CD 3.48Å; P396-L399 WeakPolarHBondContact O-CB 3.45Å; P396-L399 PolarHBondContact O-N 3.48Å; P396-K400 PolarHBondContact O-N 3.46Å; P396-K400 VanDerWaalsContact O-N 3.17Å
397	D	91.8	Very high	89.9	Confident	98 Å²	98	64.6 Å²	64.6	52%	0.524	33%	0.331	S	S	.	.	H	α-helix	trans	-54.8	-42.1	-178.1	-62.9	-33.8	0	0	0	113.9	L399 K400 Y401	D397-L399 PolarHBondContact O-N 2.98Å; D397-L399 VanDerWaalsContact O-N 3.15Å; D397-K400 WeakPolarHBondContact O-CB 3.47Å; D397-K400 PolarHBondContact O-N 3.37Å; D397-Y401 HydrophobicContact CB-CD2 4.2Å; D397-Y401 HydrophobicContact CB-CE2 3.88Å; D397-Y401 WeakPolarHBondContact O-CD2 3.32Å; D397-Y401 PolarHBondContact O-N 3.12Å
398	P	92.2	Very high	88.7	Confident	98 Å²	98	68.9 Å²	68.9	64%	0.636	35%	0.354	S	S	*	.	H	α-helix	trans	-55.9	-35.4	176.2	-27.4	36	0	0	0	113.5	P396 Y402	P396-P398 VanDerWaalsContact C-CD 3.48Å; P398-Y402 VanDerWaalsContact O-CB 3.25Å; P398-Y402 WeakPolarHBondContact O-CB 3.37Å; P398-Y402 PolarHBondContact O-N 3.27Å
399	L	91.2	Very high	87.1	Confident	66 Å²	66	72.9 Å²	72.9	35%	0.346	37%	0.37	S	S	.	.	H	α-helix	trans	-76.6	-36	178.5	-174.1	59.9	0	0	0	111.6	L395 P396 D397 Y402 L403	L395-L399 HydrophobicContact CB-CD2 4.31Å; L395-L399 HydrophobicContact CD1-CD2 4.02Å; L395-L399 HydrophobicContact CD1-CG 4.29Å; L395-L399 HydrophobicContact CD2-CD2 4Å; L395-L399 HydrophobicContact CG-CD2 4.32Å; P396-L399 WeakPolarHBondContact O-CB 3.45Å; P396-L399 PolarHBondContact O-N 3.48Å; D397-L399 PolarHBondContact O-N 2.98Å; D397-L399 VanDerWaalsContact O-N 3.15Å; L399-Y402 HydrophobicContact CD1-CD1 4.3Å; L399-Y402 PolarHBondContact O-N 2.79Å; L399-L403 VanDerWaalsContact O-CG 3.29Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 3.26Å
400	K	92.3	Very high	86.9	Confident	33 Å²	33	73.6 Å²	73.6	14%	0.143	38%	0.376	C	S	.	.	H	α-helix	trans	-60.9	-49.4	172	-67.4	176.6	174.5	175.1	0	110.7	V390 L391 L393 L395 P396 D397 Y402 L403 L404	V390-K400 HydrophobicContact CG1-CB 4.22Å; V390-K400 HydrophobicContact CG1-CG 4.43Å; L391-K400 HydrophobicContact CD2-CB 4.43Å; L391-K400 HydrophobicContact CD2-CD 4.34Å; L391-K400 WeakPolarHBondContact O-CE 3.46Å; L391-K400 PolarHBondContact O-NZ 3.27Å; L393-K400 WeakPolarHBondContact O-CE 3.38Å; L393-K400 PolarHBondContact O-NZ 3.44Å; L393-K400 VanDerWaalsContact O-NZ 3.16Å; L395-K400 HydrophobicContact CB-CG 4.11Å; L395-K400 WeakPolarHBondContact O-CE 3.2Å; P396-K400 PolarHBondContact O-N 3.46Å; P396-K400 VanDerWaalsContact O-N 3.17Å; D397-K400 WeakPolarHBondContact O-CB 3.47Å; D397-K400 PolarHBondContact O-N 3.37Å; K400-Y402 VanDerWaalsContact C-N 3.34Å; K400-Y402 PolarHBondContact O-N 3.01Å; K400-L403 PolarHBondContact O-N 3.12Å; K400-L404 WeakPolarHBondContact O-CG 3.33Å; K400-L404 PolarHBondContact O-N 3.21Å; K400-L404 VanDerWaalsContact O-N 3.1Å
401	Y	89.6	Confident	86.7	Confident	99 Å²	99	77.5 Å²	77.5	39%	0.388	40%	0.395	S	S	.	.	H	α-helix	trans	-60.1	-44.4	175.8	-70.5	-61	0	0	0	111.6	D397 L403 L404 Y405 Y406 E408	D397-Y401 HydrophobicContact CB-CD2 4.2Å; D397-Y401 HydrophobicContact CB-CE2 3.88Å; D397-Y401 WeakPolarHBondContact O-CD2 3.32Å; D397-Y401 PolarHBondContact O-N 3.12Å; Y401-L403 VanDerWaalsContact C-N 3.3Å; Y401-L403 PolarHBondContact O-N 3.02Å; Y401-L404 CarbonylContact O-C 3.43Å; Y401-L404 WeakPolarHBondContact O-CA 3.43Å; Y401-L404 PolarHBondContact O-N 2.75Å; Y401-Y405 PolarHBondContact O-N 3.15Å; Y401-Y406 WeakPolarHBondContact O-CA 3.35Å; Y401-Y406 PolarHBondContact O-N 3.45Å; Y401-E408 HydrophobicContact CE1-CG 4.32Å
402	Y	90.4	Very high	86.4	Confident	16 Å²	16	78.4 Å²	78.4	6%	0.063	40%	0.4	C	S	.	.	H	α-helix	trans	-56.6	-43.1	175.9	-177.3	-101.8	0	0	0	112.7	Q292 D293 R296 P398 L399 K400 L404 Y405 Y406	Q292-Y402 WeakPolarHBondContact CB-OH 3.34Å; Q292-Y402 HydrophobicContact CG-CE1 4.12Å; Q292-Y402 HydrophobicContact CG-CE2 4.07Å; Q292-Y402 WeakPolarHBondContact CG-OH 3.35Å; Q292-Y402 PolarHBondContact O-OH 2.72Å; D293-Y402 PolarHBondContact N-OH 3.29Å; R296-Y402 HydrophobicContact CB-CD1 4.41Å; R296-Y402 HydrophobicContact CB-CE1 3.64Å; R296-Y402 VanDerWaalsContact CD-O 3.28Å; R296-Y402 WeakPolarHBondContact CD-O 3.46Å; R296-Y402 HydrophobicContact CG-CD1 4.17Å; R296-Y402 HydrophobicContact CG-CE1 3.86Å; R296-Y402 VanDerWaalsContact CZ-CE2 3.49Å; R296-Y402 PolarHBondContact NE-O 2.81Å; R296-Y402 PolarHBondContact NH1-OH 2.86Å; R296-Y402 PolarHBondContact NH2-OH 2.92Å; R296-Y402 VanDerWaalsContact NH2-OH 3.09Å; P398-Y402 VanDerWaalsContact O-CB 3.25Å; P398-Y402 WeakPolarHBondContact O-CB 3.37Å; P398-Y402 PolarHBondContact O-N 3.27Å; L399-Y402 HydrophobicContact CD1-CD1 4.3Å; L399-Y402 PolarHBondContact O-N 2.79Å; K400-Y402 VanDerWaalsContact C-N 3.34Å; K400-Y402 PolarHBondContact O-N 3.01Å; Y402-L404 PolarHBondContact O-N 3.12Å; Y402-Y405 PolarHBondContact O-N 3.44Å; Y402-Y406 HydrophobicContact CD2-CE1 4.24Å; Y402-Y406 HydrophobicContact CD2-CE2 4.41Å; Y402-Y406 AromaticContact CD2-CZ 3.76Å; Y402-Y406 WeakPolarHBondContact CD2-OH 3.49Å
403	L	90.6	Very high	86	Confident	1 Å²	1	77.9 Å²	77.9	1%	0.005	39%	0.388	C	S	.	.	H	α-helix	trans	-68.2	-21.4	176.3	-70.2	172.8	0	0	0	113.2	R296 I299 R300 V390 L395 L399 K400 Y401	R296-L403 HydrophobicContact CG-CD2 4.06Å; I299-L403 HydrophobicContact CB-CD2 3.86Å; I299-L403 HydrophobicContact CD1-CD2 4.27Å; I299-L403 HydrophobicContact CG2-CD1 3.98Å; I299-L403 HydrophobicContact CG2-CD2 3.59Å; I299-L403 HydrophobicContact CG2-CG 4.47Å; R300-L403 WeakPolarHBondContact CD-O 3.29Å; R300-L403 HydrophobicContact CG-CD2 4.36Å; R300-L403 PolarHBondContact NH1-O 2.82Å; V390-L403 HydrophobicContact CG1-CB 3.93Å; V390-L403 HydrophobicContact CG1-CD1 4.17Å; V390-L403 HydrophobicContact CG2-CB 4.4Å; L395-L403 HydrophobicContact CD1-CD1 3.92Å; L399-L403 VanDerWaalsContact O-CG 3.29Å; L399-L403 WeakPolarHBondContact O-CG 3.33Å; L399-L403 PolarHBondContact O-N 3.26Å; K400-L403 PolarHBondContact O-N 3.12Å; Y401-L403 VanDerWaalsContact C-N 3.3Å; Y401-L403 PolarHBondContact O-N 3.02Å
404	L	88.2	Confident	85.6	Confident	2 Å²	2	79.5 Å²	79.5	1%	0.01	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	10.9	177.6	-62.6	175.4	0	0	0	113.6	R387 V390 L391 K400 Y401 Y402 Y406 R407	R387-L404 HydrophobicContact CB-CD2 4.12Å; R387-L404 HydrophobicContact CG-CD1 4.03Å; R387-L404 HydrophobicContact CG-CD2 4.11Å; V390-L404 HydrophobicContact CB-CD2 4.12Å; V390-L404 HydrophobicContact CB-CG 4.48Å; V390-L404 HydrophobicContact CG1-CD1 4.31Å; V390-L404 HydrophobicContact CG1-CD2 4.16Å; V390-L404 HydrophobicContact CG1-CG 3.99Å; V390-L404 HydrophobicContact CG2-CD2 4.27Å; L391-L404 HydrophobicContact CD2-CD1 3.98Å; L391-L404 HydrophobicContact CG-CD1 4.25Å; K400-L404 WeakPolarHBondContact O-CG 3.33Å; K400-L404 PolarHBondContact O-N 3.21Å; K400-L404 VanDerWaalsContact O-N 3.1Å; Y401-L404 CarbonylContact O-C 3.43Å; Y401-L404 WeakPolarHBondContact O-CA 3.43Å; Y401-L404 PolarHBondContact O-N 2.75Å; Y402-L404 PolarHBondContact O-N 3.12Å; L404-Y406 VanDerWaalsContact C-N 3.29Å; L404-Y406 PolarHBondContact O-N 3.03Å; L404-R407 WeakPolarHBondContact O-CB 3.25Å; L404-R407 PolarHBondContact O-N 2.8Å; L404-R407 PolarHBondContact O-NE 2.87Å; L404-R407 PolarHBondContact O-NH2 2.94Å; L404-R407 VanDerWaalsContact O-NH2 3.11Å
405	Y	85.1	Confident	85	Confident	62 Å²	62	76.2 Å²	76.2	24%	0.243	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	58.6	40.2	-173.8	-66.5	-91.3	0	0	0	112.8	F183 Y401 Y402 R407	F183-Y405 HydrophobicContact CD1-CD2 4.45Å; F183-Y405 HydrophobicContact CE1-CD1 4.37Å; F183-Y405 AromaticContact CE1-CD2 3.38Å; F183-Y405 HydrophobicContact CE1-CD2 3.38Å; F183-Y405 AromaticContact CE1-CE2 3.7Å; F183-Y405 HydrophobicContact CE1-CE2 3.7Å; F183-Y405 AromaticContact CE1-CG 3.74Å; F183-Y405 HydrophobicContact CE1-CG 3.74Å; F183-Y405 HydrophobicContact CZ-CD1 4.27Å; F183-Y405 AromaticContact CZ-CD2 3.9Å; F183-Y405 HydrophobicContact CZ-CD2 3.9Å; F183-Y405 HydrophobicContact CZ-CE1 4.26Å; F183-Y405 AromaticContact CZ-CE2 3.85Å; F183-Y405 HydrophobicContact CZ-CE2 3.85Å; F183-Y405 HydrophobicContact CZ-CG 4.09Å; Y401-Y405 PolarHBondContact O-N 3.15Å; Y402-Y405 PolarHBondContact O-N 3.44Å; Y405-R407 PolarHBondContact O-N 3.21Å; Y405-R407 VanDerWaalsContact O-N 3.11Å
406	Y	79.6	Confident	84.4	Confident	151 Å²	151	77.7 Å²	77.7	59%	0.592	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.5	22.7	-179.6	-49.2	-76.4	0	0	0	114.3	Y401 Y402 L404	Y401-Y406 WeakPolarHBondContact O-CA 3.35Å; Y401-Y406 PolarHBondContact O-N 3.45Å; Y402-Y406 HydrophobicContact CD2-CE1 4.24Å; Y402-Y406 HydrophobicContact CD2-CE2 4.41Å; Y402-Y406 AromaticContact CD2-CZ 3.76Å; Y402-Y406 WeakPolarHBondContact CD2-OH 3.49Å; L404-Y406 VanDerWaalsContact C-N 3.29Å; L404-Y406 PolarHBondContact O-N 3.03Å
407	R	76.3	Confident	83.6	Confident	24 Å²	24	76.8 Å²	76.8	9%	0.091	36%	0.355	C	S	.	.			trans	-78.7	135.2	171.4	-72.9	177.6	-69.2	154.8	19.3	110.7	I177 R178 D184 L404 Y405	I177-R407 VanDerWaalsContact O-CD 3.29Å; I177-R407 WeakPolarHBondContact O-CD 3.32Å; R178-R407 WeakPolarHBondContact O-CD 3.33Å; D184-R407 IonicContact OD1-CZ 2.95Å; D184-R407 IonicContact OD1-NH1 3.96Å; D184-R407 IonicContact OD1-NH2 2.99Å; D184-R407 PolarHBondContact OD1-NH2 2.89Å; D184-R407 IonicContact OD2-CZ 2.84Å; D184-R407 IonicContact OD2-NH1 2.81Å; D184-R407 PolarHBondContact OD2-NH1 2.85Å; D184-R407 IonicContact OD2-NH2 3.37Å; D184-R407 PolarHBondContact OD2-NH2 2.92Å; L404-R407 WeakPolarHBondContact O-CB 3.25Å; L404-R407 PolarHBondContact O-N 2.8Å; L404-R407 PolarHBondContact O-NE 2.87Å; L404-R407 PolarHBondContact O-NH2 2.94Å; L404-R407 VanDerWaalsContact O-NH2 3.11Å; Y405-R407 PolarHBondContact O-N 3.21Å; Y405-R407 VanDerWaalsContact O-N 3.11Å
408	E	64.1	Low	83	Confident	157 Å²	157	75.1 Å²	75.1	73%	0.734	34%	0.341	S	S	*	.			trans	-93.3	-31.1	175.5	-64.6	-178	170.8	0	0	112.5	R387 Y401	R387-E408 PolarHBondContact NH2-O 3.4Å; Y401-E408 HydrophobicContact CE1-CG 4.32Å
409	K	56	Low	82.1	Confident	192 Å²	192	73 Å²	73	84%	0.835	31%	0.314	S	S	*	.			trans	-60.5	0	-177.5	-84.3	-174.4	173.3	-177.8	0	112.7	R387	R387-K409 WeakPolarHBondContact CD-O 3.48Å; R387-K409 VanDerWaalsContact CZ-C 3.43Å; R387-K409 VanDerWaalsContact CZ-O 3.25Å; R387-K409 VanDerWaalsContact NE-C 3.27Å; R387-K409 PolarHBondContact NE-O 2.91Å; R387-K409 PolarHBondContact NE-OXT 3.23Å; R387-K409 VanDerWaalsContact NH2-C 3.25Å; R387-K409 PolarHBondContact NH2-O 3.3Å; R387-K409 PolarHBondContact NH2-OXT 3.49Å

Retrieved 409 of 409 residues in 1048.8 ms (Link to these results)

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