A0A3Q0KMW6_SCHMA Loading...

Putative regulator of G protein signaling AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KMW6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 710 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.7	Very low	33	Very low	198 Å²	198	107.1 Å²	107.1	98%	0.975	55%	0.55	S	S	*	*				0	-54.2	0	-91.7	168	-94.6	0	0	113.6	N3 Q4 L5	M1-N3 VanDerWaalsContact C-N 3.3Å; M1-N3 PolarHBondContact O-N 2.94Å; M1-Q4 PolarHBondContact O-N 2.64Å; M1-L5 PolarHBondContact O-N 3.06Å
2	V	30.4	Very low	34	Very low	84 Å²	84	100.7 Å²	100.7	51%	0.509	52%	0.516	S	S	.	.	H	α-helix	trans	-40.2	-46	-172.3	-179.4	0	0	0	0	115.7	Q4 L5 K6	V2-Q4 PolarHBondContact O-N 3.5Å; V2-L5 WeakPolarHBondContact O-CB 3.39Å; V2-L5 PolarHBondContact O-N 3.24Å; V2-K6 HydrophobicContact CG1-CD 4.17Å; V2-K6 WeakPolarHBondContact O-CG 3.46Å; V2-K6 PolarHBondContact O-N 2.88Å
3	N	29.5	Very low	35.1	Very low	124 Å²	124	94.9 Å²	94.9	66%	0.663	49%	0.489	S	S	*	.	H	α-helix	trans	-71.5	-25.2	-177.4	-68.7	-14.7	0	0	0	114.5	M1 S7	M1-N3 VanDerWaalsContact C-N 3.3Å; M1-N3 PolarHBondContact O-N 2.94Å; N3-S7 PolarHBondContact O-N 2.8Å
4	Q	30.8	Very low	35.6	Very low	131 Å²	131	95.6 Å²	95.6	61%	0.612	49%	0.488	S	S	*	.	H	α-helix	trans	-73.8	-41.5	169.4	-78.8	174.7	-37.6	0	0	110.9	M1 V2 K6 S7 M8	M1-Q4 PolarHBondContact O-N 2.64Å; V2-Q4 PolarHBondContact O-N 3.5Å; Q4-K6 VanDerWaalsContact C-N 3.33Å; Q4-K6 PolarHBondContact O-N 3.42Å; Q4-S7 WeakPolarHBondContact O-CB 3.35Å; Q4-S7 PolarHBondContact O-N 3.12Å; Q4-M8 WeakPolarHBondContact O-CG 3.34Å; Q4-M8 PolarHBondContact O-N 2.65Å
5	L	33.9	Very low	36.1	Very low	114 Å²	114	95.3 Å²	95.3	60%	0.597	49%	0.489	S	S	*	.	H	α-helix	trans	-56.5	-46.6	174	-122.5	71.2	0	0	0	111.4	M1 V2 S7 M8 A9	M1-L5 PolarHBondContact O-N 3.06Å; V2-L5 WeakPolarHBondContact O-CB 3.39Å; V2-L5 PolarHBondContact O-N 3.24Å; L5-S7 VanDerWaalsContact C-N 3.33Å; L5-S7 PolarHBondContact O-N 3.15Å; L5-M8 PolarHBondContact O-N 3.47Å; L5-A9 WeakPolarHBondContact O-CB 3.28Å; L5-A9 PolarHBondContact O-N 2.96Å
6	K	31.5	Very low	36.6	Very low	128 Å²	128	92.8 Å²	92.8	56%	0.557	48%	0.475	S	S	*	.	H	α-helix	trans	-55.9	-44	173	-71.8	173.3	178.3	173.1	0	112	V2 Q4 M8 C10	V2-K6 HydrophobicContact CG1-CD 4.17Å; V2-K6 WeakPolarHBondContact O-CG 3.46Å; V2-K6 PolarHBondContact O-N 2.88Å; Q4-K6 VanDerWaalsContact C-N 3.33Å; Q4-K6 PolarHBondContact O-N 3.42Å; K6-M8 PolarHBondContact O-N 2.91Å; K6-C10 WeakPolarHBondContact O-CB 3.35Å; K6-C10 PolarHBondContact O-N 3.02Å; K6-C10 PolarHBondContact O-SG 2.65Å
7	S	29.2	Very low	37.1	Very low	53 Å²	53	92.9 Å²	92.9	37%	0.371	48%	0.481	S	S	.	.	H	α-helix	trans	-69.5	-29.3	178.9	-169.2	0	0	0	0	114.4	N3 Q4 L5 R11	N3-S7 PolarHBondContact O-N 2.8Å; Q4-S7 WeakPolarHBondContact O-CB 3.35Å; Q4-S7 PolarHBondContact O-N 3.12Å; L5-S7 VanDerWaalsContact C-N 3.33Å; L5-S7 PolarHBondContact O-N 3.15Å; S7-R11 PolarHBondContact O-NE 2.76Å; S7-R11 VanDerWaalsContact O-NE 3.13Å; S7-R11 PolarHBondContact OG-NH2 3.26Å
8	M	34.1	Very low	37.1	Very low	90 Å²	90	93.9 Å²	93.9	44%	0.443	48%	0.483	S	S	.	.	H	α-helix	trans	-85.1	-43.1	-179	-70.5	171.8	170.9	0	0	111.9	Q4 L5 K6 R11 H12	Q4-M8 WeakPolarHBondContact O-CG 3.34Å; Q4-M8 PolarHBondContact O-N 2.65Å; L5-M8 PolarHBondContact O-N 3.47Å; K6-M8 PolarHBondContact O-N 2.91Å; M8-R11 PolarHBondContact O-N 3.27Å; M8-H12 PolarHBondContact O-N 3.02Å; M8-H12 VanDerWaalsContact O-N 3.16Å
9	A	35.7	Very low	37.2	Very low	34 Å²	34	91.5 Å²	91.5	28%	0.281	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-46	174.2	0	0	0	0	0	111.7	L5 R11 H12 V13	L5-A9 WeakPolarHBondContact O-CB 3.28Å; L5-A9 PolarHBondContact O-N 2.96Å; A9-R11 VanDerWaalsContact C-N 3.29Å; A9-R11 PolarHBondContact O-N 2.96Å; A9-H12 PolarHBondContact O-N 3.31Å; A9-H12 VanDerWaalsContact O-N 3.16Å; A9-V13 PolarHBondContact O-N 2.9Å; A9-V13 VanDerWaalsContact O-N 3.08Å
10	C	35.7	Very low	37.4	Very low	70 Å²	70	90.5 Å²	90.5	47%	0.473	47%	0.473	S	S	.	.	H	α-helix	trans	-53.2	-44.3	174.7	-80.8	0	0	0	0	112.2	K6 Q14	K6-C10 WeakPolarHBondContact O-CB 3.35Å; K6-C10 PolarHBondContact O-N 3.02Å; K6-C10 PolarHBondContact O-SG 2.65Å; C10-Q14 WeakPolarHBondContact O-CB 3.31Å; C10-Q14 WeakPolarHBondContact O-CG 3.36Å; C10-Q14 PolarHBondContact O-N 2.67Å
11	R	39.1	Very low	37.3	Very low	152 Å²	152	91 Å²	91	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-68.2	-37.7	179.9	-75.7	-179	-113.5	-165.5	-6.4	113	S7 M8 A9 N15	S7-R11 PolarHBondContact O-NE 2.76Å; S7-R11 VanDerWaalsContact O-NE 3.13Å; S7-R11 PolarHBondContact OG-NH2 3.26Å; M8-R11 PolarHBondContact O-N 3.27Å; A9-R11 VanDerWaalsContact C-N 3.29Å; A9-R11 PolarHBondContact O-N 2.96Å; R11-N15 VanDerWaalsContact O-CG 3.24Å; R11-N15 PolarHBondContact O-N 3.35Å; R11-N15 VanDerWaalsContact O-N 3.09Å; R11-N15 PolarHBondContact O-OD1 2.85Å
12	H	44.8	Very low	37.3	Very low	30 Å²	30	89.7 Å²	89.7	14%	0.139	47%	0.473	C	S	.	.	H	α-helix	trans	-68.7	-45.2	-179.5	-160.8	17.1	0	0	0	111.7	M8 A9 N15 M16 D273 R276	M8-H12 PolarHBondContact O-N 3.02Å; M8-H12 VanDerWaalsContact O-N 3.16Å; A9-H12 PolarHBondContact O-N 3.31Å; A9-H12 VanDerWaalsContact O-N 3.16Å; H12-N15 WeakPolarHBondContact O-CB 3.32Å; H12-N15 PolarHBondContact O-N 2.69Å; H12-M16 PolarHBondContact O-N 2.75Å; H12-M16 VanDerWaalsContact O-N 3.09Å; H12-D273 IonicContact NE2-OD1 2.74Å; H12-R276 VanDerWaalsContact CD2-CZ 3.48Å; H12-R276 PolarHBondContact CD2-NH1 3.1Å; H12-R276 PolarHBondContact CD2-NH2 3.32Å; H12-R276 PolarHBondContact NE2-NH1 2.91Å
13	V	47.7	Very low	37.6	Very low	26 Å²	26	91.1 Å²	91.1	16%	0.158	49%	0.486	C	S	.	.	H	α-helix	trans	-79.8	-25.6	179.9	-167.4	0	0	0	0	112.2	A9 N15 M16 V17 F209	A9-V13 PolarHBondContact O-N 2.9Å; A9-V13 VanDerWaalsContact O-N 3.08Å; V13-N15 VanDerWaalsContact C-N 3.3Å; V13-N15 PolarHBondContact O-N 3.27Å; V13-M16 HydrophobicContact CG1-CB 4.36Å; V13-M16 HydrophobicContact CG1-SD 4.5Å; V13-M16 PolarHBondContact O-N 3.44Å; V13-V17 HydrophobicContact CG1-CG2 4Å; V13-V17 WeakPolarHBondContact O-CB 3.36Å; V13-V17 WeakPolarHBondContact O-CG2 3.45Å; V13-V17 PolarHBondContact O-N 3.15Å; V13-F209 HydrophobicContact CB-CE1 4.07Å; V13-F209 HydrophobicContact CB-CE2 4.41Å; V13-F209 HydrophobicContact CB-CZ 3.92Å; V13-F209 HydrophobicContact CG1-CE1 3.58Å; V13-F209 HydrophobicContact CG1-CE2 4.34Å; V13-F209 HydrophobicContact CG1-CZ 3.43Å; V13-F209 VanDerWaalsContact CG1-CZ 3.43Å; V13-F209 HydrophobicContact CG2-CD1 4.03Å; V13-F209 HydrophobicContact CG2-CE1 3.81Å; V13-F209 HydrophobicContact CG2-CZ 4.14Å
14	Q	42.1	Very low	37.8	Very low	104 Å²	104	90.4 Å²	90.4	49%	0.486	49%	0.49	S	S	.	.	H	α-helix	trans	-61.2	-39.2	165	-80.1	-178.1	-65.2	0	0	111.4	C10 Q18	C10-Q14 WeakPolarHBondContact O-CB 3.31Å; C10-Q14 WeakPolarHBondContact O-CG 3.36Å; C10-Q14 PolarHBondContact O-N 2.67Å; Q14-Q18 WeakPolarHBondContact O-CB 3.24Å; Q14-Q18 WeakPolarHBondContact O-CG 3.33Å; Q14-Q18 PolarHBondContact O-N 3.46Å
15	N	44.1	Very low	37.8	Very low	92 Å²	92	87.3 Å²	87.3	49%	0.492	49%	0.494	S	S	.	.	H	α-helix	trans	-65.5	-40.4	174.1	-69.2	-7.1	0	0	0	112	R11 H12 V13 S19	R11-N15 VanDerWaalsContact O-CG 3.24Å; R11-N15 PolarHBondContact O-N 3.35Å; R11-N15 VanDerWaalsContact O-N 3.09Å; R11-N15 PolarHBondContact O-OD1 2.85Å; H12-N15 WeakPolarHBondContact O-CB 3.32Å; H12-N15 PolarHBondContact O-N 2.69Å; V13-N15 VanDerWaalsContact C-N 3.3Å; V13-N15 PolarHBondContact O-N 3.27Å; N15-S19 PolarHBondContact O-N 3.39Å; N15-S19 PolarHBondContact O-OG 3.17Å
16	M	43.6	Very low	37.6	Very low	55 Å²	55	89.6 Å²	89.6	27%	0.271	51%	0.506	S	S	.	.	H	α-helix	trans	-63	-45.3	176.5	-163.9	178.7	-80.7	0	0	111.7	H12 V13 S19 V20	H12-M16 PolarHBondContact O-N 2.75Å; H12-M16 VanDerWaalsContact O-N 3.09Å; V13-M16 HydrophobicContact CG1-CB 4.36Å; V13-M16 HydrophobicContact CG1-SD 4.5Å; V13-M16 PolarHBondContact O-N 3.44Å; M16-S19 PolarHBondContact O-OG 3.28Å; M16-V20 WeakPolarHBondContact O-CG2 3.48Å
17	V	44.8	Very low	37.6	Very low	95 Å²	95	93 Å²	93	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-75.2	-31.4	178.5	173.1	0	0	0	0	112.4	V13 S21	V13-V17 HydrophobicContact CG1-CG2 4Å; V13-V17 WeakPolarHBondContact O-CB 3.36Å; V13-V17 WeakPolarHBondContact O-CG2 3.45Å; V13-V17 PolarHBondContact O-N 3.15Å; V17-S21 PolarHBondContact O-N 2.8Å
18	Q	36.7	Very low	37.7	Very low	110 Å²	110	94.3 Å²	94.3	51%	0.514	54%	0.539	S	S	.	.	H	α-helix	trans	-80.8	-18.3	179.1	-71	174	11.2	0	0	113.9	Q14	Q14-Q18 WeakPolarHBondContact O-CB 3.24Å; Q14-Q18 WeakPolarHBondContact O-CG 3.33Å; Q14-Q18 PolarHBondContact O-N 3.46Å
19	S	39.1	Very low	37.9	Very low	48 Å²	48	96.2 Å²	96.2	34%	0.336	56%	0.558	S	S	.	*	H	α-helix	trans	-70.8	-49.9	169	61.5	0	0	0	0	110.7	N15 M16 S21 K22	N15-S19 PolarHBondContact O-N 3.39Å; N15-S19 PolarHBondContact O-OG 3.17Å; M16-S19 PolarHBondContact O-OG 3.28Å; S19-S21 VanDerWaalsContact C-N 3.27Å; S19-S21 PolarHBondContact O-N 2.96Å; S19-K22 PolarHBondContact O-N 3.49Å; S19-K22 VanDerWaalsContact O-N 3.08Å
20	V	42.5	Very low	37.7	Very low	71 Å²	71	105.7 Å²	105.7	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-54.1	-41.4	-179.8	175.6	0	0	0	0	112.1	M16 K22 C23	M16-V20 WeakPolarHBondContact O-CG2 3.48Å; V20-K22 PolarHBondContact O-N 3.08Å; V20-C23 PolarHBondContact O-N 3.38Å
21	S	33.9	Very low	37.5	Very low	101 Å²	101	107.3 Å²	107.3	71%	0.706	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.1	-5.1	-178.9	-161.2	0	0	0	0	115.2	V17 S19	V17-S21 PolarHBondContact O-N 2.8Å; S19-S21 VanDerWaalsContact C-N 3.27Å; S19-S21 PolarHBondContact O-N 2.96Å
22	K	34.8	Very low	37.4	Very low	171 Å²	171	105.9 Å²	105.9	74%	0.743	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105	-6	177.7	-72.7	-176.3	175.3	178.9	0	115.3	S19 V20	S19-K22 PolarHBondContact O-N 3.49Å; S19-K22 VanDerWaalsContact O-N 3.08Å; V20-K22 PolarHBondContact O-N 3.08Å
23	C	36.8	Very low	36.7	Very low	115 Å²	115	111.9 Å²	111.9	78%	0.777	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-114.8	-6.7	-179.2	-64.9	0	0	0	0	114.2	V20 G25	V20-C23 PolarHBondContact O-N 3.38Å; C23-G25 PolarHBondContact O-N 3.41Å; C23-G25 VanDerWaalsContact O-N 3.08Å
24	S	34	Very low	36.2	Very low	108 Å²	108	116.3 Å²	116.3	76%	0.755	67%	0.668	S	S	*	*			trans	-83.8	69.9	-179.2	176.9	0	0	0	0	113.1
25	G	30.1	Very low	35.6	Very low	67 Å²	67	118.8 Å²	118.8	69%	0.691	69%	0.685	S	S	*	*			trans	-101.4	108.6	170.1	0	0	0	0	0	112.5	C23	C23-G25 PolarHBondContact O-N 3.41Å; C23-G25 VanDerWaalsContact O-N 3.08Å
26	N	28.9	Very low	35.2	Very low	161 Å²	161	120.3 Å²	120.3	86%	0.861	70%	0.698	S	S	*	*	S	Bend	trans	42.5	94.1	165.9	-63.5	-9	0	0	0	118.5
27	E	33	Very low	34.5	Very low	200 Å²	200	121.3 Å²	121.3	94%	0.935	72%	0.722	S	S	*	*			trans	-157.4	162.4	141.4	-123.1	164.2	-153.9	0	0	112.5
28	A	31.2	Very low	34	Very low	81 Å²	81	122.8 Å²	122.8	67%	0.669	74%	0.735	S	S	*	*			trans	-97.7	150.9	-170.3	0	0	0	0	0	112.9	Y30	A28-Y30 PolarHBondContact O-N 3.39Å
29	P	37.4	Very low	33.7	Very low	130 Å²	130	125.4 Å²	125.4	84%	0.844	75%	0.753	S	S	*	*			trans	-74.7	109.9	-175.1	29.4	-34.8	0	0	0	112.6
30	Y	32.5	Very low	33.4	Very low	232 Å²	232	128.7 Å²	128.7	91%	0.91	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-71.8	145	158.7	-93.9	-93.6	0	0	0	110.4	A28	A28-Y30 PolarHBondContact O-N 3.39Å
31	S	29.8	Very low	32.9	Very low	105 Å²	105	131.7 Å²	131.7	73%	0.734	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-74.8	147.2	-179.9	-62.1	0	0	0	0	111.9	I33	S31-I33 PolarHBondContact O-N 3.16Å
32	P	37	Very low	33	Very low	122 Å²	122	132.8 Å²	132.8	79%	0.792	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-63.4	133.6	175	-19.5	32	0	0	0	111.6
33	I	31.6	Very low	32.8	Very low	156 Å²	156	130.1 Å²	130.1	80%	0.8	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.5	134.5	165.8	-64.3	172.6	0	0	0	107.7	S31	S31-I33 PolarHBondContact O-N 3.16Å
34	V	36.3	Very low	32.7	Very low	118 Å²	118	133 Å²	133	72%	0.715	81%	0.814	S	S	*	*			trans	-92.6	109.1	174	-176.7	0	0	0	0	108.3	T36	V34-T36 HydrophobicContact CG1-CG2 4.26Å; V34-T36 PolarHBondContact O-N 3.22Å
35	D	30.7	Very low	32.8	Very low	157 Å²	157	133.6 Å²	133.6	84%	0.84	82%	0.815	S	S	*	*			trans	-67	125.1	170.3	-96.7	-43.9	0	0	0	110.4
36	T	34.6	Very low	32.8	Very low	124 Å²	124	140.6 Å²	140.6	76%	0.761	83%	0.827	S	S	*	*			trans	-126.4	65.3	176.1	38.9	0	0	0	0	110.7	V34 C38	V34-T36 HydrophobicContact CG1-CG2 4.26Å; V34-T36 PolarHBondContact O-N 3.22Å; T36-C38 PolarHBondContact O-N 3.46Å
37	G	30	Very low	33	Very low	75 Å²	75	136.8 Å²	136.8	77%	0.773	83%	0.825	S	S	*	*			trans	-73.1	100.5	173.5	0	0	0	0	0	112.3
38	C	32.6	Very low	32.9	Very low	127 Å²	127	133.6 Å²	133.6	86%	0.858	82%	0.824	S	S	*	*			trans	-140.3	84.6	170.5	-87.5	0	0	0	0	110.6	T36	T36-C38 PolarHBondContact O-N 3.46Å
39	D	30.5	Very low	32.8	Very low	165 Å²	165	139 Å²	139	88%	0.882	83%	0.832	S	S	*	*			trans	-75.3	120.6	170.6	-81.9	-56.2	0	0	0	111.4
40	S	33.9	Very low	32.7	Very low	117 Å²	117	139.9 Å²	139.9	82%	0.818	84%	0.835	S	S	*	*			trans	-164.1	110.7	161.2	-82.9	0	0	0	0	110.9
41	P	31.7	Very low	32.7	Very low	133 Å²	133	134.8 Å²	134.8	86%	0.864	83%	0.834	S	S	*	*			trans	-96.1	127.9	-175.1	34.2	-32.1	0	0	0	113.4
42	S	35.5	Very low	32.8	Very low	125 Å²	125	133.2 Å²	133.2	87%	0.874	83%	0.834	S	S	*	*			trans	-155.4	135.4	156.7	60.4	0	0	0	0	112.4
43	S	31.5	Very low	32.6	Very low	114 Å²	114	136.3 Å²	136.3	80%	0.797	84%	0.843	S	S	*	*			trans	-92.9	152.1	-177.2	57.2	0	0	0	0	113.8
44	L	33.7	Very low	32.4	Very low	176 Å²	176	134.2 Å²	134.2	92%	0.921	84%	0.842	S	S	*	*			trans	-152.4	162.6	147	-95.2	165.7	0	0	0	109.4
45	P	36.2	Very low	32.3	Very low	120 Å²	120	138.2 Å²	138.2	78%	0.779	85%	0.853	S	S	*	*			trans	-109.9	-172.7	-146.4	42.6	-40	0	0	0	117.9
46	K	31.4	Very low	32.2	Very low	215 Å²	215	140.1 Å²	140.1	94%	0.935	85%	0.854	S	S	*	*			trans	-82	147.5	-168	-54.4	164.2	-177.3	170.3	0	114.8
47	G	32.2	Very low	32.1	Very low	80 Å²	80	144 Å²	144	83%	0.825	86%	0.86	S	S	*	*			trans	154.3	138.7	161.6	0	0	0	0	0	111.3
48	C	30.8	Very low	32.2	Very low	134 Å²	134	145.3 Å²	145.3	91%	0.905	86%	0.857	S	S	*	*			cis	-140.9	165.4	0.6	-167.5	0	0	0	0	110.5
49	K	29	Very low	32	Very low	194 Å²	194	147.6 Å²	147.6	84%	0.843	86%	0.856	S	S	*	*			trans	-98.9	144.6	174.2	-66	179.7	178.2	-179.5	0	111.2
50	T	35.5	Very low	32.1	Very low	149 Å²	149	145.4 Å²	145.4	91%	0.914	85%	0.853	S	S	*	*			trans	-140.9	136.4	144.5	39.2	0	0	0	0	109.9
51	S	31.5	Very low	31.9	Very low	125 Å²	125	147.8 Å²	147.8	87%	0.874	85%	0.851	S	S	*	*			trans	-101.2	153.4	-177.1	50.3	0	0	0	0	112.1
52	G	31.9	Very low	32.1	Very low	72 Å²	72	147.3 Å²	147.3	74%	0.742	85%	0.851	S	S	*	*			trans	-166.3	86.8	175.9	0	0	0	0	0	116.4
53	L	34	Very low	31.8	Very low	186 Å²	186	148.8 Å²	148.8	97%	0.974	84%	0.844	S	S	*	*			trans	66.9	156.3	154.9	-65.3	161.5	0	0	0	119.3
54	S	27.8	Very low	32	Very low	113 Å²	113	151.2 Å²	151.2	79%	0.79	85%	0.846	S	S	*	*			trans	-158.1	130.7	-175	152.6	0	0	0	0	108
55	E	33.3	Very low	31.7	Very low	202 Å²	202	147.3 Å²	147.3	94%	0.944	83%	0.826	S	S	*	*			trans	-140	147.7	173.8	-119.4	175.4	172.3	0	0	112.2
56	K	28.5	Very low	31.8	Very low	196 Å²	196	148.1 Å²	148.1	85%	0.852	83%	0.828	S	S	*	*			trans	-125.4	127.2	-176.8	-86	-174.8	171.6	-175.7	0	110.2
57	K	31.7	Very low	31.9	Very low	206 Å²	206	145.3 Å²	145.3	90%	0.896	82%	0.816	S	S	*	*			trans	166.1	153.8	152.8	-99.6	170.5	175.6	-175.6	0	108.8
58	S	32.1	Very low	31.7	Very low	102 Å²	102	146.8 Å²	146.8	71%	0.713	81%	0.813	S	S	*	*			cis	-162.9	171.4	-21.2	35.2	0	0	0	0	108.4
59	E	28.1	Very low	31.9	Very low	176 Å²	176	148.5 Å²	148.5	82%	0.822	81%	0.812	S	S	*	*			trans	-67.2	157.2	-170.9	-56.6	117.8	131	0	0	115.9
60	S	34	Very low	32	Very low	119 Å²	119	146.4 Å²	146.4	83%	0.832	81%	0.81	S	S	*	*			trans	-147.9	127.8	144.2	61.6	0	0	0	0	110.1
61	H	30.3	Very low	32	Very low	166 Å²	166	148.1 Å²	148.1	77%	0.769	81%	0.805	S	S	*	*			trans	-74.4	152.5	179.4	-94.3	-129.2	0	0	0	113.3
62	S	34.7	Very low	32	Very low	123 Å²	123	147.2 Å²	147.2	86%	0.86	80%	0.799	S	S	*	*			trans	-147.4	123.5	143.3	63.2	0	0	0	0	109.6
63	E	28.8	Very low	32	Very low	157 Å²	157	148.9 Å²	148.9	73%	0.734	80%	0.797	S	S	*	*			trans	-118.8	141.3	-173.5	-179.4	176.9	-173.5	0	0	109.6
64	I	35.8	Very low	32.1	Very low	165 Å²	165	146.2 Å²	146.2	85%	0.846	79%	0.789	S	S	*	*			trans	-131.1	109.1	172.9	-60.2	-178.5	0	0	0	108.3
65	D	28.6	Very low	32.4	Very low	94 Å²	94	146.2 Å²	146.2	50%	0.503	79%	0.786	S	S	.	*			trans	-102.7	143.4	179.5	171.8	33.6	0	0	0	110.7	K67	D65-K67 IonicContact OD2-NZ 3.42Å; D65-K67 PolarHBondContact OD2-NZ 3.34Å
66	V	38.2	Very low	33.1	Very low	136 Å²	136	142.6 Å²	142.6	82%	0.824	78%	0.78	S	S	*	*			trans	-138.1	108.3	172.6	-177.5	0	0	0	0	109.1
67	K	32.7	Very low	33.5	Very low	157 Å²	157	138.5 Å²	138.5	68%	0.683	78%	0.776	S	S	*	*			trans	-88.3	145.7	-169.9	-80.1	-175.4	169.3	69.6	0	115.4	D65	D65-K67 IonicContact OD2-NZ 3.42Å; D65-K67 PolarHBondContact OD2-NZ 3.34Å
68	C	27.7	Very low	33.5	Very low	110 Å²	110	135 Å²	135	74%	0.743	77%	0.772	S	S	*	*			trans	40	136.8	135.8	-55.8	0	0	0	0	122.1
69	L	36	Very low	33.5	Very low	170 Å²	170	136 Å²	136	89%	0.89	77%	0.773	S	S	*	*				-145.3	147.5	123.7	-141.5	79.1	0	0	0	110.9
70	N	29.9	Very low	33.7	Very low	151 Å²	151	135.2 Å²	135.2	81%	0.807	77%	0.77	S	S	*	*			trans	-153.2	132.2	-176.1	-171.7	8.5	0	0	0	112
71	K	35.9	Very low	33.8	Very low	185 Å²	185	135 Å²	135	80%	0.804	77%	0.765	S	S	*	*			trans	-155	125.7	172.8	-68.5	-168.4	179.9	-179.4	0	107.8
72	S	32.6	Very low	33.7	Very low	106 Å²	106	132.2 Å²	132.2	74%	0.741	76%	0.764	S	S	*	*				79.6	128.1	60.6	-173.2	0	0	0	0	112.2
73	C	31.8	Very low	33.4	Very low	106 Å²	106	133 Å²	133	72%	0.716	76%	0.758	S	S	*	*			cis	-168.9	168.7	4.8	-120.4	0	0	0	0	114.4
74	V	35.1	Very low	33.1	Very low	131 Å²	131	132.9 Å²	132.9	79%	0.794	76%	0.762	S	S	*	*			trans	72.6	148	140.1	154.7	0	0	0	0	121.1
75	P	35.5	Very low	32.7	Very low	112 Å²	112	133.8 Å²	133.8	73%	0.727	76%	0.762	S	S	*	*			cis	-139.3	-170	-30.5	42.3	-22.5	0	0	0	115.5
76	P	46.6	Very low	32.4	Very low	126 Å²	126	140 Å²	140	82%	0.818	78%	0.779	S	S	*	*			trans	-126.4	175.6	-179.7	42.9	-30.8	0	0	0	118.2
77	S	37.3	Very low	31.7	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	78%	0.78	S	S	*	*			trans	-150.6	143.7	165.5	45.9	0	0	0	0	110.9
78	V	31.7	Very low	31.4	Very low	133 Å²	133	138 Å²	138	81%	0.806	78%	0.781	S	S	*	*			cis	83.9	122.7	38.1	172.1	0	0	0	0	111.4
79	T	33	Very low	31.3	Very low	122 Å²	122	139.3 Å²	139.3	75%	0.748	78%	0.781	S	S	*	*			cis	-148.7	-169.5	16.5	-16.3	0	0	0	0	110.2
80	Q	32.6	Very low	30.8	Very low	161 Å²	161	139.1 Å²	139.1	75%	0.752	78%	0.775	S	S	*	*			cis	-162.6	160.3	-6	-167.2	163.1	-39.5	0	0	110.5
81	P	35.5	Very low	30.7	Very low	113 Å²	113	141.3 Å²	141.3	73%	0.734	78%	0.781	S	S	*	*			trans	-117	158.1	173.4	40.2	-30.5	0	0	0	117
82	C	27.9	Very low	30.2	Very low	109 Å²	109	140.8 Å²	140.8	74%	0.736	79%	0.786	S	S	*	*			trans	-165.8	159.9	171.6	-84.5	0	0	0	0	108.3
83	D	27.4	Very low	29.8	Very low	138 Å²	138	143.2 Å²	143.2	74%	0.738	79%	0.791	S	S	*	*			cis	-161.1	178.9	-24.7	-116.8	-55.6	0	0	0	110.3
84	L	24.2	Very low	29.7	Very low	156 Å²	156	144.1 Å²	144.1	82%	0.817	79%	0.793	S	S	*	*			trans	-74.9	146.3	-172	-65	74.5	0	0	0	115.6
85	H	26	Very low	29.2	Very low	183 Å²	183	141.3 Å²	141.3	85%	0.847	79%	0.79	S	S	*	*				-160.9	167.1	112	-150.8	-98.7	0	0	0	112.9
86	W	22.1	Very low	28.8	Very low	226 Å²	226	141.2 Å²	141.2	86%	0.856	79%	0.791	S	S	*	*			trans	-111.5	147.8	-177.7	-164.8	-99.5	0	0	0	111.4
87	E	24.7	Very low	28.1	Very low	180 Å²	180	139.4 Å²	139.4	84%	0.841	79%	0.787	S	S	*	*			trans	155.8	158.6	140	-89.3	-171.6	168.5	0	0	113.1
88	G	26.3	Very low	27.6	Very low	70 Å²	70	143.1 Å²	143.1	72%	0.722	79%	0.792	S	S	*	*			trans	104	74.8	147.7	0	0	0	0	0	119.9
89	N	26.3	Very low	27.4	Very low	137 Å²	137	142.2 Å²	142.2	73%	0.733	79%	0.792	S	S	*	*			trans	56.6	114.4	145.6	-75.9	-39.4	0	0	0	122.4
90	Q	25.3	Very low	27.3	Very low	166 Å²	166	146 Å²	146	78%	0.776	80%	0.798	S	S	*	*				53.7	89.8	122	-58.6	178.5	58.3	0	0	119.6
91	Q	27.4	Very low	27.1	Very low	197 Å²	197	147.6 Å²	147.6	92%	0.921	80%	0.802	S	S	*	*				-157.9	127.2	124.6	-110.8	161.9	26	0	0	111.7	N93	Q91-N93 PolarHBondContact O-N 3.38Å; Q91-N93 VanDerWaalsContact O-N 3.13Å
92	L	24.5	Very low	26.8	Very low	174 Å²	174	148.5 Å²	148.5	91%	0.911	80%	0.798	S	S	*	*			trans	-79.8	90.8	-178.4	-78.7	166.1	0	0	0	111
93	N	24.2	Very low	26.9	Very low	157 Å²	157	146.5 Å²	146.5	84%	0.84	78%	0.783	S	S	*	*			trans	-103.7	90	172.2	-164.2	6.4	0	0	0	110.5	Q91 G95	Q91-N93 PolarHBondContact O-N 3.38Å; Q91-N93 VanDerWaalsContact O-N 3.13Å; N93-G95 PolarHBondContact O-N 3.02Å; N93-G95 VanDerWaalsContact O-N 3.09Å
94	V	30.2	Very low	27.4	Very low	126 Å²	126	144.8 Å²	144.8	76%	0.764	78%	0.781	S	S	*	*			trans	-78.9	94.2	-176.7	-176.1	0	0	0	0	110.1	C96	V94-C96 PolarHBondContact O-N 3.04Å
95	G	25.6	Very low	27.8	Very low	72 Å²	72	144.6 Å²	144.6	74%	0.742	78%	0.776	S	S	*	*			trans	-62.4	104	174.1	0	0	0	0	0	111.7	N93 A97	N93-G95 PolarHBondContact O-N 3.02Å; N93-G95 VanDerWaalsContact O-N 3.09Å; G95-A97 PolarHBondContact O-N 2.65Å
96	C	26.1	Very low	28.3	Very low	109 Å²	109	140.5 Å²	140.5	74%	0.736	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-65.9	131.7	175.9	-172.6	0	0	0	0	110.5	V94	V94-C96 PolarHBondContact O-N 3.04Å
97	A	30.8	Very low	29.3	Very low	89 Å²	89	134.6 Å²	134.6	74%	0.736	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-60.1	152.3	-177.9	0	0	0	0	0	112.8	G95 S99	G95-A97 PolarHBondContact O-N 2.65Å; A97-S99 PolarHBondContact O-N 3.09Å
98	Q	27.6	Very low	30.2	Very low	187 Å²	187	130.9 Å²	130.9	87%	0.874	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-65	119.5	-172.9	-66.8	169.8	-16.9	0	0	111.9	K100	Q98-K100 PolarHBondContact O-N 2.83Å
99	S	28	Very low	31.2	Very low	115 Å²	115	134.9 Å²	134.9	80%	0.804	74%	0.736	S	S	*	*			trans	-63.2	105.9	167.4	-179.2	0	0	0	0	109.4	A97 K101	A97-S99 PolarHBondContact O-N 3.09Å; S99-K101 PolarHBondContact O-N 2.86Å; S99-K101 VanDerWaalsContact O-N 3.1Å
100	K	29.8	Very low	32.5	Very low	202 Å²	202	137.5 Å²	137.5	88%	0.878	74%	0.736	S	S	*	*			trans	-56.4	118.6	172.3	-80.9	-170.4	174.7	-175.5	0	109.4	Q98 M102	Q98-K100 PolarHBondContact O-N 2.83Å; K100-M102 PolarHBondContact O-N 2.71Å
101	K	29.9	Very low	34.2	Very low	194 Å²	194	133.4 Å²	133.4	84%	0.843	72%	0.717	S	S	*	*			trans	-83.5	99.3	176.6	-172.7	-177.4	-177.1	-174.4	0	107.7	S99 T103	S99-K101 PolarHBondContact O-N 2.86Å; S99-K101 VanDerWaalsContact O-N 3.1Å; K101-T103 PolarHBondContact O-N 3.08Å
102	M	28.8	Very low	36.4	Very low	132 Å²	132	125.1 Å²	125.1	65%	0.65	68%	0.68	S	S	*	*			trans	-51.5	121.6	179.5	-151.6	167.8	84.8	0	0	109.5	K100 D106 L107	K100-M102 PolarHBondContact O-N 2.71Å; M102-D106 HydrophobicContact CG-CB 4.02Å; M102-L107 HydrophobicContact CE-CD2 3.74Å; M102-L107 HydrophobicContact CE-CG 4.25Å
103	T	30.6	Very low	39.1	Very low	66 Å²	66	119.1 Å²	119.1	41%	0.405	65%	0.652	S	S	.	*			trans	-84	167	-179.8	61.5	0	0	0	0	109.8	K101 E105	K101-T103 PolarHBondContact O-N 3.08Å; T103-E105 PolarHBondContact O-N 3.32Å
104	S	37.9	Very low	42	Very low	102 Å²	102	112.6 Å²	112.6	71%	0.713	62%	0.617	S	S	*	*	S	Bend	trans	-66.2	-12.9	174.7	48.7	0	0	0	0	113.5
105	E	32.4	Very low	44.6	Very low	152 Å²	152	108.2 Å²	108.2	71%	0.71	59%	0.589	S	S	*	*	S	Bend	trans	-79.8	-35.8	-177.8	-62.5	164.4	135.8	0	0	111.6	T103 L107 D108	T103-E105 PolarHBondContact O-N 3.32Å; E105-L107 PolarHBondContact O-N 3.18Å; E105-D108 PolarHBondContact O-N 3.17Å
106	D	35.7	Very low	47.6	Very low	98 Å²	98	112.5 Å²	112.5	52%	0.524	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.7	-14.2	175.3	-73.2	-38.1	0	0	0	113.7	M102	M102-D106 HydrophobicContact CG-CB 4.02Å
107	L	43.7	Very low	50.7	Low	101 Å²	101	110.8 Å²	110.8	53%	0.529	57%	0.568	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.1	-29.6	-177.3	-70.5	172.6	0	0	0	113.9	M102 E105 R110	M102-L107 HydrophobicContact CE-CD2 3.74Å; M102-L107 HydrophobicContact CE-CG 4.25Å; E105-L107 PolarHBondContact O-N 3.18Å; L107-R110 PolarHBondContact O-N 3.28Å
108	D	42.6	Very low	53.6	Low	102 Å²	102	107.7 Å²	107.7	55%	0.545	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-80.9	-20.2	-168.5	-156.1	41.1	0	0	0	113.6	E105 R110 Q111	E105-D108 PolarHBondContact O-N 3.17Å; D108-R110 VanDerWaalsContact C-N 3.25Å; D108-R110 PolarHBondContact O-N 3.42Å; D108-Q111 WeakPolarHBondContact O-CG 3.33Å; D108-Q111 PolarHBondContact OD1-NE2 3.02Å
109	D	47.7	Very low	56.7	Low	155 Å²	155	105.3 Å²	105.3	83%	0.829	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-79.2	-7.8	172.9	-125	10.2	0	0	0	112.9
110	R	52.8	Low	59.8	Low	192 Å²	192	105.9 Å²	105.9	73%	0.725	51%	0.511	S	S	*	.	G	3₁₀ helix	trans	-102.1	15.5	179.9	-73.4	-175.8	165.5	-145.9	-6.5	114.6	L107 D108 S112	L107-R110 PolarHBondContact O-N 3.28Å; D108-R110 VanDerWaalsContact C-N 3.25Å; D108-R110 PolarHBondContact O-N 3.42Å; R110-S112 PolarHBondContact O-N 2.95Å
111	Q	62.8	Low	62.8	Low	80 Å²	80	97.2 Å²	97.2	37%	0.374	48%	0.475	S	S	.	.			trans	-51.9	111	176.9	-74.8	172.5	2.7	0	0	112	D108	D108-Q111 WeakPolarHBondContact O-CG 3.33Å; D108-Q111 PolarHBondContact OD1-NE2 3.02Å
112	S	73.2	Confident	66	Low	22 Å²	22	89.2 Å²	89.2	15%	0.154	44%	0.44	C	S	.	.			trans	-72.9	147.8	-179.3	175.4	0	0	0	0	110.9	R110 N114 D115 W118	R110-S112 PolarHBondContact O-N 2.95Å; S112-N114 PolarHBondContact O-N 2.93Å; S112-N114 PolarHBondContact OG-N 3.06Å; S112-N114 VanDerWaalsContact OG-N 3.12Å; S112-D115 WeakPolarHBondContact CA-OD1 3.35Å; S112-D115 WeakPolarHBondContact CB-OD1 3.31Å; S112-D115 PolarHBondContact N-OD1 3.49Å; S112-D115 WeakPolarHBondContact O-CB 3.22Å; S112-D115 PolarHBondContact O-N 3.47Å; S112-W118 WeakPolarHBondContact OG-CH2 3.46Å; S112-W118 WeakPolarHBondContact OG-CZ3 3.26Å
113	P	79.9	Confident	69.1	Low	49 Å²	49	85.3 Å²	85.3	32%	0.318	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-12.9	165.1	-26.3	35.3	0	0	0	115.4	I307 K311 A315	P113-I307 HydrophobicContact CB-CG2 4.41Å; P113-I307 HydrophobicContact CG-CG2 4.27Å; P113-K311 HydrophobicContact CB-CB 3.67Å; P113-K311 HydrophobicContact CB-CD 3.79Å; P113-K311 HydrophobicContact CB-CG 4.01Å; P113-K311 HydrophobicContact CG-CB 3.87Å; P113-A315 HydrophobicContact CG-CB 4.02Å
114	N	85.7	Confident	72.2	Confident	19 Å²	19	83.6 Å²	83.6	10%	0.102	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.6	1.2	179.1	-62.9	-18.5	0	0	0	113.6	S112 Y116 L117 W118 K311	S112-N114 PolarHBondContact O-N 2.93Å; S112-N114 PolarHBondContact OG-N 3.06Å; S112-N114 VanDerWaalsContact OG-N 3.12Å; N114-Y116 VanDerWaalsContact C-N 3.27Å; N114-Y116 PolarHBondContact O-N 3.15Å; N114-Y116 VanDerWaalsContact O-N 3.14Å; N114-L117 WeakPolarHBondContact O-CA 3.25Å; N114-L117 WeakPolarHBondContact O-CB 2.97Å; N114-L117 PolarHBondContact O-N 3.13Å; N114-W118 HydrophobicContact CB-CD2 4.25Å; N114-W118 HydrophobicContact CB-CH2 4.29Å; N114-W118 HydrophobicContact CB-CZ2 3.79Å; N114-W118 PolarHBondContact O-N 3.35Å; N114-K311 PolarHBondContact OD1-NZ 3.18Å
115	D	85.8	Confident	75	Confident	35 Å²	35	78.8 Å²	78.8	19%	0.187	38%	0.383	C	S	.	.	H	α-helix	trans	-46.8	-46.1	179.9	-95.2	27.4	0	0	0	113.8	S112 L117 W118 K119	S112-D115 WeakPolarHBondContact CA-OD1 3.35Å; S112-D115 WeakPolarHBondContact CB-OD1 3.31Å; S112-D115 PolarHBondContact N-OD1 3.49Å; S112-D115 WeakPolarHBondContact O-CB 3.22Å; S112-D115 PolarHBondContact O-N 3.47Å; D115-L117 VanDerWaalsContact C-N 3.29Å; D115-L117 PolarHBondContact O-N 3.07Å; D115-W118 PolarHBondContact O-N 3.01Å; D115-K119 WeakPolarHBondContact O-CB 3.47Å; D115-K119 VanDerWaalsContact O-CG 3.32Å; D115-K119 WeakPolarHBondContact O-CG 3.12Å; D115-K119 PolarHBondContact O-N 3.45Å; D115-K119 IonicContact OD2-NZ 2.65Å; D115-K119 PolarHBondContact OD2-NZ 2.89Å
116	Y	88.2	Confident	78	Confident	162 Å²	162	76.2 Å²	76.2	64%	0.635	37%	0.374	S	S	*	.	H	α-helix	trans	-64.9	-33.7	-179.1	175.7	-94.9	0	0	0	112.5	N114 K120	N114-Y116 VanDerWaalsContact C-N 3.27Å; N114-Y116 PolarHBondContact O-N 3.15Å; N114-Y116 VanDerWaalsContact O-N 3.14Å; Y116-K120 HydrophobicContact CE1-CD 3.85Å; Y116-K120 PolarHBondContact O-N 2.95Å; Y116-K120 VanDerWaalsContact OH-CE 3.25Å; Y116-K120 WeakPolarHBondContact OH-CE 3.33Å; Y116-K120 PolarHBondContact OH-NZ 3.38Å
117	L	90.6	Very high	80.8	Confident	73 Å²	73	76.9 Å²	76.9	38%	0.382	37%	0.374	S	S	.	.	H	α-helix	trans	-72.6	-48	176.9	176.9	60.8	0	0	0	110.1	N114 D115 K119 K120 L121 M182	N114-L117 WeakPolarHBondContact O-CA 3.25Å; N114-L117 WeakPolarHBondContact O-CB 2.97Å; N114-L117 PolarHBondContact O-N 3.13Å; D115-L117 VanDerWaalsContact C-N 3.29Å; D115-L117 PolarHBondContact O-N 3.07Å; L117-K119 PolarHBondContact O-N 3.45Å; L117-K120 PolarHBondContact O-N 2.91Å; L117-L121 HydrophobicContact CD1-CD1 3.89Å; L117-L121 HydrophobicContact CD1-CG 4.21Å; L117-L121 HydrophobicContact CG-CD1 3.79Å; L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 3.39Å; L117-M182 HydrophobicContact CD2-CE 4.09Å
118	W	91.5	Very high	83.4	Confident	24 Å²	24	72 Å²	72	9%	0.091	35%	0.349	C	S	.	.	H	α-helix	trans	-61.4	-44.8	177.5	-57.4	-40.6	0	0	0	112.3	S112 N114 D115 K120 L121 E122 M216	S112-W118 WeakPolarHBondContact OG-CH2 3.46Å; S112-W118 WeakPolarHBondContact OG-CZ3 3.26Å; N114-W118 HydrophobicContact CB-CD2 4.25Å; N114-W118 HydrophobicContact CB-CH2 4.29Å; N114-W118 HydrophobicContact CB-CZ2 3.79Å; N114-W118 PolarHBondContact O-N 3.35Å; D115-W118 PolarHBondContact O-N 3.01Å; W118-K120 VanDerWaalsContact C-N 3.25Å; W118-K120 PolarHBondContact O-N 3.27Å; W118-L121 PolarHBondContact O-N 2.94Å; W118-L121 VanDerWaalsContact O-N 3.1Å; W118-E122 WeakPolarHBondContact O-CB 3.48Å; W118-E122 PolarHBondContact O-N 3.07Å; W118-M216 HydrophobicContact CH2-CE 4.39Å; W118-M216 HydrophobicContact CH2-CG 3.94Å; W118-M216 HydrophobicContact CH2-SD 3.31Å; W118-M216 WeakPolarHBondContact CH2-SD 3.39Å; W118-M216 HydrophobicContact CZ2-CE 4.41Å; W118-M216 HydrophobicContact CZ2-SD 3.41Å; W118-M216 WeakPolarHBondContact CZ2-SD 3.49Å; W118-M216 HydrophobicContact CZ3-SD 4.4Å
119	K	92.4	Very high	85.9	Confident	137 Å²	137	70.8 Å²	70.8	60%	0.596	34%	0.342	S	S	*	.	H	α-helix	trans	-60.6	-33.2	176.5	-73.1	168.4	-177.9	164.7	0	112.6	D115 L117 A123	D115-K119 WeakPolarHBondContact O-CB 3.47Å; D115-K119 VanDerWaalsContact O-CG 3.32Å; D115-K119 WeakPolarHBondContact O-CG 3.12Å; D115-K119 PolarHBondContact O-N 3.45Å; D115-K119 IonicContact OD2-NZ 2.65Å; D115-K119 PolarHBondContact OD2-NZ 2.89Å; L117-K119 PolarHBondContact O-N 3.45Å; K119-A123 VanDerWaalsContact O-CB 3.3Å; K119-A123 WeakPolarHBondContact O-CB 3.25Å; K119-A123 PolarHBondContact O-N 3.5Å
120	K	93.5	Very high	88.1	Confident	126 Å²	126	65.8 Å²	65.8	55%	0.548	32%	0.319	S	S	.	.	H	α-helix	trans	-72.8	-39.5	172.4	-88.9	-171.4	157.1	-176.4	0	113.4	Y116 L117 W118 L124	Y116-K120 HydrophobicContact CE1-CD 3.85Å; Y116-K120 PolarHBondContact O-N 2.95Å; Y116-K120 VanDerWaalsContact OH-CE 3.25Å; Y116-K120 WeakPolarHBondContact OH-CE 3.33Å; Y116-K120 PolarHBondContact OH-NZ 3.38Å; L117-K120 PolarHBondContact O-N 2.91Å; W118-K120 VanDerWaalsContact C-N 3.25Å; W118-K120 PolarHBondContact O-N 3.27Å; K120-L124 WeakPolarHBondContact O-CB 3.35Å; K120-L124 PolarHBondContact O-N 2.91Å; K120-L124 VanDerWaalsContact O-N 3.12Å
121	L	94.1	Very high	89.9	Confident	20 Å²	20	65.9 Å²	65.9	11%	0.105	33%	0.328	C	S	.	.	H	α-helix	trans	-70.5	-42.1	178.5	-69.7	164.1	0	0	0	111.4	L117 W118 L124 V125 I179 M182 Y184	L117-L121 HydrophobicContact CD1-CD1 3.89Å; L117-L121 HydrophobicContact CD1-CG 4.21Å; L117-L121 HydrophobicContact CG-CD1 3.79Å; L117-L121 WeakPolarHBondContact O-CG 3.4Å; L117-L121 PolarHBondContact O-N 3.39Å; W118-L121 PolarHBondContact O-N 2.94Å; W118-L121 VanDerWaalsContact O-N 3.1Å; L121-L124 WeakPolarHBondContact O-CB 3.44Å; L121-L124 PolarHBondContact O-N 3.37Å; L121-V125 WeakPolarHBondContact O-CB 3.31Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.31Å; L121-V125 PolarHBondContact O-N 2.92Å; L121-I179 HydrophobicContact CD2-CG1 4.23Å; L121-M182 HydrophobicContact CD1-SD 3.37Å; L121-M182 WeakPolarHBondContact CD1-SD 3.49Å; L121-Y184 HydrophobicContact CB-CD2 4.35Å; L121-Y184 HydrophobicContact CB-CE2 3.75Å; L121-Y184 HydrophobicContact CD1-CE2 3.89Å; L121-Y184 HydrophobicContact CG-CE2 4.41Å
122	E	95.5	Very high	91.2	Very high	26 Å²	26	70.5 Å²	70.5	12%	0.121	35%	0.349	C	S	.	.	H	α-helix	trans	-62.2	-46.7	174.5	-76.5	173.7	-121.5	0	0	111	W118 L124 V125 D126 Y184 Y211 S213 R214	W118-E122 WeakPolarHBondContact O-CB 3.48Å; W118-E122 PolarHBondContact O-N 3.07Å; E122-L124 PolarHBondContact O-N 3.45Å; E122-V125 PolarHBondContact O-N 3.03Å; E122-D126 WeakPolarHBondContact O-CB 3.46Å; E122-D126 VanDerWaalsContact O-CG 3.28Å; E122-D126 PolarHBondContact O-N 3.13Å; E122-Y184 HydrophobicContact CG-CE1 3.56Å; E122-Y184 PolarHBondContact OE1-OH 2.97Å; E122-Y211 HydrophobicContact CG-CD2 3.66Å; E122-Y211 HydrophobicContact CG-CE2 3.77Å; E122-Y211 WeakPolarHBondContact OE2-CD2 3.4Å; E122-S213 WeakPolarHBondContact OE1-CB 3.39Å; E122-S213 PolarHBondContact OE1-OG 3.08Å; E122-R214 IonicContact OE2-CZ 3.5Å; E122-R214 IonicContact OE2-NE 3.32Å; E122-R214 IonicContact OE2-NH2 2.74Å; E122-R214 PolarHBondContact OE2-NH2 2.93Å
123	A	95.3	Very high	92	Very high	50 Å²	50	74.7 Å²	74.7	41%	0.413	37%	0.37	S	S	.	.	H	α-helix	trans	-62.4	-25.5	175	0	0	0	0	0	113.7	K119 Q127	K119-A123 VanDerWaalsContact O-CB 3.3Å; K119-A123 WeakPolarHBondContact O-CB 3.25Å; K119-A123 PolarHBondContact O-N 3.5Å; A123-Q127 PolarHBondContact O-NE2 3.01Å
124	L	95	Very high	92.8	Very high	31 Å²	31	73.1 Å²	73.1	16%	0.162	36%	0.363	C	S	.	.	H	α-helix	trans	-79.8	-43.4	172.8	-179.5	63.8	0	0	0	111.8	K120 L121 E122 D126 Q127 M128 W159 I164 I179	K120-L124 WeakPolarHBondContact O-CB 3.35Å; K120-L124 PolarHBondContact O-N 2.91Å; K120-L124 VanDerWaalsContact O-N 3.12Å; L121-L124 WeakPolarHBondContact O-CB 3.44Å; L121-L124 PolarHBondContact O-N 3.37Å; E122-L124 PolarHBondContact O-N 3.45Å; L124-D126 VanDerWaalsContact C-N 3.3Å; L124-D126 PolarHBondContact O-N 3.38Å; L124-Q127 WeakPolarHBondContact O-CB 3.44Å; L124-Q127 PolarHBondContact O-N 2.92Å; L124-Q127 VanDerWaalsContact O-N 3.08Å; L124-M128 HydrophobicContact CG-SD 4.3Å; L124-M128 WeakPolarHBondContact O-CG 3.37Å; L124-M128 PolarHBondContact O-N 3.02Å; L124-W159 HydrophobicContact CD1-CH2 3.96Å; L124-W159 HydrophobicContact CD1-CZ3 4.04Å; L124-I164 HydrophobicContact CD1-CD1 3.71Å; L124-I164 HydrophobicContact CD1-CG1 4.15Å; L124-I164 HydrophobicContact CD2-CD1 3.74Å; L124-I164 HydrophobicContact CG-CD1 4.32Å; L124-I179 HydrophobicContact CD2-CD1 3.86Å
125	V	96.1	Very high	93.3	Very high	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.36	C	S	.	.	H	α-helix	trans	-66.1	-34.6	178.4	170.7	0	0	0	0	111	L121 E122 Q127 M128 I129 I179 Y184 F205 Y211	L121-V125 WeakPolarHBondContact O-CB 3.31Å; L121-V125 VanDerWaalsContact O-CG2 3.25Å; L121-V125 WeakPolarHBondContact O-CG2 3.31Å; L121-V125 PolarHBondContact O-N 2.92Å; E122-V125 PolarHBondContact O-N 3.03Å; V125-Q127 VanDerWaalsContact C-N 3.28Å; V125-Q127 PolarHBondContact O-N 2.83Å; V125-M128 HydrophobicContact CG2-SD 4.33Å; V125-M128 CarbonylContact O-C 3.6Å; V125-M128 WeakPolarHBondContact O-CB 3.34Å; V125-M128 PolarHBondContact O-N 3.33Å; V125-I129 HydrophobicContact CG1-CD1 3.63Å; V125-I129 HydrophobicContact CG1-CG1 4.38Å; V125-I129 WeakPolarHBondContact O-CB 3.41Å; V125-I129 VanDerWaalsContact O-CG1 3.23Å; V125-I129 WeakPolarHBondContact O-CG1 3.29Å; V125-I129 PolarHBondContact O-N 3.44Å; V125-I179 HydrophobicContact CG2-CG2 4.17Å; V125-Y184 HydrophobicContact CG2-CD1 4.15Å; V125-Y184 HydrophobicContact CG2-CG 4.04Å; V125-F205 HydrophobicContact CG1-CD1 4.22Å; V125-F205 HydrophobicContact CG1-CE1 4.49Å; V125-Y211 WeakPolarHBondContact CG1-OH 3.5Å
126	D	95.5	Very high	93.8	Very high	98 Å²	98	74.2 Å²	74.2	52%	0.524	37%	0.372	S	S	.	.	H	α-helix	trans	-62.8	-32.6	171.5	-72.5	-20.8	0	0	0	112	E122 L124 S130	E122-D126 WeakPolarHBondContact O-CB 3.46Å; E122-D126 VanDerWaalsContact O-CG 3.28Å; E122-D126 PolarHBondContact O-N 3.13Å; L124-D126 VanDerWaalsContact C-N 3.3Å; L124-D126 PolarHBondContact O-N 3.38Å; D126-S130 PolarHBondContact O-N 2.82Å
127	Q	95.8	Very high	94.1	Very high	112 Å²	112	69.9 Å²	69.9	52%	0.523	36%	0.363	S	S	.	.	H	α-helix	trans	-71.7	-43.2	170.6	-70.6	164.8	79.7	0	0	111.5	A123 L124 V125 I129 S130 W159	A123-Q127 PolarHBondContact O-NE2 3.01Å; L124-Q127 WeakPolarHBondContact O-CB 3.44Å; L124-Q127 PolarHBondContact O-N 2.92Å; L124-Q127 VanDerWaalsContact O-N 3.08Å; V125-Q127 VanDerWaalsContact C-N 3.28Å; V125-Q127 PolarHBondContact O-N 2.83Å; Q127-I129 PolarHBondContact O-N 2.78Å; Q127-I129 VanDerWaalsContact O-N 3.16Å; Q127-S130 VanDerWaalsContact O-CB 3.24Å; Q127-S130 WeakPolarHBondContact O-CB 3.17Å; Q127-S130 PolarHBondContact O-N 3.33Å; Q127-S130 VanDerWaalsContact O-N 3.08Å; Q127-W159 HydrophobicContact CB-CH2 4.07Å; Q127-W159 HydrophobicContact CB-CZ2 4.07Å
128	M	96.7	Very high	94.3	Very high	0 Å²	0	72.3 Å²	72.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-61	-22.3	175.2	-63.2	169.7	87.7	0	0	113.1	L124 V125 I135 I156 W159 L160 I179 I185 F205	L124-M128 HydrophobicContact CG-SD 4.3Å; L124-M128 WeakPolarHBondContact O-CG 3.37Å; L124-M128 PolarHBondContact O-N 3.02Å; V125-M128 HydrophobicContact CG2-SD 4.33Å; V125-M128 CarbonylContact O-C 3.6Å; V125-M128 WeakPolarHBondContact O-CB 3.34Å; V125-M128 PolarHBondContact O-N 3.33Å; M128-I135 HydrophobicContact CB-CD1 4.04Å; M128-I135 HydrophobicContact CB-CG1 4.31Å; M128-I135 HydrophobicContact CE-CD1 3.56Å; M128-I135 HydrophobicContact CG-CD1 4.26Å; M128-I135 PolarHBondContact O-N 3.37Å; M128-I156 HydrophobicContact CE-CG2 3.96Å; M128-W159 HydrophobicContact CB-CH2 4.44Å; M128-W159 HydrophobicContact CE-CE3 4.4Å; M128-W159 HydrophobicContact CG-CD2 4.24Å; M128-W159 HydrophobicContact CG-CE3 3.71Å; M128-W159 HydrophobicContact CG-CH2 3.49Å; M128-W159 VanDerWaalsContact CG-CH2 3.49Å; M128-W159 HydrophobicContact CG-CZ2 4.01Å; M128-W159 HydrophobicContact CG-CZ3 3.32Å; M128-W159 HydrophobicContact SD-CZ3 4.23Å; M128-L160 HydrophobicContact CE-CD2 4.26Å; M128-I179 HydrophobicContact CE-CD1 4.43Å; M128-I179 HydrophobicContact SD-CD1 4.24Å; M128-I185 HydrophobicContact CE-CD1 3.5Å; M128-I185 VanDerWaalsContact CE-CD1 3.5Å; M128-I185 HydrophobicContact SD-CD1 4.25Å; M128-F205 HydrophobicContact CB-CE1 3.88Å; M128-F205 HydrophobicContact CB-CZ 3.89Å; M128-F205 WeakPolarHBondContact O-CZ 3.25Å
129	I	95.8	Very high	94.3	Very high	75 Å²	75	76.2 Å²	76.2	39%	0.385	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-5.5	179.5	-70.8	169.9	0	0	0	112.6	V125 Q127 F205	V125-I129 HydrophobicContact CG1-CD1 3.63Å; V125-I129 HydrophobicContact CG1-CG1 4.38Å; V125-I129 WeakPolarHBondContact O-CB 3.41Å; V125-I129 VanDerWaalsContact O-CG1 3.23Å; V125-I129 WeakPolarHBondContact O-CG1 3.29Å; V125-I129 PolarHBondContact O-N 3.44Å; Q127-I129 PolarHBondContact O-N 2.78Å; Q127-I129 VanDerWaalsContact O-N 3.16Å; I129-F205 HydrophobicContact CD1-CB 4.19Å; I129-F205 HydrophobicContact CD1-CD1 3.92Å; I129-F205 HydrophobicContact CD1-CD2 4.22Å; I129-F205 HydrophobicContact CD1-CE1 4.35Å; I129-F205 HydrophobicContact CD1-CG 3.86Å; I129-F205 HydrophobicContact CG1-CD1 3.82Å; I129-F205 HydrophobicContact CG1-CD2 3.66Å; I129-F205 HydrophobicContact CG1-CE1 3.8Å; I129-F205 HydrophobicContact CG1-CE2 3.65Å; I129-F205 HydrophobicContact CG1-CG 3.76Å; I129-F205 HydrophobicContact CG1-CZ 3.72Å
130	S	94.1	Very high	94.3	Very high	51 Å²	51	71.4 Å²	71.4	36%	0.357	37%	0.371	S	S	.	.			trans	-54.9	142.7	-175.7	-171.3	0	0	0	0	113.5	D126 Q127 E132 G134	D126-S130 PolarHBondContact O-N 2.82Å; Q127-S130 VanDerWaalsContact O-CB 3.24Å; Q127-S130 WeakPolarHBondContact O-CB 3.17Å; Q127-S130 PolarHBondContact O-N 3.33Å; Q127-S130 VanDerWaalsContact O-N 3.08Å; S130-E132 VanDerWaalsContact C-N 3.3Å; S130-E132 PolarHBondContact O-N 3.19Å; S130-G134 VanDerWaalsContact O-CA 3.23Å; S130-G134 WeakPolarHBondContact O-CA 3.45Å; S130-G134 PolarHBondContact O-N 2.99Å
131	E	90.4	Very high	94.1	Very high	194 Å²	194	73.3 Å²	73.3	91%	0.907	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.7	-16.2	177.9	-65.3	-172	176.5	0	0	112.9
132	E	89.4	Confident	93.5	Very high	176 Å²	176	76 Å²	76	82%	0.822	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.9	-66.8	-178.7	-61.8	-177.6	155.7	0	0	111.2	S130	S130-E132 VanDerWaalsContact C-N 3.3Å; S130-E132 PolarHBondContact O-N 3.19Å
133	D	91.7	Very high	93	Very high	111 Å²	111	83 Å²	83	59%	0.594	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.6	19.4	-176.3	-55.7	-47.6	0	0	0	113.7	W159	D133-W159 PolarHBondContact O-NE1 3.04Å
134	G	95.4	Very high	92.1	Very high	16 Å²	16	89.1 Å²	89.1	17%	0.165	46%	0.46	C	S	.	.	S	Bend	trans	-87.8	-178.2	-175	0	0	0	0	0	115.3	S130 P136	S130-G134 VanDerWaalsContact O-CA 3.23Å; S130-G134 WeakPolarHBondContact O-CA 3.45Å; S130-G134 PolarHBondContact O-N 2.99Å; G134-P136 WeakPolarHBondContact O-CD 3.33Å
135	I	97.1	Very high	91.6	Very high	7 Å²	7	90.5 Å²	90.5	4%	0.036	47%	0.472	C	S	.	.			trans	-74	123	176.5	-61.8	-179.9	0	0	0	109.2	M128 V137 F151 D155 I156 W159 F205	M128-I135 HydrophobicContact CB-CD1 4.04Å; M128-I135 HydrophobicContact CB-CG1 4.31Å; M128-I135 HydrophobicContact CE-CD1 3.56Å; M128-I135 HydrophobicContact CG-CD1 4.26Å; M128-I135 PolarHBondContact O-N 3.37Å; I135-V137 WeakPolarHBondContact O-CG2 3.31Å; I135-V137 PolarHBondContact O-N 3.2Å; I135-F151 HydrophobicContact CG2-CB 3.75Å; I135-F151 HydrophobicContact CG2-CD1 4.43Å; I135-F151 HydrophobicContact CG2-CD2 3.9Å; I135-F151 HydrophobicContact CG2-CG 3.78Å; I135-D155 HydrophobicContact CG2-CB 4.07Å; I135-I156 HydrophobicContact CD1-CB 4.41Å; I135-I156 HydrophobicContact CD1-CG1 4.26Å; I135-I156 HydrophobicContact CD1-CG2 4.34Å; I135-W159 HydrophobicContact CD1-CB 4.28Å; I135-W159 HydrophobicContact CD1-CD2 4.48Å; I135-W159 HydrophobicContact CD1-CG 4.28Å; I135-W159 HydrophobicContact CG1-CB 3.88Å; I135-W159 HydrophobicContact CG1-CD2 4.11Å; I135-W159 HydrophobicContact CG1-CG 3.64Å; I135-F205 HydrophobicContact CB-CZ 4.28Å; I135-F205 HydrophobicContact CD1-CZ 4.23Å
136	P	95	Very high	91.3	Very high	69 Å²	69	94.2 Å²	94.2	45%	0.448	49%	0.491	S	S	.	.			trans	-70	94.6	-173.5	26.6	-37	0	0	0	113	G134 R138	G134-P136 WeakPolarHBondContact O-CD 3.33Å; P136-R138 VanDerWaalsContact CG-NH2 3.33Å; P136-R138 WeakPolarHBondContact O-CG 3.31Å; P136-R138 PolarHBondContact O-NE 3.21Å; P136-R138 VanDerWaalsContact O-NE 3.16Å
137	V	95.8	Very high	91.1	Very high	72 Å²	72	91.2 Å²	91.2	44%	0.436	47%	0.474	S	S	.	.			trans	-74.3	131.2	178.3	-173	0	0	0	0	111.8	I135 F151 F205	I135-V137 WeakPolarHBondContact O-CG2 3.31Å; I135-V137 PolarHBondContact O-N 3.2Å; V137-F151 HydrophobicContact CG2-CD1 4.03Å; V137-F205 HydrophobicContact CG2-CD2 4.37Å; V137-F205 HydrophobicContact CG2-CE2 3.99Å
138	R	93.4	Very high	91	Very high	124 Å²	124	86.3 Å²	86.3	47%	0.468	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	156.4	-170.4	-54.1	172.3	-145.9	166.9	10.6	112.5	P136 S149 T150 D155	P136-R138 VanDerWaalsContact CG-NH2 3.33Å; P136-R138 WeakPolarHBondContact O-CG 3.31Å; P136-R138 PolarHBondContact O-NE 3.21Å; P136-R138 VanDerWaalsContact O-NE 3.16Å; R138-S149 PolarHBondContact O-N 3.33Å; R138-T150 PolarHBondContact N-O 3.4Å; R138-T150 PolarHBondContact O-N 3.33Å; R138-T150 PolarHBondContact O-OG1 2.9Å; R138-D155 IonicContact CZ-OD1 3.9Å; R138-D155 IonicContact NH2-OD1 3.89Å; R138-D155 PolarHBondContact NH2-OD1 2.68Å; R138-D155 IonicContact NH2-OD2 3.95Å
139	N	93.1	Very high	90.9	Very high	105 Å²	105	89.1 Å²	89.1	56%	0.561	47%	0.472	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.9	103	167.1	-69.5	-21.1	0	0	0	108.9	I147 P148 S149	N139-I147 CarbonylContact C-O 3.56Å; N139-I147 WeakPolarHBondContact CA-O 3.42Å; N139-P148 VanDerWaalsContact OD1-CA 3.27Å; N139-P148 WeakPolarHBondContact OD1-CA 3.37Å; N139-S149 PolarHBondContact OD1-N 3Å
140	V	91.9	Very high	90.9	Very high	37 Å²	37	85.6 Å²	85.6	22%	0.224	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	129	-178.6	-178.6	0	0	0	0	109.6	I146 I147 Y202	V140-I146 WeakPolarHBondContact O-CA 3.45Å; V140-I147 HydrophobicContact CB-CB 4.35Å; V140-I147 PolarHBondContact N-O 3.09Å; V140-I147 PolarHBondContact O-N 3.29Å; V140-Y202 HydrophobicContact CG1-CE1 4.46Å; V140-Y202 HydrophobicContact CG1-CE2 4.48Å; V140-Y202 HydrophobicContact CG2-CD1 4.31Å; V140-Y202 HydrophobicContact CG2-CE1 3.91Å
141	K	89.4	Confident	91	Very high	166 Å²	166	83.3 Å²	83.3	72%	0.722	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.2	122.4	175.7	-62.1	-175.1	-179.6	176.6	0	109.7	I146	K141-I146 HydrophobicContact CG-CG1 4.27Å; K141-I146 HydrophobicContact CG-CG2 4.45Å
142	S	82.3	Confident	91.4	Very high	76 Å²	76	75 Å²	75	53%	0.531	40%	0.4	S	S	.	.			trans	-102.7	171.2	167.6	-176.3	0	0	0	0	109.8	M144 S145	S142-M144 PolarHBondContact O-N 3.34Å; S142-S145 PolarHBondContact N-O 2.88Å
143	L	83.3	Confident	91.7	Very high	173 Å²	173	66.6 Å²	66.6	91%	0.906	36%	0.36	S	S	*	.	S	Bend	trans	-58.6	-29.3	-179.7	-175.5	64.4	0	0	0	113.2
144	M	77.8	Confident	92	Very high	179 Å²	179	63.3 Å²	63.3	88%	0.882	35%	0.346	S	S	*	.	S	Bend	trans	-122.4	-4.4	-173.4	-58.5	-179.6	73.9	0	0	114.1	S142	S142-M144 PolarHBondContact O-N 3.34Å
145	S	84.1	Confident	92.1	Very high	59 Å²	59	64 Å²	64	41%	0.413	35%	0.346	S	S	.	.			trans	-154.2	159.3	-171.7	61.6	0	0	0	0	112.8	S142	S142-S145 PolarHBondContact N-O 2.88Å
146	I	90	Very high	92.1	Very high	79 Å²	79	63.6 Å²	63.6	41%	0.405	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	124.7	166.9	-56.2	176.6	0	0	0	106.8	V140 K141 P148	V140-I146 WeakPolarHBondContact O-CA 3.45Å; K141-I146 HydrophobicContact CG-CG1 4.27Å; K141-I146 HydrophobicContact CG-CG2 4.45Å; I146-P148 WeakPolarHBondContact O-CD 3.46Å
147	I	91.3	Very high	92.2	Very high	35 Å²	35	60.5 Å²	60.5	18%	0.179	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	102.1	173.8	-55.6	176.1	0	0	0	106.2	N139 V140 T150 I188 Y202	N139-I147 CarbonylContact C-O 3.56Å; N139-I147 WeakPolarHBondContact CA-O 3.42Å; V140-I147 HydrophobicContact CB-CB 4.35Å; V140-I147 PolarHBondContact N-O 3.09Å; V140-I147 PolarHBondContact O-N 3.29Å; I147-T150 HydrophobicContact CG2-CG2 3.64Å; I147-I188 HydrophobicContact CD1-CD1 4.14Å; I147-I188 HydrophobicContact CG2-CD1 3.69Å; I147-Y202 HydrophobicContact CD1-CD2 4.12Å; I147-Y202 HydrophobicContact CD1-CE2 4.3Å
148	P	93.5	Very high	92.2	Very high	9 Å²	9	62.8 Å²	62.8	6%	0.058	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	156.2	-178.8	31	-35.7	0	0	0	110.7	N139 I146 T150 R204 L279 V283	N139-P148 VanDerWaalsContact OD1-CA 3.27Å; N139-P148 WeakPolarHBondContact OD1-CA 3.37Å; I146-P148 WeakPolarHBondContact O-CD 3.46Å; P148-T150 PolarHBondContact O-N 2.9Å; P148-R204 VanDerWaalsContact O-CZ 3.23Å; P148-R204 PolarHBondContact O-NH1 3.34Å; P148-R204 PolarHBondContact O-NH2 2.92Å; P148-L279 HydrophobicContact CG-CB 4.32Å; P148-L279 HydrophobicContact CG-CD2 4.21Å; P148-V283 HydrophobicContact CB-CG2 4.42Å; P148-V283 HydrophobicContact CG-CG2 3.77Å
149	S	93.6	Very high	92.4	Very high	58 Å²	58	57.5 Å²	57.5	41%	0.406	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	44.6	64.5	164	-51.4	0	0	0	0	116	R138 N139 R204	R138-S149 PolarHBondContact O-N 3.33Å; N139-S149 PolarHBondContact OD1-N 3Å; S149-R204 PolarHBondContact O-NH1 3.28Å
150	T	96	Very high	92.5	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	160.1	-179.9	42.8	0	0	0	0	113	R138 I147 P148 I188 Y203 R204	R138-T150 PolarHBondContact N-O 3.4Å; R138-T150 PolarHBondContact O-N 3.33Å; R138-T150 PolarHBondContact O-OG1 2.9Å; I147-T150 HydrophobicContact CG2-CG2 3.64Å; P148-T150 PolarHBondContact O-N 2.9Å; T150-I188 HydrophobicContact CG2-CD1 4.49Å; T150-I188 HydrophobicContact CG2-CG2 3.96Å; T150-Y203 WeakPolarHBondContact CA-O 3.32Å; T150-R204 HydrophobicContact CG2-CG 3.98Å
151	F	97.5	Very high	92.7	Very high	3 Å²	3	54.2 Å²	54.2	1%	0.013	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	162.6	172.6	44.6	-85.1	0	0	0	109.1	I135 V137 D155 I156 I185 Y202 Y203 F205	I135-F151 HydrophobicContact CG2-CB 3.75Å; I135-F151 HydrophobicContact CG2-CD1 4.43Å; I135-F151 HydrophobicContact CG2-CD2 3.9Å; I135-F151 HydrophobicContact CG2-CG 3.78Å; V137-F151 HydrophobicContact CG2-CD1 4.03Å; F151-D155 HydrophobicContact CB-CB 4.46Å; F151-I156 HydrophobicContact CD2-CD1 3.94Å; F151-I156 HydrophobicContact CD2-CG1 3.62Å; F151-I156 HydrophobicContact CE2-CD1 3.69Å; F151-I156 HydrophobicContact CE2-CG1 3.67Å; F151-I185 HydrophobicContact CE2-CG2 4.02Å; F151-I185 HydrophobicContact CZ-CG2 4.12Å; F151-Y202 WeakPolarHBondContact O-CA 3.1Å; F151-Y203 PolarHBondContact N-O 2.9Å; F151-Y203 VanDerWaalsContact N-O 3.13Å; F151-Y203 PolarHBondContact O-N 3.29Å; F151-F205 HydrophobicContact CD1-CD2 4.36Å; F151-F205 HydrophobicContact CD1-CE2 4.1Å; F151-F205 HydrophobicContact CE1-CD1 4.42Å; F151-F205 AromaticContact CE1-CD2 3.39Å; F151-F205 HydrophobicContact CE1-CD2 3.39Å; F151-F205 HydrophobicContact CE1-CE1 4.44Å; F151-F205 AromaticContact CE1-CE2 3.41Å; F151-F205 HydrophobicContact CE1-CE2 3.41Å; F151-F205 VanDerWaalsContact CE1-CE2 3.41Å; F151-F205 AromaticContact CE1-CG 3.93Å; F151-F205 HydrophobicContact CE1-CG 3.93Å; F151-F205 AromaticContact CE1-CZ 3.96Å; F151-F205 HydrophobicContact CE1-CZ 3.96Å; F151-F205 HydrophobicContact CZ-CD1 4.04Å; F151-F205 AromaticContact CZ-CD2 3.85Å; F151-F205 HydrophobicContact CZ-CD2 3.85Å; F151-F205 AromaticContact CZ-CE1 3.97Å; F151-F205 HydrophobicContact CZ-CE1 3.97Å; F151-F205 AromaticContact CZ-CE2 3.77Å; F151-F205 HydrophobicContact CZ-CE2 3.77Å; F151-F205 AromaticContact CZ-CG 3.97Å; F151-F205 HydrophobicContact CZ-CG 3.97Å; F151-F205 AromaticContact CZ-CZ 3.83Å; F151-F205 HydrophobicContact CZ-CZ 3.83Å
152	T	97.5	Very high	92.9	Very high	19 Å²	19	52.3 Å²	52.3	12%	0.117	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	163.2	-179.6	68.6	0	0	0	0	112	S154 D155 I156 G199 Y202	T152-S154 VanDerWaalsContact C-N 3.3Å; T152-S154 PolarHBondContact O-N 3.13Å; T152-D155 WeakPolarHBondContact CB-OD2 3.41Å; T152-D155 PolarHBondContact N-OD2 3.47Å; T152-D155 PolarHBondContact O-N 3.43Å; T152-D155 PolarHBondContact OG1-N 3.1Å; T152-D155 PolarHBondContact OG1-OD2 2.87Å; T152-I156 PolarHBondContact O-N 2.72Å; T152-G199 WeakPolarHBondContact CG2-O 3.21Å; T152-Y202 HydrophobicContact CG2-CD1 4.14Å; T152-Y202 HydrophobicContact CG2-CE1 3.93Å
153	G	96.8	Very high	93.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.7	-38.1	174.1	0	0	0	0	0	113.1	I156 V157 K196 D198 T201	G153-I156 WeakPolarHBondContact O-CB 3.16Å; G153-I156 PolarHBondContact O-N 3.11Å; G153-V157 WeakPolarHBondContact O-CG2 3.49Å; G153-V157 PolarHBondContact O-N 3.17Å; G153-V157 VanDerWaalsContact O-N 3.1Å; G153-K196 VanDerWaalsContact CA-O 3.3Å; G153-K196 WeakPolarHBondContact CA-O 3.4Å; G153-D198 PolarHBondContact N-O 2.85Å; G153-D198 VanDerWaalsContact N-O 3.14Å; G153-T201 PolarHBondContact N-O 3.5Å
154	S	97.2	Very high	93.7	Very high	42 Å²	42	48 Å²	48	29%	0.294	25%	0.251	S	S	.	.	H	α-helix	trans	-67.6	-32.2	174.7	-64.8	0	0	0	0	113.9	T152 I156 V157 H158 N197 D198	T152-S154 VanDerWaalsContact C-N 3.3Å; T152-S154 PolarHBondContact O-N 3.13Å; S154-I156 VanDerWaalsContact C-N 3.29Å; S154-I156 PolarHBondContact O-N 3.17Å; S154-V157 PolarHBondContact O-N 3.23Å; S154-H158 WeakPolarHBondContact O-CB 3.34Å; S154-H158 PolarHBondContact O-N 3.01Å; S154-N197 WeakPolarHBondContact CA-OD1 3.46Å; S154-N197 WeakPolarHBondContact CB-OD1 3.28Å; S154-N197 PolarHBondContact OG-OD1 3.45Å; S154-D198 PolarHBondContact N-O 2.73Å; S154-D198 WeakPolarHBondContact OG-CA 3.41Å; S154-D198 PolarHBondContact OG-N 3.25Å; S154-D198 PolarHBondContact OG-O 3.48Å
155	D	97.3	Very high	94.1	Very high	30 Å²	30	42.2 Å²	42.2	16%	0.16	24%	0.237	C	C	.	.	H	α-helix	trans	-61	-40.1	172.6	-62.6	-61.5	0	0	0	110.7	I135 R138 F151 T152 W159	I135-D155 HydrophobicContact CG2-CB 4.07Å; R138-D155 IonicContact CZ-OD1 3.9Å; R138-D155 IonicContact NH2-OD1 3.89Å; R138-D155 PolarHBondContact NH2-OD1 2.68Å; R138-D155 IonicContact NH2-OD2 3.95Å; F151-D155 HydrophobicContact CB-CB 4.46Å; T152-D155 WeakPolarHBondContact CB-OD2 3.41Å; T152-D155 PolarHBondContact N-OD2 3.47Å; T152-D155 PolarHBondContact O-N 3.43Å; T152-D155 PolarHBondContact OG1-N 3.1Å; T152-D155 PolarHBondContact OG1-OD2 2.87Å; D155-W159 WeakPolarHBondContact O-CB 3.32Å; D155-W159 PolarHBondContact O-N 3.23Å
156	I	97.2	Very high	94.2	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-64.9	-49.3	176.2	-51.4	166	0	0	0	110.5	M128 I135 F151 T152 G153 S154 H158 W159 L160 A176 I185 V195 Y203	M128-I156 HydrophobicContact CE-CG2 3.96Å; I135-I156 HydrophobicContact CD1-CB 4.41Å; I135-I156 HydrophobicContact CD1-CG1 4.26Å; I135-I156 HydrophobicContact CD1-CG2 4.34Å; F151-I156 HydrophobicContact CD2-CD1 3.94Å; F151-I156 HydrophobicContact CD2-CG1 3.62Å; F151-I156 HydrophobicContact CE2-CD1 3.69Å; F151-I156 HydrophobicContact CE2-CG1 3.67Å; T152-I156 PolarHBondContact O-N 2.72Å; G153-I156 WeakPolarHBondContact O-CB 3.16Å; G153-I156 PolarHBondContact O-N 3.11Å; S154-I156 VanDerWaalsContact C-N 3.29Å; S154-I156 PolarHBondContact O-N 3.17Å; I156-H158 PolarHBondContact O-N 3.21Å; I156-W159 PolarHBondContact O-N 2.86Å; I156-L160 HydrophobicContact CG2-CD1 3.85Å; I156-L160 HydrophobicContact CG2-CG 4.28Å; I156-L160 VanDerWaalsContact O-CG 3.28Å; I156-L160 WeakPolarHBondContact O-CG 3.17Å; I156-L160 PolarHBondContact O-N 2.84Å; I156-A176 HydrophobicContact CG2-CB 3.89Å; I156-I185 HydrophobicContact CD1-CG2 4.19Å; I156-V195 HydrophobicContact CD1-CG1 3.95Å; I156-V195 HydrophobicContact CD1-CG2 4.21Å; I156-Y203 HydrophobicContact CD1-CD1 4.33Å; I156-Y203 HydrophobicContact CD1-CD2 4.04Å; I156-Y203 HydrophobicContact CD1-CG 3.86Å
157	V	96.8	Very high	94.2	Very high	4 Å²	4	40.9 Å²	40.9	2%	0.024	24%	0.236	C	C	.	.	H	α-helix	trans	-64.4	-42	-175	171.9	0	0	0	0	111.5	G153 S154 L160 M161 V169 A172 V173 N197	G153-V157 WeakPolarHBondContact O-CG2 3.49Å; G153-V157 PolarHBondContact O-N 3.17Å; G153-V157 VanDerWaalsContact O-N 3.1Å; S154-V157 PolarHBondContact O-N 3.23Å; V157-L160 PolarHBondContact O-N 2.72Å; V157-M161 HydrophobicContact CG1-SD 4.25Å; V157-M161 WeakPolarHBondContact O-CG 3.47Å; V157-M161 PolarHBondContact O-N 3.09Å; V157-M161 VanDerWaalsContact O-N 3.15Å; V157-V169 HydrophobicContact CG1-CG1 4.23Å; V157-A172 HydrophobicContact CG1-CB 3.96Å; V157-V173 HydrophobicContact CG1-CG2 4.46Å; V157-V173 HydrophobicContact CG2-CG2 3.66Å; V157-N197 HydrophobicContact CG2-CB 4.05Å
158	H	95.9	Very high	94.3	Very high	120 Å²	120	42.2 Å²	42.2	56%	0.556	24%	0.244	S	C	*	.	H	α-helix	trans	-59.3	-50.1	174.1	-169.2	-71.7	0	0	0	111.2	S154 I156 L160 M161 E162	S154-H158 WeakPolarHBondContact O-CB 3.34Å; S154-H158 PolarHBondContact O-N 3.01Å; I156-H158 PolarHBondContact O-N 3.21Å; H158-L160 VanDerWaalsContact C-N 3.31Å; H158-L160 PolarHBondContact O-N 2.75Å; H158-M161 PolarHBondContact O-N 2.87Å; H158-E162 IonicContact CE1-OE2 3.06Å; H158-E162 PolarHBondContact CE1-OE2 3.32Å; H158-E162 IonicContact ND1-OE2 2.78Å; H158-E162 PolarHBondContact ND1-OE2 2.84Å; H158-E162 VanDerWaalsContact ND1-OE2 3.09Å; H158-E162 WeakPolarHBondContact O-CB 3.3Å; H158-E162 PolarHBondContact O-N 3.33Å
159	W	97	Very high	94.4	Very high	12 Å²	12	44.9 Å²	44.9	5%	0.045	26%	0.259	C	S	.	.	H	α-helix	trans	-58.5	-41.8	-178.7	-172	92.3	0	0	0	112.2	L124 Q127 M128 D133 I135 D155 I156 E162 H163 I164	L124-W159 HydrophobicContact CD1-CH2 3.96Å; L124-W159 HydrophobicContact CD1-CZ3 4.04Å; Q127-W159 HydrophobicContact CB-CH2 4.07Å; Q127-W159 HydrophobicContact CB-CZ2 4.07Å; M128-W159 HydrophobicContact CB-CH2 4.44Å; M128-W159 HydrophobicContact CE-CE3 4.4Å; M128-W159 HydrophobicContact CG-CD2 4.24Å; M128-W159 HydrophobicContact CG-CE3 3.71Å; M128-W159 HydrophobicContact CG-CH2 3.49Å; M128-W159 VanDerWaalsContact CG-CH2 3.49Å; M128-W159 HydrophobicContact CG-CZ2 4.01Å; M128-W159 HydrophobicContact CG-CZ3 3.32Å; M128-W159 HydrophobicContact SD-CZ3 4.23Å; D133-W159 PolarHBondContact O-NE1 3.04Å; I135-W159 HydrophobicContact CD1-CB 4.28Å; I135-W159 HydrophobicContact CD1-CD2 4.48Å; I135-W159 HydrophobicContact CD1-CG 4.28Å; I135-W159 HydrophobicContact CG1-CB 3.88Å; I135-W159 HydrophobicContact CG1-CD2 4.11Å; I135-W159 HydrophobicContact CG1-CG 3.64Å; D155-W159 WeakPolarHBondContact O-CB 3.32Å; D155-W159 PolarHBondContact O-N 3.23Å; I156-W159 PolarHBondContact O-N 2.86Å; W159-E162 PolarHBondContact O-N 3.16Å; W159-H163 AromaticContact CD1-CE1 3.63Å; W159-H163 AromaticContact CD1-ND1 3.46Å; W159-H163 HydrophobicContact CD2-CB 4.23Å; W159-H163 AromaticContact CD2-ND1 3.86Å; W159-H163 AromaticContact CE2-CG 3.72Å; W159-H163 AromaticContact CE2-ND1 3.71Å; W159-H163 HydrophobicContact CE3-CB 4.36Å; W159-H163 AromaticContact CG-ND1 3.7Å; W159-H163 HydrophobicContact CH2-CB 4.05Å; W159-H163 HydrophobicContact CZ2-CB 3.91Å; W159-H163 AromaticContact CZ2-CG 3.98Å; W159-H163 HydrophobicContact CZ3-CB 4.27Å; W159-H163 AromaticContact NE1-CE1 3.63Å; W159-H163 AromaticContact NE1-CG 3.78Å; W159-H163 AromaticContact NE1-ND1 3.45Å; W159-H163 PolarHBondContact NE1-ND1 3.33Å; W159-H163 WeakPolarHBondContact O-CB 3.45Å; W159-H163 PolarHBondContact O-N 2.89Å; W159-H163 PolarHBondContact O-ND1 3.4Å; W159-I164 HydrophobicContact CZ3-CD1 4.34Å; W159-I164 HydrophobicContact CZ3-CG1 4.23Å
160	L	96.4	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.1	-38.8	178.5	-66.7	171.1	0	0	0	113	M128 I156 V157 H158 E162 I164 G165 A172 I175 A176 I179	M128-L160 HydrophobicContact CE-CD2 4.26Å; I156-L160 HydrophobicContact CG2-CD1 3.85Å; I156-L160 HydrophobicContact CG2-CG 4.28Å; I156-L160 VanDerWaalsContact O-CG 3.28Å; I156-L160 WeakPolarHBondContact O-CG 3.17Å; I156-L160 PolarHBondContact O-N 2.84Å; V157-L160 PolarHBondContact O-N 2.72Å; H158-L160 VanDerWaalsContact C-N 3.31Å; H158-L160 PolarHBondContact O-N 2.75Å; L160-E162 VanDerWaalsContact C-N 3.34Å; L160-I164 HydrophobicContact CD2-CD1 3.37Å; L160-I164 HydrophobicContact CD2-CG1 4.18Å; L160-I164 WeakPolarHBondContact O-CB 3.24Å; L160-I164 PolarHBondContact O-N 3.46Å; L160-I164 VanDerWaalsContact O-N 3.1Å; L160-G165 PolarHBondContact O-N 3.41Å; L160-A172 HydrophobicContact CB-CB 4.31Å; L160-A172 WeakPolarHBondContact CD1-O 3.47Å; L160-I175 HydrophobicContact CD1-CG2 4.26Å; L160-I175 HydrophobicContact CD2-CG2 4.15Å; L160-A176 HydrophobicContact CD1-CB 3.55Å; L160-I179 HydrophobicContact CD2-CD1 4.32Å
161	M	94.8	Very high	94.6	Very high	73 Å²	73	51 Å²	51	36%	0.36	29%	0.289	S	S	.	.	H	α-helix	trans	-65.6	-40	175.6	-69.6	178.8	69.7	0	0	111.4	V157 H158 G165 A166 V169 A172	V157-M161 HydrophobicContact CG1-SD 4.25Å; V157-M161 WeakPolarHBondContact O-CG 3.47Å; V157-M161 PolarHBondContact O-N 3.09Å; V157-M161 VanDerWaalsContact O-N 3.15Å; H158-M161 PolarHBondContact O-N 2.87Å; M161-G165 WeakPolarHBondContact O-CA 3.43Å; M161-G165 PolarHBondContact O-N 3.21Å; M161-A166 HydrophobicContact CG-CB 4.42Å; M161-V169 HydrophobicContact CE-CG2 4.11Å; M161-V169 HydrophobicContact SD-CG2 3.78Å; M161-A172 HydrophobicContact CG-CB 3.7Å; M161-A172 HydrophobicContact SD-CB 4.44Å
162	E	94.3	Very high	94.5	Very high	127 Å²	127	50.8 Å²	50.8	59%	0.593	29%	0.288	S	S	*	.	H	α-helix	trans	-74.9	-44.8	-177.8	-173.7	167.2	-149.2	0	0	113.3	H158 W159 L160	H158-E162 IonicContact CE1-OE2 3.06Å; H158-E162 PolarHBondContact CE1-OE2 3.32Å; H158-E162 IonicContact ND1-OE2 2.78Å; H158-E162 PolarHBondContact ND1-OE2 2.84Å; H158-E162 VanDerWaalsContact ND1-OE2 3.09Å; H158-E162 WeakPolarHBondContact O-CB 3.3Å; H158-E162 PolarHBondContact O-N 3.33Å; W159-E162 PolarHBondContact O-N 3.16Å; L160-E162 VanDerWaalsContact C-N 3.34Å
163	H	93.2	Very high	94.5	Very high	84 Å²	84	51.6 Å²	51.6	39%	0.389	29%	0.293	S	S	.	.	H	α-helix	trans	-100.5	-27.4	-169.7	-62.1	81.3	0	0	0	114.6	W159	W159-H163 AromaticContact CD1-CE1 3.63Å; W159-H163 AromaticContact CD1-ND1 3.46Å; W159-H163 HydrophobicContact CD2-CB 4.23Å; W159-H163 AromaticContact CD2-ND1 3.86Å; W159-H163 AromaticContact CE2-CG 3.72Å; W159-H163 AromaticContact CE2-ND1 3.71Å; W159-H163 HydrophobicContact CE3-CB 4.36Å; W159-H163 AromaticContact CG-ND1 3.7Å; W159-H163 HydrophobicContact CH2-CB 4.05Å; W159-H163 HydrophobicContact CZ2-CB 3.91Å; W159-H163 AromaticContact CZ2-CG 3.98Å; W159-H163 HydrophobicContact CZ3-CB 4.27Å; W159-H163 AromaticContact NE1-CE1 3.63Å; W159-H163 AromaticContact NE1-CG 3.78Å; W159-H163 AromaticContact NE1-ND1 3.45Å; W159-H163 PolarHBondContact NE1-ND1 3.33Å; W159-H163 WeakPolarHBondContact O-CB 3.45Å; W159-H163 PolarHBondContact O-N 2.89Å; W159-H163 PolarHBondContact O-ND1 3.4Å
164	I	88.8	Confident	94.5	Very high	74 Å²	74	57.9 Å²	57.9	38%	0.379	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-22.7	175.6	-52.1	-173.1	0	0	0	111.4	L124 W159 L160	L124-I164 HydrophobicContact CD1-CD1 3.71Å; L124-I164 HydrophobicContact CD1-CG1 4.15Å; L124-I164 HydrophobicContact CD2-CD1 3.74Å; L124-I164 HydrophobicContact CG-CD1 4.32Å; W159-I164 HydrophobicContact CZ3-CD1 4.34Å; W159-I164 HydrophobicContact CZ3-CG1 4.23Å; L160-I164 HydrophobicContact CD2-CD1 3.37Å; L160-I164 HydrophobicContact CD2-CG1 4.18Å; L160-I164 WeakPolarHBondContact O-CB 3.24Å; L160-I164 PolarHBondContact O-N 3.46Å; L160-I164 VanDerWaalsContact O-N 3.1Å
165	G	86.3	Confident	94.4	Very high	57 Å²	57	57.9 Å²	57.9	59%	0.588	32%	0.318	S	S	*	.			trans	75.8	36.1	-174.6	0	0	0	0	0	113	L160 M161 S167	L160-G165 PolarHBondContact O-N 3.41Å; M161-G165 WeakPolarHBondContact O-CA 3.43Å; M161-G165 PolarHBondContact O-N 3.21Å; G165-S167 PolarHBondContact O-N 3.18Å
166	A	86.8	Confident	94.4	Very high	11 Å²	11	56.5 Å²	56.5	9%	0.091	31%	0.31	C	S	.	.			trans	-57.3	130.5	171.3	0	0	0	0	0	110.3	M161 D168 E171 A172 I175	M161-A166 HydrophobicContact CG-CB 4.42Å; A166-D168 PolarHBondContact O-N 3.31Å; A166-E171 HydrophobicContact CB-CG 4.26Å; A166-A172 HydrophobicContact CB-CB 3.92Å; A166-I175 HydrophobicContact CB-CD1 4.39Å
167	S	90	Very high	94.4	Very high	99 Å²	99	57.5 Å²	57.5	69%	0.692	32%	0.317	S	S	*	.	S	Bend	trans	-71.3	-29.5	-167.4	61.1	0	0	0	0	114	G165 E171	G165-S167 PolarHBondContact O-N 3.18Å; S167-E171 WeakPolarHBondContact CB-OE2 3.49Å; S167-E171 PolarHBondContact N-OE2 3.02Å; S167-E171 PolarHBondContact OG-OE2 3.33Å
168	D	93.6	Very high	94.3	Very high	64 Å²	64	62.7 Å²	62.7	34%	0.342	34%	0.337	S	S	.	.	S	Bend	trans	-148.3	175.3	170.2	73.1	37.4	0	0	0	112.8	A166 T170 E171 A172	A166-D168 PolarHBondContact O-N 3.31Å; D168-T170 VanDerWaalsContact C-N 3.25Å; D168-T170 PolarHBondContact O-N 3.33Å; D168-T170 VanDerWaalsContact OD1-CA 3.23Å; D168-T170 WeakPolarHBondContact OD1-CA 3.3Å; D168-T170 WeakPolarHBondContact OD1-CB 3.44Å; D168-T170 PolarHBondContact OD1-N 2.91Å; D168-T170 PolarHBondContact OD1-OG1 3.07Å; D168-E171 PolarHBondContact O-N 3.33Å; D168-E171 PolarHBondContact OD1-N 3.05Å; D168-A172 PolarHBondContact O-N 3.32Å
169	V	96.2	Very high	94.3	Very high	64 Å²	64	57.1 Å²	57.1	39%	0.388	31%	0.311	S	S	.	.	H	α-helix	trans	-61.5	-31.3	179.3	174.2	0	0	0	0	112.5	V157 M161 V173 N197	V157-V169 HydrophobicContact CG1-CG1 4.23Å; M161-V169 HydrophobicContact CE-CG2 4.11Å; M161-V169 HydrophobicContact SD-CG2 3.78Å; V169-V173 HydrophobicContact CG1-CG2 4.35Å; V169-V173 WeakPolarHBondContact O-CB 3.39Å; V169-V173 WeakPolarHBondContact O-CG2 3.28Å; V169-V173 PolarHBondContact O-N 2.91Å; V169-N197 VanDerWaalsContact CG1-ND2 3.32Å; V169-N197 WeakPolarHBondContact CG1-ND2 3.46Å
170	T	96.1	Very high	94.3	Very high	105 Å²	105	56.6 Å²	56.6	64%	0.644	31%	0.309	S	S	*	.	H	α-helix	trans	-71.6	-43.6	179.6	-42.8	0	0	0	0	110.6	D168 V173 H174	D168-T170 VanDerWaalsContact C-N 3.25Å; D168-T170 PolarHBondContact O-N 3.33Å; D168-T170 VanDerWaalsContact OD1-CA 3.23Å; D168-T170 WeakPolarHBondContact OD1-CA 3.3Å; D168-T170 WeakPolarHBondContact OD1-CB 3.44Å; D168-T170 PolarHBondContact OD1-N 2.91Å; D168-T170 PolarHBondContact OD1-OG1 3.07Å; T170-V173 PolarHBondContact O-N 3.14Å; T170-H174 VanDerWaalsContact O-CB 3.32Å; T170-H174 WeakPolarHBondContact O-CB 3.5Å; T170-H174 PolarHBondContact O-N 3.04Å
171	E	95.9	Very high	94.2	Very high	82 Å²	82	57.7 Å²	57.7	38%	0.383	32%	0.317	S	S	.	.	H	α-helix	trans	-61.8	-46.7	172.2	-178.9	171.4	-146.6	0	0	110.9	A166 S167 D168 V173 H174 I175	A166-E171 HydrophobicContact CB-CG 4.26Å; S167-E171 WeakPolarHBondContact CB-OE2 3.49Å; S167-E171 PolarHBondContact N-OE2 3.02Å; S167-E171 PolarHBondContact OG-OE2 3.33Å; D168-E171 PolarHBondContact O-N 3.33Å; D168-E171 PolarHBondContact OD1-N 3.05Å; E171-V173 PolarHBondContact O-N 3.39Å; E171-H174 PolarHBondContact O-N 2.82Å; E171-H174 VanDerWaalsContact O-N 3.16Å; E171-I175 HydrophobicContact CG-CD1 3.8Å; E171-I175 HydrophobicContact CG-CG1 4.41Å; E171-I175 WeakPolarHBondContact O-CG1 3.35Å; E171-I175 PolarHBondContact O-N 3.41Å
172	A	96.9	Very high	94.2	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-59.7	-44.8	177.4	0	0	0	0	0	112.5	V157 L160 M161 A166 D168 H174 I175 A176	V157-A172 HydrophobicContact CG1-CB 3.96Å; L160-A172 HydrophobicContact CB-CB 4.31Å; L160-A172 WeakPolarHBondContact CD1-O 3.47Å; M161-A172 HydrophobicContact CG-CB 3.7Å; M161-A172 HydrophobicContact SD-CB 4.44Å; A166-A172 HydrophobicContact CB-CB 3.92Å; D168-A172 PolarHBondContact O-N 3.32Å; A172-H174 VanDerWaalsContact C-N 3.35Å; A172-H174 PolarHBondContact O-N 3.43Å; A172-I175 PolarHBondContact O-N 2.95Å; A172-A176 VanDerWaalsContact O-CB 3.29Å; A172-A176 WeakPolarHBondContact O-CB 3.35Å; A172-A176 PolarHBondContact O-N 2.97Å
173	V	97.3	Very high	94.3	Very high	36 Å²	36	49.6 Å²	49.6	22%	0.218	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-37.2	174.5	166.4	0	0	0	0	112.2	V157 V169 T170 E171 S177 N197	V157-V173 HydrophobicContact CG1-CG2 4.46Å; V157-V173 HydrophobicContact CG2-CG2 3.66Å; V169-V173 HydrophobicContact CG1-CG2 4.35Å; V169-V173 WeakPolarHBondContact O-CB 3.39Å; V169-V173 WeakPolarHBondContact O-CG2 3.28Å; V169-V173 PolarHBondContact O-N 2.91Å; T170-V173 PolarHBondContact O-N 3.14Å; E171-V173 PolarHBondContact O-N 3.39Å; V173-S177 VanDerWaalsContact O-CB 3.24Å; V173-S177 WeakPolarHBondContact O-CB 3.22Å; V173-S177 PolarHBondContact O-N 3.31Å; V173-S177 PolarHBondContact O-OG 2.94Å; V173-N197 HydrophobicContact CG2-CB 3.72Å
174	H	96.4	Very high	94.4	Very high	131 Å²	131	45.6 Å²	45.6	61%	0.606	26%	0.26	S	S	*	.	H	α-helix	trans	-66.7	-45.1	176.4	-173	81	0	0	0	111.5	T170 E171 A172 S177 R178	T170-H174 VanDerWaalsContact O-CB 3.32Å; T170-H174 WeakPolarHBondContact O-CB 3.5Å; T170-H174 PolarHBondContact O-N 3.04Å; E171-H174 PolarHBondContact O-N 2.82Å; E171-H174 VanDerWaalsContact O-N 3.16Å; A172-H174 VanDerWaalsContact C-N 3.35Å; A172-H174 PolarHBondContact O-N 3.43Å; H174-S177 PolarHBondContact O-N 3.21Å; H174-R178 WeakPolarHBondContact O-CB 3.5Å; H174-R178 PolarHBondContact O-N 3.22Å
175	I	95.8	Very high	94.8	Very high	43 Å²	43	42 Å²	42	22%	0.221	24%	0.242	C	C	.	.	H	α-helix	trans	-61.6	-48.4	174.8	-68.3	167.9	0	0	0	110.4	L160 A166 E171 A172 S177 R178 I179	L160-I175 HydrophobicContact CD1-CG2 4.26Å; L160-I175 HydrophobicContact CD2-CG2 4.15Å; A166-I175 HydrophobicContact CB-CD1 4.39Å; E171-I175 HydrophobicContact CG-CD1 3.8Å; E171-I175 HydrophobicContact CG-CG1 4.41Å; E171-I175 WeakPolarHBondContact O-CG1 3.35Å; E171-I175 PolarHBondContact O-N 3.41Å; A172-I175 PolarHBondContact O-N 2.95Å; I175-S177 PolarHBondContact O-N 3.41Å; I175-R178 PolarHBondContact O-N 3.18Å; I175-I179 HydrophobicContact CG2-CD1 3.92Å; I175-I179 WeakPolarHBondContact O-CG1 3.46Å; I175-I179 PolarHBondContact O-N 2.94Å
176	A	97.1	Very high	95.4	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-56.9	-48.6	177.2	0	0	0	0	0	111.8	I156 L160 A172 R178 I179 A180 V195	I156-A176 HydrophobicContact CG2-CB 3.89Å; L160-A176 HydrophobicContact CD1-CB 3.55Å; A172-A176 VanDerWaalsContact O-CB 3.29Å; A172-A176 WeakPolarHBondContact O-CB 3.35Å; A172-A176 PolarHBondContact O-N 2.97Å; A176-R178 VanDerWaalsContact C-N 3.26Å; A176-R178 PolarHBondContact O-N 3.42Å; A176-I179 PolarHBondContact O-N 2.93Å; A176-A180 WeakPolarHBondContact O-CB 3.44Å; A176-A180 PolarHBondContact O-N 3.25Å; A176-V195 HydrophobicContact CB-CB 3.66Å; A176-V195 HydrophobicContact CB-CG1 3.75Å; A176-V195 HydrophobicContact CB-CG2 3.81Å; A176-V195 WeakPolarHBondContact O-CG2 3.29Å
177	S	96.9	Very high	95.9	Very high	21 Å²	21	39.1 Å²	39.1	15%	0.147	21%	0.212	C	C	.	.	H	α-helix	trans	-63.2	-31.6	175.9	-67.8	0	0	0	0	112.5	V173 H174 I175 S181 T194 V195	V173-S177 VanDerWaalsContact O-CB 3.24Å; V173-S177 WeakPolarHBondContact O-CB 3.22Å; V173-S177 PolarHBondContact O-N 3.31Å; V173-S177 PolarHBondContact O-OG 2.94Å; H174-S177 PolarHBondContact O-N 3.21Å; I175-S177 PolarHBondContact O-N 3.41Å; S177-S181 WeakPolarHBondContact O-CB 3.37Å; S177-S181 PolarHBondContact O-N 3.34Å; S177-S181 PolarHBondContact O-OG 2.95Å; S177-T194 PolarHBondContact OG-OG1 3.3Å; S177-V195 PolarHBondContact OG-N 3.03Å; S177-V195 PolarHBondContact OG-O 3.47Å
178	R	94.7	Very high	96.1	Very high	113 Å²	113	35.3 Å²	35.3	43%	0.426	18%	0.184	S	C	.	.	H	α-helix	trans	-72.3	-43.3	177.1	-161.2	66	178.5	135.5	-11.6	112	H174 I175 A176 A180 S181 M182 T304	H174-R178 WeakPolarHBondContact O-CB 3.5Å; H174-R178 PolarHBondContact O-N 3.22Å; I175-R178 PolarHBondContact O-N 3.18Å; A176-R178 VanDerWaalsContact C-N 3.26Å; A176-R178 PolarHBondContact O-N 3.42Å; R178-A180 VanDerWaalsContact C-N 3.29Å; R178-A180 PolarHBondContact O-N 3.38Å; R178-S181 PolarHBondContact NH1-OG 3.13Å; R178-S181 PolarHBondContact O-N 2.78Å; R178-S181 PolarHBondContact O-OG 3.44Å; R178-M182 HydrophobicContact CG-CE 4.19Å; R178-M182 WeakPolarHBondContact O-CG 3.47Å; R178-M182 PolarHBondContact O-N 2.93Å; R178-T304 VanDerWaalsContact NH1-CG2 3.32Å
179	I	96	Very high	95.9	Very high	4 Å²	4	38.9 Å²	38.9	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-58.6	-43.5	172.3	-64.7	165	0	0	0	110	L121 L124 V125 M128 L160 I175 A176 M182 I185	L121-I179 HydrophobicContact CD2-CG1 4.23Å; L124-I179 HydrophobicContact CD2-CD1 3.86Å; V125-I179 HydrophobicContact CG2-CG2 4.17Å; M128-I179 HydrophobicContact CE-CD1 4.43Å; M128-I179 HydrophobicContact SD-CD1 4.24Å; L160-I179 HydrophobicContact CD2-CD1 4.32Å; I175-I179 HydrophobicContact CG2-CD1 3.92Å; I175-I179 WeakPolarHBondContact O-CG1 3.46Å; I175-I179 PolarHBondContact O-N 2.94Å; A176-I179 PolarHBondContact O-N 2.93Å; I179-M182 PolarHBondContact O-N 2.91Å; I179-I185 HydrophobicContact CG2-CD1 3.91Å; I179-I185 HydrophobicContact CG2-CG1 4.14Å
180	A	96.9	Very high	95.8	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-64.4	-46	176.7	0	0	0	0	0	112.7	A176 R178 M182 G183 I185 V195	A176-A180 WeakPolarHBondContact O-CB 3.44Å; A176-A180 PolarHBondContact O-N 3.25Å; R178-A180 VanDerWaalsContact C-N 3.29Å; R178-A180 PolarHBondContact O-N 3.38Å; A180-M182 PolarHBondContact O-N 3.34Å; A180-G183 PolarHBondContact O-N 3.35Å; A180-I185 WeakPolarHBondContact CA-O 3.3Å; A180-I185 WeakPolarHBondContact CB-O 3.26Å; A180-V195 HydrophobicContact CB-CG2 3.83Å
181	S	95	Very high	95.7	Very high	23 Å²	23	34.7 Å²	34.7	16%	0.161	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-17.4	176.7	74.9	0	0	0	0	114.2	S177 R178 L193 T304	S177-S181 WeakPolarHBondContact O-CB 3.37Å; S177-S181 PolarHBondContact O-N 3.34Å; S177-S181 PolarHBondContact O-OG 2.95Å; R178-S181 PolarHBondContact NH1-OG 3.13Å; R178-S181 PolarHBondContact O-N 2.78Å; R178-S181 PolarHBondContact O-OG 3.44Å; S181-L193 PolarHBondContact N-O 3.11Å; S181-T304 WeakPolarHBondContact O-CB 3.32Å; S181-T304 VanDerWaalsContact O-CG2 3.26Å; S181-T304 WeakPolarHBondContact O-CG2 3.25Å; S181-T304 PolarHBondContact O-OG1 3.43Å
182	M	94.4	Very high	95.7	Very high	27 Å²	27	33.5 Å²	33.5	13%	0.133	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.2	11.5	176	-66.9	173.5	173.8	0	0	112.8	L117 L121 R178 I179 A180 Y184 P212	L117-M182 HydrophobicContact CD2-CE 4.09Å; L121-M182 HydrophobicContact CD1-SD 3.37Å; L121-M182 WeakPolarHBondContact CD1-SD 3.49Å; R178-M182 HydrophobicContact CG-CE 4.19Å; R178-M182 WeakPolarHBondContact O-CG 3.47Å; R178-M182 PolarHBondContact O-N 2.93Å; I179-M182 PolarHBondContact O-N 2.91Å; A180-M182 PolarHBondContact O-N 3.34Å; M182-Y184 VanDerWaalsContact C-N 3.34Å; M182-Y184 HydrophobicContact CB-CD2 3.87Å; M182-Y184 HydrophobicContact CB-CE2 3.98Å; M182-Y184 PolarHBondContact O-N 2.74Å; M182-P212 WeakPolarHBondContact O-CG 3.4Å
183	G	95	Very high	95.7	Very high	2 Å²	2	34.6 Å²	34.6	2%	0.021	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.7	6.2	170.7	0	0	0	0	0	115.8	A180 Q206	A180-G183 PolarHBondContact O-N 3.35Å; G183-Q206 WeakPolarHBondContact O-CB 3.24Å; G183-Q206 WeakPolarHBondContact O-CG 3.23Å
184	Y	96.9	Very high	95.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	18%	0.18	C	C	.	.	S	Bend	trans	-80	-31	179.2	-67.2	-78.3	0	0	0	113.2	L121 E122 V125 M182 Q206 Y211 P212	L121-Y184 HydrophobicContact CB-CD2 4.35Å; L121-Y184 HydrophobicContact CB-CE2 3.75Å; L121-Y184 HydrophobicContact CD1-CE2 3.89Å; L121-Y184 HydrophobicContact CG-CE2 4.41Å; E122-Y184 HydrophobicContact CG-CE1 3.56Å; E122-Y184 PolarHBondContact OE1-OH 2.97Å; V125-Y184 HydrophobicContact CG2-CD1 4.15Å; V125-Y184 HydrophobicContact CG2-CG 4.04Å; M182-Y184 VanDerWaalsContact C-N 3.34Å; M182-Y184 HydrophobicContact CB-CD2 3.87Å; M182-Y184 HydrophobicContact CB-CE2 3.98Å; M182-Y184 PolarHBondContact O-N 2.74Å; Y184-Q206 PolarHBondContact O-N 2.69Å; Y184-Y211 AromaticContact CD1-CD1 3.82Å; Y184-Y211 HydrophobicContact CD1-CD1 3.82Å; Y184-Y211 HydrophobicContact CD1-CD2 4.26Å; Y184-Y211 AromaticContact CD1-CE1 3.73Å; Y184-Y211 HydrophobicContact CD1-CE1 3.73Å; Y184-Y211 HydrophobicContact CD1-CE2 4.17Å; Y184-Y211 HydrophobicContact CD1-CG 4.09Å; Y184-Y211 AromaticContact CD1-CZ 3.9Å; Y184-Y211 AromaticContact CE1-CD1 3.98Å; Y184-Y211 HydrophobicContact CE1-CD1 3.98Å; Y184-Y211 AromaticContact CE1-CD2 3.79Å; Y184-Y211 HydrophobicContact CE1-CD2 3.79Å; Y184-Y211 HydrophobicContact CE1-CE1 4.22Å; Y184-Y211 HydrophobicContact CE1-CE2 4.03Å; Y184-Y211 AromaticContact CE1-CG 3.75Å; Y184-Y211 HydrophobicContact CE1-CG 3.75Å; Y184-P212 HydrophobicContact CE2-CG 4.48Å
185	I	97.4	Very high	95.7	Very high	0 Å²	0	29 Å²	29	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	142.6	178.2	-62.3	175.6	0	0	0	108.1	M128 F151 I156 I179 A180 Y203 R204 F205	M128-I185 HydrophobicContact CE-CD1 3.5Å; M128-I185 VanDerWaalsContact CE-CD1 3.5Å; M128-I185 HydrophobicContact SD-CD1 4.25Å; F151-I185 HydrophobicContact CE2-CG2 4.02Å; F151-I185 HydrophobicContact CZ-CG2 4.12Å; I156-I185 HydrophobicContact CD1-CG2 4.19Å; I179-I185 HydrophobicContact CG2-CD1 3.91Å; I179-I185 HydrophobicContact CG2-CG1 4.14Å; A180-I185 WeakPolarHBondContact CA-O 3.3Å; A180-I185 WeakPolarHBondContact CB-O 3.26Å; I185-Y203 HydrophobicContact CG2-CD1 4Å; I185-Y203 HydrophobicContact CG2-CG 4.43Å; I185-R204 VanDerWaalsContact CA-O 3.29Å; I185-R204 WeakPolarHBondContact CA-O 3.36Å; I185-F205 HydrophobicContact CD1-CD1 4.21Å; I185-F205 HydrophobicContact CD1-CE1 3.86Å; I185-F205 HydrophobicContact CG1-CD1 3.79Å; I185-F205 HydrophobicContact CG1-CE1 3.98Å
186	F	97.6	Very high	95.7	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	150.5	-179.8	60.3	-87.9	0	0	0	112.4	L193 Y203 R204 Q206 S286 Q287 A290	F186-L193 HydrophobicContact CB-CD2 3.77Å; F186-Y203 CarbonylContact O-C 3.59Å; F186-Y203 VanDerWaalsContact O-CA 3.28Å; F186-Y203 WeakPolarHBondContact O-CA 3.21Å; F186-Y203 WeakPolarHBondContact O-CD1 3.4Å; F186-R204 HydrophobicContact CD1-CB 4.33Å; F186-R204 HydrophobicContact CD2-CB 4.33Å; F186-R204 HydrophobicContact CE1-CB 3.78Å; F186-R204 HydrophobicContact CE2-CB 3.8Å; F186-R204 HydrophobicContact CE2-CG 4.25Å; F186-R204 HydrophobicContact CZ-CB 3.49Å; F186-R204 VanDerWaalsContact CZ-CB 3.49Å; F186-R204 HydrophobicContact CZ-CG 4.21Å; F186-R204 PolarHBondContact N-O 3Å; F186-R204 PolarHBondContact O-N 3.12Å; F186-Q206 HydrophobicContact CD1-CB 4.45Å; F186-Q206 HydrophobicContact CE1-CB 4.31Å; F186-S286 VanDerWaalsContact CE2-O 3.27Å; F186-S286 WeakPolarHBondContact CE2-O 3.5Å; F186-Q287 HydrophobicContact CE1-CG 4Å; F186-Q287 HydrophobicContact CZ-CB 4.37Å; F186-Q287 HydrophobicContact CZ-CG 3.69Å; F186-A290 HydrophobicContact CB-CB 3.67Å; F186-A290 HydrophobicContact CD1-CB 3.4Å; F186-A290 HydrophobicContact CD2-CB 3.54Å; F186-A290 HydrophobicContact CE1-CB 3.81Å; F186-A290 HydrophobicContact CE2-CB 3.92Å; F186-A290 HydrophobicContact CG-CB 3.25Å; F186-A290 HydrophobicContact CZ-CB 4.05Å
187	C	96.8	Very high	95.7	Very high	6 Å²	6	34.4 Å²	34.4	4%	0.041	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	138.3	172	-178.3	0	0	0	0	109.7	D189 D190 T201 Y203 R289	C187-D189 PolarHBondContact O-N 3.41Å; C187-D190 HydrophobicContact CB-CB 3.87Å; C187-T201 WeakPolarHBondContact SG-CG2 3.39Å; C187-Y203 HydrophobicContact CB-CD1 4.19Å; C187-Y203 HydrophobicContact CB-CE1 3.7Å; C187-R289 PolarHBondContact O-NH2 3.12Å
188	I	94.2	Very high	95.6	Very high	19 Å²	19	34.7 Å²	34.7	10%	0.097	18%	0.177	C	C	.	.	S	Bend	trans	-72.2	-28.2	-175.8	65.1	168.5	0	0	0	114.1	I147 T150 Y202 R204 R289	I147-I188 HydrophobicContact CD1-CD1 4.14Å; I147-I188 HydrophobicContact CG2-CD1 3.69Å; T150-I188 HydrophobicContact CG2-CD1 4.49Å; T150-I188 HydrophobicContact CG2-CG2 3.96Å; I188-Y202 HydrophobicContact CD1-CD2 4.26Å; I188-Y202 HydrophobicContact CD1-CG 4.42Å; I188-Y202 PolarHBondContact N-O 2.94Å; I188-R204 HydrophobicContact CG2-CG 3.56Å; I188-R289 PolarHBondContact O-NH2 2.93Å
189	D	90.8	Very high	95.6	Very high	139 Å²	139	31.6 Å²	31.6	74%	0.743	18%	0.181	S	C	*	.	S	Bend	trans	-116.2	3	-171.6	-60.1	-40.6	0	0	0	113.6	C187	C187-D189 PolarHBondContact O-N 3.41Å
190	D	93.3	Very high	95.5	Very high	43 Å²	43	38 Å²	38	23%	0.23	21%	0.211	C	C	.	.			trans	-126.6	138.7	-176.4	-161.3	-23.5	0	0	0	110.4	C187 V192 K196 R289	C187-D190 HydrophobicContact CB-CB 3.87Å; D190-V192 PolarHBondContact OD1-N 3.13Å; D190-K196 IonicContact OD2-NZ 3.54Å; D190-K196 PolarHBondContact OD2-NZ 3.13Å; D190-R289 PolarHBondContact O-NH1 3.04Å; D190-R289 PolarHBondContact O-NH2 3.35Å
191	H	94.9	Very high	95.4	Very high	39 Å²	39	38.8 Å²	38.8	18%	0.181	22%	0.215	C	C	.	.	S	Bend	trans	-82	-18.4	174.5	-75.9	-92.5	0	0	0	112.2	L193 E244 D293 P298	H191-L193 PolarHBondContact O-N 3.34Å; H191-E244 IonicContact CE1-OE1 2.79Å; H191-E244 PolarHBondContact CE1-OE1 3.32Å; H191-E244 IonicContact CE1-OE2 3.09Å; H191-E244 IonicContact NE2-OE2 2.72Å; H191-D293 IonicContact CE1-OD1 3.44Å; H191-D293 IonicContact CG-OD1 3.32Å; H191-D293 IonicContact ND1-OD1 3.87Å; H191-D293 PolarHBondContact ND1-OD1 3.34Å; H191-D293 IonicContact ND1-OD2 3.77Å; H191-D293 PolarHBondContact ND1-OD2 3.16Å; H191-P298 HydrophobicContact CB-CG 3.79Å
192	V	95.8	Very high	95.5	Very high	57 Å²	57	40.4 Å²	40.4	35%	0.345	22%	0.218	S	C	.	.	S	Bend	trans	-80.6	114.8	177.5	-174.8	0	0	0	0	109.4	D190 T194	D190-V192 PolarHBondContact OD1-N 3.13Å; V192-T194 VanDerWaalsContact C-N 3.26Å; V192-T194 HydrophobicContact CB-CG2 4.35Å; V192-T194 HydrophobicContact CG1-CG2 3.8Å; V192-T194 PolarHBondContact O-N 3.26Å
193	L	96.1	Very high	95.7	Very high	22 Å²	22	39.1 Å²	39.1	12%	0.115	21%	0.212	C	C	.	.			trans	-74.4	71.4	-178.8	-62.2	-178	0	0	0	112.4	S181 F186 H191 D293 L294	S181-L193 PolarHBondContact N-O 3.11Å; F186-L193 HydrophobicContact CB-CD2 3.77Å; H191-L193 PolarHBondContact O-N 3.34Å; L193-D293 HydrophobicContact CD1-CB 4.32Å; L193-D293 HydrophobicContact CD2-CB 4.26Å; L193-D293 HydrophobicContact CG-CB 4.23Å; L193-L294 HydrophobicContact CD1-CB 4.12Å
194	T	96.4	Very high	95.8	Very high	47 Å²	47	39.6 Å²	39.6	29%	0.288	21%	0.213	S	C	.	.			trans	-137.5	154.5	-177.8	-171.8	0	0	0	0	112.4	S177 V192 Y203	S177-T194 PolarHBondContact OG-OG1 3.3Å; V192-T194 VanDerWaalsContact C-N 3.26Å; V192-T194 HydrophobicContact CB-CG2 4.35Å; V192-T194 HydrophobicContact CG1-CG2 3.8Å; V192-T194 PolarHBondContact O-N 3.26Å; T194-Y203 VanDerWaalsContact O-CE1 3.31Å; T194-Y203 WeakPolarHBondContact O-CE1 3.42Å; T194-Y203 PolarHBondContact O-OH 3.18Å
195	V	97.1	Very high	95.9	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.024	22%	0.219	C	C	.	.			trans	-107.7	124.9	179.9	-179.5	0	0	0	0	110.9	I156 A176 S177 A180 Y203	I156-V195 HydrophobicContact CD1-CG1 3.95Å; I156-V195 HydrophobicContact CD1-CG2 4.21Å; A176-V195 HydrophobicContact CB-CB 3.66Å; A176-V195 HydrophobicContact CB-CG1 3.75Å; A176-V195 HydrophobicContact CB-CG2 3.81Å; A176-V195 WeakPolarHBondContact O-CG2 3.29Å; S177-V195 PolarHBondContact OG-N 3.03Å; S177-V195 PolarHBondContact OG-O 3.47Å; A180-V195 HydrophobicContact CB-CG2 3.83Å; V195-Y203 WeakPolarHBondContact CA-OH 3.34Å; V195-Y203 HydrophobicContact CG1-CE2 4.47Å; V195-Y203 HydrophobicContact CG2-CD1 4.44Å; V195-Y203 HydrophobicContact CG2-CE1 3.99Å
196	K	96.4	Very high	95.8	Very high	82 Å²	82	41 Å²	41	36%	0.357	22%	0.219	S	C	.	.			trans	-99.2	134.4	174.3	-60.8	162.9	-167.1	161.7	0	107.9	G153 D190 D198 T201 Y203	G153-K196 VanDerWaalsContact CA-O 3.3Å; G153-K196 WeakPolarHBondContact CA-O 3.4Å; D190-K196 IonicContact OD2-NZ 3.54Å; D190-K196 PolarHBondContact OD2-NZ 3.13Å; K196-D198 VanDerWaalsContact C-N 3.33Å; K196-D198 WeakPolarHBondContact CB-OD2 3.5Å; K196-D198 PolarHBondContact O-N 3.28Å; K196-T201 HydrophobicContact CD-CG2 4.44Å; K196-Y203 PolarHBondContact N-OH 3.36Å
197	N	96.5	Very high	95.7	Very high	73 Å²	73	42.6 Å²	42.6	39%	0.39	23%	0.229	S	C	.	.	S	Bend	trans	-81.2	81.8	176	-175.6	13.5	0	0	0	110.5	S154 V157 V169 V173	S154-N197 WeakPolarHBondContact CA-OD1 3.46Å; S154-N197 WeakPolarHBondContact CB-OD1 3.28Å; S154-N197 PolarHBondContact OG-OD1 3.45Å; V157-N197 HydrophobicContact CG2-CB 4.05Å; V169-N197 VanDerWaalsContact CG1-ND2 3.32Å; V169-N197 WeakPolarHBondContact CG1-ND2 3.46Å; V173-N197 HydrophobicContact CG2-CB 3.72Å
198	D	96.1	Very high	95.5	Very high	27 Å²	27	44.9 Å²	44.9	14%	0.144	24%	0.244	C	C	.	.	S	Bend	trans	-149.2	165.1	175.2	73.7	67.3	0	0	0	112.3	G153 S154 K196 H200 T201	G153-D198 PolarHBondContact N-O 2.85Å; G153-D198 VanDerWaalsContact N-O 3.14Å; S154-D198 PolarHBondContact N-O 2.73Å; S154-D198 WeakPolarHBondContact OG-CA 3.41Å; S154-D198 PolarHBondContact OG-N 3.25Å; S154-D198 PolarHBondContact OG-O 3.48Å; K196-D198 VanDerWaalsContact C-N 3.33Å; K196-D198 WeakPolarHBondContact CB-OD2 3.5Å; K196-D198 PolarHBondContact O-N 3.28Å; D198-H200 VanDerWaalsContact CG-ND1 3.32Å; D198-H200 IonicContact OD1-CE1 3.74Å; D198-H200 PolarHBondContact OD1-CE1 3.43Å; D198-H200 IonicContact OD1-CG 2.72Å; D198-H200 PolarHBondContact OD1-N 3.09Å; D198-H200 IonicContact OD1-ND1 3.47Å; D198-H200 PolarHBondContact OD1-ND1 3.29Å; D198-H200 IonicContact OD2-CE1 3.51Å; D198-T201 WeakPolarHBondContact OD1-CB 3.36Å; D198-T201 PolarHBondContact OD1-N 3.17Å; D198-T201 PolarHBondContact OD1-OG1 2.93Å; D198-T201 WeakPolarHBondContact OD2-CB 3.31Å; D198-T201 PolarHBondContact OD2-OG1 3.23Å
199	G	94.5	Very high	95.3	Very high	49 Å²	49	48.5 Å²	48.5	51%	0.505	26%	0.259	S	S	.	.	S	Bend	trans	-93.7	11.9	-180	0	0	0	0	0	116.1	T152	T152-G199 WeakPolarHBondContact CG2-O 3.21Å
200	H	93.1	Very high	95.5	Very high	138 Å²	138	43.4 Å²	43.4	64%	0.639	23%	0.232	S	C	*	.	S	Bend	trans	-127.8	-22.5	-173.7	68.1	-75.7	0	0	0	114.5	D198 Y202	D198-H200 VanDerWaalsContact CG-ND1 3.32Å; D198-H200 IonicContact OD1-CE1 3.74Å; D198-H200 PolarHBondContact OD1-CE1 3.43Å; D198-H200 IonicContact OD1-CG 2.72Å; D198-H200 PolarHBondContact OD1-N 3.09Å; D198-H200 IonicContact OD1-ND1 3.47Å; D198-H200 PolarHBondContact OD1-ND1 3.29Å; D198-H200 IonicContact OD2-CE1 3.51Å; H200-Y202 WeakPolarHBondContact O-CE2 3.44Å
201	T	95.8	Very high	95.5	Very high	18 Å²	18	41.5 Å²	41.5	11%	0.11	22%	0.221	C	C	.	.	S	Bend	trans	-77.4	118.8	166.7	-54.6	0	0	0	0	108.7	G153 C187 K196 D198 Y203	G153-T201 PolarHBondContact N-O 3.5Å; C187-T201 WeakPolarHBondContact SG-CG2 3.39Å; K196-T201 HydrophobicContact CD-CG2 4.44Å; D198-T201 WeakPolarHBondContact OD1-CB 3.36Å; D198-T201 PolarHBondContact OD1-N 3.17Å; D198-T201 PolarHBondContact OD1-OG1 2.93Å; D198-T201 WeakPolarHBondContact OD2-CB 3.31Å; D198-T201 PolarHBondContact OD2-OG1 3.23Å; T201-Y203 HydrophobicContact CG2-CD2 4.34Å; T201-Y203 HydrophobicContact CG2-CE2 3.47Å; T201-Y203 VanDerWaalsContact CG2-CE2 3.47Å; T201-Y203 WeakPolarHBondContact CG2-OH 3.38Å; T201-Y203 WeakPolarHBondContact O-CD2 3.38Å
202	Y	96.7	Very high	95.2	Very high	56 Å²	56	40.1 Å²	40.1	22%	0.22	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	140.9	-178.4	-60.2	-62.2	0	0	0	112.7	V140 I147 F151 T152 I188 H200	V140-Y202 HydrophobicContact CG1-CE1 4.46Å; V140-Y202 HydrophobicContact CG1-CE2 4.48Å; V140-Y202 HydrophobicContact CG2-CD1 4.31Å; V140-Y202 HydrophobicContact CG2-CE1 3.91Å; I147-Y202 HydrophobicContact CD1-CD2 4.12Å; I147-Y202 HydrophobicContact CD1-CE2 4.3Å; F151-Y202 WeakPolarHBondContact O-CA 3.1Å; T152-Y202 HydrophobicContact CG2-CD1 4.14Å; T152-Y202 HydrophobicContact CG2-CE1 3.93Å; I188-Y202 HydrophobicContact CD1-CD2 4.26Å; I188-Y202 HydrophobicContact CD1-CG 4.42Å; I188-Y202 PolarHBondContact N-O 2.94Å; H200-Y202 WeakPolarHBondContact O-CE2 3.44Å
203	Y	98.1	Very high	94.9	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	156.3	-176	-70.5	-87.8	0	0	0	111.9	T150 F151 I156 I185 F186 C187 T194 V195 K196 T201	T150-Y203 WeakPolarHBondContact CA-O 3.32Å; F151-Y203 PolarHBondContact N-O 2.9Å; F151-Y203 VanDerWaalsContact N-O 3.13Å; F151-Y203 PolarHBondContact O-N 3.29Å; I156-Y203 HydrophobicContact CD1-CD1 4.33Å; I156-Y203 HydrophobicContact CD1-CD2 4.04Å; I156-Y203 HydrophobicContact CD1-CG 3.86Å; I185-Y203 HydrophobicContact CG2-CD1 4Å; I185-Y203 HydrophobicContact CG2-CG 4.43Å; F186-Y203 CarbonylContact O-C 3.59Å; F186-Y203 VanDerWaalsContact O-CA 3.28Å; F186-Y203 WeakPolarHBondContact O-CA 3.21Å; F186-Y203 WeakPolarHBondContact O-CD1 3.4Å; C187-Y203 HydrophobicContact CB-CD1 4.19Å; C187-Y203 HydrophobicContact CB-CE1 3.7Å; T194-Y203 VanDerWaalsContact O-CE1 3.31Å; T194-Y203 WeakPolarHBondContact O-CE1 3.42Å; T194-Y203 PolarHBondContact O-OH 3.18Å; V195-Y203 WeakPolarHBondContact CA-OH 3.34Å; V195-Y203 HydrophobicContact CG1-CE2 4.47Å; V195-Y203 HydrophobicContact CG2-CD1 4.44Å; V195-Y203 HydrophobicContact CG2-CE1 3.99Å; K196-Y203 PolarHBondContact N-OH 3.36Å; T201-Y203 HydrophobicContact CG2-CD2 4.34Å; T201-Y203 HydrophobicContact CG2-CE2 3.47Å; T201-Y203 VanDerWaalsContact CG2-CE2 3.47Å; T201-Y203 WeakPolarHBondContact CG2-OH 3.38Å; T201-Y203 WeakPolarHBondContact O-CD2 3.38Å
204	R	97.7	Very high	94.4	Very high	12 Å²	12	45.1 Å²	45.1	5%	0.045	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	151.7	176.1	-71.2	179.4	-175.2	-62.9	-8.1	111	P148 S149 T150 I185 F186 I188 S286	P148-R204 VanDerWaalsContact O-CZ 3.23Å; P148-R204 PolarHBondContact O-NH1 3.34Å; P148-R204 PolarHBondContact O-NH2 2.92Å; S149-R204 PolarHBondContact O-NH1 3.28Å; T150-R204 HydrophobicContact CG2-CG 3.98Å; I185-R204 VanDerWaalsContact CA-O 3.29Å; I185-R204 WeakPolarHBondContact CA-O 3.36Å; F186-R204 HydrophobicContact CD1-CB 4.33Å; F186-R204 HydrophobicContact CD2-CB 4.33Å; F186-R204 HydrophobicContact CE1-CB 3.78Å; F186-R204 HydrophobicContact CE2-CB 3.8Å; F186-R204 HydrophobicContact CE2-CG 4.25Å; F186-R204 HydrophobicContact CZ-CB 3.49Å; F186-R204 VanDerWaalsContact CZ-CB 3.49Å; F186-R204 HydrophobicContact CZ-CG 4.21Å; F186-R204 PolarHBondContact N-O 3Å; F186-R204 PolarHBondContact O-N 3.12Å; I188-R204 HydrophobicContact CG2-CG 3.56Å; R204-S286 WeakPolarHBondContact CD-OG 3.36Å; R204-S286 PolarHBondContact NE-OG 3.37Å
205	F	97.8	Very high	93.2	Very high	26 Å²	26	44.4 Å²	44.4	11%	0.114	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	141.7	160.9	-64.8	-68.3	0	0	0	110.7	V125 M128 I129 I135 V137 F151 I185 Q287	V125-F205 HydrophobicContact CG1-CD1 4.22Å; V125-F205 HydrophobicContact CG1-CE1 4.49Å; M128-F205 HydrophobicContact CB-CE1 3.88Å; M128-F205 HydrophobicContact CB-CZ 3.89Å; M128-F205 WeakPolarHBondContact O-CZ 3.25Å; I129-F205 HydrophobicContact CD1-CB 4.19Å; I129-F205 HydrophobicContact CD1-CD1 3.92Å; I129-F205 HydrophobicContact CD1-CD2 4.22Å; I129-F205 HydrophobicContact CD1-CE1 4.35Å; I129-F205 HydrophobicContact CD1-CG 3.86Å; I129-F205 HydrophobicContact CG1-CD1 3.82Å; I129-F205 HydrophobicContact CG1-CD2 3.66Å; I129-F205 HydrophobicContact CG1-CE1 3.8Å; I129-F205 HydrophobicContact CG1-CE2 3.65Å; I129-F205 HydrophobicContact CG1-CG 3.76Å; I129-F205 HydrophobicContact CG1-CZ 3.72Å; I135-F205 HydrophobicContact CB-CZ 4.28Å; I135-F205 HydrophobicContact CD1-CZ 4.23Å; V137-F205 HydrophobicContact CG2-CD2 4.37Å; V137-F205 HydrophobicContact CG2-CE2 3.99Å; F151-F205 HydrophobicContact CD1-CD2 4.36Å; F151-F205 HydrophobicContact CD1-CE2 4.1Å; F151-F205 HydrophobicContact CE1-CD1 4.42Å; F151-F205 AromaticContact CE1-CD2 3.39Å; F151-F205 HydrophobicContact CE1-CD2 3.39Å; F151-F205 HydrophobicContact CE1-CE1 4.44Å; F151-F205 AromaticContact CE1-CE2 3.41Å; F151-F205 HydrophobicContact CE1-CE2 3.41Å; F151-F205 VanDerWaalsContact CE1-CE2 3.41Å; F151-F205 AromaticContact CE1-CG 3.93Å; F151-F205 HydrophobicContact CE1-CG 3.93Å; F151-F205 AromaticContact CE1-CZ 3.96Å; F151-F205 HydrophobicContact CE1-CZ 3.96Å; F151-F205 HydrophobicContact CZ-CD1 4.04Å; F151-F205 AromaticContact CZ-CD2 3.85Å; F151-F205 HydrophobicContact CZ-CD2 3.85Å; F151-F205 AromaticContact CZ-CE1 3.97Å; F151-F205 HydrophobicContact CZ-CE1 3.97Å; F151-F205 AromaticContact CZ-CE2 3.77Å; F151-F205 HydrophobicContact CZ-CE2 3.77Å; F151-F205 AromaticContact CZ-CG 3.97Å; F151-F205 HydrophobicContact CZ-CG 3.97Å; F151-F205 AromaticContact CZ-CZ 3.83Å; F151-F205 HydrophobicContact CZ-CZ 3.83Å; I185-F205 HydrophobicContact CD1-CD1 4.21Å; I185-F205 HydrophobicContact CD1-CE1 3.86Å; I185-F205 HydrophobicContact CG1-CD1 3.79Å; I185-F205 HydrophobicContact CG1-CE1 3.98Å; F205-Q287 PolarHBondContact O-NE2 3.27Å
206	Q	96.9	Very high	91.7	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.019	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-71.7	148.8	169.6	-176.5	56.8	-74.1	0	0	110.8	G183 Y184 F186 L210 Y211 Q287	G183-Q206 WeakPolarHBondContact O-CB 3.24Å; G183-Q206 WeakPolarHBondContact O-CG 3.23Å; Y184-Q206 PolarHBondContact O-N 2.69Å; F186-Q206 HydrophobicContact CD1-CB 4.45Å; F186-Q206 HydrophobicContact CE1-CB 4.31Å; Q206-L210 HydrophobicContact CG-CB 3.98Å; Q206-Y211 HydrophobicContact CB-CD1 4.39Å; Q206-Y211 HydrophobicContact CB-CE1 4.18Å; Q206-Y211 HydrophobicContact CG-CD1 4.23Å; Q206-Y211 HydrophobicContact CG-CE1 4.48Å; Q206-Q287 PolarHBondContact NE2-O 3.29Å; Q206-Q287 VanDerWaalsContact OE1-CB 3.3Å
207	T	94.8	Very high	90.5	Very high	34 Å²	34	51.1 Å²	51.1	21%	0.209	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-68.3	134.5	172.6	177	0	0	0	0	109.4	F209 L210	T207-F209 HydrophobicContact CG2-CB 4.4Å; T207-F209 PolarHBondContact O-N 3.39Å; T207-L210 HydrophobicContact CG2-CB 4.06Å; T207-L210 HydrophobicContact CG2-CD1 3.77Å; T207-L210 HydrophobicContact CG2-CG 3.77Å; T207-L210 PolarHBondContact O-N 3.22Å
208	P	93.7	Very high	89.9	Confident	54 Å²	54	48.3 Å²	48.3	35%	0.351	25%	0.25	S	S	.	.	G	3₁₀ helix	trans	-56.8	-13.5	178.8	-28.4	35.2	0	0	0	115.1	Y211 R214	P208-Y211 HydrophobicContact CB-CD2 4.1Å; P208-Y211 HydrophobicContact CB-CE1 4.45Å; P208-Y211 HydrophobicContact CB-CE2 3.82Å; P208-Y211 HydrophobicContact CG-CE1 4.41Å; P208-Y211 HydrophobicContact CG-CE2 4.09Å; P208-R214 WeakPolarHBondContact O-CD 3.08Å; P208-R214 PolarHBondContact O-NE 3.12Å; P208-R214 PolarHBondContact O-NH1 2.94Å
209	F	89.9	Confident	89.6	Confident	94 Å²	94	51 Å²	51	41%	0.412	26%	0.264	S	S	.	.	G	3₁₀ helix	trans	-68.3	-36.7	171.2	-171	-84.2	0	0	0	112.7	V13 T207 Y211	V13-F209 HydrophobicContact CB-CE1 4.07Å; V13-F209 HydrophobicContact CB-CE2 4.41Å; V13-F209 HydrophobicContact CB-CZ 3.92Å; V13-F209 HydrophobicContact CG1-CE1 3.58Å; V13-F209 HydrophobicContact CG1-CE2 4.34Å; V13-F209 HydrophobicContact CG1-CZ 3.43Å; V13-F209 VanDerWaalsContact CG1-CZ 3.43Å; V13-F209 HydrophobicContact CG2-CD1 4.03Å; V13-F209 HydrophobicContact CG2-CE1 3.81Å; V13-F209 HydrophobicContact CG2-CZ 4.14Å; T207-F209 HydrophobicContact CG2-CB 4.4Å; T207-F209 PolarHBondContact O-N 3.39Å; F209-Y211 VanDerWaalsContact C-N 3.35Å
210	L	93.4	Very high	89.5	Confident	33 Å²	33	50.5 Å²	50.5	17%	0.173	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	-96.2	21.2	-176.7	-62.4	175.8	0	0	0	112.6	Q206 T207 Y291	Q206-L210 HydrophobicContact CG-CB 3.98Å; T207-L210 HydrophobicContact CG2-CB 4.06Å; T207-L210 HydrophobicContact CG2-CD1 3.77Å; T207-L210 HydrophobicContact CG2-CG 3.77Å; T207-L210 PolarHBondContact O-N 3.22Å; L210-Y291 HydrophobicContact CB-CD2 4.11Å; L210-Y291 HydrophobicContact CD2-CD2 3.88Å; L210-Y291 HydrophobicContact CD2-CE2 4.28Å; L210-Y291 HydrophobicContact CD2-CG 4.08Å; L210-Y291 HydrophobicContact CG-CD2 4.48Å
211	Y	93.6	Very high	89.6	Confident	2 Å²	2	45.2 Å²	45.2	1%	0.008	23%	0.232	C	C	.	.			trans	-72.3	144.6	173.5	-74.6	-2.5	0	0	0	111.2	E122 V125 Y184 Q206 P208 F209 S213 R214 C215	E122-Y211 HydrophobicContact CG-CD2 3.66Å; E122-Y211 HydrophobicContact CG-CE2 3.77Å; E122-Y211 WeakPolarHBondContact OE2-CD2 3.4Å; V125-Y211 WeakPolarHBondContact CG1-OH 3.5Å; Y184-Y211 AromaticContact CD1-CD1 3.82Å; Y184-Y211 HydrophobicContact CD1-CD1 3.82Å; Y184-Y211 HydrophobicContact CD1-CD2 4.26Å; Y184-Y211 AromaticContact CD1-CE1 3.73Å; Y184-Y211 HydrophobicContact CD1-CE1 3.73Å; Y184-Y211 HydrophobicContact CD1-CE2 4.17Å; Y184-Y211 HydrophobicContact CD1-CG 4.09Å; Y184-Y211 AromaticContact CD1-CZ 3.9Å; Y184-Y211 AromaticContact CE1-CD1 3.98Å; Y184-Y211 HydrophobicContact CE1-CD1 3.98Å; Y184-Y211 AromaticContact CE1-CD2 3.79Å; Y184-Y211 HydrophobicContact CE1-CD2 3.79Å; Y184-Y211 HydrophobicContact CE1-CE1 4.22Å; Y184-Y211 HydrophobicContact CE1-CE2 4.03Å; Y184-Y211 AromaticContact CE1-CG 3.75Å; Y184-Y211 HydrophobicContact CE1-CG 3.75Å; Q206-Y211 HydrophobicContact CB-CD1 4.39Å; Q206-Y211 HydrophobicContact CB-CE1 4.18Å; Q206-Y211 HydrophobicContact CG-CD1 4.23Å; Q206-Y211 HydrophobicContact CG-CE1 4.48Å; P208-Y211 HydrophobicContact CB-CD2 4.1Å; P208-Y211 HydrophobicContact CB-CE1 4.45Å; P208-Y211 HydrophobicContact CB-CE2 3.82Å; P208-Y211 HydrophobicContact CG-CE1 4.41Å; P208-Y211 HydrophobicContact CG-CE2 4.09Å; F209-Y211 VanDerWaalsContact C-N 3.35Å; Y211-S213 PolarHBondContact O-N 3.34Å; Y211-S213 VanDerWaalsContact O-N 3.13Å; Y211-R214 PolarHBondContact O-N 3.09Å; Y211-C215 PolarHBondContact O-N 3.42Å
212	P	89.7	Confident	89.5	Confident	10 Å²	10	46.9 Å²	46.9	7%	0.065	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-35.3	-176.3	-20.4	27.1	0	0	0	113.5	M182 Y184 R214 C215 M216 L294	M182-P212 WeakPolarHBondContact O-CG 3.4Å; Y184-P212 HydrophobicContact CE2-CG 4.48Å; P212-R214 PolarHBondContact O-N 2.76Å; P212-R214 VanDerWaalsContact O-N 3.11Å; P212-C215 CarbonylContact O-C 3.58Å; P212-M216 WeakPolarHBondContact O-CG 3.4Å; P212-M216 VanDerWaalsContact O-SD 3.36Å; P212-L294 HydrophobicContact CB-CD2 4.47Å; P212-L294 HydrophobicContact CG-CD2 3.88Å
213	S	89.3	Confident	89.5	Confident	40 Å²	40	44.5 Å²	44.5	28%	0.28	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-15.8	178.6	57.4	0	0	0	0	114.9	E122 Y211	E122-S213 WeakPolarHBondContact OE1-CB 3.39Å; E122-S213 PolarHBondContact OE1-OG 3.08Å; Y211-S213 PolarHBondContact O-N 3.34Å; Y211-S213 VanDerWaalsContact O-N 3.13Å
214	R	85.4	Confident	89.4	Confident	144 Å²	144	44.5 Å²	44.5	54%	0.543	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-26.9	-175	-50.5	-172.4	-163.6	175	1.3	112.7	E122 P208 Y211 P212	E122-R214 IonicContact OE2-CZ 3.5Å; E122-R214 IonicContact OE2-NE 3.32Å; E122-R214 IonicContact OE2-NH2 2.74Å; E122-R214 PolarHBondContact OE2-NH2 2.93Å; P208-R214 WeakPolarHBondContact O-CD 3.08Å; P208-R214 PolarHBondContact O-NE 3.12Å; P208-R214 PolarHBondContact O-NH1 2.94Å; Y211-R214 PolarHBondContact O-N 3.09Å; P212-R214 PolarHBondContact O-N 2.76Å; P212-R214 VanDerWaalsContact O-N 3.11Å
215	C	70.6	Confident	89.4	Confident	32 Å²	32	44.2 Å²	44.2	22%	0.216	23%	0.23	C	C	.	.			trans	-130.5	84.5	178.8	-165.9	0	0	0	0	109.9	Y211 P212 Y291 H295	Y211-C215 PolarHBondContact O-N 3.42Å; P212-C215 CarbonylContact O-C 3.58Å; C215-Y291 HydrophobicContact CB-CE2 4.11Å; C215-Y291 PolarHBondContact SG-OH 3.19Å; C215-H295 PolarHBondContact O-CE1 2.94Å; C215-H295 PolarHBondContact O-NE2 3.06Å
216	M	65.5	Low	89.3	Confident	69 Å²	69	43.2 Å²	43.2	34%	0.34	23%	0.226	S	C	.	.			trans	-83	-27	179.5	-83.5	-58.2	-49.1	0	0	113.9	W118 P212 I307	W118-M216 HydrophobicContact CH2-CE 4.39Å; W118-M216 HydrophobicContact CH2-CG 3.94Å; W118-M216 HydrophobicContact CH2-SD 3.31Å; W118-M216 WeakPolarHBondContact CH2-SD 3.39Å; W118-M216 HydrophobicContact CZ2-CE 4.41Å; W118-M216 HydrophobicContact CZ2-SD 3.41Å; W118-M216 WeakPolarHBondContact CZ2-SD 3.49Å; W118-M216 HydrophobicContact CZ3-SD 4.4Å; P212-M216 WeakPolarHBondContact O-CG 3.4Å; P212-M216 VanDerWaalsContact O-SD 3.36Å; M216-I307 HydrophobicContact CE-CD1 4.21Å
217	E	71.5	Confident	89.2	Confident	159 Å²	159	43 Å²	43	74%	0.743	23%	0.225	S	C	*	.			trans	-114.5	94.8	-172.1	-67.7	175.5	160.5	0	0	109
218	A	83.5	Confident	89.2	Confident	14 Å²	14	41.5 Å²	41.5	12%	0.116	22%	0.216	C	C	.	.			trans	-90.1	113	173.7	0	0	0	0	0	109.5	Y291 W292 H295 R296	A218-Y291 HydrophobicContact CB-CE1 4.44Å; A218-Y291 VanDerWaalsContact CB-OH 3.25Å; A218-Y291 WeakPolarHBondContact CB-OH 3.43Å; A218-W292 HydrophobicContact CB-CH2 4.34Å; A218-W292 HydrophobicContact CB-CZ3 3.89Å; A218-H295 HydrophobicContact CB-CB 3.7Å; A218-R296 PolarHBondContact O-NH2 3.16Å
219	D	89.8	Confident	89.3	Confident	83 Å²	83	39 Å²	39	44%	0.444	20%	0.199	S	C	.	.			trans	-71.7	151.3	-176.1	-164.8	7	0	0	0	112.3	A221 D222 Y223	D219-A221 PolarHBondContact OD1-N 3.46Å; D219-A221 WeakPolarHBondContact OD2-CB 3.42Å; D219-D222 HydrophobicContact CB-CB 4.34Å; D219-Y223 PolarHBondContact O-N 3.29Å
220	T	93.8	Very high	89.4	Confident	38 Å²	38	36.1 Å²	36.1	23%	0.233	19%	0.186	C	C	.	.	H	α-helix	trans	-76.6	-24.2	174.4	-58.4	0	0	0	0	111.9	A224 L251 Y255 R296	T220-A224 PolarHBondContact O-N 2.85Å; T220-L251 HydrophobicContact CG2-CD2 3.38Å; T220-Y255 HydrophobicContact CG2-CE2 4.24Å; T220-R296 PolarHBondContact OG1-NH2 3.43Å
221	A	94.2	Very high	89.3	Confident	27 Å²	27	36.9 Å²	36.9	22%	0.223	19%	0.192	C	C	.	.	H	α-helix	trans	-69.5	-47.6	169.5	0	0	0	0	0	111.6	D219 Y223 A224 V225 Y255	D219-A221 PolarHBondContact OD1-N 3.46Å; D219-A221 WeakPolarHBondContact OD2-CB 3.42Å; A221-Y223 VanDerWaalsContact C-N 3.28Å; A221-Y223 PolarHBondContact O-N 3.48Å; A221-A224 WeakPolarHBondContact O-CA 3.38Å; A221-A224 WeakPolarHBondContact O-CB 3.49Å; A221-A224 PolarHBondContact O-N 2.94Å; A221-V225 PolarHBondContact O-N 3.04Å; A221-Y255 PolarHBondContact N-OH 3.31Å
222	D	94.1	Very high	89.1	Confident	54 Å²	54	38.9 Å²	38.9	29%	0.289	20%	0.202	S	C	.	.	H	α-helix	trans	-59.6	-38.1	175.8	-68.4	-30.9	0	0	0	111.9	D219 A224 V225 Y226 W292	D219-D222 HydrophobicContact CB-CB 4.34Å; D222-A224 VanDerWaalsContact C-N 3.31Å; D222-A224 PolarHBondContact O-N 3.2Å; D222-V225 WeakPolarHBondContact O-CB 3.47Å; D222-V225 PolarHBondContact O-N 2.77Å; D222-Y226 PolarHBondContact O-N 3.17Å; D222-W292 HydrophobicContact CB-CH2 3.87Å; D222-W292 HydrophobicContact CB-CZ2 4.03Å
223	Y	96.1	Very high	88.6	Confident	6 Å²	6	42.4 Å²	42.4	2%	0.024	22%	0.217	C	C	.	.	H	α-helix	trans	-65.1	-34.3	174.8	-168.6	-133.3	0	0	0	112.8	D219 A221 Y226 L227 R247 L251 W292 R296	D219-Y223 PolarHBondContact O-N 3.29Å; A221-Y223 VanDerWaalsContact C-N 3.28Å; A221-Y223 PolarHBondContact O-N 3.48Å; Y223-Y226 AromaticContact CD2-CD1 3.78Å; Y223-Y226 HydrophobicContact CD2-CD1 3.78Å; Y223-Y226 AromaticContact CE2-CD1 3.72Å; Y223-Y226 HydrophobicContact CE2-CD1 3.72Å; Y223-Y226 HydrophobicContact CE2-CE1 4.05Å; Y223-Y226 PolarHBondContact O-N 3.36Å; Y223-L227 HydrophobicContact CD1-CD1 4.07Å; Y223-L227 HydrophobicContact CD2-CG 4.27Å; Y223-L227 HydrophobicContact CE1-CD1 3.65Å; Y223-L227 HydrophobicContact CE1-CG 4.33Å; Y223-L227 HydrophobicContact CE2-CD1 4.16Å; Y223-L227 HydrophobicContact CE2-CD2 4.1Å; Y223-L227 HydrophobicContact CE2-CG 3.95Å; Y223-L227 WeakPolarHBondContact O-CG 3.44Å; Y223-L227 PolarHBondContact O-N 2.9Å; Y223-R247 HydrophobicContact CD1-CG 4.4Å; Y223-R247 HydrophobicContact CE1-CG 3.79Å; Y223-L251 HydrophobicContact CD1-CD1 3.97Å; Y223-W292 HydrophobicContact CD2-CB 4.36Å; Y223-W292 AromaticContact CD2-CD2 3.5Å; Y223-W292 HydrophobicContact CD2-CD2 3.5Å; Y223-W292 VanDerWaalsContact CD2-CD2 3.5Å; Y223-W292 AromaticContact CD2-CE3 3.31Å; Y223-W292 HydrophobicContact CD2-CE3 3.31Å; Y223-W292 AromaticContact CD2-CG 3.97Å; Y223-W292 HydrophobicContact CD2-CG 3.97Å; Y223-W292 HydrophobicContact CD2-CH2 4.36Å; Y223-W292 HydrophobicContact CD2-CZ2 4.5Å; Y223-W292 AromaticContact CD2-CZ3 3.79Å; Y223-W292 HydrophobicContact CD2-CZ3 3.79Å; Y223-W292 HydrophobicContact CE2-CB 4.01Å; Y223-W292 HydrophobicContact CE2-CD2 4.08Å; Y223-W292 HydrophobicContact CE2-CE3 4.01Å; Y223-W292 HydrophobicContact CE2-CG 4.1Å; Y223-W292 HydrophobicContact CG-CD2 4.47Å; Y223-W292 AromaticContact CG-CE3 3.94Å; Y223-W292 HydrophobicContact CG-CE3 3.94Å; Y223-W292 HydrophobicContact CG-CH2 4.5Å; Y223-W292 AromaticContact CG-CZ3 3.96Å; Y223-W292 HydrophobicContact CG-CZ3 3.96Å; Y223-R296 HydrophobicContact CD1-CG 3.86Å; Y223-R296 HydrophobicContact CD2-CG 4.2Å; Y223-R296 HydrophobicContact CE1-CB 3.99Å; Y223-R296 HydrophobicContact CE1-CG 3.8Å; Y223-R296 HydrophobicContact CE2-CB 4.19Å; Y223-R296 HydrophobicContact CE2-CG 4.16Å; Y223-R296 HydrophobicContact CG-CG 4.06Å
224	A	97.1	Very high	87.7	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.4	-37.9	173.3	0	0	0	0	0	111.8	T220 A221 D222 C228 L251 Y255 W259 I262	T220-A224 PolarHBondContact O-N 2.85Å; A221-A224 WeakPolarHBondContact O-CA 3.38Å; A221-A224 WeakPolarHBondContact O-CB 3.49Å; A221-A224 PolarHBondContact O-N 2.94Å; D222-A224 VanDerWaalsContact C-N 3.31Å; D222-A224 PolarHBondContact O-N 3.2Å; A224-C228 WeakPolarHBondContact O-CB 3.25Å; A224-C228 PolarHBondContact O-N 3.1Å; A224-L251 HydrophobicContact CB-CB 4.15Å; A224-L251 HydrophobicContact CB-CD1 4.11Å; A224-L251 HydrophobicContact CB-CD2 4.49Å; A224-L251 HydrophobicContact CB-CG 4.48Å; A224-Y255 HydrophobicContact CB-CD2 4.32Å; A224-Y255 HydrophobicContact CB-CE2 4.47Å; A224-W259 HydrophobicContact CB-CZ3 4.37Å; A224-I262 HydrophobicContact CB-CD1 4.14Å; A224-I262 HydrophobicContact CB-CG2 4.09Å
225	V	96.4	Very high	86.4	Confident	5 Å²	5	46.4 Å²	46.4	3%	0.03	24%	0.236	C	C	.	.	H	α-helix	trans	-62.3	-47.3	172.1	175.8	0	0	0	0	110.6	A221 D222 C228 K229 I262 Q265 A266	A221-V225 PolarHBondContact O-N 3.04Å; D222-V225 WeakPolarHBondContact O-CB 3.47Å; D222-V225 PolarHBondContact O-N 2.77Å; V225-C228 PolarHBondContact O-N 3.14Å; V225-K229 VanDerWaalsContact O-CB 3.29Å; V225-K229 WeakPolarHBondContact O-CB 3.31Å; V225-K229 PolarHBondContact O-N 3.5Å; V225-I262 HydrophobicContact CG2-CG2 3.94Å; V225-Q265 HydrophobicContact CG1-CB 4.28Å; V225-Q265 HydrophobicContact CG1-CG 3.85Å; V225-Q265 HydrophobicContact CG2-CB 4.3Å; V225-Q265 HydrophobicContact CG2-CG 4.28Å; V225-A266 HydrophobicContact CG1-CB 4.12Å
226	Y	95.7	Very high	85.5	Confident	5 Å²	5	54 Å²	54	2%	0.02	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-51.5	177.7	166.8	-104.5	0	0	0	113.1	D222 Y223 C228 K229 R230 E288 R289 W292	D222-Y226 PolarHBondContact O-N 3.17Å; Y223-Y226 AromaticContact CD2-CD1 3.78Å; Y223-Y226 HydrophobicContact CD2-CD1 3.78Å; Y223-Y226 AromaticContact CE2-CD1 3.72Å; Y223-Y226 HydrophobicContact CE2-CD1 3.72Å; Y223-Y226 HydrophobicContact CE2-CE1 4.05Å; Y223-Y226 PolarHBondContact O-N 3.36Å; Y226-C228 VanDerWaalsContact C-N 3.33Å; Y226-C228 PolarHBondContact O-N 2.93Å; Y226-K229 WeakPolarHBondContact O-CB 3.37Å; Y226-K229 PolarHBondContact O-N 3.33Å; Y226-R230 HydrophobicContact CE2-CG 4.24Å; Y226-R230 PolarHBondContact O-N 3.46Å; Y226-R230 VanDerWaalsContact OH-CD 3.22Å; Y226-R230 WeakPolarHBondContact OH-CD 3.45Å; Y226-R230 PolarHBondContact OH-NH1 3.5Å; Y226-E288 HydrophobicContact CD2-CG 3.85Å; Y226-E288 WeakPolarHBondContact CD2-OE1 3.24Å; Y226-E288 HydrophobicContact CE2-CG 3.83Å; Y226-R289 WeakPolarHBondContact OH-CA 3.29Å; Y226-R289 WeakPolarHBondContact OH-CB 3.34Å; Y226-W292 HydrophobicContact CD1-CB 4.3Å; Y226-W292 AromaticContact CD1-CD1 3.45Å; Y226-W292 VanDerWaalsContact CD1-CD1 3.45Å; Y226-W292 HydrophobicContact CD1-CD2 4.32Å; Y226-W292 AromaticContact CD1-CG 3.77Å; Y226-W292 HydrophobicContact CD1-CG 3.77Å; Y226-W292 AromaticContact CD1-NE1 3.81Å; Y226-W292 AromaticContact CD2-CD1 3.37Å; Y226-W292 HydrophobicContact CD2-CG 4.42Å; Y226-W292 AromaticContact CD2-NE1 3.46Å; Y226-W292 HydrophobicContact CE1-CB 3.93Å; Y226-W292 AromaticContact CE1-CD1 3.6Å; Y226-W292 AromaticContact CE1-CG 3.85Å; Y226-W292 HydrophobicContact CE1-CG 3.85Å; Y226-W292 AromaticContact CE2-CD1 3.51Å; Y226-W292 HydrophobicContact CE2-CG 4.48Å; Y226-W292 AromaticContact CG-CD1 3.32Å; Y226-W292 HydrophobicContact CG-CD2 4.47Å; Y226-W292 HydrophobicContact CG-CG 4.06Å; Y226-W292 AromaticContact CG-NE1 3.28Å; Y226-W292 VanDerWaalsContact CG-NE1 3.28Å; Y226-W292 AromaticContact CZ-CD1 3.61Å
227	L	95.9	Very high	85	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-39.9	179.3	-70.2	179.8	0	0	0	111.5	Y223 R230 T231 L240 E244 L248 L251	Y223-L227 HydrophobicContact CD1-CD1 4.07Å; Y223-L227 HydrophobicContact CD2-CG 4.27Å; Y223-L227 HydrophobicContact CE1-CD1 3.65Å; Y223-L227 HydrophobicContact CE1-CG 4.33Å; Y223-L227 HydrophobicContact CE2-CD1 4.16Å; Y223-L227 HydrophobicContact CE2-CD2 4.1Å; Y223-L227 HydrophobicContact CE2-CG 3.95Å; Y223-L227 WeakPolarHBondContact O-CG 3.44Å; Y223-L227 PolarHBondContact O-N 2.9Å; L227-R230 PolarHBondContact O-N 3.32Å; L227-T231 PolarHBondContact O-N 2.82Å; L227-L240 HydrophobicContact CD2-CD2 4.06Å; L227-E244 HydrophobicContact CD2-CB 3.89Å; L227-E244 HydrophobicContact CD2-CG 4.32Å; L227-L248 HydrophobicContact CB-CB 4.36Å; L227-L248 HydrophobicContact CB-CD1 3.97Å; L227-L248 HydrophobicContact CD1-CB 4.15Å; L227-L251 HydrophobicContact CD1-CD1 4Å
228	C	95	Very high	84.5	Confident	3 Å²	3	57.4 Å²	57.4	2%	0.02	28%	0.28	C	S	.	.	H	α-helix	trans	-60.1	-47.8	173.3	-169.6	0	0	0	0	111.2	A224 V225 Y226 R230 T231 W259 I262 A266	A224-C228 WeakPolarHBondContact O-CB 3.25Å; A224-C228 PolarHBondContact O-N 3.1Å; V225-C228 PolarHBondContact O-N 3.14Å; Y226-C228 VanDerWaalsContact C-N 3.33Å; Y226-C228 PolarHBondContact O-N 2.93Å; C228-R230 VanDerWaalsContact C-N 3.32Å; C228-R230 PolarHBondContact O-N 3.2Å; C228-T231 PolarHBondContact O-N 3.41Å; C228-T231 VanDerWaalsContact O-N 3.09Å; C228-T231 PolarHBondContact O-OG1 3.4Å; C228-W259 HydrophobicContact CB-CH2 4.16Å; C228-W259 HydrophobicContact CB-CZ2 4.24Å; C228-I262 HydrophobicContact CB-CG2 4.44Å; C228-A266 HydrophobicContact CB-CB 3.82Å
229	K	94.2	Very high	84.1	Confident	1 Å²	1	61 Å²	61	0%	0.004	29%	0.294	C	S	.	.	H	α-helix	trans	-56.2	-42.8	177.1	179.4	172	65.1	-176.8	0	111.9	V225 Y226 T231 M232 A266 E269 A270 E288	V225-K229 VanDerWaalsContact O-CB 3.29Å; V225-K229 WeakPolarHBondContact O-CB 3.31Å; V225-K229 PolarHBondContact O-N 3.5Å; Y226-K229 WeakPolarHBondContact O-CB 3.37Å; Y226-K229 PolarHBondContact O-N 3.33Å; K229-T231 VanDerWaalsContact C-N 3.34Å; K229-T231 PolarHBondContact O-N 2.92Å; K229-M232 WeakPolarHBondContact O-CB 3.47Å; K229-M232 PolarHBondContact O-N 3.44Å; K229-A266 HydrophobicContact CB-CB 4.08Å; K229-E269 HydrophobicContact CD-CB 3.69Å; K229-E269 IonicContact NZ-OE2 3.73Å; K229-E269 PolarHBondContact NZ-OE2 2.9Å; K229-A270 HydrophobicContact CG-CB 4.36Å; K229-E288 WeakPolarHBondContact CE-OE1 3.34Å; K229-E288 WeakPolarHBondContact CE-OE2 3.37Å; K229-E288 IonicContact NZ-OE1 2.77Å; K229-E288 PolarHBondContact NZ-OE1 3.32Å; K229-E288 IonicContact NZ-OE2 2.74Å; K229-E288 PolarHBondContact NZ-OE2 3.37Å
230	R	92.8	Very high	84.1	Confident	34 Å²	34	58.6 Å²	58.6	13%	0.128	28%	0.282	C	S	.	.	H	α-helix	trans	-62.7	-34.9	176.6	-81.2	-177.8	60.1	-160.2	-13.8	113.8	Y226 L227 C228 M232 Q233 E239 L240 E244	Y226-R230 HydrophobicContact CE2-CG 4.24Å; Y226-R230 PolarHBondContact O-N 3.46Å; Y226-R230 VanDerWaalsContact OH-CD 3.22Å; Y226-R230 WeakPolarHBondContact OH-CD 3.45Å; Y226-R230 PolarHBondContact OH-NH1 3.5Å; L227-R230 PolarHBondContact O-N 3.32Å; C228-R230 VanDerWaalsContact C-N 3.32Å; C228-R230 PolarHBondContact O-N 3.2Å; R230-M232 PolarHBondContact O-N 3.28Å; R230-Q233 PolarHBondContact O-N 3.17Å; R230-E239 PolarHBondContact NH2-O 3.45Å; R230-L240 HydrophobicContact CB-CD2 3.76Å; R230-E244 IonicContact CZ-OE1 3.5Å; R230-E244 IonicContact CZ-OE2 3.51Å; R230-E244 VanDerWaalsContact NH1-CD 3.29Å; R230-E244 IonicContact NH1-OE1 2.74Å; R230-E244 PolarHBondContact NH1-OE1 2.76Å; R230-E244 IonicContact NH1-OE2 2.69Å; R230-E244 PolarHBondContact NH1-OE2 2.72Å; R230-E244 IonicContact NH2-OE1 3.75Å; R230-E244 IonicContact NH2-OE2 3.21Å; R230-E244 PolarHBondContact NH2-OE2 3.41Å
231	T	91.9	Very high	84.1	Confident	49 Å²	49	58.1 Å²	58.1	30%	0.301	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-18.6	173.3	69.8	0	0	0	0	113.8	L227 C228 K229 L238 L240 L248	L227-T231 PolarHBondContact O-N 2.82Å; C228-T231 PolarHBondContact O-N 3.41Å; C228-T231 VanDerWaalsContact O-N 3.09Å; C228-T231 PolarHBondContact O-OG1 3.4Å; K229-T231 VanDerWaalsContact C-N 3.34Å; K229-T231 PolarHBondContact O-N 2.92Å; T231-L238 HydrophobicContact CG2-CD2 4.2Å; T231-L240 HydrophobicContact CG2-CD1 3.84Å; T231-L240 HydrophobicContact CG2-CG 4.5Å; T231-L248 HydrophobicContact CG2-CD2 3.68Å
232	M	88.9	Confident	84	Confident	44 Å²	44	59.2 Å²	59.2	22%	0.217	30%	0.295	C	S	.	.	H	α-helix	trans	-89.3	-19.4	-179.3	-53.8	-173.3	-169.5	0	0	114.2	K229 R230 N234 Y263 A266 E267 A270	K229-M232 WeakPolarHBondContact O-CB 3.47Å; K229-M232 PolarHBondContact O-N 3.44Å; R230-M232 PolarHBondContact O-N 3.28Å; M232-N234 PolarHBondContact O-N 2.91Å; M232-Y263 HydrophobicContact CE-CD2 3.68Å; M232-Y263 HydrophobicContact CE-CE2 3.59Å; M232-Y263 HydrophobicContact CE-CG 4.24Å; M232-A266 HydrophobicContact CE-CB 3.67Å; M232-E267 HydrophobicContact CE-CB 4.06Å; M232-E267 VanDerWaalsContact SD-CA 3.56Å; M232-E267 HydrophobicContact SD-CB 3.85Å; M232-E267 HydrophobicContact SD-CG 4.03Å; M232-A270 HydrophobicContact SD-CB 4.44Å
233	Q	78.7	Confident	84.1	Confident	83 Å²	83	58.6 Å²	58.6	39%	0.388	29%	0.29	S	S	.	.	H	α-helix	trans	-68.3	-36.9	-169.7	-79.5	168.1	-41.6	0	0	113.4	R230 E285	R230-Q233 PolarHBondContact O-N 3.17Å; Q233-E285 PolarHBondContact NE2-OE1 3.13Å
234	N	69.9	Low	84.1	Confident	57 Å²	57	58.3 Å²	58.3	31%	0.305	29%	0.289	S	S	.	.			trans	-131.8	102.7	-174.8	-170.4	-7.3	0	0	0	112.5	M232 Q236 R237 E239	M232-N234 PolarHBondContact O-N 2.91Å; N234-Q236 PolarHBondContact O-N 3.41Å; N234-Q236 VanDerWaalsContact O-N 3.12Å; N234-Q236 PolarHBondContact OD1-N 3.15Å; N234-R237 PolarHBondContact O-N 3.41Å; N234-R237 VanDerWaalsContact O-O 3.1Å; N234-E239 PolarHBondContact ND2-OE2 3.45Å
235	K	57.8	Low	84	Confident	211 Å²	211	60.6 Å²	60.6	92%	0.917	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-13.9	-176.5	-74	-162.9	172.5	-164	0	115.5
236	Q	53.2	Low	83.9	Confident	191 Å²	191	67.2 Å²	67.2	89%	0.893	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.5	-9.7	-176.4	-70.5	-178.3	-25.1	0	0	113.3	N234	N234-Q236 PolarHBondContact O-N 3.41Å; N234-Q236 VanDerWaalsContact O-N 3.12Å; N234-Q236 PolarHBondContact OD1-N 3.15Å
237	R	55.1	Low	84	Confident	167 Å²	167	71.4 Å²	71.4	63%	0.63	35%	0.354	S	S	*	.			trans	-154.3	120.5	-177.5	-164.8	169.3	174.5	-140.3	11.1	110.3	N234 E239	N234-R237 PolarHBondContact O-N 3.41Å; N234-R237 VanDerWaalsContact O-O 3.1Å; R237-E239 HydrophobicContact CB-CG 4.11Å; R237-E239 VanDerWaalsContact CD-OE1 3.29Å; R237-E239 WeakPolarHBondContact CD-OE1 3.3Å; R237-E239 HydrophobicContact CG-CG 3.76Å; R237-E239 IonicContact CZ-OE1 2.72Å; R237-E239 IonicContact NE-OE1 3.52Å; R237-E239 IonicContact NH1-OE1 3.02Å; R237-E239 PolarHBondContact NH1-OE1 3.38Å; R237-E239 PolarHBondContact O-N 3.39Å
238	L	60	Low	84	Confident	133 Å²	133	72 Å²	72	70%	0.696	36%	0.358	S	S	*	.			trans	-73.4	108.6	168.4	-72.4	167.5	0	0	0	108.1	T231	T231-L238 HydrophobicContact CG2-CD2 4.2Å
239	E	75.6	Confident	84.1	Confident	89 Å²	89	74 Å²	74	42%	0.416	37%	0.374	S	S	.	.			trans	-105	55.3	-176.6	-67	175.7	149.6	0	0	110.1	R230 N234 R237	R230-E239 PolarHBondContact NH2-O 3.45Å; N234-E239 PolarHBondContact ND2-OE2 3.45Å; R237-E239 HydrophobicContact CB-CG 4.11Å; R237-E239 VanDerWaalsContact CD-OE1 3.29Å; R237-E239 WeakPolarHBondContact CD-OE1 3.3Å; R237-E239 HydrophobicContact CG-CG 3.76Å; R237-E239 IonicContact CZ-OE1 2.72Å; R237-E239 IonicContact NE-OE1 3.52Å; R237-E239 IonicContact NH1-OE1 3.02Å; R237-E239 PolarHBondContact NH1-OE1 3.38Å; R237-E239 PolarHBondContact O-N 3.39Å
240	L	90.3	Very high	84.3	Confident	34 Å²	34	76 Å²	76	18%	0.178	39%	0.388	C	S	.	.			trans	-105.7	144.7	165.7	-68.9	-175.7	0	0	0	109.5	L227 R230 T231 E244 L248	L227-L240 HydrophobicContact CD2-CD2 4.06Å; R230-L240 HydrophobicContact CB-CD2 3.76Å; T231-L240 HydrophobicContact CG2-CD1 3.84Å; T231-L240 HydrophobicContact CG2-CG 4.5Å; L240-E244 HydrophobicContact CB-CB 4.21Å; L240-E244 HydrophobicContact CD2-CB 4.32Å; L240-L248 HydrophobicContact CD1-CD2 3.73Å
241	A	92.5	Very high	84.5	Confident	27 Å²	27	74.4 Å²	74.4	22%	0.223	38%	0.382	C	S	.	.			trans	-72.9	161	167.7	0	0	0	0	0	111	F243 E244 A245	A241-F243 HydrophobicContact CB-CD1 3.8Å; A241-F243 HydrophobicContact CB-CE1 3.5Å; A241-F243 VanDerWaalsContact CB-CE1 3.5Å; A241-F243 HydrophobicContact CB-CZ 4.31Å; A241-F243 PolarHBondContact O-N 3.47Å; A241-E244 HydrophobicContact CB-CG 4.09Å; A241-E244 PolarHBondContact N-OE2 2.95Å; A241-E244 WeakPolarHBondContact O-CB 3.45Å; A241-E244 PolarHBondContact O-N 3.18Å; A241-A245 PolarHBondContact O-N 3.49Å
242	G	93.3	Very high	84.7	Confident	50 Å²	50	76 Å²	76	52%	0.515	39%	0.386	S	S	.	.	H	α-helix	trans	-55.2	-48.8	-175.8	0	0	0	0	0	113.5	E244 A245 E246	G242-E244 PolarHBondContact O-N 3.49Å; G242-A245 PolarHBondContact O-N 3.39Å; G242-A245 VanDerWaalsContact O-N 3.16Å; G242-E246 WeakPolarHBondContact O-CG 3.16Å; G242-E246 PolarHBondContact O-N 2.84Å
243	F	94.7	Very high	85.1	Confident	41 Å²	41	80 Å²	80	18%	0.18	41%	0.409	C	S	.	.	H	α-helix	trans	-62.6	-30.2	177.3	73.4	-87.8	0	0	0	113.1	A241 R247 P298 P299	A241-F243 HydrophobicContact CB-CD1 3.8Å; A241-F243 HydrophobicContact CB-CE1 3.5Å; A241-F243 VanDerWaalsContact CB-CE1 3.5Å; A241-F243 HydrophobicContact CB-CZ 4.31Å; A241-F243 PolarHBondContact O-N 3.47Å; F243-R247 VanDerWaalsContact O-CB 3.22Å; F243-R247 WeakPolarHBondContact O-CB 3.47Å; F243-R247 PolarHBondContact O-N 3.12Å; F243-P298 HydrophobicContact CE1-CB 4.05Å; F243-P298 HydrophobicContact CE1-CG 4.13Å; F243-P298 HydrophobicContact CE2-CB 4.48Å; F243-P298 HydrophobicContact CE2-CG 4.41Å; F243-P298 HydrophobicContact CZ-CB 4.05Å; F243-P298 HydrophobicContact CZ-CG 3.79Å; F243-P299 HydrophobicContact CB-CG 3.87Å; F243-P299 HydrophobicContact CG-CG 4.42Å
244	E	96.4	Very high	85.9	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-73.7	-38.7	176.1	-59	-174.2	119.5	0	0	111.6	H191 L227 R230 L240 A241 G242 R247 L248	H191-E244 IonicContact CE1-OE1 2.79Å; H191-E244 PolarHBondContact CE1-OE1 3.32Å; H191-E244 IonicContact CE1-OE2 3.09Å; H191-E244 IonicContact NE2-OE2 2.72Å; L227-E244 HydrophobicContact CD2-CB 3.89Å; L227-E244 HydrophobicContact CD2-CG 4.32Å; R230-E244 IonicContact CZ-OE1 3.5Å; R230-E244 IonicContact CZ-OE2 3.51Å; R230-E244 VanDerWaalsContact NH1-CD 3.29Å; R230-E244 IonicContact NH1-OE1 2.74Å; R230-E244 PolarHBondContact NH1-OE1 2.76Å; R230-E244 IonicContact NH1-OE2 2.69Å; R230-E244 PolarHBondContact NH1-OE2 2.72Å; R230-E244 IonicContact NH2-OE1 3.75Å; R230-E244 IonicContact NH2-OE2 3.21Å; R230-E244 PolarHBondContact NH2-OE2 3.41Å; L240-E244 HydrophobicContact CB-CB 4.21Å; L240-E244 HydrophobicContact CD2-CB 4.32Å; A241-E244 HydrophobicContact CB-CG 4.09Å; A241-E244 PolarHBondContact N-OE2 2.95Å; A241-E244 WeakPolarHBondContact O-CB 3.45Å; A241-E244 PolarHBondContact O-N 3.18Å; G242-E244 PolarHBondContact O-N 3.49Å; E244-R247 PolarHBondContact O-N 3.49Å; E244-L248 VanDerWaalsContact O-CB 3.28Å; E244-L248 WeakPolarHBondContact O-CB 3.4Å; E244-L248 PolarHBondContact O-N 2.72Å
245	A	94.7	Very high	87.1	Confident	49 Å²	49	79.5 Å²	79.5	41%	0.405	41%	0.405	S	S	.	.	H	α-helix	trans	-68.4	-43	176.2	0	0	0	0	0	111.7	A241 G242 R247 L248 A249	A241-A245 PolarHBondContact O-N 3.49Å; G242-A245 PolarHBondContact O-N 3.39Å; G242-A245 VanDerWaalsContact O-N 3.16Å; A245-R247 VanDerWaalsContact C-N 3.35Å; A245-L248 PolarHBondContact O-N 3.41Å; A245-A249 PolarHBondContact O-N 3.01Å
246	E	96.1	Very high	89	Confident	144 Å²	144	73.7 Å²	73.7	67%	0.673	39%	0.389	S	S	*	.	H	α-helix	trans	-59.5	-45.1	171.8	-72.3	168.4	-164.5	0	0	111.3	G242 A249 S250	G242-E246 WeakPolarHBondContact O-CG 3.16Å; G242-E246 PolarHBondContact O-N 2.84Å; E246-A249 PolarHBondContact O-N 3.4Å; E246-S250 PolarHBondContact O-N 3.32Å
247	R	96.3	Very high	91	Very high	92 Å²	92	70.5 Å²	70.5	35%	0.347	37%	0.374	S	S	.	.	H	α-helix	trans	-69.7	-35.2	178.5	-171.2	50.3	175.9	-176.1	-1.6	112.4	Y223 F243 E244 A245 S250 L251	Y223-R247 HydrophobicContact CD1-CG 4.4Å; Y223-R247 HydrophobicContact CE1-CG 3.79Å; F243-R247 VanDerWaalsContact O-CB 3.22Å; F243-R247 WeakPolarHBondContact O-CB 3.47Å; F243-R247 PolarHBondContact O-N 3.12Å; E244-R247 PolarHBondContact O-N 3.49Å; A245-R247 VanDerWaalsContact C-N 3.35Å; R247-S250 PolarHBondContact NH1-OG 3.45Å; R247-S250 WeakPolarHBondContact O-CB 3.46Å; R247-S250 PolarHBondContact O-N 3.06Å; R247-L251 HydrophobicContact CG-CD1 4.04Å; R247-L251 HydrophobicContact CG-CG 4.45Å; R247-L251 WeakPolarHBondContact O-CB 3.38Å; R247-L251 WeakPolarHBondContact O-CD1 3.12Å; R247-L251 WeakPolarHBondContact O-CG 3.4Å; R247-L251 PolarHBondContact O-N 3Å
248	L	96.7	Very high	92.9	Very high	14 Å²	14	67.6 Å²	67.6	7%	0.073	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-45.1	171.9	177.5	57.2	0	0	0	111.4	L227 T231 L240 E244 A245 S250 L251 Q252 W259	L227-L248 HydrophobicContact CB-CB 4.36Å; L227-L248 HydrophobicContact CB-CD1 3.97Å; L227-L248 HydrophobicContact CD1-CB 4.15Å; T231-L248 HydrophobicContact CG2-CD2 3.68Å; L240-L248 HydrophobicContact CD1-CD2 3.73Å; E244-L248 VanDerWaalsContact O-CB 3.28Å; E244-L248 WeakPolarHBondContact O-CB 3.4Å; E244-L248 PolarHBondContact O-N 2.72Å; A245-L248 PolarHBondContact O-N 3.41Å; L248-S250 PolarHBondContact O-N 2.99Å; L248-L251 PolarHBondContact O-N 3.43Å; L248-Q252 HydrophobicContact CD1-CG 4.41Å; L248-Q252 WeakPolarHBondContact O-CG 3.39Å; L248-Q252 PolarHBondContact O-N 3Å; L248-W259 HydrophobicContact CD1-CH2 3.65Å; L248-W259 HydrophobicContact CD1-CZ2 4.36Å
249	A	96.9	Very high	94.7	Very high	45 Å²	45	63.9 Å²	63.9	37%	0.372	34%	0.343	S	S	.	.	H	α-helix	trans	-63	-40.4	175.8	0	0	0	0	0	112.2	A245 E246 Q252 N253	A245-A249 PolarHBondContact O-N 3.01Å; E246-A249 PolarHBondContact O-N 3.4Å; A249-Q252 PolarHBondContact O-N 3.05Å; A249-N253 PolarHBondContact O-N 3.35Å; A249-N253 PolarHBondContact O-ND2 3.39Å
250	S	97.5	Very high	95.7	Very high	43 Å²	43	66.4 Å²	66.4	30%	0.301	36%	0.355	S	S	.	.	H	α-helix	trans	-59.1	-44.7	171.6	175.1	0	0	0	0	112.1	E246 R247 L248 N253 I254	E246-S250 PolarHBondContact O-N 3.32Å; R247-S250 PolarHBondContact NH1-OG 3.45Å; R247-S250 WeakPolarHBondContact O-CB 3.46Å; R247-S250 PolarHBondContact O-N 3.06Å; L248-S250 PolarHBondContact O-N 2.99Å; S250-N253 PolarHBondContact O-N 2.8Å; S250-I254 WeakPolarHBondContact O-CG1 3.19Å; S250-I254 PolarHBondContact O-N 3.5Å; S250-I254 VanDerWaalsContact O-N 3.1Å
251	L	97.4	Very high	96	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-68.7	-34.6	179.1	-68.2	163.7	0	0	0	112.9	T220 Y223 A224 L227 R247 L248 N253 I254 Y255	T220-L251 HydrophobicContact CG2-CD2 3.38Å; Y223-L251 HydrophobicContact CD1-CD1 3.97Å; A224-L251 HydrophobicContact CB-CB 4.15Å; A224-L251 HydrophobicContact CB-CD1 4.11Å; A224-L251 HydrophobicContact CB-CD2 4.49Å; A224-L251 HydrophobicContact CB-CG 4.48Å; L227-L251 HydrophobicContact CD1-CD1 4Å; R247-L251 HydrophobicContact CG-CD1 4.04Å; R247-L251 HydrophobicContact CG-CG 4.45Å; R247-L251 WeakPolarHBondContact O-CB 3.38Å; R247-L251 WeakPolarHBondContact O-CD1 3.12Å; R247-L251 WeakPolarHBondContact O-CG 3.4Å; R247-L251 PolarHBondContact O-N 3Å; L248-L251 PolarHBondContact O-N 3.43Å; L251-N253 VanDerWaalsContact C-N 3.32Å; L251-N253 PolarHBondContact O-N 2.65Å; L251-I254 PolarHBondContact O-N 2.96Å; L251-Y255 HydrophobicContact CB-CD2 4.49Å; L251-Y255 HydrophobicContact CD2-CD2 4.27Å; L251-Y255 HydrophobicContact CD2-CE2 3.88Å; L251-Y255 WeakPolarHBondContact O-CD2 3.12Å; L251-Y255 PolarHBondContact O-N 2.78Å
252	Q	96.8	Very high	96.2	Very high	82 Å²	82	70.8 Å²	70.8	38%	0.383	37%	0.368	S	S	.	.	H	α-helix	trans	-62.2	-38	172.9	-77.5	175.1	-19.2	0	0	112.2	L248 A249 C256 W259	L248-Q252 HydrophobicContact CD1-CG 4.41Å; L248-Q252 WeakPolarHBondContact O-CG 3.39Å; L248-Q252 PolarHBondContact O-N 3Å; A249-Q252 PolarHBondContact O-N 3.05Å; Q252-C256 VanDerWaalsContact O-CA 3.3Å; Q252-C256 WeakPolarHBondContact O-CA 3.5Å; Q252-C256 WeakPolarHBondContact O-CB 3.25Å; Q252-C256 PolarHBondContact O-N 3.03Å; Q252-C256 VanDerWaalsContact O-N 3.09Å; Q252-W259 HydrophobicContact CB-CE3 4.42Å; Q252-W259 HydrophobicContact CB-CZ3 4.46Å; Q252-W259 HydrophobicContact CG-CD2 3.96Å; Q252-W259 HydrophobicContact CG-CE3 3.81Å; Q252-W259 HydrophobicContact CG-CH2 3.54Å; Q252-W259 HydrophobicContact CG-CZ2 3.66Å; Q252-W259 HydrophobicContact CG-CZ3 3.59Å
253	N	96.8	Very high	96.3	Very high	128 Å²	128	73.8 Å²	73.8	68%	0.684	37%	0.365	S	S	*	.	H	α-helix	trans	-69.3	-43.6	174.4	-69.1	-31.7	0	0	0	112	A249 S250 L251 C256	A249-N253 PolarHBondContact O-N 3.35Å; A249-N253 PolarHBondContact O-ND2 3.39Å; S250-N253 PolarHBondContact O-N 2.8Å; L251-N253 VanDerWaalsContact C-N 3.32Å; L251-N253 PolarHBondContact O-N 2.65Å; N253-C256 PolarHBondContact O-SG 3Å; N253-C256 VanDerWaalsContact O-SG 3.39Å
254	I	95.6	Very high	96.4	Very high	86 Å²	86	76 Å²	76	44%	0.441	38%	0.378	S	S	.	.	H	α-helix	trans	-64.7	-47.3	179.8	-68	163.2	0	0	0	111.6	S250 L251	S250-I254 WeakPolarHBondContact O-CG1 3.19Å; S250-I254 PolarHBondContact O-N 3.5Å; S250-I254 VanDerWaalsContact O-N 3.1Å; L251-I254 PolarHBondContact O-N 2.96Å
255	Y	96.1	Very high	96.5	Very high	44 Å²	44	78.3 Å²	78.3	17%	0.173	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99	21.7	-176.1	-63.7	-70.5	0	0	0	113.5	T220 A221 A224 L251 H257 K258 W259 I262	T220-Y255 HydrophobicContact CG2-CE2 4.24Å; A221-Y255 PolarHBondContact N-OH 3.31Å; A224-Y255 HydrophobicContact CB-CD2 4.32Å; A224-Y255 HydrophobicContact CB-CE2 4.47Å; L251-Y255 HydrophobicContact CB-CD2 4.49Å; L251-Y255 HydrophobicContact CD2-CD2 4.27Å; L251-Y255 HydrophobicContact CD2-CE2 3.88Å; L251-Y255 WeakPolarHBondContact O-CD2 3.12Å; L251-Y255 PolarHBondContact O-N 2.78Å; Y255-H257 PolarHBondContact O-N 3.4Å; Y255-H257 VanDerWaalsContact O-N 3.08Å; Y255-K258 CarbonylContact O-C 3.39Å; Y255-K258 WeakPolarHBondContact O-CA 3.45Å; Y255-K258 PolarHBondContact O-N 2.94Å; Y255-W259 PolarHBondContact O-N 2.74Å; Y255-I262 HydrophobicContact CD1-CD1 4.35Å; Y255-I262 HydrophobicContact CD2-CD1 4.03Å; Y255-I262 HydrophobicContact CG-CD1 3.73Å
256	C	96.2	Very high	96.5	Very high	88 Å²	88	76 Å²	76	60%	0.595	37%	0.369	S	S	*	.	G	3₁₀ helix	trans	-49.1	-41	-177.4	59.4	0	0	0	0	113.5	Q252 N253 K258	Q252-C256 VanDerWaalsContact O-CA 3.3Å; Q252-C256 WeakPolarHBondContact O-CA 3.5Å; Q252-C256 WeakPolarHBondContact O-CB 3.25Å; Q252-C256 PolarHBondContact O-N 3.03Å; Q252-C256 VanDerWaalsContact O-N 3.09Å; N253-C256 PolarHBondContact O-SG 3Å; N253-C256 VanDerWaalsContact O-SG 3.39Å; C256-K258 VanDerWaalsContact C-N 3.29Å; C256-K258 PolarHBondContact O-N 3.29Å
257	H	96.3	Very high	96.4	Very high	125 Å²	125	72.3 Å²	72.3	58%	0.579	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-74.8	-7.9	178.4	69.1	-79.6	0	0	0	115.2	Y255	Y255-H257 PolarHBondContact O-N 3.4Å; Y255-H257 VanDerWaalsContact O-N 3.08Å
258	K	95.3	Very high	96.4	Very high	106 Å²	106	70.4 Å²	70.4	46%	0.461	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-128.9	4.8	179.5	-79.9	166.5	-173.5	155.1	0	113	Y255 C256 E260 F261 I262	Y255-K258 CarbonylContact O-C 3.39Å; Y255-K258 WeakPolarHBondContact O-CA 3.45Å; Y255-K258 PolarHBondContact O-N 2.94Å; C256-K258 VanDerWaalsContact C-N 3.29Å; C256-K258 PolarHBondContact O-N 3.29Å; K258-E260 VanDerWaalsContact C-N 3.27Å; K258-E260 PolarHBondContact O-N 3.17Å; K258-F261 HydrophobicContact CB-CD2 4.36Å; K258-F261 HydrophobicContact CG-CD2 4.37Å; K258-F261 PolarHBondContact O-N 3.32Å; K258-I262 PolarHBondContact O-N 3.31Å
259	W	96.8	Very high	96.3	Very high	54 Å²	54	70.7 Å²	70.7	21%	0.205	36%	0.357	C	S	.	.	H	α-helix	trans	-61.5	-33.2	-169.8	-172	-102.5	0	0	0	113.4	A224 C228 L248 Q252 Y255 F261 I262 Y263	A224-W259 HydrophobicContact CB-CZ3 4.37Å; C228-W259 HydrophobicContact CB-CH2 4.16Å; C228-W259 HydrophobicContact CB-CZ2 4.24Å; L248-W259 HydrophobicContact CD1-CH2 3.65Å; L248-W259 HydrophobicContact CD1-CZ2 4.36Å; Q252-W259 HydrophobicContact CB-CE3 4.42Å; Q252-W259 HydrophobicContact CB-CZ3 4.46Å; Q252-W259 HydrophobicContact CG-CD2 3.96Å; Q252-W259 HydrophobicContact CG-CE3 3.81Å; Q252-W259 HydrophobicContact CG-CH2 3.54Å; Q252-W259 HydrophobicContact CG-CZ2 3.66Å; Q252-W259 HydrophobicContact CG-CZ3 3.59Å; Y255-W259 PolarHBondContact O-N 2.74Å; W259-F261 VanDerWaalsContact C-N 3.34Å; W259-F261 PolarHBondContact O-N 2.75Å; W259-I262 HydrophobicContact CE3-CB 4.39Å; W259-I262 HydrophobicContact CE3-CD1 4.07Å; W259-I262 HydrophobicContact CE3-CG2 4.3Å; W259-I262 HydrophobicContact CH2-CG2 4.14Å; W259-I262 HydrophobicContact CZ3-CD1 4.26Å; W259-I262 HydrophobicContact CZ3-CG2 3.94Å; W259-I262 PolarHBondContact O-N 3.43Å; W259-Y263 WeakPolarHBondContact O-CB 3.09Å; W259-Y263 PolarHBondContact O-N 3.36Å
260	E	96.8	Very high	96	Very high	143 Å²	143	69.6 Å²	69.6	67%	0.668	35%	0.348	S	S	*	.	H	α-helix	trans	-59.4	-41.8	174.9	-175	171.6	-160.3	0	0	112.2	K258 Y263 I264	K258-E260 VanDerWaalsContact C-N 3.27Å; K258-E260 PolarHBondContact O-N 3.17Å; E260-Y263 PolarHBondContact O-N 2.92Å; E260-I264 HydrophobicContact CG-CD1 3.86Å; E260-I264 WeakPolarHBondContact O-CB 3.43Å; E260-I264 VanDerWaalsContact O-CG1 3.23Å; E260-I264 WeakPolarHBondContact O-CG1 3.21Å; E260-I264 PolarHBondContact O-N 3.36Å
261	F	96.7	Very high	95.8	Very high	139 Å²	139	72.7 Å²	72.7	61%	0.61	36%	0.356	S	S	*	.	H	α-helix	trans	-66.7	-41.4	176.7	-58.4	-71.3	0	0	0	112	K258 W259 Y263 I264 Q265	K258-F261 HydrophobicContact CB-CD2 4.36Å; K258-F261 HydrophobicContact CG-CD2 4.37Å; K258-F261 PolarHBondContact O-N 3.32Å; W259-F261 VanDerWaalsContact C-N 3.34Å; W259-F261 PolarHBondContact O-N 2.75Å; F261-Y263 VanDerWaalsContact C-N 3.35Å; F261-I264 PolarHBondContact O-N 3.1Å; F261-Q265 PolarHBondContact O-N 3.35Å
262	I	96	Very high	95.6	Very high	13 Å²	13	75.4 Å²	75.4	7%	0.067	37%	0.372	C	S	.	.	H	α-helix	trans	-61.4	-44.6	176	-64.4	174.6	0	0	0	110.4	A224 V225 C228 Y255 K258 W259 Q265 A266	A224-I262 HydrophobicContact CB-CD1 4.14Å; A224-I262 HydrophobicContact CB-CG2 4.09Å; V225-I262 HydrophobicContact CG2-CG2 3.94Å; C228-I262 HydrophobicContact CB-CG2 4.44Å; Y255-I262 HydrophobicContact CD1-CD1 4.35Å; Y255-I262 HydrophobicContact CD2-CD1 4.03Å; Y255-I262 HydrophobicContact CG-CD1 3.73Å; K258-I262 PolarHBondContact O-N 3.31Å; W259-I262 HydrophobicContact CE3-CB 4.39Å; W259-I262 HydrophobicContact CE3-CD1 4.07Å; W259-I262 HydrophobicContact CE3-CG2 4.3Å; W259-I262 HydrophobicContact CH2-CG2 4.14Å; W259-I262 HydrophobicContact CZ3-CD1 4.26Å; W259-I262 HydrophobicContact CZ3-CG2 3.94Å; W259-I262 PolarHBondContact O-N 3.43Å; I262-Q265 PolarHBondContact O-N 2.9Å; I262-A266 WeakPolarHBondContact O-CB 3.25Å; I262-A266 PolarHBondContact O-N 2.68Å
263	Y	97	Very high	95.3	Very high	113 Å²	113	72 Å²	72	44%	0.443	36%	0.357	S	S	.	.	H	α-helix	trans	-63.8	-45.4	176.5	-177.9	-86.8	0	0	0	112.1	M232 W259 E260 F261 Q265 A266 E267	M232-Y263 HydrophobicContact CE-CD2 3.68Å; M232-Y263 HydrophobicContact CE-CE2 3.59Å; M232-Y263 HydrophobicContact CE-CG 4.24Å; W259-Y263 WeakPolarHBondContact O-CB 3.09Å; W259-Y263 PolarHBondContact O-N 3.36Å; E260-Y263 PolarHBondContact O-N 2.92Å; F261-Y263 VanDerWaalsContact C-N 3.35Å; Y263-Q265 VanDerWaalsContact C-N 3.34Å; Y263-Q265 PolarHBondContact O-N 3.5Å; Y263-A266 PolarHBondContact O-N 2.84Å; Y263-E267 HydrophobicContact CE1-CB 4.5Å; Y263-E267 WeakPolarHBondContact O-CB 3.47Å; Y263-E267 PolarHBondContact O-N 3.37Å
264	I	97	Very high	94.9	Very high	89 Å²	89	73.9 Å²	73.9	46%	0.456	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-41.3	177.6	-72	166.3	0	0	0	111.3	E260 F261 A268	E260-I264 HydrophobicContact CG-CD1 3.86Å; E260-I264 WeakPolarHBondContact O-CB 3.43Å; E260-I264 VanDerWaalsContact O-CG1 3.23Å; E260-I264 WeakPolarHBondContact O-CG1 3.21Å; E260-I264 PolarHBondContact O-N 3.36Å; F261-I264 PolarHBondContact O-N 3.1Å; I264-A268 VanDerWaalsContact O-CB 3.32Å; I264-A268 WeakPolarHBondContact O-CB 3.38Å; I264-A268 PolarHBondContact O-N 3Å
265	Q	96.7	Very high	94.8	Very high	48 Å²	48	78.3 Å²	78.3	22%	0.224	38%	0.375	C	S	.	.	H	α-helix	trans	-65.3	-48.7	175.9	-175.5	177.5	-29.4	0	0	111.5	V225 F261 I262 Y263 E267 A268 E269	V225-Q265 HydrophobicContact CG1-CB 4.28Å; V225-Q265 HydrophobicContact CG1-CG 3.85Å; V225-Q265 HydrophobicContact CG2-CB 4.3Å; V225-Q265 HydrophobicContact CG2-CG 4.28Å; F261-Q265 PolarHBondContact O-N 3.35Å; I262-Q265 PolarHBondContact O-N 2.9Å; Y263-Q265 VanDerWaalsContact C-N 3.34Å; Y263-Q265 PolarHBondContact O-N 3.5Å; Q265-E267 VanDerWaalsContact C-N 3.3Å; Q265-E267 PolarHBondContact O-N 2.73Å; Q265-A268 WeakPolarHBondContact O-CB 3.43Å; Q265-A268 PolarHBondContact O-N 2.9Å; Q265-A268 VanDerWaalsContact O-N 3.15Å; Q265-E269 PolarHBondContact NE2-OE1 2.95Å; Q265-E269 VanDerWaalsContact NE2-OE1 3.11Å; Q265-E269 PolarHBondContact O-N 3.16Å
266	A	95.4	Very high	94.6	Very high	0 Å²	0	78.1 Å²	78.1	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-59.2	-40.4	178.4	0	0	0	0	0	112.4	V225 C228 K229 M232 I262 Y263 E269 A270	V225-A266 HydrophobicContact CG1-CB 4.12Å; C228-A266 HydrophobicContact CB-CB 3.82Å; K229-A266 HydrophobicContact CB-CB 4.08Å; M232-A266 HydrophobicContact CE-CB 3.67Å; I262-A266 WeakPolarHBondContact O-CB 3.25Å; I262-A266 PolarHBondContact O-N 2.68Å; Y263-A266 PolarHBondContact O-N 2.84Å; A266-E269 PolarHBondContact O-N 2.95Å; A266-A270 WeakPolarHBondContact O-CB 3.38Å; A266-A270 PolarHBondContact O-N 3.07Å
267	E	95.3	Very high	94.4	Very high	67 Å²	67	78.5 Å²	78.5	31%	0.313	37%	0.37	S	S	.	.	H	α-helix	trans	-69.8	-36.3	176.9	-158.3	-141.5	-175.6	0	0	111.9	M232 Y263 Q265 K271	M232-E267 HydrophobicContact CE-CB 4.06Å; M232-E267 VanDerWaalsContact SD-CA 3.56Å; M232-E267 HydrophobicContact SD-CB 3.85Å; M232-E267 HydrophobicContact SD-CG 4.03Å; Y263-E267 HydrophobicContact CE1-CB 4.5Å; Y263-E267 WeakPolarHBondContact O-CB 3.47Å; Y263-E267 PolarHBondContact O-N 3.37Å; Q265-E267 VanDerWaalsContact C-N 3.3Å; Q265-E267 PolarHBondContact O-N 2.73Å; E267-K271 HydrophobicContact CG-CD 4.48Å; E267-K271 WeakPolarHBondContact O-CB 3.49Å; E267-K271 WeakPolarHBondContact O-CD 3.37Å; E267-K271 WeakPolarHBondContact O-CG 3.35Å; E267-K271 PolarHBondContact O-N 3.25Å; E267-K271 WeakPolarHBondContact OE1-CE 3.5Å; E267-K271 IonicContact OE1-NZ 3.63Å; E267-K271 PolarHBondContact OE1-NZ 2.65Å; E267-K271 WeakPolarHBondContact OE2-CE 3.26Å; E267-K271 IonicContact OE2-NZ 2.75Å; E267-K271 PolarHBondContact OE2-NZ 3.31Å
268	A	95.9	Very high	94.1	Very high	51 Å²	51	79.8 Å²	79.8	42%	0.421	37%	0.374	S	S	.	.	H	α-helix	trans	-65.5	-42.5	174.4	0	0	0	0	0	112.1	I264 Q265 K271 V272	I264-A268 VanDerWaalsContact O-CB 3.32Å; I264-A268 WeakPolarHBondContact O-CB 3.38Å; I264-A268 PolarHBondContact O-N 3Å; Q265-A268 WeakPolarHBondContact O-CB 3.43Å; Q265-A268 PolarHBondContact O-N 2.9Å; Q265-A268 VanDerWaalsContact O-N 3.15Å; A268-K271 PolarHBondContact O-N 2.97Å; A268-V272 WeakPolarHBondContact O-CG2 3.3Å; A268-V272 PolarHBondContact O-N 3.03Å
269	E	93.5	Very high	93.9	Very high	20 Å²	20	78 Å²	78	9%	0.093	37%	0.369	C	S	.	.	H	α-helix	trans	-63.9	-49.8	174.1	-73.5	-179.9	-149	0	0	111.5	K229 Q265 A266 K271 V272 D273	K229-E269 HydrophobicContact CD-CB 3.69Å; K229-E269 IonicContact NZ-OE2 3.73Å; K229-E269 PolarHBondContact NZ-OE2 2.9Å; Q265-E269 PolarHBondContact NE2-OE1 2.95Å; Q265-E269 VanDerWaalsContact NE2-OE1 3.11Å; Q265-E269 PolarHBondContact O-N 3.16Å; A266-E269 PolarHBondContact O-N 2.95Å; E269-K271 PolarHBondContact O-N 3.12Å; E269-V272 WeakPolarHBondContact O-CA 3.45Å; E269-V272 WeakPolarHBondContact O-CB 3.16Å; E269-V272 PolarHBondContact O-N 3.14Å; E269-D273 PolarHBondContact O-N 3.08Å
270	A	91.7	Very high	93.7	Very high	23 Å²	23	78.5 Å²	78.5	19%	0.19	37%	0.374	C	S	.	.	H	α-helix	trans	-56.4	-35	175.8	0	0	0	0	0	112.8	K229 M232 A266 V272 K274	K229-A270 HydrophobicContact CG-CB 4.36Å; M232-A270 HydrophobicContact SD-CB 4.44Å; A266-A270 WeakPolarHBondContact O-CB 3.38Å; A266-A270 PolarHBondContact O-N 3.07Å; A270-V272 VanDerWaalsContact C-N 3.33Å; A270-K274 VanDerWaalsContact O-CB 3.24Å; A270-K274 WeakPolarHBondContact O-CB 3.46Å; A270-K274 PolarHBondContact O-N 3Å
271	K	93	Very high	93.4	Very high	108 Å²	108	74.6 Å²	74.6	47%	0.47	35%	0.353	S	S	.	.	H	α-helix	trans	-70	-23.7	173.4	-77.9	166.9	178.4	170.5	0	113.9	E267 A268 E269 K275	E267-K271 HydrophobicContact CG-CD 4.48Å; E267-K271 WeakPolarHBondContact O-CB 3.49Å; E267-K271 WeakPolarHBondContact O-CD 3.37Å; E267-K271 WeakPolarHBondContact O-CG 3.35Å; E267-K271 PolarHBondContact O-N 3.25Å; E267-K271 WeakPolarHBondContact OE1-CE 3.5Å; E267-K271 IonicContact OE1-NZ 3.63Å; E267-K271 PolarHBondContact OE1-NZ 2.65Å; E267-K271 WeakPolarHBondContact OE2-CE 3.26Å; E267-K271 IonicContact OE2-NZ 2.75Å; E267-K271 PolarHBondContact OE2-NZ 3.31Å; A268-K271 PolarHBondContact O-N 2.97Å; E269-K271 PolarHBondContact O-N 3.12Å; K271-K275 WeakPolarHBondContact O-CE 3.46Å
272	V	93	Very high	93.1	Very high	57 Å²	57	71.5 Å²	71.5	35%	0.345	34%	0.342	S	S	.	.	H	α-helix	trans	-81.6	-48.2	171.8	173.8	0	0	0	0	110.1	A268 E269 A270 K274 K275	A268-V272 WeakPolarHBondContact O-CG2 3.3Å; A268-V272 PolarHBondContact O-N 3.03Å; E269-V272 WeakPolarHBondContact O-CA 3.45Å; E269-V272 WeakPolarHBondContact O-CB 3.16Å; E269-V272 PolarHBondContact O-N 3.14Å; A270-V272 VanDerWaalsContact C-N 3.33Å; V272-K274 VanDerWaalsContact C-N 3.29Å; V272-K274 PolarHBondContact O-N 3.42Å; V272-K275 WeakPolarHBondContact O-CB 3.3Å; V272-K275 PolarHBondContact O-N 2.73Å
273	D	90	Very high	93	Very high	10 Å²	10	72.3 Å²	72.3	5%	0.053	35%	0.348	C	S	.	.	H	α-helix	trans	-57.6	-42.4	177.9	-75.2	-49.2	0	0	0	112.3	H12 E269 K275 R276 R281	H12-D273 IonicContact NE2-OD1 2.74Å; E269-D273 PolarHBondContact O-N 3.08Å; D273-K275 PolarHBondContact O-N 3.27Å; D273-R276 WeakPolarHBondContact O-CB 3.46Å; D273-R276 PolarHBondContact O-N 3.12Å; D273-R276 IonicContact OD1-CZ 2.65Å; D273-R276 IonicContact OD1-NH1 3.9Å; D273-R276 PolarHBondContact OD1-NH1 3.34Å; D273-R281 HydrophobicContact CB-CG 4.42Å; D273-R281 VanDerWaalsContact O-CZ 3.27Å; D273-R281 PolarHBondContact O-NE 3.41Å; D273-R281 PolarHBondContact O-NH2 3.5Å
274	K	89.5	Confident	92.8	Very high	167 Å²	167	69.4 Å²	69.4	73%	0.726	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-16.8	177.1	-169.9	165.6	-178.3	174.2	0	114.4	A270 V272 R281	A270-K274 VanDerWaalsContact O-CB 3.24Å; A270-K274 WeakPolarHBondContact O-CB 3.46Å; A270-K274 PolarHBondContact O-N 3Å; V272-K274 VanDerWaalsContact C-N 3.29Å; V272-K274 PolarHBondContact O-N 3.42Å; K274-R281 PolarHBondContact O-NH2 2.83Å; K274-R281 VanDerWaalsContact O-NH2 3.1Å
275	K	92.6	Very high	92.6	Very high	180 Å²	180	67.5 Å²	67.5	78%	0.783	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-12.1	175.5	-62.4	174.2	-176	177.7	0	114.1	K271 V272 D273	K271-K275 WeakPolarHBondContact O-CE 3.46Å; V272-K275 WeakPolarHBondContact O-CB 3.3Å; V272-K275 PolarHBondContact O-N 2.73Å; D273-K275 PolarHBondContact O-N 3.27Å
276	R	91.4	Very high	92.5	Very high	40 Å²	40	65.9 Å²	65.9	15%	0.151	32%	0.323	C	S	.	.	S	Bend	trans	-72.6	159.2	175.1	-65.9	-175	158.5	97.2	8.8	111.9	H12 D273 E280 R281	H12-R276 VanDerWaalsContact CD2-CZ 3.48Å; H12-R276 PolarHBondContact CD2-NH1 3.1Å; H12-R276 PolarHBondContact CD2-NH2 3.32Å; H12-R276 PolarHBondContact NE2-NH1 2.91Å; D273-R276 WeakPolarHBondContact O-CB 3.46Å; D273-R276 PolarHBondContact O-N 3.12Å; D273-R276 IonicContact OD1-CZ 2.65Å; D273-R276 IonicContact OD1-NH1 3.9Å; D273-R276 PolarHBondContact OD1-NH1 3.34Å; R276-E280 IonicContact NE-OE1 2.61Å; R276-R281 HydrophobicContact CB-CB 4.31Å; R276-R281 PolarHBondContact O-NH2 3.18Å
277	D	92.9	Very high	92.5	Very high	95 Å²	95	67.1 Å²	67.1	51%	0.508	33%	0.329	S	S	.	.			trans	-58.6	152	167.7	175.8	57.7	0	0	0	111.3	L279 E280 R281	D277-L279 PolarHBondContact O-N 3.09Å; D277-L279 WeakPolarHBondContact OD2-CB 3.44Å; D277-L279 PolarHBondContact OD2-N 3.35Å; D277-E280 HydrophobicContact CB-CB 4.21Å; D277-E280 PolarHBondContact OD2-N 2.88Å; D277-R281 VanDerWaalsContact O-CB 3.27Å; D277-R281 WeakPolarHBondContact O-CB 3.22Å; D277-R281 PolarHBondContact O-N 2.93Å
278	K	90.4	Very high	92.5	Very high	152 Å²	152	65.7 Å²	65.7	66%	0.661	32%	0.322	S	S	*	.	H	α-helix	trans	-62.6	-40.1	-178.4	-173.4	179.1	178.1	-177.2	0	112.5	L282	K278-L282 HydrophobicContact CG-CD1 4.35Å; K278-L282 WeakPolarHBondContact O-CD1 3.32Å; K278-L282 VanDerWaalsContact O-CG 3.27Å; K278-L282 WeakPolarHBondContact O-CG 3.34Å; K278-L282 PolarHBondContact O-N 3.1Å
279	L	90.1	Very high	92.5	Very high	70 Å²	70	64.5 Å²	64.5	37%	0.366	31%	0.306	S	S	.	.	H	α-helix	trans	-77	-40.2	-178.7	-61.5	178.3	0	0	0	111.4	P148 D277 R281 L282 V283	P148-L279 HydrophobicContact CG-CB 4.32Å; P148-L279 HydrophobicContact CG-CD2 4.21Å; D277-L279 PolarHBondContact O-N 3.09Å; D277-L279 WeakPolarHBondContact OD2-CB 3.44Å; D277-L279 PolarHBondContact OD2-N 3.35Å; L279-R281 VanDerWaalsContact C-N 3.34Å; L279-R281 PolarHBondContact O-N 3.13Å; L279-L282 PolarHBondContact O-N 2.59Å; L279-V283 WeakPolarHBondContact O-CG2 3.36Å; L279-V283 PolarHBondContact O-N 3.03Å
280	E	92.3	Very high	92.6	Very high	64 Å²	64	63.5 Å²	63.5	30%	0.299	30%	0.302	S	S	.	.	H	α-helix	trans	-57.6	-47.7	173.4	-172	-164.4	168.7	0	0	110.9	R276 D277 V283 L284	R276-E280 IonicContact NE-OE1 2.61Å; D277-E280 HydrophobicContact CB-CB 4.21Å; D277-E280 PolarHBondContact OD2-N 2.88Å; E280-V283 PolarHBondContact O-N 3.4Å; E280-L284 HydrophobicContact CG-CD1 4.03Å; E280-L284 WeakPolarHBondContact O-CG 3.48Å; E280-L284 PolarHBondContact O-N 2.72Å; E280-L284 VanDerWaalsContact O-N 3.07Å
281	R	91.5	Very high	92.8	Very high	61 Å²	61	63.4 Å²	63.4	23%	0.23	30%	0.297	C	S	.	.	H	α-helix	trans	-60.8	-47.3	-179.1	-164.7	-168.4	-53.8	159.3	10	112.5	D273 K274 R276 D277 L279 V283 L284 E285	D273-R281 HydrophobicContact CB-CG 4.42Å; D273-R281 VanDerWaalsContact O-CZ 3.27Å; D273-R281 PolarHBondContact O-NE 3.41Å; D273-R281 PolarHBondContact O-NH2 3.5Å; K274-R281 PolarHBondContact O-NH2 2.83Å; K274-R281 VanDerWaalsContact O-NH2 3.1Å; R276-R281 HydrophobicContact CB-CB 4.31Å; R276-R281 PolarHBondContact O-NH2 3.18Å; D277-R281 VanDerWaalsContact O-CB 3.27Å; D277-R281 WeakPolarHBondContact O-CB 3.22Å; D277-R281 PolarHBondContact O-N 2.93Å; L279-R281 VanDerWaalsContact C-N 3.34Å; L279-R281 PolarHBondContact O-N 3.13Å; R281-V283 PolarHBondContact O-N 3.02Å; R281-L284 PolarHBondContact O-N 2.99Å; R281-L284 VanDerWaalsContact O-N 3.11Å; R281-E285 VanDerWaalsContact CD-OE1 3.27Å; R281-E285 WeakPolarHBondContact CD-OE1 3.45Å; R281-E285 HydrophobicContact CG-CG 4.08Å; R281-E285 WeakPolarHBondContact CG-OE1 3.36Å; R281-E285 WeakPolarHBondContact O-CB 3.44Å; R281-E285 WeakPolarHBondContact O-CG 3.29Å; R281-E285 PolarHBondContact O-N 3.09Å
282	L	90.6	Very high	92.9	Very high	74 Å²	74	58.9 Å²	58.9	39%	0.387	28%	0.276	S	S	.	.	H	α-helix	trans	-59.7	-34.1	178.6	-73.3	168.5	0	0	0	112.8	K278 L279 S286	K278-L282 HydrophobicContact CG-CD1 4.35Å; K278-L282 WeakPolarHBondContact O-CD1 3.32Å; K278-L282 VanDerWaalsContact O-CG 3.27Å; K278-L282 WeakPolarHBondContact O-CG 3.34Å; K278-L282 PolarHBondContact O-N 3.1Å; L279-L282 PolarHBondContact O-N 2.59Å; L282-S286 WeakPolarHBondContact O-CB 3.11Å; L282-S286 PolarHBondContact O-N 3.24Å; L282-S286 PolarHBondContact O-OG 2.85Å
283	V	93.3	Very high	93	Very high	29 Å²	29	56.3 Å²	56.3	18%	0.176	26%	0.261	C	S	.	.	H	α-helix	trans	-68.6	-50	173.8	176.9	0	0	0	0	110.3	P148 L279 E280 R281 S286 Q287	P148-V283 HydrophobicContact CB-CG2 4.42Å; P148-V283 HydrophobicContact CG-CG2 3.77Å; L279-V283 WeakPolarHBondContact O-CG2 3.36Å; L279-V283 PolarHBondContact O-N 3.03Å; E280-V283 PolarHBondContact O-N 3.4Å; R281-V283 PolarHBondContact O-N 3.02Å; V283-S286 PolarHBondContact O-N 3.23Å; V283-S286 PolarHBondContact O-OG 2.73Å; V283-Q287 HydrophobicContact CG1-CG 4.49Å; V283-Q287 WeakPolarHBondContact O-CG 3.48Å; V283-Q287 PolarHBondContact O-N 2.93Å
284	L	93.6	Very high	93.2	Very high	52 Å²	52	56.1 Å²	56.1	27%	0.272	26%	0.26	S	S	.	.	H	α-helix	trans	-62.9	-44.8	-178.5	-68.5	171.8	0	0	0	112.7	E280 R281 S286 Q287 E288	E280-L284 HydrophobicContact CG-CD1 4.03Å; E280-L284 WeakPolarHBondContact O-CG 3.48Å; E280-L284 PolarHBondContact O-N 2.72Å; E280-L284 VanDerWaalsContact O-N 3.07Å; R281-L284 PolarHBondContact O-N 2.99Å; R281-L284 VanDerWaalsContact O-N 3.11Å; L284-S286 VanDerWaalsContact C-N 3.27Å; L284-S286 PolarHBondContact O-N 3.36Å; L284-Q287 PolarHBondContact O-N 3.15Å; L284-Q287 VanDerWaalsContact O-N 3.16Å; L284-E288 WeakPolarHBondContact O-CB 3.34Å; L284-E288 PolarHBondContact O-N 2.7Å
285	E	92.6	Very high	93.4	Very high	50 Å²	50	48.6 Å²	48.6	23%	0.234	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-39.3	176.2	-72.6	169.2	157.3	0	0	111.2	Q233 R281 R289	Q233-E285 PolarHBondContact NE2-OE1 3.13Å; R281-E285 VanDerWaalsContact CD-OE1 3.27Å; R281-E285 WeakPolarHBondContact CD-OE1 3.45Å; R281-E285 HydrophobicContact CG-CG 4.08Å; R281-E285 WeakPolarHBondContact CG-OE1 3.36Å; R281-E285 WeakPolarHBondContact O-CB 3.44Å; R281-E285 WeakPolarHBondContact O-CG 3.29Å; R281-E285 PolarHBondContact O-N 3.09Å; E285-R289 WeakPolarHBondContact O-CB 3.5Å; E285-R289 PolarHBondContact O-N 3.35Å
286	S	94.2	Very high	93.5	Very high	14 Å²	14	42.9 Å²	42.9	10%	0.098	20%	0.201	C	C	.	.	H	α-helix	trans	-72.1	-35.4	176.3	76.6	0	0	0	0	113.5	F186 R204 L282 V283 L284 A290	F186-S286 VanDerWaalsContact CE2-O 3.27Å; F186-S286 WeakPolarHBondContact CE2-O 3.5Å; R204-S286 WeakPolarHBondContact CD-OG 3.36Å; R204-S286 PolarHBondContact NE-OG 3.37Å; L282-S286 WeakPolarHBondContact O-CB 3.11Å; L282-S286 PolarHBondContact O-N 3.24Å; L282-S286 PolarHBondContact O-OG 2.85Å; V283-S286 PolarHBondContact O-N 3.23Å; V283-S286 PolarHBondContact O-OG 2.73Å; L284-S286 VanDerWaalsContact C-N 3.27Å; L284-S286 PolarHBondContact O-N 3.36Å; S286-A290 PolarHBondContact O-N 3.12Å
287	Q	95.7	Very high	93.7	Very high	26 Å²	26	42.7 Å²	42.7	12%	0.121	21%	0.205	C	C	.	.	H	α-helix	trans	-71.3	-38.5	176.5	-78.8	-176.7	-24.3	0	0	112.1	F186 F205 Q206 V283 L284 A290 Y291	F186-Q287 HydrophobicContact CE1-CG 4Å; F186-Q287 HydrophobicContact CZ-CB 4.37Å; F186-Q287 HydrophobicContact CZ-CG 3.69Å; F205-Q287 PolarHBondContact O-NE2 3.27Å; Q206-Q287 PolarHBondContact NE2-O 3.29Å; Q206-Q287 VanDerWaalsContact OE1-CB 3.3Å; V283-Q287 HydrophobicContact CG1-CG 4.49Å; V283-Q287 WeakPolarHBondContact O-CG 3.48Å; V283-Q287 PolarHBondContact O-N 2.93Å; L284-Q287 PolarHBondContact O-N 3.15Å; L284-Q287 VanDerWaalsContact O-N 3.16Å; Q287-A290 PolarHBondContact O-N 2.65Å; Q287-Y291 PolarHBondContact O-N 3.21Å; Q287-Y291 VanDerWaalsContact O-N 3.13Å
288	E	94.9	Very high	93.7	Very high	36 Å²	36	39 Å²	39	17%	0.168	19%	0.186	C	C	.	.	H	α-helix	trans	-65.8	-42.9	173.1	-171.5	178.4	-170.5	0	0	111.2	Y226 K229 L284 A290 Y291 W292	Y226-E288 HydrophobicContact CD2-CG 3.85Å; Y226-E288 WeakPolarHBondContact CD2-OE1 3.24Å; Y226-E288 HydrophobicContact CE2-CG 3.83Å; K229-E288 WeakPolarHBondContact CE-OE1 3.34Å; K229-E288 WeakPolarHBondContact CE-OE2 3.37Å; K229-E288 IonicContact NZ-OE1 2.77Å; K229-E288 PolarHBondContact NZ-OE1 3.32Å; K229-E288 IonicContact NZ-OE2 2.74Å; K229-E288 PolarHBondContact NZ-OE2 3.37Å; L284-E288 WeakPolarHBondContact O-CB 3.34Å; L284-E288 PolarHBondContact O-N 2.7Å; E288-A290 PolarHBondContact O-N 3.44Å; E288-Y291 PolarHBondContact O-N 2.8Å; E288-W292 PolarHBondContact O-N 2.96Å; E288-W292 VanDerWaalsContact O-N 3.14Å
289	R	95.1	Very high	94	Very high	26 Å²	26	36.8 Å²	36.8	10%	0.098	19%	0.187	C	C	.	.	H	α-helix	trans	-56.6	-50.9	172.4	-176.8	-177.1	62.5	78.6	-13.7	111.8	C187 I188 D190 Y226 E285 Y291 W292 D293	C187-R289 PolarHBondContact O-NH2 3.12Å; I188-R289 PolarHBondContact O-NH2 2.93Å; D190-R289 PolarHBondContact O-NH1 3.04Å; D190-R289 PolarHBondContact O-NH2 3.35Å; Y226-R289 WeakPolarHBondContact OH-CA 3.29Å; Y226-R289 WeakPolarHBondContact OH-CB 3.34Å; E285-R289 WeakPolarHBondContact O-CB 3.5Å; E285-R289 PolarHBondContact O-N 3.35Å; R289-Y291 VanDerWaalsContact C-N 3.25Å; R289-Y291 PolarHBondContact O-N 3.16Å; R289-W292 CarbonylContact O-C 3.6Å; R289-W292 WeakPolarHBondContact O-CA 3.37Å; R289-W292 PolarHBondContact O-N 3.23Å; R289-D293 WeakPolarHBondContact CG-OD2 3.22Å; R289-D293 IonicContact CZ-OD2 3.59Å; R289-D293 IonicContact NH1-OD2 2.65Å; R289-D293 PolarHBondContact NH1-OD2 3.41Å; R289-D293 PolarHBondContact O-N 3.38Å
290	A	95.9	Very high	94.1	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-63.6	-28.4	-178	0	0	0	0	0	114.1	F186 S286 Q287 E288 L294	F186-A290 HydrophobicContact CB-CB 3.67Å; F186-A290 HydrophobicContact CD1-CB 3.4Å; F186-A290 HydrophobicContact CD2-CB 3.54Å; F186-A290 HydrophobicContact CE1-CB 3.81Å; F186-A290 HydrophobicContact CE2-CB 3.92Å; F186-A290 HydrophobicContact CG-CB 3.25Å; F186-A290 HydrophobicContact CZ-CB 4.05Å; S286-A290 PolarHBondContact O-N 3.12Å; Q287-A290 PolarHBondContact O-N 2.65Å; E288-A290 PolarHBondContact O-N 3.44Å; A290-L294 PolarHBondContact O-N 3.23Å
291	Y	95.5	Very high	94.2	Very high	21 Å²	21	36.9 Å²	36.9	8%	0.082	21%	0.214	C	C	.	.	H	α-helix	trans	-66.9	-44.9	169.7	166.1	-93.7	0	0	0	111.2	L210 C215 A218 Q287 E288 R289 L294 H295	L210-Y291 HydrophobicContact CB-CD2 4.11Å; L210-Y291 HydrophobicContact CD2-CD2 3.88Å; L210-Y291 HydrophobicContact CD2-CE2 4.28Å; L210-Y291 HydrophobicContact CD2-CG 4.08Å; L210-Y291 HydrophobicContact CG-CD2 4.48Å; C215-Y291 HydrophobicContact CB-CE2 4.11Å; C215-Y291 PolarHBondContact SG-OH 3.19Å; A218-Y291 HydrophobicContact CB-CE1 4.44Å; A218-Y291 VanDerWaalsContact CB-OH 3.25Å; A218-Y291 WeakPolarHBondContact CB-OH 3.43Å; Q287-Y291 PolarHBondContact O-N 3.21Å; Q287-Y291 VanDerWaalsContact O-N 3.13Å; E288-Y291 PolarHBondContact O-N 2.8Å; R289-Y291 VanDerWaalsContact C-N 3.25Å; R289-Y291 PolarHBondContact O-N 3.16Å; Y291-L294 WeakPolarHBondContact O-CB 3.41Å; Y291-L294 PolarHBondContact O-N 3.23Å; Y291-H295 AromaticContact CD2-CD2 3.57Å; Y291-H295 AromaticContact CD2-NE2 3.77Å; Y291-H295 AromaticContact CE2-CD2 3.29Å; Y291-H295 WeakPolarHBondContact CE2-CD2 3.11Å; Y291-H295 AromaticContact CE2-NE2 3.29Å; Y291-H295 VanDerWaalsContact CE2-NE2 3.29Å; Y291-H295 WeakPolarHBondContact CE2-NE2 3.23Å; Y291-H295 AromaticContact CZ-CD2 3.67Å; Y291-H295 AromaticContact CZ-NE2 3.96Å; Y291-H295 PolarHBondContact O-CD2 3.35Å; Y291-H295 VanDerWaalsContact O-CD2 3.29Å; Y291-H295 PolarHBondContact O-N 2.84Å; Y291-H295 VanDerWaalsContact O-N 3.13Å
292	W	95.6	Very high	94.2	Very high	12 Å²	12	40.9 Å²	40.9	5%	0.045	24%	0.238	C	C	.	.	H	α-helix	trans	-69.1	-34.5	176.7	-70.9	115.1	0	0	0	113.4	A218 D222 Y223 Y226 E288 R289 L294 H295 R296	A218-W292 HydrophobicContact CB-CH2 4.34Å; A218-W292 HydrophobicContact CB-CZ3 3.89Å; D222-W292 HydrophobicContact CB-CH2 3.87Å; D222-W292 HydrophobicContact CB-CZ2 4.03Å; Y223-W292 HydrophobicContact CD2-CB 4.36Å; Y223-W292 AromaticContact CD2-CD2 3.5Å; Y223-W292 HydrophobicContact CD2-CD2 3.5Å; Y223-W292 VanDerWaalsContact CD2-CD2 3.5Å; Y223-W292 AromaticContact CD2-CE3 3.31Å; Y223-W292 HydrophobicContact CD2-CE3 3.31Å; Y223-W292 AromaticContact CD2-CG 3.97Å; Y223-W292 HydrophobicContact CD2-CG 3.97Å; Y223-W292 HydrophobicContact CD2-CH2 4.36Å; Y223-W292 HydrophobicContact CD2-CZ2 4.5Å; Y223-W292 AromaticContact CD2-CZ3 3.79Å; Y223-W292 HydrophobicContact CD2-CZ3 3.79Å; Y223-W292 HydrophobicContact CE2-CB 4.01Å; Y223-W292 HydrophobicContact CE2-CD2 4.08Å; Y223-W292 HydrophobicContact CE2-CE3 4.01Å; Y223-W292 HydrophobicContact CE2-CG 4.1Å; Y223-W292 HydrophobicContact CG-CD2 4.47Å; Y223-W292 AromaticContact CG-CE3 3.94Å; Y223-W292 HydrophobicContact CG-CE3 3.94Å; Y223-W292 HydrophobicContact CG-CH2 4.5Å; Y223-W292 AromaticContact CG-CZ3 3.96Å; Y223-W292 HydrophobicContact CG-CZ3 3.96Å; Y226-W292 HydrophobicContact CD1-CB 4.3Å; Y226-W292 AromaticContact CD1-CD1 3.45Å; Y226-W292 VanDerWaalsContact CD1-CD1 3.45Å; Y226-W292 HydrophobicContact CD1-CD2 4.32Å; Y226-W292 AromaticContact CD1-CG 3.77Å; Y226-W292 HydrophobicContact CD1-CG 3.77Å; Y226-W292 AromaticContact CD1-NE1 3.81Å; Y226-W292 AromaticContact CD2-CD1 3.37Å; Y226-W292 HydrophobicContact CD2-CG 4.42Å; Y226-W292 AromaticContact CD2-NE1 3.46Å; Y226-W292 HydrophobicContact CE1-CB 3.93Å; Y226-W292 AromaticContact CE1-CD1 3.6Å; Y226-W292 AromaticContact CE1-CG 3.85Å; Y226-W292 HydrophobicContact CE1-CG 3.85Å; Y226-W292 AromaticContact CE2-CD1 3.51Å; Y226-W292 HydrophobicContact CE2-CG 4.48Å; Y226-W292 AromaticContact CG-CD1 3.32Å; Y226-W292 HydrophobicContact CG-CD2 4.47Å; Y226-W292 HydrophobicContact CG-CG 4.06Å; Y226-W292 AromaticContact CG-NE1 3.28Å; Y226-W292 VanDerWaalsContact CG-NE1 3.28Å; Y226-W292 AromaticContact CZ-CD1 3.61Å; E288-W292 PolarHBondContact O-N 2.96Å; E288-W292 VanDerWaalsContact O-N 3.14Å; R289-W292 CarbonylContact O-C 3.6Å; R289-W292 WeakPolarHBondContact O-CA 3.37Å; R289-W292 PolarHBondContact O-N 3.23Å; W292-L294 PolarHBondContact O-N 2.78Å; W292-H295 PolarHBondContact O-N 3.38Å; W292-R296 HydrophobicContact CE3-CG 4.14Å; W292-R296 HydrophobicContact CZ3-CG 4.48Å; W292-R296 CarbonylContact O-C 3.58Å; W292-R296 WeakPolarHBondContact O-CA 3.17Å; W292-R296 WeakPolarHBondContact O-CB 3.33Å; W292-R296 PolarHBondContact O-N 3.12Å
293	D	95.6	Very high	94.2	Very high	4 Å²	4	39.4 Å²	39.4	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-65.2	-25.9	172.9	-66.9	-34.4	0	0	0	113	H191 L193 R289 P297	H191-D293 IonicContact CE1-OD1 3.44Å; H191-D293 IonicContact CG-OD1 3.32Å; H191-D293 IonicContact ND1-OD1 3.87Å; H191-D293 PolarHBondContact ND1-OD1 3.34Å; H191-D293 IonicContact ND1-OD2 3.77Å; H191-D293 PolarHBondContact ND1-OD2 3.16Å; L193-D293 HydrophobicContact CD1-CB 4.32Å; L193-D293 HydrophobicContact CD2-CB 4.26Å; L193-D293 HydrophobicContact CG-CB 4.23Å; R289-D293 WeakPolarHBondContact CG-OD2 3.22Å; R289-D293 IonicContact CZ-OD2 3.59Å; R289-D293 IonicContact NH1-OD2 2.65Å; R289-D293 PolarHBondContact NH1-OD2 3.41Å; R289-D293 PolarHBondContact O-N 3.38Å; D293-P297 VanDerWaalsContact O-CA 3.22Å; D293-P297 WeakPolarHBondContact O-CA 3.32Å; D293-P297 WeakPolarHBondContact O-CB 3.32Å
294	L	94.8	Very high	94.1	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-73.8	-47.9	170.9	171.2	70.4	0	0	0	111.6	L193 P212 A290 Y291 W292 T304 T305	L193-L294 HydrophobicContact CD1-CB 4.12Å; P212-L294 HydrophobicContact CB-CD2 4.47Å; P212-L294 HydrophobicContact CG-CD2 3.88Å; A290-L294 PolarHBondContact O-N 3.23Å; Y291-L294 WeakPolarHBondContact O-CB 3.41Å; Y291-L294 PolarHBondContact O-N 3.23Å; W292-L294 PolarHBondContact O-N 2.78Å; L294-T304 WeakPolarHBondContact CD1-OG1 3.32Å; L294-T305 HydrophobicContact CD1-CG2 4.26Å; L294-T305 HydrophobicContact CG-CG2 4.11Å
295	H	93.6	Very high	93.8	Very high	10 Å²	10	38.7 Å²	38.7	5%	0.046	23%	0.228	C	C	.	.	H	α-helix	trans	-89.1	-15.2	-171.4	-73.8	-80.7	0	0	0	114.6	C215 A218 Y291 W292	C215-H295 PolarHBondContact O-CE1 2.94Å; C215-H295 PolarHBondContact O-NE2 3.06Å; A218-H295 HydrophobicContact CB-CB 3.7Å; Y291-H295 AromaticContact CD2-CD2 3.57Å; Y291-H295 AromaticContact CD2-NE2 3.77Å; Y291-H295 AromaticContact CE2-CD2 3.29Å; Y291-H295 WeakPolarHBondContact CE2-CD2 3.11Å; Y291-H295 AromaticContact CE2-NE2 3.29Å; Y291-H295 VanDerWaalsContact CE2-NE2 3.29Å; Y291-H295 WeakPolarHBondContact CE2-NE2 3.23Å; Y291-H295 AromaticContact CZ-CD2 3.67Å; Y291-H295 AromaticContact CZ-NE2 3.96Å; Y291-H295 PolarHBondContact O-CD2 3.35Å; Y291-H295 VanDerWaalsContact O-CD2 3.29Å; Y291-H295 PolarHBondContact O-N 2.84Å; Y291-H295 VanDerWaalsContact O-N 3.13Å; W292-H295 PolarHBondContact O-N 3.38Å
296	R	94.2	Very high	93.5	Very high	60 Å²	60	41.8 Å²	41.8	23%	0.226	25%	0.246	C	C	.	.	S	Bend	trans	-142.1	60.7	179	-61	-64.7	-175.6	-81.5	-3.4	109.2	A218 T220 Y223 W292	A218-R296 PolarHBondContact O-NH2 3.16Å; T220-R296 PolarHBondContact OG1-NH2 3.43Å; Y223-R296 HydrophobicContact CD1-CG 3.86Å; Y223-R296 HydrophobicContact CD2-CG 4.2Å; Y223-R296 HydrophobicContact CE1-CB 3.99Å; Y223-R296 HydrophobicContact CE1-CG 3.8Å; Y223-R296 HydrophobicContact CE2-CB 4.19Å; Y223-R296 HydrophobicContact CE2-CG 4.16Å; Y223-R296 HydrophobicContact CG-CG 4.06Å; W292-R296 HydrophobicContact CE3-CG 4.14Å; W292-R296 HydrophobicContact CZ3-CG 4.48Å; W292-R296 CarbonylContact O-C 3.58Å; W292-R296 WeakPolarHBondContact O-CA 3.17Å; W292-R296 WeakPolarHBondContact O-CB 3.33Å; W292-R296 PolarHBondContact O-N 3.12Å
297	P	94.7	Very high	93.1	Very high	36 Å²	36	43 Å²	43	23%	0.234	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-64.2	155	-168.8	27	-36.6	0	0	0	113.5	D293 C301 N303	D293-P297 VanDerWaalsContact O-CA 3.22Å; D293-P297 WeakPolarHBondContact O-CA 3.32Å; D293-P297 WeakPolarHBondContact O-CB 3.32Å; P297-C301 HydrophobicContact CB-CB 4.05Å; P297-N303 HydrophobicContact CG-CB 4.14Å
298	P	94.2	Very high	92.7	Very high	16 Å²	16	46 Å²	46	10%	0.104	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-56.5	145.7	176.8	-24.6	33.5	0	0	0	112.7	H191 F243 G300 C301	H191-P298 HydrophobicContact CB-CG 3.79Å; F243-P298 HydrophobicContact CE1-CB 4.05Å; F243-P298 HydrophobicContact CE1-CG 4.13Å; F243-P298 HydrophobicContact CE2-CB 4.48Å; F243-P298 HydrophobicContact CE2-CG 4.41Å; F243-P298 HydrophobicContact CZ-CB 4.05Å; F243-P298 HydrophobicContact CZ-CG 3.79Å; P298-G300 PolarHBondContact O-N 3.33Å; P298-C301 VanDerWaalsContact O-CB 3.25Å; P298-C301 WeakPolarHBondContact O-CB 3.49Å; P298-C301 PolarHBondContact O-N 2.88Å
299	P	95.2	Very high	92.3	Very high	107 Å²	107	50.8 Å²	50.8	70%	0.695	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	130.5	178.1	-28.9	35.6	0	0	0	113	F243	F243-P299 HydrophobicContact CB-CG 3.87Å; F243-P299 HydrophobicContact CG-CG 4.42Å
300	G	93.3	Very high	91.9	Very high	85 Å²	85	58.8 Å²	58.8	88%	0.876	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.2	-11.9	-175.5	0	0	0	0	0	115.2	P298	P298-G300 PolarHBondContact O-N 3.33Å
301	C	93.6	Very high	91.4	Very high	51 Å²	51	63 Å²	63	35%	0.345	34%	0.341	S	S	.	.	S	Bend	trans	-79.3	148.4	170	-65.1	0	0	0	0	111.5	P297 P298	P297-C301 HydrophobicContact CB-CB 4.05Å; P298-C301 VanDerWaalsContact O-CB 3.25Å; P298-C301 WeakPolarHBondContact O-CB 3.49Å; P298-C301 PolarHBondContact O-N 2.88Å
302	I	91.6	Very high	90.6	Very high	144 Å²	144	65 Å²	65	74%	0.738	35%	0.353	S	S	*	.			trans	-77.8	122.8	177.2	-59.3	172.1	0	0	0	109.1	T304	I302-T304 PolarHBondContact O-N 2.91Å
303	N	91.2	Very high	89.9	Confident	43 Å²	43	67.6 Å²	67.6	23%	0.23	37%	0.372	C	S	.	.			trans	-69.1	115	170.8	-176.8	16.8	0	0	0	110.9	P297 T305 D306	P297-N303 HydrophobicContact CG-CB 4.14Å; N303-T305 VanDerWaalsContact CG-OG1 3.25Å; N303-T305 PolarHBondContact ND2-OG1 3.43Å; N303-T305 PolarHBondContact OD1-N 3.36Å; N303-T305 PolarHBondContact OD1-OG1 3.35Å; N303-D306 VanDerWaalsContact ND2-CG 3.26Å; N303-D306 PolarHBondContact ND2-OD1 3.36Å; N303-D306 PolarHBondContact ND2-OD2 2.92Å
304	T	90.5	Very high	89.1	Confident	33 Å²	33	76.2 Å²	76.2	20%	0.202	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8.7	179.3	48.2	0	0	0	0	113.9	R178 S181 L294 I302 D306	R178-T304 VanDerWaalsContact NH1-CG2 3.32Å; S181-T304 WeakPolarHBondContact O-CB 3.32Å; S181-T304 VanDerWaalsContact O-CG2 3.26Å; S181-T304 WeakPolarHBondContact O-CG2 3.25Å; S181-T304 PolarHBondContact O-OG1 3.43Å; L294-T304 WeakPolarHBondContact CD1-OG1 3.32Å; I302-T304 PolarHBondContact O-N 2.91Å; T304-D306 VanDerWaalsContact C-N 3.32Å
305	T	87.4	Confident	88.1	Confident	33 Å²	33	78.6 Å²	78.6	20%	0.202	42%	0.424	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	-15.2	175.8	67.2	0	0	0	0	113.1	L294 N303	L294-T305 HydrophobicContact CD1-CG2 4.26Å; L294-T305 HydrophobicContact CG-CG2 4.11Å; N303-T305 VanDerWaalsContact CG-OG1 3.25Å; N303-T305 PolarHBondContact ND2-OG1 3.43Å; N303-T305 PolarHBondContact OD1-N 3.36Å; N303-T305 PolarHBondContact OD1-OG1 3.35Å
306	D	87.3	Confident	87.1	Confident	115 Å²	115	87 Å²	87	62%	0.615	46%	0.461	S	S	*	.			trans	-67.4	140.8	-178.5	-70	-22	0	0	0	112.7	N303 T304	N303-D306 VanDerWaalsContact ND2-CG 3.26Å; N303-D306 PolarHBondContact ND2-OD1 3.36Å; N303-D306 PolarHBondContact ND2-OD2 2.92Å; T304-D306 VanDerWaalsContact C-N 3.32Å
307	I	85.2	Confident	85.8	Confident	39 Å²	39	92.6 Å²	92.6	20%	0.2	48%	0.482	C	S	.	.			trans	-125.5	127.2	-176.8	-54.5	174.4	0	0	0	110.1	P113 M216 M309 K311 L312	P113-I307 HydrophobicContact CB-CG2 4.41Å; P113-I307 HydrophobicContact CG-CG2 4.27Å; M216-I307 HydrophobicContact CE-CD1 4.21Å; I307-M309 PolarHBondContact O-N 2.63Å; I307-K311 HydrophobicContact CG2-CB 3.98Å; I307-K311 HydrophobicContact CG2-CD 4.24Å; I307-L312 HydrophobicContact CB-CD1 4.34Å; I307-L312 HydrophobicContact CB-CD2 3.98Å; I307-L312 HydrophobicContact CB-CG 4.07Å; I307-L312 HydrophobicContact CD1-CD2 4.23Å; I307-L312 HydrophobicContact CG2-CD2 3.75Å; I307-L312 HydrophobicContact CG2-CG 3.79Å
308	D	86.7	Confident	84.2	Confident	91 Å²	91	96.5 Å²	96.5	49%	0.487	51%	0.507	S	S	.	.			trans	-46.1	127.8	174.3	179.9	-38.1	0	0	0	112.2	R310 K311 L312	D308-R310 PolarHBondContact O-N 3.43Å; D308-R310 WeakPolarHBondContact OD1-CA 3.42Å; D308-R310 WeakPolarHBondContact OD1-CB 3.43Å; D308-R310 PolarHBondContact OD1-N 3.28Å; D308-K311 HydrophobicContact CB-CB 4.17Å; D308-K311 HydrophobicContact CB-CD 4.07Å; D308-K311 HydrophobicContact CB-CG 4.05Å; D308-K311 WeakPolarHBondContact O-CA 3.14Å; D308-K311 VanDerWaalsContact O-CB 3.24Å; D308-K311 WeakPolarHBondContact O-CB 3.35Å; D308-K311 PolarHBondContact O-N 3.11Å; D308-K311 PolarHBondContact OD1-N 3.25Å; D308-L312 PolarHBondContact O-N 2.72Å
309	M	86.7	Confident	82.7	Confident	136 Å²	136	102.4 Å²	102.4	67%	0.67	53%	0.531	S	S	*	.	H	α-helix	trans	-55.2	-37.9	-179.8	-169.3	63.2	68.8	0	0	112.9	I307 K311 L312 C313	I307-M309 PolarHBondContact O-N 2.63Å; M309-K311 VanDerWaalsContact C-N 3.31Å; M309-K311 PolarHBondContact O-N 3.18Å; M309-L312 PolarHBondContact O-N 2.87Å; M309-C313 WeakPolarHBondContact O-CB 3.24Å; M309-C313 PolarHBondContact O-N 3.21Å; M309-C313 PolarHBondContact O-SG 2.97Å
310	R	87	Confident	80.7	Confident	194 Å²	194	106.5 Å²	106.5	73%	0.732	54%	0.538	S	S	*	.	H	α-helix	trans	-66.8	-31.5	175.7	-55.7	175	170.7	-174.5	-2	111.6	D308 R314	D308-R310 PolarHBondContact O-N 3.43Å; D308-R310 WeakPolarHBondContact OD1-CA 3.42Å; D308-R310 WeakPolarHBondContact OD1-CB 3.43Å; D308-R310 PolarHBondContact OD1-N 3.28Å; R310-R314 WeakPolarHBondContact O-CB 3.39Å; R310-R314 WeakPolarHBondContact O-CD 3.34Å; R310-R314 WeakPolarHBondContact O-CG 3.41Å; R310-R314 PolarHBondContact O-N 2.97Å
311	K	85.2	Confident	78.5	Confident	88 Å²	88	108.9 Å²	108.9	38%	0.383	54%	0.536	S	S	.	.	H	α-helix	trans	-68.9	-49.4	171	-78.7	-178.8	170.4	-173.5	0	110.7	P113 N114 I307 D308 M309 C313 R314 A315	P113-K311 HydrophobicContact CB-CB 3.67Å; P113-K311 HydrophobicContact CB-CD 3.79Å; P113-K311 HydrophobicContact CB-CG 4.01Å; P113-K311 HydrophobicContact CG-CB 3.87Å; N114-K311 PolarHBondContact OD1-NZ 3.18Å; I307-K311 HydrophobicContact CG2-CB 3.98Å; I307-K311 HydrophobicContact CG2-CD 4.24Å; D308-K311 HydrophobicContact CB-CB 4.17Å; D308-K311 HydrophobicContact CB-CD 4.07Å; D308-K311 HydrophobicContact CB-CG 4.05Å; D308-K311 WeakPolarHBondContact O-CA 3.14Å; D308-K311 VanDerWaalsContact O-CB 3.24Å; D308-K311 WeakPolarHBondContact O-CB 3.35Å; D308-K311 PolarHBondContact O-N 3.11Å; D308-K311 PolarHBondContact OD1-N 3.25Å; M309-K311 VanDerWaalsContact C-N 3.31Å; M309-K311 PolarHBondContact O-N 3.18Å; K311-C313 PolarHBondContact O-N 3.33Å; K311-R314 WeakPolarHBondContact O-CB 3.37Å; K311-R314 PolarHBondContact O-N 3.18Å; K311-A315 PolarHBondContact O-N 3.44Å
312	L	80	Confident	76.3	Confident	64 Å²	64	112 Å²	112	34%	0.335	55%	0.554	S	S	.	*	H	α-helix	trans	-58.6	-47.3	178.2	-66.8	173.8	0	0	0	112	I307 D308 M309 R314 A315 K316	I307-L312 HydrophobicContact CB-CD1 4.34Å; I307-L312 HydrophobicContact CB-CD2 3.98Å; I307-L312 HydrophobicContact CB-CG 4.07Å; I307-L312 HydrophobicContact CD1-CD2 4.23Å; I307-L312 HydrophobicContact CG2-CD2 3.75Å; I307-L312 HydrophobicContact CG2-CG 3.79Å; D308-L312 PolarHBondContact O-N 2.72Å; M309-L312 PolarHBondContact O-N 2.87Å; L312-R314 PolarHBondContact O-N 2.92Å; L312-A315 PolarHBondContact O-N 2.9Å; L312-K316 PolarHBondContact O-N 3.42Å; L312-K316 VanDerWaalsContact O-N 3.16Å
313	C	80.8	Confident	74	Confident	65 Å²	65	110.2 Å²	110.2	44%	0.439	55%	0.554	S	S	.	*	H	α-helix	trans	-65.9	-21.2	175.8	-67.5	0	0	0	0	113.8	M309 K311 R317	M309-C313 WeakPolarHBondContact O-CB 3.24Å; M309-C313 PolarHBondContact O-N 3.21Å; M309-C313 PolarHBondContact O-SG 2.97Å; K311-C313 PolarHBondContact O-N 3.33Å; C313-R317 WeakPolarHBondContact O-CG 3.37Å
314	R	78.9	Confident	71.9	Confident	186 Å²	186	117.4 Å²	117.4	70%	0.702	58%	0.578	S	S	*	*	H	α-helix	trans	-81.5	-41.3	173.5	-78.9	170.6	-173.3	-140.1	3.6	111.8	R310 K311 L312 K316 R317	R310-R314 WeakPolarHBondContact O-CB 3.39Å; R310-R314 WeakPolarHBondContact O-CD 3.34Å; R310-R314 WeakPolarHBondContact O-CG 3.41Å; R310-R314 PolarHBondContact O-N 2.97Å; K311-R314 WeakPolarHBondContact O-CB 3.37Å; K311-R314 PolarHBondContact O-N 3.18Å; L312-R314 PolarHBondContact O-N 2.92Å; R314-K316 VanDerWaalsContact C-N 3.33Å; R314-K316 PolarHBondContact O-N 3.44Å; R314-R317 PolarHBondContact O-N 2.97Å
315	A	73.6	Confident	69.7	Low	54 Å²	54	120.2 Å²	120.2	45%	0.446	60%	0.596	S	S	.	*	H	α-helix	trans	-61.8	-39.8	176.3	0	0	0	0	0	112.2	P113 K311 L312 R317	P113-A315 HydrophobicContact CG-CB 4.02Å; K311-A315 PolarHBondContact O-N 3.44Å; L312-A315 PolarHBondContact O-N 2.9Å; A315-R317 PolarHBondContact O-N 3.12Å
316	K	71.3	Confident	67.9	Low	188 Å²	188	125.7 Å²	125.7	82%	0.817	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.3	0.6	177.5	-65.7	-173.5	178.9	-175.4	0	115.1	L312 R314	L312-K316 PolarHBondContact O-N 3.42Å; L312-K316 VanDerWaalsContact O-N 3.16Å; R314-K316 VanDerWaalsContact C-N 3.33Å; R314-K316 PolarHBondContact O-N 3.44Å
317	R	67.1	Low	65.9	Low	176 Å²	176	126.6 Å²	126.6	66%	0.664	63%	0.628	S	S	*	*	S	Bend	trans	-85.5	138.5	174.2	-78.5	170.5	-176.3	-158.3	-2.7	109.8	C313 R314 A315 K319	C313-R317 WeakPolarHBondContact O-CG 3.37Å; R314-R317 PolarHBondContact O-N 2.97Å; A315-R317 PolarHBondContact O-N 3.12Å; R317-K319 PolarHBondContact O-N 3.35Å; R317-K319 VanDerWaalsContact O-N 3.12Å
318	P	61.3	Low	64.3	Low	119 Å²	119	132.5 Å²	132.5	77%	0.773	65%	0.652	S	S	*	*			trans	-57.2	122.4	175.3	23.7	-33.2	0	0	0	109.8	K320	P318-K320 PolarHBondContact O-N 3.41Å
319	K	62.8	Low	62.4	Low	139 Å²	139	130.7 Å²	130.7	60%	0.604	65%	0.645	S	S	*	*			trans	-61.9	93.9	178.7	-66.7	172.2	-177.3	168.8	0	108.7	R317 T321	R317-K319 PolarHBondContact O-N 3.35Å; R317-K319 VanDerWaalsContact O-N 3.12Å; K319-T321 PolarHBondContact O-N 3.13Å; K319-T321 VanDerWaalsContact O-N 3.13Å
320	K	53.5	Low	60.7	Low	194 Å²	194	131 Å²	131	84%	0.843	65%	0.648	S	S	*	*			trans	-55.7	121.5	171.6	-78.4	-167.9	174.7	-172.4	0	108.2	P318 T322	P318-K320 PolarHBondContact O-N 3.41Å; K320-T322 PolarHBondContact O-N 3.38Å
321	T	47.7	Very low	58.9	Low	134 Å²	134	126.1 Å²	126.1	82%	0.822	64%	0.641	S	S	*	*			trans	-53.9	122.7	178.5	40.4	0	0	0	0	109.2	K319 S323	K319-T321 PolarHBondContact O-N 3.13Å; K319-T321 VanDerWaalsContact O-N 3.13Å; T321-S323 VanDerWaalsContact C-N 3.35Å; T321-S323 PolarHBondContact O-N 3.44Å
322	T	45.6	Very low	57.1	Low	117 Å²	117	126.7 Å²	126.7	72%	0.718	66%	0.657	S	S	*	*			trans	-81.3	84.7	-169.6	-59.9	0	0	0	0	109.5	K320 R324	K320-T322 PolarHBondContact O-N 3.38Å; T322-R324 HydrophobicContact CG2-CB 4.47Å; T322-R324 PolarHBondContact O-N 3.49Å
323	S	44.7	Very low	55.9	Low	106 Å²	106	125.5 Å²	125.5	74%	0.741	66%	0.66	S	S	*	*			trans	-67.3	19.2	177.5	59.8	0	0	0	0	114.6	T321	T321-S323 VanDerWaalsContact C-N 3.35Å; T321-S323 PolarHBondContact O-N 3.44Å
324	R	46.5	Very low	54.8	Low	195 Å²	195	129.3 Å²	129.3	74%	0.736	68%	0.684	S	S	*	*			trans	-129.1	96	-175.9	-66.7	-172.9	177.8	-164.3	-2.3	109.6	T322 I326	T322-R324 HydrophobicContact CG2-CB 4.47Å; T322-R324 PolarHBondContact O-N 3.49Å; R324-I326 PolarHBondContact O-N 3.36Å; R324-I326 VanDerWaalsContact O-N 3.12Å
325	P	43.8	Very low	53.6	Low	91 Å²	91	125.5 Å²	125.5	59%	0.591	68%	0.677	S	S	*	*			trans	-61.5	113.6	159.9	26.3	-32.3	0	0	0	108.1	N327	P325-N327 VanDerWaalsContact C-N 3.28Å
326	I	49.5	Very low	52.7	Low	149 Å²	149	124.5 Å²	124.5	76%	0.764	67%	0.672	S	S	*	*			trans	-79.6	-14.3	-178.1	-72.6	174.7	0	0	0	111.7	R324	R324-I326 PolarHBondContact O-N 3.36Å; R324-I326 VanDerWaalsContact O-N 3.12Å
327	N	47	Very low	51.8	Low	133 Å²	133	118.8 Å²	118.8	71%	0.711	66%	0.656	S	S	*	*			trans	-85.9	113.2	175.9	-65.5	-2	0	0	0	110.8	P325 P329	P325-N327 VanDerWaalsContact C-N 3.28Å; N327-P329 WeakPolarHBondContact O-CD 3.47Å
328	F	50.8	Low	51.3	Low	164 Å²	164	114 Å²	114	72%	0.719	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-69.2	121.4	151.8	-91.1	-90.4	0	0	0	107.9
329	P	47	Very low	51	Low	52 Å²	52	113.1 Å²	113.1	34%	0.338	63%	0.631	S	S	.	*	P	Polyproline II helix	trans	-65.8	136	169.4	28.5	-32.6	0	0	0	109.2	N327 I338 V342	N327-P329 WeakPolarHBondContact O-CD 3.47Å; P329-I338 HydrophobicContact CB-CG2 3.82Å; P329-I338 HydrophobicContact CG-CG2 3.86Å; P329-V342 HydrophobicContact CG-CG2 3.85Å
330	I	51.5	Low	51	Low	144 Å²	144	112.3 Å²	112.3	74%	0.738	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-68.9	125.8	169	-60.4	175	0	0	0	106.7	S332	I330-S332 PolarHBondContact O-N 2.73Å
331	P	49.2	Very low	51.6	Low	90 Å²	90	106 Å²	106	58%	0.584	61%	0.608	S	S	*	*			trans	-71.2	105	-177.2	27.2	-33.2	0	0	0	110.4	L339	P331-L339 HydrophobicContact CB-CD1 4.38Å
332	S	46.5	Very low	52.5	Low	101 Å²	101	101.2 Å²	101.2	71%	0.706	58%	0.579	S	S	*	*			trans	-125	70.8	176.5	-61.1	0	0	0	0	109.8	I330	I330-S332 PolarHBondContact O-N 2.73Å
333	G	55	Low	53.6	Low	38 Å²	38	96.6 Å²	96.6	39%	0.392	55%	0.549	S	S	.	.	S	Bend	trans	-167.5	143.8	177.5	0	0	0	0	0	110.9	D335	G333-D335 PolarHBondContact O-N 3.35Å
334	P	56.5	Low	54.8	Low	146 Å²	146	96.7 Å²	96.7	95%	0.948	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-15.1	-177.9	-18.6	32.5	0	0	0	114.7
335	D	54.4	Low	56.2	Low	106 Å²	106	91.6 Å²	91.6	57%	0.567	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.9	-13.9	-159.9	62.2	-63.7	0	0	0	113.9	G333 S337	G333-D335 PolarHBondContact O-N 3.35Å; D335-S337 PolarHBondContact O-N 2.9Å; D335-S337 VanDerWaalsContact O-N 3.13Å; D335-S337 WeakPolarHBondContact OD2-CB 3.39Å; D335-S337 PolarHBondContact OD2-N 2.91Å; D335-S337 PolarHBondContact OD2-OG 2.61Å
336	G	54.2	Low	57.8	Low	33 Å²	33	89.6 Å²	89.6	34%	0.34	53%	0.534	S	S	.	.			trans	69.9	1.5	174.9	0	0	0	0	0	116.5	I338 L339	G336-I338 VanDerWaalsContact C-N 3.28Å; G336-I338 PolarHBondContact O-N 2.76Å; G336-L339 VanDerWaalsContact O-CB 3.24Å; G336-L339 WeakPolarHBondContact O-CB 3.32Å; G336-L339 PolarHBondContact O-N 3.03Å
337	S	54.1	Low	59.4	Low	67 Å²	67	85.3 Å²	85.3	47%	0.469	52%	0.517	S	S	.	.	H	α-helix	trans	-54.1	-41.5	-178.4	59.1	0	0	0	0	113.4	D335 L339 F340 S341	D335-S337 PolarHBondContact O-N 2.9Å; D335-S337 VanDerWaalsContact O-N 3.13Å; D335-S337 WeakPolarHBondContact OD2-CB 3.39Å; D335-S337 PolarHBondContact OD2-N 2.91Å; D335-S337 PolarHBondContact OD2-OG 2.61Å; S337-L339 PolarHBondContact O-N 3.36Å; S337-L339 VanDerWaalsContact O-N 3.15Å; S337-F340 PolarHBondContact O-N 3.44Å; S337-F340 VanDerWaalsContact O-N 3.12Å; S337-S341 PolarHBondContact O-N 2.91Å
338	I	55.2	Low	61.1	Low	75 Å²	75	85.2 Å²	85.2	39%	0.385	52%	0.516	S	S	.	.	H	α-helix	trans	-59.8	-24.4	177.7	-57	173.5	0	0	0	112.4	P329 G336 S341	P329-I338 HydrophobicContact CB-CG2 3.82Å; P329-I338 HydrophobicContact CG-CG2 3.86Å; G336-I338 VanDerWaalsContact C-N 3.28Å; G336-I338 PolarHBondContact O-N 2.76Å; I338-S341 PolarHBondContact O-OG 3.49Å
339	L	55.7	Low	62.7	Low	102 Å²	102	86.1 Å²	86.1	53%	0.534	52%	0.515	S	S	.	.	H	α-helix	trans	-77	-24.6	-179.3	-161.7	139.7	0	0	0	112.3	P331 G336 S337	P331-L339 HydrophobicContact CB-CD1 4.38Å; G336-L339 VanDerWaalsContact O-CB 3.24Å; G336-L339 WeakPolarHBondContact O-CB 3.32Å; G336-L339 PolarHBondContact O-N 3.03Å; S337-L339 PolarHBondContact O-N 3.36Å; S337-L339 VanDerWaalsContact O-N 3.15Å
340	F	61.9	Low	64.4	Low	121 Å²	121	87.4 Å²	87.4	53%	0.531	52%	0.519	S	S	.	.	H	α-helix	trans	-99.8	-20.1	179.9	-72.3	-74.3	0	0	0	114.3	S337 V342 L343	S337-F340 PolarHBondContact O-N 3.44Å; S337-F340 VanDerWaalsContact O-N 3.12Å; F340-V342 PolarHBondContact O-N 3.16Å; F340-V342 VanDerWaalsContact O-N 3.15Å; F340-L343 HydrophobicContact CD1-CD1 3.96Å; F340-L343 HydrophobicContact CE1-CD1 4.46Å; F340-L343 WeakPolarHBondContact O-CA 3.38Å; F340-L343 VanDerWaalsContact O-CB 3.26Å; F340-L343 WeakPolarHBondContact O-CB 3.46Å; F340-L343 PolarHBondContact O-N 3.48Å
341	S	66.9	Low	65.7	Low	63 Å²	63	84.3 Å²	84.3	44%	0.441	50%	0.498	S	S	.	.	H	α-helix	trans	-59.7	-26.8	175.9	64.4	0	0	0	0	113.4	S337 I338 L343 D344	S337-S341 PolarHBondContact O-N 2.91Å; I338-S341 PolarHBondContact O-OG 3.49Å; S341-L343 PolarHBondContact O-N 3.17Å; S341-L343 VanDerWaalsContact O-N 3.16Å; S341-D344 PolarHBondContact O-N 3.11Å
342	V	65.7	Low	67.4	Low	33 Å²	33	83.8 Å²	83.8	20%	0.2	49%	0.489	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-9.6	172	179.3	0	0	0	0	112.8	P329 F340 K354	P329-V342 HydrophobicContact CG-CG2 3.85Å; F340-V342 PolarHBondContact O-N 3.16Å; F340-V342 VanDerWaalsContact O-N 3.15Å; V342-K354 PolarHBondContact O-NZ 3.44Å
343	L	68.8	Low	69	Low	20 Å²	20	82.6 Å²	82.6	11%	0.105	48%	0.475	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.4	-9.4	172.4	-54.3	-167.4	0	0	0	113.3	F340 S341 L346 R351 K354	F340-L343 HydrophobicContact CD1-CD1 3.96Å; F340-L343 HydrophobicContact CE1-CD1 4.46Å; F340-L343 WeakPolarHBondContact O-CA 3.38Å; F340-L343 VanDerWaalsContact O-CB 3.26Å; F340-L343 WeakPolarHBondContact O-CB 3.46Å; F340-L343 PolarHBondContact O-N 3.48Å; S341-L343 PolarHBondContact O-N 3.17Å; S341-L343 VanDerWaalsContact O-N 3.16Å; L343-L346 HydrophobicContact CD2-CD1 4.36Å; L343-L346 WeakPolarHBondContact O-CB 3.33Å; L343-L346 WeakPolarHBondContact O-CG 3.49Å; L343-L346 PolarHBondContact O-N 3.43Å; L343-R351 HydrophobicContact CB-CG 4.18Å; L343-R351 VanDerWaalsContact O-CZ 3.26Å; L343-R351 PolarHBondContact O-NE 3.21Å; L343-R351 PolarHBondContact O-NH2 3.3Å; L343-K354 HydrophobicContact CD2-CB 3.92Å; L343-K354 HydrophobicContact CD2-CD 3.5Å; L343-K354 HydrophobicContact CD2-CG 4.36Å
344	D	71.6	Confident	70	Confident	107 Å²	107	84 Å²	84	57%	0.572	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.1	148.1	-178.7	-70.4	-39.5	0	0	0	113	S341 L346 R351	S341-D344 PolarHBondContact O-N 3.11Å; D344-L346 PolarHBondContact O-N 3.02Å; D344-L346 VanDerWaalsContact O-N 3.16Å; D344-R351 IonicContact OD1-CZ 2.95Å; D344-R351 IonicContact OD1-NH2 3.46Å; D344-R351 PolarHBondContact OD1-NH2 2.98Å
345	G	74.6	Confident	71.1	Confident	89 Å²	89	81.2 Å²	81.2	92%	0.918	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-8.4	-169.1	0	0	0	0	0	116
346	L	77.4	Confident	72.3	Confident	49 Å²	49	82.2 Å²	82.2	26%	0.257	45%	0.448	S	S	.	.			trans	-81.2	153.4	-179.9	-60	-174.6	0	0	0	113.6	L343 D344 D350 R351 K354	L343-L346 HydrophobicContact CD2-CD1 4.36Å; L343-L346 WeakPolarHBondContact O-CB 3.33Å; L343-L346 WeakPolarHBondContact O-CG 3.49Å; L343-L346 PolarHBondContact O-N 3.43Å; D344-L346 PolarHBondContact O-N 3.02Å; D344-L346 VanDerWaalsContact O-N 3.16Å; L346-D350 HydrophobicContact CB-CB 4.07Å; L346-D350 HydrophobicContact CD1-CB 4.28Å; L346-R351 HydrophobicContact CB-CG 3.93Å; L346-R351 HydrophobicContact CD1-CG 4.5Å; L346-K354 HydrophobicContact CD1-CD 3.64Å; L346-K354 VanDerWaalsContact CD1-CE 3.48Å
347	S	84.5	Confident	73.3	Confident	58 Å²	58	85.1 Å²	85.1	41%	0.406	46%	0.459	S	S	.	.			trans	-67.3	157	168.3	85.8	0	0	0	0	111.3	R349 D350 R351	S347-R349 PolarHBondContact O-N 3.5Å; S347-R349 PolarHBondContact OG-N 3.35Å; S347-D350 VanDerWaalsContact CB-OD2 3.25Å; S347-D350 WeakPolarHBondContact CB-OD2 3.29Å; S347-D350 PolarHBondContact N-OD2 3.23Å; S347-D350 PolarHBondContact O-N 3.37Å; S347-D350 VanDerWaalsContact O-N 3.16Å; S347-D350 PolarHBondContact OG-N 2.97Å; S347-D350 PolarHBondContact OG-OD2 2.81Å; S347-R351 WeakPolarHBondContact O-CG 3.34Å; S347-R351 PolarHBondContact O-N 3.24Å
348	L	82.6	Confident	74.2	Confident	131 Å²	131	85 Å²	85	69%	0.686	46%	0.458	S	S	*	.	H	α-helix	trans	-57.3	-32.8	177.5	-173.5	65	0	0	0	112.4	I352	L348-I352 HydrophobicContact CG-CD1 4.1Å; L348-I352 WeakPolarHBondContact O-CD1 3.44Å; L348-I352 VanDerWaalsContact O-CG1 3.29Å; L348-I352 WeakPolarHBondContact O-CG1 3.3Å; L348-I352 PolarHBondContact O-N 3.42Å
349	R	83.2	Confident	75.2	Confident	184 Å²	184	86.1 Å²	86.1	69%	0.694	47%	0.472	S	S	*	.	H	α-helix	trans	-66.9	-51.1	175.6	178.9	172	-70.1	-79.1	3.6	111.3	S347 R351 I352 D353	S347-R349 PolarHBondContact O-N 3.5Å; S347-R349 PolarHBondContact OG-N 3.35Å; R349-R351 PolarHBondContact O-N 3.02Å; R349-I352 PolarHBondContact O-N 3.45Å; R349-D353 WeakPolarHBondContact CG-OD2 3.34Å; R349-D353 VanDerWaalsContact O-CG 3.29Å; R349-D353 PolarHBondContact O-N 2.85Å
350	D	82.5	Confident	76.3	Confident	79 Å²	79	90.8 Å²	90.8	42%	0.422	48%	0.483	S	S	.	.	H	α-helix	trans	-59.6	-34.2	177.4	-59.1	-68.3	0	0	0	112.2	L346 S347 K354	L346-D350 HydrophobicContact CB-CB 4.07Å; L346-D350 HydrophobicContact CD1-CB 4.28Å; S347-D350 VanDerWaalsContact CB-OD2 3.25Å; S347-D350 WeakPolarHBondContact CB-OD2 3.29Å; S347-D350 PolarHBondContact N-OD2 3.23Å; S347-D350 PolarHBondContact O-N 3.37Å; S347-D350 VanDerWaalsContact O-N 3.16Å; S347-D350 PolarHBondContact OG-N 2.97Å; S347-D350 PolarHBondContact OG-OD2 2.81Å; D350-K354 WeakPolarHBondContact O-CB 3.34Å; D350-K354 WeakPolarHBondContact O-CG 3.31Å; D350-K354 PolarHBondContact O-N 3.07Å
351	R	80.1	Confident	77.3	Confident	79 Å²	79	91.6 Å²	91.6	30%	0.298	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-48.3	173	-69.2	-178.5	164.6	-156.4	-15.2	111.5	L343 D344 L346 S347 R349 K354 L355	L343-R351 HydrophobicContact CB-CG 4.18Å; L343-R351 VanDerWaalsContact O-CZ 3.26Å; L343-R351 PolarHBondContact O-NE 3.21Å; L343-R351 PolarHBondContact O-NH2 3.3Å; D344-R351 IonicContact OD1-CZ 2.95Å; D344-R351 IonicContact OD1-NH2 3.46Å; D344-R351 PolarHBondContact OD1-NH2 2.98Å; L346-R351 HydrophobicContact CB-CG 3.93Å; L346-R351 HydrophobicContact CD1-CG 4.5Å; S347-R351 WeakPolarHBondContact O-CG 3.34Å; S347-R351 PolarHBondContact O-N 3.24Å; R349-R351 PolarHBondContact O-N 3.02Å; R351-K354 PolarHBondContact O-N 3.32Å; R351-L355 WeakPolarHBondContact O-CG 3.24Å; R351-L355 PolarHBondContact O-N 3.36Å
352	I	83.2	Confident	78.3	Confident	78 Å²	78	96.2 Å²	96.2	40%	0.4	51%	0.509	S	S	.	.	H	α-helix	trans	-62.6	-44.4	177.5	-72.3	165.5	0	0	0	110.8	L348 R349 K354 L355 H356	L348-I352 HydrophobicContact CG-CD1 4.1Å; L348-I352 WeakPolarHBondContact O-CD1 3.44Å; L348-I352 VanDerWaalsContact O-CG1 3.29Å; L348-I352 WeakPolarHBondContact O-CG1 3.3Å; L348-I352 PolarHBondContact O-N 3.42Å; R349-I352 PolarHBondContact O-N 3.45Å; I352-K354 PolarHBondContact O-N 2.86Å; I352-L355 CarbonylContact O-C 3.52Å; I352-L355 PolarHBondContact O-N 3.21Å; I352-L355 VanDerWaalsContact O-N 3.07Å; I352-H356 PolarHBondContact O-CD2 2.69Å; I352-H356 PolarHBondContact O-N 3.5Å
353	D	81.2	Confident	79.5	Confident	76 Å²	76	100.6 Å²	100.6	41%	0.406	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-36.9	179.5	-63.7	-26.4	0	0	0	112	R349 T357	R349-D353 WeakPolarHBondContact CG-OD2 3.34Å; R349-D353 VanDerWaalsContact O-CG 3.29Å; R349-D353 PolarHBondContact O-N 2.85Å; D353-T357 PolarHBondContact O-N 3.21Å; D353-T357 PolarHBondContact O-OG1 2.87Å
354	K	75.9	Confident	80.7	Confident	67 Å²	67	107.6 Å²	107.6	29%	0.291	56%	0.56	S	S	.	*	H	α-helix	trans	-63.7	-39.4	168.8	-79.9	-170.1	-178.6	-166.9	0	112.4	V342 L343 L346 D350 R351 I352 T357 C358	V342-K354 PolarHBondContact O-NZ 3.44Å; L343-K354 HydrophobicContact CD2-CB 3.92Å; L343-K354 HydrophobicContact CD2-CD 3.5Å; L343-K354 HydrophobicContact CD2-CG 4.36Å; L346-K354 HydrophobicContact CD1-CD 3.64Å; L346-K354 VanDerWaalsContact CD1-CE 3.48Å; D350-K354 WeakPolarHBondContact O-CB 3.34Å; D350-K354 WeakPolarHBondContact O-CG 3.31Å; D350-K354 PolarHBondContact O-N 3.07Å; R351-K354 PolarHBondContact O-N 3.32Å; I352-K354 PolarHBondContact O-N 2.86Å; K354-T357 WeakPolarHBondContact O-CB 3.42Å; K354-T357 PolarHBondContact O-N 3.32Å; K354-C358 PolarHBondContact O-N 3Å; K354-C358 VanDerWaalsContact O-N 3.11Å
355	L	78.9	Confident	81.8	Confident	89 Å²	89	107.5 Å²	107.5	47%	0.466	57%	0.568	S	S	.	*	H	α-helix	trans	-68.9	-40	177.2	-71.6	169	0	0	0	112.2	R351 I352 T357 C358 S359	R351-L355 WeakPolarHBondContact O-CG 3.24Å; R351-L355 PolarHBondContact O-N 3.36Å; I352-L355 CarbonylContact O-C 3.52Å; I352-L355 PolarHBondContact O-N 3.21Å; I352-L355 VanDerWaalsContact O-N 3.07Å; L355-T357 VanDerWaalsContact C-N 3.25Å; L355-T357 PolarHBondContact O-N 3.45Å; L355-C358 WeakPolarHBondContact O-CA 3.4Å; L355-C358 VanDerWaalsContact O-CB 3.32Å; L355-C358 WeakPolarHBondContact O-CB 3.36Å; L355-C358 PolarHBondContact O-N 3.46Å; L355-S359 PolarHBondContact O-N 3.27Å
356	H	79.6	Confident	82.9	Confident	127 Å²	127	107.5 Å²	107.5	59%	0.588	55%	0.554	S	S	*	*	H	α-helix	trans	-59.9	-36.4	169.4	-74.9	-64.8	0	0	0	112.1	I352 C358 S359	I352-H356 PolarHBondContact O-CD2 2.69Å; I352-H356 PolarHBondContact O-N 3.5Å; H356-C358 VanDerWaalsContact C-N 3.26Å; H356-C358 PolarHBondContact O-N 2.89Å; H356-S359 WeakPolarHBondContact O-CB 3.46Å; H356-S359 PolarHBondContact O-N 3.23Å; H356-S359 VanDerWaalsContact O-N 3.13Å
357	T	75.8	Confident	83.8	Confident	93 Å²	93	110.3 Å²	110.3	57%	0.571	56%	0.564	S	S	*	*	H	α-helix	trans	-64	-30.8	173.7	-54.7	0	0	0	0	112.1	D353 K354 L355 S359 R360	D353-T357 PolarHBondContact O-N 3.21Å; D353-T357 PolarHBondContact O-OG1 2.87Å; K354-T357 WeakPolarHBondContact O-CB 3.42Å; K354-T357 PolarHBondContact O-N 3.32Å; L355-T357 VanDerWaalsContact C-N 3.25Å; L355-T357 PolarHBondContact O-N 3.45Å; T357-S359 VanDerWaalsContact C-N 3.32Å; T357-S359 PolarHBondContact O-N 3.26Å; T357-R360 WeakPolarHBondContact O-CB 3.37Å; T357-R360 PolarHBondContact O-N 2.76Å
358	C	72.8	Confident	84.4	Confident	66 Å²	66	108.8 Å²	108.8	45%	0.446	56%	0.555	S	S	.	*	H	α-helix	trans	-69.3	-26.2	173.6	-73.6	0	0	0	0	113.7	K354 L355 H356 R360	K354-C358 PolarHBondContact O-N 3Å; K354-C358 VanDerWaalsContact O-N 3.11Å; L355-C358 WeakPolarHBondContact O-CA 3.4Å; L355-C358 VanDerWaalsContact O-CB 3.32Å; L355-C358 WeakPolarHBondContact O-CB 3.36Å; L355-C358 PolarHBondContact O-N 3.46Å; H356-C358 VanDerWaalsContact C-N 3.26Å; H356-C358 PolarHBondContact O-N 2.89Å; C358-R360 PolarHBondContact O-N 2.59Å
359	S	75.9	Confident	85.1	Confident	97 Å²	97	105.3 Å²	105.3	68%	0.678	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-8.7	176	-53.9	0	0	0	0	114.3	L355 H356 T357 T361	L355-S359 PolarHBondContact O-N 3.27Å; H356-S359 WeakPolarHBondContact O-CB 3.46Å; H356-S359 PolarHBondContact O-N 3.23Å; H356-S359 VanDerWaalsContact O-N 3.13Å; T357-S359 VanDerWaalsContact C-N 3.32Å; T357-S359 PolarHBondContact O-N 3.26Å; S359-T361 PolarHBondContact O-N 3.4Å
360	R	78.6	Confident	85.8	Confident	201 Å²	201	100.5 Å²	100.5	76%	0.758	53%	0.531	S	S	*	.	S	Bend	trans	-60.9	127.6	173.3	-175.5	177.5	-179.6	179.2	2	110.1	T357 C358	T357-R360 WeakPolarHBondContact O-CB 3.37Å; T357-R360 PolarHBondContact O-N 2.76Å; C358-R360 PolarHBondContact O-N 2.59Å
361	T	84.7	Confident	86.4	Confident	137 Å²	137	100.3 Å²	100.3	84%	0.84	54%	0.535	S	S	*	.			trans	-59.1	137.3	175.6	44	0	0	0	0	111.4	S359	S359-T361 PolarHBondContact O-N 3.4Å
362	K	87.5	Confident	87.2	Confident	160 Å²	160	102.5 Å²	102.5	70%	0.696	55%	0.552	S	S	*	*			trans	-127.1	139.7	-176	-66.2	165.3	-166.6	170.2	0	109.5
363	I	89.9	Confident	87.9	Confident	125 Å²	125	104 Å²	104	64%	0.641	56%	0.557	S	S	*	*			trans	-97.9	150.4	171.2	58.5	175.7	0	0	0	110.2	A368	I363-A368 HydrophobicContact CD1-CB 3.63Å; I363-A368 HydrophobicContact CG1-CB 4.1Å
364	K	95.1	Very high	88.6	Confident	167 Å²	167	104.6 Å²	104.6	73%	0.726	56%	0.561	S	S	*	*			trans	-66	139.8	173.4	-63.1	-176.1	-179.6	-179.7	0	109.4	S366 K367 A368	K364-S366 PolarHBondContact O-N 3.18Å; K364-S366 VanDerWaalsContact O-N 3.12Å; K364-K367 WeakPolarHBondContact O-CA 3.16Å; K364-K367 PolarHBondContact O-N 2.77Å; K364-A368 PolarHBondContact O-N 3.03Å
365	S	94.8	Very high	89.6	Confident	105 Å²	105	107.1 Å²	107.1	73%	0.734	57%	0.572	S	S	*	*	H	α-helix	trans	-56.7	-31.6	-178.3	-43.3	0	0	0	0	113.4	A368 A369	S365-A368 PolarHBondContact O-N 3.24Å; S365-A369 WeakPolarHBondContact O-CB 3.45Å; S365-A369 PolarHBondContact O-N 3.44Å
366	S	96.6	Very high	90.4	Very high	89 Å²	89	105.3 Å²	105.3	62%	0.622	57%	0.57	S	S	*	*	H	α-helix	trans	-64.1	-43.3	172.3	50.7	0	0	0	0	113	K364 A368 A369 E370	K364-S366 PolarHBondContact O-N 3.18Å; K364-S366 VanDerWaalsContact O-N 3.12Å; S366-A368 VanDerWaalsContact C-N 3.35Å; S366-A369 PolarHBondContact O-N 3.41Å; S366-E370 WeakPolarHBondContact O-CB 3.39Å; S366-E370 PolarHBondContact O-N 2.88Å
367	K	96.8	Very high	91.1	Very high	108 Å²	108	103.3 Å²	103.3	47%	0.47	56%	0.564	S	S	.	*	H	α-helix	trans	-71	-32	176.6	-164.4	74	-150.1	171.9	0	111.8	K364 E370 S371	K364-K367 WeakPolarHBondContact O-CA 3.16Å; K364-K367 PolarHBondContact O-N 2.77Å; K367-E370 WeakPolarHBondContact CD-OE2 3.41Å; K367-E370 WeakPolarHBondContact CE-OE2 3.33Å; K367-E370 IonicContact NZ-OE1 3.76Å; K367-E370 PolarHBondContact NZ-OE1 3.15Å; K367-E370 IonicContact NZ-OE2 3.17Å; K367-E370 PolarHBondContact NZ-OE2 2.75Å; K367-S371 VanDerWaalsContact O-CB 3.29Å; K367-S371 WeakPolarHBondContact O-CB 3.37Å; K367-S371 PolarHBondContact O-N 3.06Å
368	A	96.4	Very high	91.9	Very high	27 Å²	27	102.4 Å²	102.4	22%	0.223	55%	0.553	C	S	.	*	H	α-helix	trans	-63.6	-49.6	171.1	0	0	0	0	0	111.3	I363 K364 S365 S366 S371 L372	I363-A368 HydrophobicContact CD1-CB 3.63Å; I363-A368 HydrophobicContact CG1-CB 4.1Å; K364-A368 PolarHBondContact O-N 3.03Å; S365-A368 PolarHBondContact O-N 3.24Å; S366-A368 VanDerWaalsContact C-N 3.35Å; A368-S371 PolarHBondContact O-N 3.32Å; A368-L372 WeakPolarHBondContact O-CG 3.26Å; A368-L372 PolarHBondContact O-N 3.21Å
369	A	97.5	Very high	92.9	Very high	57 Å²	57	100.7 Å²	100.7	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-61.5	-45.8	177.2	0	0	0	0	0	112.1	S365 S366 S371 L372 Q373	S365-A369 WeakPolarHBondContact O-CB 3.45Å; S365-A369 PolarHBondContact O-N 3.44Å; S366-A369 PolarHBondContact O-N 3.41Å; A369-S371 VanDerWaalsContact C-N 3.34Å; A369-S371 PolarHBondContact O-N 3.03Å; A369-L372 PolarHBondContact O-N 2.9Å; A369-Q373 WeakPolarHBondContact O-CB 3.37Å; A369-Q373 PolarHBondContact O-N 2.95Å
370	E	97.3	Very high	93.6	Very high	84 Å²	84	98.5 Å²	98.5	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-57.4	-45.3	174.2	-168.8	-153.6	132	0	0	111.6	S366 K367 L372 Q373 N374	S366-E370 WeakPolarHBondContact O-CB 3.39Å; S366-E370 PolarHBondContact O-N 2.88Å; K367-E370 WeakPolarHBondContact CD-OE2 3.41Å; K367-E370 WeakPolarHBondContact CE-OE2 3.33Å; K367-E370 IonicContact NZ-OE1 3.76Å; K367-E370 PolarHBondContact NZ-OE1 3.15Å; K367-E370 IonicContact NZ-OE2 3.17Å; K367-E370 PolarHBondContact NZ-OE2 2.75Å; E370-L372 VanDerWaalsContact C-N 3.33Å; E370-L372 PolarHBondContact O-N 3.41Å; E370-Q373 PolarHBondContact O-N 2.87Å; E370-N374 WeakPolarHBondContact O-CB 3.22Å; E370-N374 PolarHBondContact O-N 3.05Å; E370-N374 PolarHBondContact O-ND2 3.44Å; E370-N374 PolarHBondContact O-OD1 2.89Å
371	S	96.6	Very high	93.9	Very high	74 Å²	74	91.7 Å²	91.7	52%	0.517	50%	0.498	S	S	.	.	H	α-helix	trans	-67.1	-31.2	178.5	-169.7	0	0	0	0	113.4	K367 A368 A369 F375	K367-S371 VanDerWaalsContact O-CB 3.29Å; K367-S371 WeakPolarHBondContact O-CB 3.37Å; K367-S371 PolarHBondContact O-N 3.06Å; A368-S371 PolarHBondContact O-N 3.32Å; A369-S371 VanDerWaalsContact C-N 3.34Å; A369-S371 PolarHBondContact O-N 3.03Å; S371-F375 WeakPolarHBondContact O-CB 3.47Å; S371-F375 PolarHBondContact O-N 3.44Å
372	L	97.3	Very high	94.1	Very high	126 Å²	126	87 Å²	87	66%	0.66	47%	0.466	S	S	*	.	H	α-helix	trans	-76.5	-41.3	176.2	-72.2	169.1	0	0	0	111.4	A368 A369 E370 F375 A376	A368-L372 WeakPolarHBondContact O-CG 3.26Å; A368-L372 PolarHBondContact O-N 3.21Å; A369-L372 PolarHBondContact O-N 2.9Å; E370-L372 VanDerWaalsContact C-N 3.33Å; E370-L372 PolarHBondContact O-N 3.41Å; L372-F375 PolarHBondContact O-N 2.95Å; L372-A376 WeakPolarHBondContact O-CB 3.29Å; L372-A376 PolarHBondContact O-N 2.83Å
373	Q	96.6	Very high	94.1	Very high	108 Å²	108	82.5 Å²	82.5	51%	0.505	45%	0.45	S	S	.	.	H	α-helix	trans	-63.3	-50.9	176	-171	65.3	55.3	0	0	110.8	A369 E370 F375 A376 D377	A369-Q373 WeakPolarHBondContact O-CB 3.37Å; A369-Q373 PolarHBondContact O-N 2.95Å; E370-Q373 PolarHBondContact O-N 2.87Å; Q373-F375 PolarHBondContact O-N 2.89Å; Q373-F375 VanDerWaalsContact O-N 3.16Å; Q373-A376 PolarHBondContact O-N 3.36Å; Q373-D377 PolarHBondContact NE2-OD1 3.49Å; Q373-D377 WeakPolarHBondContact O-CB 3.22Å; Q373-D377 PolarHBondContact O-N 2.93Å
374	N	96.6	Very high	93.9	Very high	89 Å²	89	78.5 Å²	78.5	48%	0.476	43%	0.43	S	S	.	.	H	α-helix	trans	-57.6	-33.3	178.1	-67.3	-12.2	0	0	0	112.4	E370 Q378	E370-N374 WeakPolarHBondContact O-CB 3.22Å; E370-N374 PolarHBondContact O-N 3.05Å; E370-N374 PolarHBondContact O-ND2 3.44Å; E370-N374 PolarHBondContact O-OD1 2.89Å; N374-Q378 VanDerWaalsContact O-CB 3.22Å; N374-Q378 WeakPolarHBondContact O-CB 3.49Å; N374-Q378 PolarHBondContact O-N 3.01Å; N374-Q378 VanDerWaalsContact O-N 3.16Å
375	F	96.3	Very high	93.6	Very high	120 Å²	120	76.1 Å²	76.1	53%	0.526	42%	0.424	S	S	.	.	H	α-helix	trans	-72	-48.9	173.7	-175.6	-87.3	0	0	0	111.4	S371 L372 Q373 D377 Q378 Y379	S371-F375 WeakPolarHBondContact O-CB 3.47Å; S371-F375 PolarHBondContact O-N 3.44Å; L372-F375 PolarHBondContact O-N 2.95Å; Q373-F375 PolarHBondContact O-N 2.89Å; Q373-F375 VanDerWaalsContact O-N 3.16Å; F375-D377 VanDerWaalsContact C-N 3.32Å; F375-D377 PolarHBondContact O-N 3.29Å; F375-Q378 PolarHBondContact O-N 3.32Å; F375-Y379 HydrophobicContact CD1-CD2 4.15Å; F375-Y379 HydrophobicContact CD2-CD2 4.03Å; F375-Y379 AromaticContact CD2-CE2 3.72Å; F375-Y379 HydrophobicContact CD2-CE2 3.72Å; F375-Y379 AromaticContact CE1-CD2 3.93Å; F375-Y379 HydrophobicContact CE1-CD2 3.93Å; F375-Y379 HydrophobicContact CE1-CE2 4.29Å; F375-Y379 AromaticContact CE2-CD2 3.81Å; F375-Y379 HydrophobicContact CE2-CD2 3.81Å; F375-Y379 AromaticContact CE2-CE2 3.34Å; F375-Y379 HydrophobicContact CE2-CE2 3.34Å; F375-Y379 HydrophobicContact CG-CD2 4.2Å; F375-Y379 HydrophobicContact CG-CE2 4.35Å; F375-Y379 AromaticContact CZ-CD2 3.75Å; F375-Y379 HydrophobicContact CZ-CD2 3.75Å; F375-Y379 AromaticContact CZ-CE2 3.66Å; F375-Y379 HydrophobicContact CZ-CE2 3.66Å; F375-Y379 WeakPolarHBondContact O-CD2 3.42Å; F375-Y379 PolarHBondContact O-N 2.87Å; F375-Y379 VanDerWaalsContact O-N 3.12Å
376	A	95.6	Very high	93.2	Very high	52 Å²	52	75.1 Å²	75.1	43%	0.43	41%	0.41	S	S	.	.	H	α-helix	trans	-57.4	-44.7	177.6	0	0	0	0	0	111.9	L372 Q373 Y379 S380	L372-A376 WeakPolarHBondContact O-CB 3.29Å; L372-A376 PolarHBondContact O-N 2.83Å; Q373-A376 PolarHBondContact O-N 3.36Å; A376-Y379 PolarHBondContact O-N 3.46Å; A376-S380 WeakPolarHBondContact O-CB 3.17Å; A376-S380 PolarHBondContact O-N 3.28Å
377	D	93.6	Very high	92.1	Very high	85 Å²	85	71.6 Å²	71.6	46%	0.455	39%	0.386	S	S	.	.	H	α-helix	trans	-62.5	-44.7	177.5	-63.3	-18.1	0	0	0	111.2	Q373 F375 Y379 S380	Q373-D377 PolarHBondContact NE2-OD1 3.49Å; Q373-D377 WeakPolarHBondContact O-CB 3.22Å; Q373-D377 PolarHBondContact O-N 2.93Å; F375-D377 VanDerWaalsContact C-N 3.32Å; F375-D377 PolarHBondContact O-N 3.29Å; D377-Y379 VanDerWaalsContact C-N 3.33Å; D377-Y379 PolarHBondContact O-N 3.39Å; D377-S380 WeakPolarHBondContact O-CB 3.47Å; D377-S380 PolarHBondContact O-N 2.75Å; D377-S380 PolarHBondContact O-OG 2.99Å
378	Q	93.5	Very high	90.7	Very high	73 Å²	73	67.1 Å²	67.1	34%	0.341	37%	0.368	S	S	.	.	H	α-helix	trans	-61.4	-34.8	178.9	175.1	172.3	75.2	0	0	113.5	N374 F375 F546	N374-Q378 VanDerWaalsContact O-CB 3.22Å; N374-Q378 WeakPolarHBondContact O-CB 3.49Å; N374-Q378 PolarHBondContact O-N 3.01Å; N374-Q378 VanDerWaalsContact O-N 3.16Å; F375-Q378 PolarHBondContact O-N 3.32Å; Q378-F546 HydrophobicContact CG-CB 4.49Å; Q378-F546 HydrophobicContact CG-CD1 3.91Å; Q378-F546 HydrophobicContact CG-CD2 3.61Å; Q378-F546 HydrophobicContact CG-CE1 3.9Å; Q378-F546 HydrophobicContact CG-CE2 3.57Å; Q378-F546 HydrophobicContact CG-CG 3.77Å; Q378-F546 HydrophobicContact CG-CZ 3.71Å; Q378-F546 WeakPolarHBondContact O-CE2 3.25Å; Q378-F546 WeakPolarHBondContact O-CZ 3.43Å
379	Y	93	Very high	88.8	Confident	31 Å²	31	68.5 Å²	68.5	12%	0.122	38%	0.376	C	S	.	.	H	α-helix	trans	-99.2	-1.9	179.7	-69.7	-90.8	0	0	0	114.1	F375 A376 D377 E381 F382 D383 R543 F546 E550	F375-Y379 HydrophobicContact CD1-CD2 4.15Å; F375-Y379 HydrophobicContact CD2-CD2 4.03Å; F375-Y379 AromaticContact CD2-CE2 3.72Å; F375-Y379 HydrophobicContact CD2-CE2 3.72Å; F375-Y379 AromaticContact CE1-CD2 3.93Å; F375-Y379 HydrophobicContact CE1-CD2 3.93Å; F375-Y379 HydrophobicContact CE1-CE2 4.29Å; F375-Y379 AromaticContact CE2-CD2 3.81Å; F375-Y379 HydrophobicContact CE2-CD2 3.81Å; F375-Y379 AromaticContact CE2-CE2 3.34Å; F375-Y379 HydrophobicContact CE2-CE2 3.34Å; F375-Y379 HydrophobicContact CG-CD2 4.2Å; F375-Y379 HydrophobicContact CG-CE2 4.35Å; F375-Y379 AromaticContact CZ-CD2 3.75Å; F375-Y379 HydrophobicContact CZ-CD2 3.75Å; F375-Y379 AromaticContact CZ-CE2 3.66Å; F375-Y379 HydrophobicContact CZ-CE2 3.66Å; F375-Y379 WeakPolarHBondContact O-CD2 3.42Å; F375-Y379 PolarHBondContact O-N 2.87Å; F375-Y379 VanDerWaalsContact O-N 3.12Å; A376-Y379 PolarHBondContact O-N 3.46Å; D377-Y379 VanDerWaalsContact C-N 3.33Å; D377-Y379 PolarHBondContact O-N 3.39Å; Y379-E381 VanDerWaalsContact C-N 3.34Å; Y379-E381 PolarHBondContact O-N 3.02Å; Y379-F382 WeakPolarHBondContact O-CA 3.33Å; Y379-F382 WeakPolarHBondContact O-CB 3.47Å; Y379-F382 PolarHBondContact O-N 3.35Å; Y379-D383 PolarHBondContact O-N 3.04Å; Y379-R543 HydrophobicContact CE1-CG 4.42Å; Y379-F546 HydrophobicContact CD1-CD2 4.34Å; Y379-F546 HydrophobicContact CD1-CE2 4.37Å; Y379-F546 AromaticContact CE1-CD2 3.74Å; Y379-F546 HydrophobicContact CE1-CD2 3.74Å; Y379-F546 HydrophobicContact CE1-CE2 4.2Å; Y379-F546 HydrophobicContact CE2-CD2 4.14Å; Y379-F546 AromaticContact CZ-CD2 3.62Å; Y379-E550 WeakPolarHBondContact OH-CG 3.4Å
380	S	91.4	Very high	86.5	Confident	50 Å²	50	71.9 Å²	71.9	35%	0.35	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-54.9	-42.2	-176.7	62	0	0	0	0	114	A376 D377 F382 D383 S387	A376-S380 WeakPolarHBondContact O-CB 3.17Å; A376-S380 PolarHBondContact O-N 3.28Å; D377-S380 WeakPolarHBondContact O-CB 3.47Å; D377-S380 PolarHBondContact O-N 2.75Å; D377-S380 PolarHBondContact O-OG 2.99Å; S380-F382 PolarHBondContact O-N 2.72Å; S380-D383 PolarHBondContact O-N 2.99Å; S380-S387 PolarHBondContact O-OG 3.26Å
381	E	85.7	Confident	84	Confident	58 Å²	58	70.4 Å²	70.4	27%	0.271	39%	0.39	S	S	.	.	G	3₁₀ helix	trans	-70.9	-6.4	177.7	75.5	-174.1	135.5	0	0	114.5	Y379 S387 R539 K542	Y379-E381 VanDerWaalsContact C-N 3.34Å; Y379-E381 PolarHBondContact O-N 3.02Å; E381-S387 WeakPolarHBondContact CA-OG 3.34Å; E381-R539 PolarHBondContact O-NH1 2.82Å; E381-K542 WeakPolarHBondContact OE1-CE 3.4Å; E381-K542 IonicContact OE1-NZ 3.59Å; E381-K542 PolarHBondContact OE1-NZ 3.25Å; E381-K542 IonicContact OE2-NZ 2.83Å; E381-K542 PolarHBondContact OE2-NZ 3.13Å
382	F	87.4	Confident	81.4	Confident	38 Å²	38	71 Å²	71	17%	0.167	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-107.4	-17.3	177.7	-63.5	-93	0	0	0	112.6	Y379 S380 L384 R539 R543 F546	Y379-F382 WeakPolarHBondContact O-CA 3.33Å; Y379-F382 WeakPolarHBondContact O-CB 3.47Å; Y379-F382 PolarHBondContact O-N 3.35Å; S380-F382 PolarHBondContact O-N 2.72Å; F382-L384 PolarHBondContact O-N 2.71Å; F382-R539 HydrophobicContact CE1-CB 4.05Å; F382-R539 WeakPolarHBondContact CE1-O 3.36Å; F382-R539 HydrophobicContact CZ-CB 4.49Å; F382-R539 VanDerWaalsContact CZ-O 3.31Å; F382-R539 WeakPolarHBondContact CZ-O 3.42Å; F382-R543 HydrophobicContact CE1-CB 3.91Å; F382-R543 HydrophobicContact CE1-CG 4.4Å; F382-R543 HydrophobicContact CZ-CB 3.95Å; F382-F546 HydrophobicContact CD2-CE2 4.13Å; F382-F546 AromaticContact CE2-CE2 3.48Å; F382-F546 HydrophobicContact CE2-CE2 3.48Å; F382-F546 VanDerWaalsContact CE2-CE2 3.48Å; F382-F546 AromaticContact CE2-CZ 3.64Å; F382-F546 HydrophobicContact CE2-CZ 3.64Å; F382-F546 HydrophobicContact CZ-CE2 4.05Å; F382-F546 HydrophobicContact CZ-CZ 4.2Å
383	D	89.2	Confident	78.3	Confident	67 Å²	67	68.1 Å²	68.1	36%	0.358	39%	0.391	S	S	.	.			trans	-79.6	112.3	173.5	-170.5	-15.1	0	0	0	109.9	Y379 S380 L385 L386 S387	Y379-D383 PolarHBondContact O-N 3.04Å; S380-D383 PolarHBondContact O-N 2.99Å; D383-L385 PolarHBondContact O-N 2.81Å; D383-L385 VanDerWaalsContact OD1-CB 3.32Å; D383-L385 WeakPolarHBondContact OD1-CB 3.37Å; D383-L385 PolarHBondContact OD1-N 3.05Å; D383-L386 HydrophobicContact CB-CB 4.27Å; D383-L386 HydrophobicContact CB-CD1 4.09Å; D383-L386 HydrophobicContact CB-CG 4.12Å; D383-L386 PolarHBondContact O-N 3.06Å; D383-S387 VanDerWaalsContact O-CB 3.3Å; D383-S387 WeakPolarHBondContact O-CB 3.37Å; D383-S387 PolarHBondContact O-N 3.16Å; D383-S387 PolarHBondContact O-OG 2.96Å
384	L	85.4	Confident	75.4	Confident	41 Å²	41	73 Å²	73	22%	0.215	41%	0.41	C	S	.	.	H	α-helix	trans	-65.2	-25.4	177.4	-60.9	178.6	0	0	0	112.2	F382 L386 T388 V513 Y526	F382-L384 PolarHBondContact O-N 2.71Å; L384-L386 VanDerWaalsContact C-N 3.27Å; L384-L386 PolarHBondContact O-N 3.24Å; L384-T388 WeakPolarHBondContact O-CB 3.44Å; L384-T388 WeakPolarHBondContact O-CG2 3.45Å; L384-T388 PolarHBondContact O-N 3.16Å; L384-T388 PolarHBondContact O-OG1 3Å; L384-V513 HydrophobicContact CD2-CG1 4.49Å; L384-Y526 HydrophobicContact CD1-CE1 4.02Å
385	L	88.4	Confident	72.4	Confident	116 Å²	116	73.8 Å²	73.8	61%	0.607	42%	0.423	S	S	*	.	H	α-helix	trans	-77.3	-12.8	178	-57.8	179	0	0	0	113.4	D383 R446	D383-L385 PolarHBondContact O-N 2.81Å; D383-L385 VanDerWaalsContact OD1-CB 3.32Å; D383-L385 WeakPolarHBondContact OD1-CB 3.37Å; D383-L385 PolarHBondContact OD1-N 3.05Å; L385-R446 PolarHBondContact O-NH2 3Å
386	L	86.2	Confident	69.2	Low	84 Å²	84	72.6 Å²	72.6	44%	0.44	44%	0.435	S	S	.	.	H	α-helix	trans	-106.3	-50.9	174.6	-58.9	-180	0	0	0	110.6	D383 L384 T388 S389	D383-L386 HydrophobicContact CB-CB 4.27Å; D383-L386 HydrophobicContact CB-CD1 4.09Å; D383-L386 HydrophobicContact CB-CG 4.12Å; D383-L386 PolarHBondContact O-N 3.06Å; L384-L386 VanDerWaalsContact C-N 3.27Å; L384-L386 PolarHBondContact O-N 3.24Å; L386-T388 PolarHBondContact O-N 3.29Å; L386-S389 PolarHBondContact O-N 2.82Å; L386-S389 PolarHBondContact O-OG 2.99Å
387	S	73.8	Confident	66.4	Low	16 Å²	16	76.3 Å²	76.3	11%	0.112	46%	0.455	C	S	.	.	H	α-helix	trans	-68.4	-27.7	-172.5	-63.8	0	0	0	0	114.4	S380 E381 D383 T390 V513	S380-S387 PolarHBondContact O-OG 3.26Å; E381-S387 WeakPolarHBondContact CA-OG 3.34Å; D383-S387 VanDerWaalsContact O-CB 3.3Å; D383-S387 WeakPolarHBondContact O-CB 3.37Å; D383-S387 PolarHBondContact O-N 3.16Å; D383-S387 PolarHBondContact O-OG 2.96Å; S387-T390 PolarHBondContact O-OG1 3.47Å; S387-V513 WeakPolarHBondContact O-CB 3.48Å
388	T	66.8	Low	63.6	Low	14 Å²	14	77.5 Å²	77.5	9%	0.086	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-41.3	174.4	53.2	0	0	0	0	111.6	L384 L386 T390 S391 V513 S514 N517	L384-T388 WeakPolarHBondContact O-CB 3.44Å; L384-T388 WeakPolarHBondContact O-CG2 3.45Å; L384-T388 PolarHBondContact O-N 3.16Å; L384-T388 PolarHBondContact O-OG1 3Å; L386-T388 PolarHBondContact O-N 3.29Å; T388-T390 PolarHBondContact O-N 2.98Å; T388-T390 VanDerWaalsContact O-N 3.09Å; T388-S391 PolarHBondContact O-N 3Å; T388-S391 PolarHBondContact O-OG 3.32Å; T388-V513 HydrophobicContact CG2-CG1 4.45Å; T388-S514 PolarHBondContact O-OG 3.48Å; T388-N517 HydrophobicContact CG2-CB 4.06Å
389	S	57.5	Low	60.5	Low	56 Å²	56	80.2 Å²	80.2	39%	0.392	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.4	-171.8	69	0	0	0	0	114.6	L386 S391	L386-S389 PolarHBondContact O-N 2.82Å; L386-S389 PolarHBondContact O-OG 2.99Å; S389-S391 VanDerWaalsContact C-N 3.25Å; S389-S391 PolarHBondContact O-N 3.07Å
390	T	49.6	Very low	57.8	Low	128 Å²	128	84.4 Å²	84.4	79%	0.785	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-8.6	174.4	-7.2	0	0	0	0	113.8	S387 T388	S387-T390 PolarHBondContact O-OG1 3.47Å; T388-T390 PolarHBondContact O-N 2.98Å; T388-T390 VanDerWaalsContact O-N 3.09Å
391	S	43.4	Very low	54.9	Low	53 Å²	53	85.1 Å²	85.1	37%	0.371	54%	0.541	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.6	-18.5	-175.3	64.7	0	0	0	0	115.4	T388 S389 G393 S514	T388-S391 PolarHBondContact O-N 3Å; T388-S391 PolarHBondContact O-OG 3.32Å; S389-S391 VanDerWaalsContact C-N 3.25Å; S389-S391 PolarHBondContact O-N 3.07Å; S391-G393 PolarHBondContact O-N 3.23Å; S391-S514 PolarHBondContact OG-OG 3.15Å
392	V	41.9	Very low	52.5	Low	87 Å²	87	89.9 Å²	89.9	53%	0.527	57%	0.567	S	S	.	*			trans	-94.7	66.3	-175.1	-76	0	0	0	0	112.7	F394	V392-F394 PolarHBondContact O-N 3.29Å
393	G	33.3	Very low	50.1	Low	65 Å²	65	95.3 Å²	95.3	67%	0.67	60%	0.598	S	S	*	*			trans	-71.4	104.2	164	0	0	0	0	0	110.5	S391 S395	S391-G393 PolarHBondContact O-N 3.23Å; G393-S395 PolarHBondContact O-N 3.47Å; G393-S395 PolarHBondContact O-OG 3.41Å
394	F	35.2	Very low	47.3	Very low	209 Å²	209	100.3 Å²	100.3	92%	0.917	62%	0.619	S	S	*	*			trans	-63.2	89.8	179	-87.9	-91.3	0	0	0	112.1	V392	V392-F394 PolarHBondContact O-N 3.29Å
395	S	33.4	Very low	45	Very low	106 Å²	106	104.4 Å²	104.4	74%	0.741	65%	0.648	S	S	*	*			trans	-96.3	96.8	168.6	41.1	0	0	0	0	108.9	G393 P397	G393-S395 PolarHBondContact O-N 3.47Å; G393-S395 PolarHBondContact O-OG 3.41Å; S395-P397 VanDerWaalsContact O-CD 3.3Å; S395-P397 WeakPolarHBondContact O-CD 3.39Å
396	A	28.9	Very low	42.3	Very low	95 Å²	95	105.3 Å²	105.3	79%	0.785	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-65.6	120.8	-179.2	0	0	0	0	0	111.2	S398	A396-S398 PolarHBondContact O-N 2.54Å
397	P	37.3	Very low	39.8	Very low	131 Å²	131	108.4 Å²	108.4	85%	0.851	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-70.2	126.1	177.1	-18.4	32.9	0	0	0	110.9	S395	S395-P397 VanDerWaalsContact O-CD 3.3Å; S395-P397 WeakPolarHBondContact O-CD 3.39Å
398	S	33.8	Very low	37.8	Very low	109 Å²	109	113.6 Å²	113.6	76%	0.762	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-84.4	125.5	176	47.7	0	0	0	0	111.6	A396	A396-S398 PolarHBondContact O-N 2.54Å
399	T	29.8	Very low	36.2	Very low	130 Å²	130	118.3 Å²	118.3	80%	0.798	74%	0.741	S	S	*	*			trans	48.3	107.3	144.2	-42.9	0	0	0	0	118.8
400	S	35.1	Very low	34.9	Very low	119 Å²	119	121.7 Å²	121.7	83%	0.832	76%	0.759	S	S	*	*				168.4	137.8	109.6	47.2	0	0	0	0	115.1
401	G	31.7	Very low	34	Very low	66 Å²	66	120.9 Å²	120.9	68%	0.68	76%	0.759	S	S	*	*				90.5	107.4	128.1	0	0	0	0	0	122.1
402	I	35.5	Very low	33.5	Very low	157 Å²	157	127.9 Å²	127.9	81%	0.805	79%	0.785	S	S	*	*				83.5	109.6	128.8	-60.6	170.6	0	0	0	119.7
403	N	35.2	Very low	33	Very low	153 Å²	153	132.1 Å²	132.1	82%	0.818	80%	0.804	S	S	*	*			trans	69.6	118	145.9	-60.2	-1.4	0	0	0	122.9
404	Q	30.4	Very low	32.8	Very low	171 Å²	171	134.1 Å²	134.1	80%	0.799	82%	0.815	S	S	*	*			trans	-102.9	168.8	150.1	-64.2	-179.2	-5.5	0	0	110.7
405	P	37.7	Very low	32.7	Very low	127 Å²	127	132.2 Å²	132.2	83%	0.825	81%	0.813	S	S	*	*			trans	-118.3	153.8	144.1	35.7	-26.9	0	0	0	113
406	N	31.4	Very low	32.5	Very low	135 Å²	135	130.9 Å²	130.9	72%	0.722	82%	0.816	S	S	*	*			trans	-85.7	153.4	-167.2	-58.2	-43.1	0	0	0	115.6
407	T	33.8	Very low	32.5	Very low	150 Å²	150	131.8 Å²	131.8	92%	0.92	82%	0.817	S	S	*	*			trans	-136.7	138.7	144	51.1	0	0	0	0	109.6
408	T	31.2	Very low	32.2	Very low	125 Å²	125	133.6 Å²	133.6	77%	0.767	82%	0.818	S	S	*	*			trans	-125.9	125.7	-160.3	-52.1	0	0	0	0	113.7
409	S	33.7	Very low	31.9	Very low	113 Å²	113	135.2 Å²	135.2	79%	0.79	82%	0.819	S	S	*	*			trans	-162.6	85.1	158.5	59.5	0	0	0	0	113.9
410	T	31.7	Very low	32.1	Very low	126 Å²	126	134.9 Å²	134.9	77%	0.773	82%	0.816	S	S	*	*			trans	40.1	112.3	136.5	-37.6	0	0	0	0	120.9
411	S	30.5	Very low	31.7	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	81%	0.81	S	S	*	*				150.9	85.3	127.2	-67.3	0	0	0	0	113.2
412	Q	31.8	Very low	31.7	Very low	200 Å²	200	138.4 Å²	138.4	94%	0.935	81%	0.814	S	S	*	*			trans	-143.9	161.8	165.6	-80.5	-158	-9.8	0	0	113
413	L	32	Very low	31.3	Very low	177 Å²	177	138.3 Å²	138.3	93%	0.927	82%	0.816	S	S	*	*			trans	-74.7	141.9	-170.1	-65.5	157.1	0	0	0	112.7	L415	L413-L415 PolarHBondContact O-N 3.42Å
414	A	29.7	Very low	31.2	Very low	107 Å²	107	136.9 Å²	136.9	88%	0.884	82%	0.817	S	S	*	*			trans	-86.4	99.8	179.6	0	0	0	0	0	112.3
415	L	31.6	Very low	31.1	Very low	168 Å²	168	135.2 Å²	135.2	88%	0.88	82%	0.819	S	S	*	*			trans	-81	110.3	161.7	-99.1	161.7	0	0	0	109.4	L413 S417	L413-L415 PolarHBondContact O-N 3.42Å; L415-S417 PolarHBondContact O-N 3.36Å; L415-S417 VanDerWaalsContact O-N 3.11Å
416	G	29.3	Very low	30.8	Very low	78 Å²	78	134.6 Å²	134.6	80%	0.804	82%	0.818	S	S	*	*			trans	-81.2	80.4	-176.8	0	0	0	0	0	113.7
417	S	29.7	Very low	30.6	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	82%	0.821	S	S	*	*			trans	-78	116	168.5	-58.3	0	0	0	0	111.1	L415	L415-S417 PolarHBondContact O-N 3.36Å; L415-S417 VanDerWaalsContact O-N 3.11Å
418	L	30.8	Very low	30.6	Very low	168 Å²	168	132.3 Å²	132.3	88%	0.88	82%	0.818	S	S	*	*			trans	-102.6	113.5	169.1	-84.7	170.5	0	0	0	110.9
419	N	28.2	Very low	30.5	Very low	144 Å²	144	132 Å²	132	77%	0.77	82%	0.817	S	S	*	*			trans	-92.1	118.9	172.7	-179.9	5.1	0	0	0	108.8
420	V	32.8	Very low	30.4	Very low	122 Å²	122	132.4 Å²	132.4	74%	0.739	82%	0.817	S	S	*	*			trans	-124	118.4	174.2	-179.2	0	0	0	0	108.9
421	N	26.4	Very low	30.4	Very low	134 Å²	134	133.6 Å²	133.6	72%	0.717	82%	0.824	S	S	*	*			trans	-122.1	107.7	-171.9	-168.9	13.7	0	0	0	109.2
422	T	33.1	Very low	30.3	Very low	125 Å²	125	133 Å²	133	77%	0.767	82%	0.82	S	S	*	*			trans	-140.5	114.7	178	49.4	0	0	0	0	111.6
423	N	26.9	Very low	30.3	Very low	156 Å²	156	131.5 Å²	131.5	83%	0.834	82%	0.816	S	S	*	*			trans	-80.8	137.7	172.7	-68.3	-47.5	0	0	0	111.6
424	S	31.8	Very low	30	Very low	122 Å²	122	129.6 Å²	129.6	85%	0.853	81%	0.807	S	S	*	*			trans	-155.7	127	152.1	58.2	0	0	0	0	111.7
425	T	28.8	Very low	30	Very low	137 Å²	137	136.5 Å²	136.5	84%	0.84	81%	0.81	S	S	*	*			trans	-99.6	133	-168	48.7	0	0	0	0	114.7
426	S	31.6	Very low	30	Very low	114 Å²	114	134 Å²	134	80%	0.797	80%	0.802	S	S	*	*			trans	174.5	119.1	141.7	52.5	0	0	0	0	109.4
427	A	28	Very low	30.1	Very low	94 Å²	94	135.9 Å²	135.9	78%	0.777	80%	0.802	S	S	*	*			cis	90	94.1	33.6	0	0	0	0	0	115.2
428	T	32.5	Very low	30.1	Very low	142 Å²	142	133.9 Å²	133.9	87%	0.871	80%	0.8	S	S	*	*			trans	163.4	147.6	150.9	42	0	0	0	0	109.1
429	T	30.5	Very low	30.1	Very low	119 Å²	119	133.9 Å²	133.9	73%	0.73	80%	0.801	S	S	*	*			cis	-161	138.3	-27.3	-61.6	0	0	0	0	106.4
430	P	30	Very low	30.1	Very low	122 Å²	122	136.7 Å²	136.7	79%	0.792	81%	0.806	S	S	*	*			trans	-92.7	158.9	-174	36.1	-36	0	0	0	114.8
431	T	33.2	Very low	29.9	Very low	150 Å²	150	138.7 Å²	138.7	92%	0.92	81%	0.812	S	S	*	*			trans	-134.3	130.6	164.8	46.3	0	0	0	0	111.4
432	S	27.1	Very low	30.1	Very low	100 Å²	100	138.8 Å²	138.8	70%	0.699	81%	0.811	S	S	*	*			trans	-101.7	145.7	-173.3	57.4	0	0	0	0	113.9
433	I	31.8	Very low	29.9	Very low	167 Å²	167	141.3 Å²	141.3	86%	0.856	81%	0.814	S	S	*	*			trans	-130.9	127.1	152.8	-63.3	-176.4	0	0	0	108.9
434	L	26.8	Very low	30.2	Very low	138 Å²	138	141 Å²	141	72%	0.723	81%	0.807	S	S	*	*			trans	-77.7	139.4	176.5	-80.3	66.2	0	0	0	111.1
435	R	29.9	Very low	30.1	Very low	251 Å²	251	141.5 Å²	141.5	95%	0.947	81%	0.805	S	S	*	*			trans	-135.3	145.3	136.3	-76.4	-162.8	171.2	170.4	-0.8	110
436	T	29.9	Very low	30.3	Very low	117 Å²	117	142.1 Å²	142.1	72%	0.718	79%	0.792	S	S	*	*			trans	-105.8	161.3	-168.5	50.4	0	0	0	0	112.5
437	S	32.5	Very low	30.2	Very low	116 Å²	116	141.4 Å²	141.4	81%	0.811	79%	0.787	S	S	*	*			trans	111.1	106.9	147.7	-56.7	0	0	0	0	116.9
438	G	28.6	Very low	30.5	Very low	73 Å²	73	144 Å²	144	75%	0.753	79%	0.787	S	S	*	*			trans	78.2	88	136.7	0	0	0	0	0	118.2
439	D	30.9	Very low	30.5	Very low	169 Å²	169	142.2 Å²	142.2	90%	0.904	78%	0.78	S	S	*	*				-157.5	152.5	108.2	-114	-31	0	0	0	112.5	L441	D439-L441 PolarHBondContact O-N 3.02Å
440	K	29.3	Very low	30.4	Very low	203 Å²	203	141.3 Å²	141.3	88%	0.883	78%	0.784	S	S	*	*			trans	-97.1	79.3	177.6	-77.7	-171.9	175.9	-176.7	0	110.9
441	L	28.7	Very low	30.6	Very low	163 Å²	163	142.1 Å²	142.1	85%	0.853	79%	0.787	S	S	*	*			trans	-83.4	116.1	169.7	-166	68.3	0	0	0	110.2	D439 Q443	D439-L441 PolarHBondContact O-N 3.02Å; L441-Q443 PolarHBondContact O-N 2.9Å
442	I	31	Very low	30.3	Very low	136 Å²	136	139 Å²	139	70%	0.697	79%	0.785	S	S	*	*			trans	-75.3	114	174.2	-62.8	175.8	0	0	0	108.4	H444	I442-H444 PolarHBondContact O-N 3.35Å
443	Q	28.5	Very low	30.5	Very low	179 Å²	179	143.8 Å²	143.8	84%	0.836	79%	0.793	S	S	*	*			trans	-70.1	106.8	170.4	-71.9	179.7	-29.6	0	0	109.7	L441	L441-Q443 PolarHBondContact O-N 2.9Å
444	H	32.6	Very low	30.4	Very low	150 Å²	150	144.2 Å²	144.2	69%	0.694	80%	0.797	S	S	*	*			trans	-94.6	91	167.2	-100.2	-68.3	0	0	0	110.3	I442 R446	I442-H444 PolarHBondContact O-N 3.35Å; H444-R446 PolarHBondContact O-N 3.32Å
445	T	29.5	Very low	30.5	Very low	132 Å²	132	140.4 Å²	140.4	81%	0.81	79%	0.792	S	S	*	*			trans	-65	125.1	162.7	35.2	0	0	0	0	109.8
446	R	33.6	Very low	30.6	Very low	150 Å²	150	136.9 Å²	136.9	57%	0.566	79%	0.79	S	S	*	*			trans	-136.9	81.2	166.3	-81.7	-165.9	170.8	-164.6	-4.7	110	L385 H444	L385-R446 PolarHBondContact O-NH2 3Å; H444-R446 PolarHBondContact O-N 3.32Å
447	S	29.3	Very low	30.7	Very low	99 Å²	99	137.1 Å²	137.1	69%	0.692	79%	0.791	S	S	*	*			trans	-74.9	117.5	157.7	179.7	0	0	0	0	108.5
448	I	34.3	Very low	30.5	Very low	149 Å²	149	136.3 Å²	136.3	76%	0.764	79%	0.786	S	S	*	*			trans	-137.6	118.9	163.6	-60.3	-177.6	0	0	0	106.6
449	S	31.5	Very low	30.5	Very low	104 Å²	104	141.1 Å²	141.1	73%	0.727	79%	0.793	S	S	*	*			trans	-84.9	136.4	-176.1	-51.9	0	0	0	0	112.7
450	A	30	Very low	30.5	Very low	99 Å²	99	138.4 Å²	138.4	82%	0.818	78%	0.783	S	S	*	*			trans	39.6	91.3	145.6	0	0	0	0	0	119.7
451	T	33.8	Very low	30.6	Very low	140 Å²	140	134.3 Å²	134.3	86%	0.859	78%	0.78	S	S	*	*			trans	-129.8	123.7	134.7	53.3	0	0	0	0	108.7
452	G	27.6	Very low	30.5	Very low	85 Å²	85	134.2 Å²	134.2	88%	0.876	78%	0.777	S	S	*	*			trans	-77.9	122.9	-172.3	0	0	0	0	0	113.4
453	F	30.7	Very low	30.4	Very low	199 Å²	199	133.4 Å²	133.4	87%	0.873	78%	0.784	S	S	*	*			trans	-141.6	120.7	163.4	-147.3	-95.3	0	0	0	110.4	G455	F453-G455 PolarHBondContact O-N 3.36Å
454	N	30.3	Very low	30.4	Very low	176 Å²	176	132.1 Å²	132.1	94%	0.941	78%	0.781	S	S	*	*			trans	-80.4	102.3	-177.7	-79.8	-46.4	0	0	0	110.6
455	G	27.4	Very low	30.3	Very low	58 Å²	58	129.2 Å²	129.2	60%	0.598	78%	0.783	S	S	*	*			trans	-167.3	149.1	177.7	0	0	0	0	0	116.7	F453	F453-G455 PolarHBondContact O-N 3.36Å
456	I	32.4	Very low	30.3	Very low	177 Å²	177	134.4 Å²	134.4	91%	0.908	79%	0.788	S	S	*	*			trans	75.6	140.5	163.3	-47.9	177.1	0	0	0	115.7
457	T	32.3	Very low	30.3	Very low	122 Å²	122	133.9 Å²	133.9	75%	0.748	80%	0.802	S	S	*	*			trans	-94.6	128.6	-169	48.5	0	0	0	0	113.3	L459	T457-L459 PolarHBondContact O-N 3.16Å
458	S	28	Very low	30.2	Very low	100 Å²	100	136.9 Å²	136.9	70%	0.699	81%	0.81	S	S	*	*			trans	5.2	94.4	151	174.8	0	0	0	0	116.8	T460	S458-T460 PolarHBondContact O-N 3.27Å
459	L	28.9	Very low	30.2	Very low	173 Å²	173	135.1 Å²	135.1	91%	0.906	81%	0.811	S	S	*	*			trans	-83.5	99.7	158.3	-73.9	173.3	0	0	0	109	T457 S461	T457-L459 PolarHBondContact O-N 3.16Å; L459-S461 PolarHBondContact O-N 3.12Å; L459-S461 VanDerWaalsContact O-N 3.17Å
460	T	30.6	Very low	30.1	Very low	112 Å²	112	133.1 Å²	133.1	69%	0.687	81%	0.807	S	S	*	*			trans	-72.9	104.5	173.7	47.8	0	0	0	0	110.5	S458 M462	S458-T460 PolarHBondContact O-N 3.27Å; T460-M462 PolarHBondContact O-N 3.34Å; T460-M462 VanDerWaalsContact O-N 3.15Å
461	S	30.6	Very low	30.3	Very low	117 Å²	117	135.9 Å²	135.9	82%	0.818	81%	0.814	S	S	*	*			trans	-65.4	105.9	170	50.8	0	0	0	0	110.7	L459 S463	L459-S461 PolarHBondContact O-N 3.12Å; L459-S461 VanDerWaalsContact O-N 3.17Å; S461-S463 PolarHBondContact O-N 3.3Å
462	M	28	Very low	30.1	Very low	161 Å²	161	132.5 Å²	132.5	79%	0.793	81%	0.807	S	S	*	*			trans	-75.6	103.5	174.8	-67.3	-161.4	76.9	0	0	110.8	T460 L464	T460-M462 PolarHBondContact O-N 3.34Å; T460-M462 VanDerWaalsContact O-N 3.15Å; M462-L464 PolarHBondContact O-N 3.1Å
463	S	28.2	Very low	30.2	Very low	120 Å²	120	137 Å²	137	84%	0.839	81%	0.811	S	S	*	*			trans	-74.7	104.8	167.5	-170.1	0	0	0	0	109.8	S461 A465	S461-S463 PolarHBondContact O-N 3.3Å; S463-A465 PolarHBondContact O-N 3.41Å
464	L	29.4	Very low	30.2	Very low	151 Å²	151	131.4 Å²	131.4	79%	0.791	81%	0.809	S	S	*	*			trans	-90.6	87.7	174.4	-91.1	163	0	0	0	110	M462 R466	M462-L464 PolarHBondContact O-N 3.1Å; L464-R466 PolarHBondContact O-N 3.22Å
465	A	30.2	Very low	30.1	Very low	89 Å²	89	127.4 Å²	127.4	74%	0.736	80%	0.8	S	S	*	*			trans	-59.7	121.7	170.9	0	0	0	0	0	110.3	S463 T467	S463-A465 PolarHBondContact O-N 3.41Å; A465-T467 PolarHBondContact O-N 3.39Å
466	R	28.9	Very low	30.4	Very low	241 Å²	241	133.9 Å²	133.9	91%	0.909	82%	0.815	S	S	*	*			trans	-78.9	109.4	172.8	-74	-175.2	178.3	179	1.4	109.9	L464	L464-R466 PolarHBondContact O-N 3.22Å
467	T	33.1	Very low	30.2	Very low	139 Å²	139	132.5 Å²	132.5	85%	0.853	81%	0.809	S	S	*	*			trans	-66.7	138	156.1	45.6	0	0	0	0	109	A465	A465-T467 PolarHBondContact O-N 3.39Å
468	N	28	Very low	30.1	Very low	163 Å²	163	136.9 Å²	136.9	87%	0.872	82%	0.818	S	S	*	*			trans	-124.3	103.1	-173.1	-166.7	28.6	0	0	0	109.5
469	S	35.1	Very low	30	Very low	112 Å²	112	136.9 Å²	136.9	78%	0.783	82%	0.818	S	S	*	*			trans	-132.2	114.9	177.9	55.4	0	0	0	0	109.8
470	G	28.3	Very low	30.1	Very low	62 Å²	62	134.9 Å²	134.9	64%	0.639	81%	0.814	S	S	*	*			trans	-90.9	-160	-177.9	0	0	0	0	0	114.4
471	T	33.9	Very low	30	Very low	156 Å²	156	134.5 Å²	134.5	96%	0.957	82%	0.822	S	S	*	*			trans	71.2	141.7	-166.8	76.1	0	0	0	0	113.5
472	G	31.4	Very low	30	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	82%	0.82	S	S	*	*			cis	-159.4	169	-2.7	0	0	0	0	0	112.3
473	N	28.8	Very low	30	Very low	179 Å²	179	134.3 Å²	134.3	96%	0.957	83%	0.826	S	S	*	*			trans	-57.2	142.4	-171.2	-63.6	-24.4	0	0	0	114.6
474	G	31.4	Very low	30.2	Very low	81 Å²	81	136.6 Å²	136.6	84%	0.835	83%	0.828	S	S	*	*			trans	-170.1	80.7	171.4	0	0	0	0	0	111.9
475	A	27.2	Very low	30	Very low	92 Å²	92	134.9 Å²	134.9	76%	0.76	83%	0.828	S	S	*	*			trans	-92.1	135.8	179.3	0	0	0	0	0	111.4
476	H	33.9	Very low	30.1	Very low	195 Å²	195	136 Å²	136	90%	0.903	83%	0.831	S	S	*	*			trans	-157.4	134.9	145.9	-104.8	-73.5	0	0	0	110.1
477	N	27.6	Very low	30.1	Very low	148 Å²	148	128 Å²	128	79%	0.791	82%	0.823	S	S	*	*			trans	-81.5	146.2	177.3	-63	-40	0	0	0	110.8
478	F	30.1	Very low	30	Very low	213 Å²	213	130.3 Å²	130.3	93%	0.934	82%	0.824	S	S	*	*			trans	-145.8	139.6	132.9	-123	-81.7	0	0	0	111
479	S	27.1	Very low	30	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	82%	0.821	S	S	*	*			trans	-94.9	161.3	-175.9	-54.3	0	0	0	0	111.3
480	T	30.8	Very low	29.7	Very low	132 Å²	132	126.7 Å²	126.7	81%	0.81	82%	0.824	S	S	*	*				179.1	131.4	116.5	-75.9	0	0	0	0	112.7
481	A	28.7	Very low	29.8	Very low	103 Å²	103	127.5 Å²	127.5	85%	0.851	82%	0.824	S	S	*	*			trans	38.5	135.1	156.1	0	0	0	0	0	122.5
482	G	30.8	Very low	29.6	Very low	77 Å²	77	123.5 Å²	123.5	79%	0.794	81%	0.814	S	S	*	*			trans	173.9	47	171.7	0	0	0	0	0	113.5
483	Q	27.3	Very low	29.5	Very low	197 Å²	197	128.8 Å²	128.8	92%	0.921	82%	0.82	S	S	*	*			trans	-71.8	126.6	-176.3	-72.2	179.2	-40.4	0	0	112.5
484	I	31.7	Very low	29.9	Very low	168 Å²	168	128.7 Å²	128.7	86%	0.862	82%	0.815	S	S	*	*			trans	-133	128.1	149	-57.4	-178	0	0	0	107.3
485	S	26.6	Very low	29.7	Very low	115 Å²	115	127.9 Å²	127.9	80%	0.804	81%	0.808	S	S	*	*			trans	-80	142	-178.4	-173.6	0	0	0	0	111.7
486	S	32.3	Very low	29.6	Very low	113 Å²	113	126.7 Å²	126.7	79%	0.79	80%	0.804	S	S	*	*			trans	-129.1	116.6	157.7	50.7	0	0	0	0	107.9
487	G	29.3	Very low	29.4	Very low	72 Å²	72	124.9 Å²	124.9	74%	0.742	80%	0.799	S	S	*	*			trans	-77.1	132.5	-169	0	0	0	0	0	113	G489	G487-G489 PolarHBondContact O-N 3.39Å; G487-G489 VanDerWaalsContact O-N 3.12Å
488	H	29.3	Very low	29.4	Very low	189 Å²	189	124.6 Å²	124.6	88%	0.875	80%	0.804	S	S	*	*			trans	-70.9	101.8	168.1	-82.8	-67	0	0	0	111	S490	H488-S490 PolarHBondContact O-N 3.35Å
489	G	29.3	Very low	29.3	Very low	79 Å²	79	118.6 Å²	118.6	81%	0.814	79%	0.793	S	S	*	*			trans	-72.7	88	166.2	0	0	0	0	0	111.3	G487 A491	G487-G489 PolarHBondContact O-N 3.39Å; G487-G489 VanDerWaalsContact O-N 3.12Å; G489-A491 PolarHBondContact O-N 3.37Å
490	S	27.7	Very low	29.4	Very low	120 Å²	120	119.5 Å²	119.5	84%	0.839	80%	0.799	S	S	*	*			trans	-70.6	120	175.4	-68.4	0	0	0	0	111.2	H488	H488-S490 PolarHBondContact O-N 3.35Å
491	A	31.8	Very low	29.3	Very low	79 Å²	79	117.8 Å²	117.8	65%	0.653	79%	0.793	S	S	*	*			trans	-148.5	114.1	173.3	0	0	0	0	0	112.6	G489	G489-A491 PolarHBondContact O-N 3.37Å
492	G	29.8	Very low	29.5	Very low	72 Å²	72	119 Å²	119	74%	0.742	79%	0.792	S	S	*	*			trans	78.2	45	150.6	0	0	0	0	0	118.9	M494	G492-M494 PolarHBondContact O-N 3.3Å
493	H	29.2	Very low	29.5	Very low	181 Å²	181	123 Å²	123	84%	0.838	80%	0.795	S	S	*	*			trans	-70.8	93.3	162.6	-172.6	81.6	0	0	0	110.1
494	M	35.4	Very low	29.8	Very low	176 Å²	176	119.5 Å²	119.5	87%	0.867	79%	0.792	S	S	*	*			trans	-101.9	113	179.4	-92.2	-72.3	-71.9	0	0	111.4	G492	G492-M494 PolarHBondContact O-N 3.3Å
495	G	27.9	Very low	29.7	Very low	65 Å²	65	117.9 Å²	117.9	67%	0.67	79%	0.79	S	S	*	*			trans	70.3	77	158.9	0	0	0	0	0	116.5	I497	G495-I497 PolarHBondContact O-N 3.24Å
496	G	25.1	Very low	29.8	Very low	67 Å²	67	121.6 Å²	121.6	69%	0.691	79%	0.788	S	S	*	*			trans	-68.2	123	158	0	0	0	0	0	110.6
497	I	30.4	Very low	29.9	Very low	156 Å²	156	120 Å²	120	80%	0.8	77%	0.77	S	S	*	*			trans	-109.9	113.3	167.4	-64.8	178.2	0	0	0	108	G495	G495-I497 PolarHBondContact O-N 3.24Å
498	T	26.7	Very low	30.3	Very low	143 Å²	143	121.5 Å²	121.5	88%	0.877	77%	0.767	S	S	*	*			trans	-75.1	119.4	171.9	42.7	0	0	0	0	109.9
499	A	28.8	Very low	31	Very low	86 Å²	86	119.1 Å²	119.1	71%	0.711	76%	0.761	S	S	*	*			trans	-138.9	60.1	-179.5	0	0	0	0	0	112.6	S501	A499-S501 VanDerWaalsContact C-N 3.27Å; A499-S501 PolarHBondContact O-N 3.19Å
500	S	29	Very low	31.8	Very low	119 Å²	119	122.4 Å²	122.4	83%	0.832	76%	0.755	S	S	*	*			trans	-71.1	83.7	160.4	55	0	0	0	0	109.8
501	S	29	Very low	33	Very low	96 Å²	96	123.2 Å²	123.2	67%	0.671	75%	0.745	S	S	*	*			trans	-156.9	108.5	172.3	-80.4	0	0	0	0	111.5	A499 N503	A499-S501 VanDerWaalsContact C-N 3.27Å; A499-S501 PolarHBondContact O-N 3.19Å; S501-N503 PolarHBondContact O-N 3.44Å
502	P	33.2	Very low	34	Very low	129 Å²	129	122.8 Å²	122.8	84%	0.838	74%	0.736	S	S	*	*	S	Bend	trans	-78.5	73.6	173.1	33.4	-33.7	0	0	0	110.2
503	N	29.5	Very low	35.4	Very low	161 Å²	161	120.5 Å²	120.5	86%	0.861	71%	0.708	S	S	*	*			trans	-169.8	76.7	166.3	-95.1	-31.6	0	0	0	109.4	S501	S501-N503 PolarHBondContact O-N 3.44Å
504	S	33.3	Very low	36.8	Very low	123 Å²	123	112.8 Å²	112.8	86%	0.86	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-98.6	129.6	167	-173	0	0	0	0	109.1
505	V	30.2	Very low	38.2	Very low	135 Å²	135	106 Å²	106	82%	0.818	65%	0.646	S	S	*	*	P	Polyproline II helix	trans	-67	141.8	-179.8	179.2	0	0	0	0	110.3	D507	V505-D507 PolarHBondContact O-N 3.35Å
506	Y	29.6	Very low	40.4	Very low	193 Å²	193	104.9 Å²	104.9	76%	0.757	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-64.4	116.4	172.8	-178.3	-90.6	0	0	0	110.2	P508	Y506-P508 HydrophobicContact CD1-CG 4.4Å; Y506-P508 WeakPolarHBondContact O-CD 3.47Å
507	D	33.6	Very low	43.2	Very low	79 Å²	79	102.2 Å²	102.2	42%	0.422	60%	0.595	S	S	.	*			trans	-82.7	113.4	170.8	179.2	1.3	0	0	0	109.3	V505 N509 Q510	V505-D507 PolarHBondContact O-N 3.35Å; D507-N509 PolarHBondContact O-N 3.44Å; D507-N509 WeakPolarHBondContact OD1-CB 3.28Å; D507-N509 PolarHBondContact OD1-N 2.94Å; D507-N509 PolarHBondContact OD1-ND2 3.29Å; D507-Q510 PolarHBondContact O-N 2.98Å
508	P	38.2	Very low	45.9	Very low	104 Å²	104	95.1 Å²	95.1	68%	0.675	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.7	-6.5	-178.4	-20	33.9	0	0	0	114.7	Y506	Y506-P508 HydrophobicContact CD1-CG 4.4Å; Y506-P508 WeakPolarHBondContact O-CD 3.47Å
509	N	42.3	Very low	48.9	Very low	138 Å²	138	98 Å²	98	74%	0.738	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-1.1	-176.5	-53.5	-86.7	0	0	0	113.4	D507 E511	D507-N509 PolarHBondContact O-N 3.44Å; D507-N509 WeakPolarHBondContact OD1-CB 3.28Å; D507-N509 PolarHBondContact OD1-N 2.94Å; D507-N509 PolarHBondContact OD1-ND2 3.29Å; N509-E511 PolarHBondContact O-N 3.2Å
510	Q	47.1	Very low	51.7	Low	149 Å²	149	98.9 Å²	98.9	70%	0.696	55%	0.545	S	S	*	.	S	Bend	trans	-86.1	95.4	169.7	-67.9	-164.6	7.7	0	0	110.4	D507 P512	D507-Q510 PolarHBondContact O-N 2.98Å; Q510-P512 VanDerWaalsContact O-N 3.13Å
511	E	52	Low	54.4	Low	136 Å²	136	95.3 Å²	95.3	64%	0.636	52%	0.52	S	S	*	.			trans	-39.9	117.3	160.1	-84	-71.4	144.6	0	0	109.8	N509 V513 A515 L516	N509-E511 PolarHBondContact O-N 3.2Å; E511-V513 PolarHBondContact O-N 3.03Å; E511-A515 WeakPolarHBondContact OE2-CB 3.49Å; E511-L516 HydrophobicContact CB-CD1 4.2Å
512	P	54	Low	57.1	Low	71 Å²	71	97.8 Å²	97.8	46%	0.461	53%	0.526	S	S	.	.			trans	-63.8	137.6	-176.1	26.8	-33.8	0	0	0	108.6	Q510 S514 A515	Q510-P512 VanDerWaalsContact O-N 3.13Å; P512-S514 PolarHBondContact O-N 3.21Å; P512-A515 HydrophobicContact CG-CB 4.31Å; P512-A515 VanDerWaalsContact O-CB 3.29Å; P512-A515 WeakPolarHBondContact O-CB 3.46Å; P512-A515 PolarHBondContact O-N 3.32Å
513	V	58.8	Low	59.6	Low	23 Å²	23	95 Å²	95	14%	0.139	50%	0.504	C	S	.	.	G	3₁₀ helix	trans	-63.2	-20	-168.9	-168	0	0	0	0	113.1	L384 S387 T388 E511 A515 L516	L384-V513 HydrophobicContact CD2-CG1 4.49Å; S387-V513 WeakPolarHBondContact O-CB 3.48Å; T388-V513 HydrophobicContact CG2-CG1 4.45Å; E511-V513 PolarHBondContact O-N 3.03Å; V513-A515 VanDerWaalsContact C-N 3.26Å; V513-A515 PolarHBondContact O-N 3.44Å; V513-L516 HydrophobicContact CG1-CB 4.45Å; V513-L516 WeakPolarHBondContact O-CB 3.46Å; V513-L516 PolarHBondContact O-N 3.39Å
514	S	58.8	Low	62.4	Low	20 Å²	20	90.1 Å²	90.1	14%	0.14	48%	0.481	C	S	.	.	G	3₁₀ helix	trans	-56.4	-33.2	167.3	-61.6	0	0	0	0	114.1	T388 S391 P512 L516 N517	T388-S514 PolarHBondContact O-OG 3.48Å; S391-S514 PolarHBondContact OG-OG 3.15Å; P512-S514 PolarHBondContact O-N 3.21Å; S514-L516 VanDerWaalsContact C-N 3.32Å; S514-N517 PolarHBondContact O-N 3.44Å
515	A	65	Low	64.7	Low	34 Å²	34	87.5 Å²	87.5	28%	0.281	46%	0.457	S	S	.	.	G	3₁₀ helix	trans	-69.4	-27.7	173.5	0	0	0	0	0	112.9	E511 P512 V513 N517 S521	E511-A515 WeakPolarHBondContact OE2-CB 3.49Å; P512-A515 HydrophobicContact CG-CB 4.31Å; P512-A515 VanDerWaalsContact O-CB 3.29Å; P512-A515 WeakPolarHBondContact O-CB 3.46Å; P512-A515 PolarHBondContact O-N 3.32Å; V513-A515 VanDerWaalsContact C-N 3.26Å; V513-A515 PolarHBondContact O-N 3.44Å; A515-N517 PolarHBondContact O-N 2.88Å; A515-S521 PolarHBondContact O-OG 2.82Å; A515-S521 VanDerWaalsContact O-OG 3.12Å
516	L	73.1	Confident	67	Low	40 Å²	40	85.4 Å²	85.4	21%	0.209	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-77.7	-2.8	177	-72.3	92.5	0	0	0	113.7	E511 V513 S514 P518 Y526	E511-L516 HydrophobicContact CB-CD1 4.2Å; V513-L516 HydrophobicContact CG1-CB 4.45Å; V513-L516 WeakPolarHBondContact O-CB 3.46Å; V513-L516 PolarHBondContact O-N 3.39Å; S514-L516 VanDerWaalsContact C-N 3.32Å; L516-P518 WeakPolarHBondContact O-CD 3.45Å; L516-Y526 HydrophobicContact CB-CD2 4.1Å; L516-Y526 HydrophobicContact CB-CE2 4.38Å; L516-Y526 HydrophobicContact CD2-CD2 3.95Å; L516-Y526 HydrophobicContact CD2-CE2 3.89Å; L516-Y526 HydrophobicContact CG-CD2 4.31Å; L516-Y526 VanDerWaalsContact O-CD1 3.28Å; L516-Y526 WeakPolarHBondContact O-CD1 3.25Å
517	N	84.4	Confident	69.6	Low	12 Å²	12	82.3 Å²	82.3	6%	0.064	42%	0.423	C	S	.	.			trans	-102.4	107	174.7	-172.7	2.1	0	0	0	110.4	T388 S514 A515 W519 I520 S521	T388-N517 HydrophobicContact CG2-CB 4.06Å; S514-N517 PolarHBondContact O-N 3.44Å; A515-N517 PolarHBondContact O-N 2.88Å; N517-W519 PolarHBondContact O-N 3.43Å; N517-W519 VanDerWaalsContact OD1-CD1 3.29Å; N517-W519 PolarHBondContact OD1-N 3.1Å; N517-I520 HydrophobicContact CB-CB 4.42Å; N517-I520 HydrophobicContact CB-CD1 4.29Å; N517-I520 HydrophobicContact CB-CG1 4.39Å; N517-I520 VanDerWaalsContact ND2-CD1 3.29Å; N517-I520 WeakPolarHBondContact ND2-CD1 3.24Å; N517-I520 PolarHBondContact O-N 3.01Å; N517-S521 PolarHBondContact O-N 2.7Å; N517-S521 PolarHBondContact O-OG 3.19Å
518	P	87.3	Confident	71.8	Confident	7 Å²	7	81.4 Å²	81.4	5%	0.045	42%	0.418	C	S	.	.	H	α-helix	trans	-62.5	-23.4	-178.6	-26.3	37.8	0	0	0	113.7	L516 I520 D522 N523 W527	L516-P518 WeakPolarHBondContact O-CD 3.45Å; P518-I520 PolarHBondContact O-N 3.02Å; P518-D522 VanDerWaalsContact O-CA 3.32Å; P518-D522 WeakPolarHBondContact O-CA 3.33Å; P518-D522 PolarHBondContact O-N 3.14Å; P518-D522 VanDerWaalsContact O-N 3.09Å; P518-N523 WeakPolarHBondContact CB-O 3.15Å; P518-N523 WeakPolarHBondContact CG-O 3.33Å; P518-W527 HydrophobicContact CB-CD2 4.28Å; P518-W527 HydrophobicContact CB-CE3 4.4Å; P518-W527 HydrophobicContact CB-CH2 3.82Å; P518-W527 HydrophobicContact CB-CZ2 3.67Å; P518-W527 HydrophobicContact CB-CZ3 4.19Å; P518-W527 HydrophobicContact CG-CD2 3.95Å; P518-W527 HydrophobicContact CG-CE3 4.48Å; P518-W527 HydrophobicContact CG-CG 4.32Å; P518-W527 HydrophobicContact CG-CH2 4.47Å; P518-W527 HydrophobicContact CG-CZ2 3.94Å
519	W	89.6	Confident	73.3	Confident	204 Å²	204	78 Å²	78	77%	0.773	40%	0.395	S	S	*	.	H	α-helix	trans	-76.9	0	176	-50.1	113.4	0	0	0	114.2	N517 W527	N517-W519 PolarHBondContact O-N 3.43Å; N517-W519 VanDerWaalsContact OD1-CD1 3.29Å; N517-W519 PolarHBondContact OD1-N 3.1Å; W519-W527 HydrophobicContact CD2-CH2 4.49Å; W519-W527 HydrophobicContact CD2-CZ2 4.27Å; W519-W527 AromaticContact CE2-CZ2 3.68Å; W519-W527 AromaticContact CH2-CH2 3.99Å; W519-W527 HydrophobicContact CH2-CH2 3.99Å; W519-W527 HydrophobicContact CH2-CZ2 4.18Å; W519-W527 AromaticContact CZ2-CH2 3.94Å; W519-W527 HydrophobicContact CZ2-CH2 3.94Å; W519-W527 AromaticContact CZ2-CZ2 3.64Å; W519-W527 HydrophobicContact CZ2-CZ2 3.64Å; W519-W527 HydrophobicContact CZ3-CH2 4.28Å; W519-W527 AromaticContact NE1-CZ2 3.95Å
520	I	87.6	Confident	74.3	Confident	103 Å²	103	76.2 Å²	76.2	53%	0.528	39%	0.386	S	S	.	.	H	α-helix	trans	-126.2	-34.6	177.7	-60.5	177.9	0	0	0	111.1	N517 P518	N517-I520 HydrophobicContact CB-CB 4.42Å; N517-I520 HydrophobicContact CB-CD1 4.29Å; N517-I520 HydrophobicContact CB-CG1 4.39Å; N517-I520 VanDerWaalsContact ND2-CD1 3.29Å; N517-I520 WeakPolarHBondContact ND2-CD1 3.24Å; N517-I520 PolarHBondContact O-N 3.01Å; P518-I520 PolarHBondContact O-N 3.02Å
521	S	85.5	Confident	75.1	Confident	44 Å²	44	75.4 Å²	75.4	31%	0.308	39%	0.385	S	S	.	.	H	α-helix	trans	-96.5	-7.8	-178.3	61.7	0	0	0	0	114.7	A515 N517 N523	A515-S521 PolarHBondContact O-OG 2.82Å; A515-S521 VanDerWaalsContact O-OG 3.12Å; N517-S521 PolarHBondContact O-N 2.7Å; N517-S521 PolarHBondContact O-OG 3.19Å; S521-N523 PolarHBondContact O-N 2.94Å; S521-N523 PolarHBondContact OG-N 3.33Å
522	D	87	Confident	75.6	Confident	149 Å²	149	75.2 Å²	75.2	80%	0.797	38%	0.379	S	S	*	.			trans	52.1	12.9	-168.4	-68	-39.2	0	0	0	114.9	P518 P524	P518-D522 VanDerWaalsContact O-CA 3.32Å; P518-D522 WeakPolarHBondContact O-CA 3.33Å; P518-D522 PolarHBondContact O-N 3.14Å; P518-D522 VanDerWaalsContact O-N 3.09Å; D522-P524 WeakPolarHBondContact O-CD 3.48Å
523	N	84.8	Confident	75.9	Confident	69 Å²	69	75.9 Å²	75.9	37%	0.369	38%	0.383	S	S	.	.			trans	-99.5	112.3	179.1	-172.6	-3.5	0	0	0	112	P518 S521 D525	P518-N523 WeakPolarHBondContact CB-O 3.15Å; P518-N523 WeakPolarHBondContact CG-O 3.33Å; S521-N523 PolarHBondContact O-N 2.94Å; S521-N523 PolarHBondContact OG-N 3.33Å; N523-D525 VanDerWaalsContact C-N 3.25Å; N523-D525 PolarHBondContact ND2-OD2 3.27Å; N523-D525 PolarHBondContact O-N 2.96Å; N523-D525 WeakPolarHBondContact OD1-CB 3.4Å; N523-D525 PolarHBondContact OD1-N 3.49Å; N523-D525 PolarHBondContact OD1-OD2 3Å
524	P	87.4	Confident	76.2	Confident	60 Å²	60	85.1 Å²	85.1	39%	0.39	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	0.8	177.6	33.6	-37.4	0	0	0	114.5	D522 Y526 W527 N528	D522-P524 WeakPolarHBondContact O-CD 3.48Å; P524-Y526 PolarHBondContact O-N 3.1Å; P524-Y526 VanDerWaalsContact O-N 3.13Å; P524-W527 HydrophobicContact CB-CE3 3.86Å; P524-W527 HydrophobicContact CB-CZ3 4.24Å; P524-W527 PolarHBondContact O-N 3.03Å; P524-W527 VanDerWaalsContact O-N 3.11Å; P524-N528 PolarHBondContact O-N 2.93Å; P524-N528 VanDerWaalsContact O-N 3.17Å; P524-N528 PolarHBondContact O-ND2 3.35Å
525	D	81.8	Confident	76.7	Confident	67 Å²	67	91.6 Å²	91.6	36%	0.358	44%	0.444	S	S	.	.	H	α-helix	trans	-51	-36.7	178.3	-99.7	-50.3	0	0	0	112.5	N523 W527 N528 T529 R532	N523-D525 VanDerWaalsContact C-N 3.25Å; N523-D525 PolarHBondContact ND2-OD2 3.27Å; N523-D525 PolarHBondContact O-N 2.96Å; N523-D525 WeakPolarHBondContact OD1-CB 3.4Å; N523-D525 PolarHBondContact OD1-N 3.49Å; N523-D525 PolarHBondContact OD1-OD2 3Å; D525-W527 PolarHBondContact O-N 3.28Å; D525-N528 CarbonylContact O-C 3.5Å; D525-N528 WeakPolarHBondContact O-CA 3.14Å; D525-N528 PolarHBondContact O-N 2.8Å; D525-N528 VanDerWaalsContact O-N 3.1Å; D525-T529 PolarHBondContact O-N 3.2Å; D525-T529 PolarHBondContact O-OG1 2.66Å; D525-R532 IonicContact OD1-CZ 3.74Å; D525-R532 IonicContact OD1-NH1 2.94Å; D525-R532 PolarHBondContact OD1-NH1 2.81Å; D525-R532 VanDerWaalsContact OD1-NH1 3.08Å; D525-R532 IonicContact OD1-NH2 2.75Å; D525-R532 PolarHBondContact OD1-NH2 2.86Å
526	Y	79.2	Confident	77.4	Confident	91 Å²	91	91.1 Å²	91.1	36%	0.357	44%	0.437	S	S	.	.	H	α-helix	trans	-58.9	-46.2	178.8	-177.7	-111	0	0	0	112.3	L384 L516 P524 N528 T529	L384-Y526 HydrophobicContact CD1-CE1 4.02Å; L516-Y526 HydrophobicContact CB-CD2 4.1Å; L516-Y526 HydrophobicContact CB-CE2 4.38Å; L516-Y526 HydrophobicContact CD2-CD2 3.95Å; L516-Y526 HydrophobicContact CD2-CE2 3.89Å; L516-Y526 HydrophobicContact CG-CD2 4.31Å; L516-Y526 VanDerWaalsContact O-CD1 3.28Å; L516-Y526 WeakPolarHBondContact O-CD1 3.25Å; P524-Y526 PolarHBondContact O-N 3.1Å; P524-Y526 VanDerWaalsContact O-N 3.13Å; Y526-N528 VanDerWaalsContact C-N 3.33Å; Y526-N528 PolarHBondContact O-N 3.28Å; Y526-T529 WeakPolarHBondContact O-CB 3.35Å; Y526-T529 PolarHBondContact O-N 3.27Å; Y526-T529 PolarHBondContact O-OG1 3.47Å
527	W	84.1	Confident	77.9	Confident	129 Å²	129	91 Å²	91	49%	0.489	44%	0.438	S	S	.	.	H	α-helix	trans	-65.6	-36.3	174.3	-59.5	-34.8	0	0	0	112.2	P518 W519 P524 D525 T529	P518-W527 HydrophobicContact CB-CD2 4.28Å; P518-W527 HydrophobicContact CB-CE3 4.4Å; P518-W527 HydrophobicContact CB-CH2 3.82Å; P518-W527 HydrophobicContact CB-CZ2 3.67Å; P518-W527 HydrophobicContact CB-CZ3 4.19Å; P518-W527 HydrophobicContact CG-CD2 3.95Å; P518-W527 HydrophobicContact CG-CE3 4.48Å; P518-W527 HydrophobicContact CG-CG 4.32Å; P518-W527 HydrophobicContact CG-CH2 4.47Å; P518-W527 HydrophobicContact CG-CZ2 3.94Å; W519-W527 HydrophobicContact CD2-CH2 4.49Å; W519-W527 HydrophobicContact CD2-CZ2 4.27Å; W519-W527 AromaticContact CE2-CZ2 3.68Å; W519-W527 AromaticContact CH2-CH2 3.99Å; W519-W527 HydrophobicContact CH2-CH2 3.99Å; W519-W527 HydrophobicContact CH2-CZ2 4.18Å; W519-W527 AromaticContact CZ2-CH2 3.94Å; W519-W527 HydrophobicContact CZ2-CH2 3.94Å; W519-W527 AromaticContact CZ2-CZ2 3.64Å; W519-W527 HydrophobicContact CZ2-CZ2 3.64Å; W519-W527 HydrophobicContact CZ3-CH2 4.28Å; W519-W527 AromaticContact NE1-CZ2 3.95Å; P524-W527 HydrophobicContact CB-CE3 3.86Å; P524-W527 HydrophobicContact CB-CZ3 4.24Å; P524-W527 PolarHBondContact O-N 3.03Å; P524-W527 VanDerWaalsContact O-N 3.11Å; D525-W527 PolarHBondContact O-N 3.28Å; W527-T529 PolarHBondContact O-N 3.15Å
528	N	79.2	Confident	77.9	Confident	59 Å²	59	94.4 Å²	94.4	32%	0.316	46%	0.455	S	S	.	.	H	α-helix	trans	-71.1	-10	177.5	-69.4	-67.2	0	0	0	113.8	P524 D525 Y526 D530 L531	P524-N528 PolarHBondContact O-N 2.93Å; P524-N528 VanDerWaalsContact O-N 3.17Å; P524-N528 PolarHBondContact O-ND2 3.35Å; D525-N528 CarbonylContact O-C 3.5Å; D525-N528 WeakPolarHBondContact O-CA 3.14Å; D525-N528 PolarHBondContact O-N 2.8Å; D525-N528 VanDerWaalsContact O-N 3.1Å; Y526-N528 VanDerWaalsContact C-N 3.33Å; Y526-N528 PolarHBondContact O-N 3.28Å; N528-D530 PolarHBondContact O-N 2.93Å; N528-L531 PolarHBondContact O-N 3.49Å
529	T	70.6	Confident	77.9	Confident	34 Å²	34	98.8 Å²	98.8	21%	0.209	47%	0.471	C	S	.	.	G	3₁₀ helix	trans	-56.6	-39.7	176.7	-51.4	0	0	0	0	111.9	D525 Y526 W527 L531 R532 P537	D525-T529 PolarHBondContact O-N 3.2Å; D525-T529 PolarHBondContact O-OG1 2.66Å; Y526-T529 WeakPolarHBondContact O-CB 3.35Å; Y526-T529 PolarHBondContact O-N 3.27Å; Y526-T529 PolarHBondContact O-OG1 3.47Å; W527-T529 PolarHBondContact O-N 3.15Å; T529-L531 PolarHBondContact O-N 3.12Å; T529-R532 PolarHBondContact O-N 3.25Å; T529-P537 HydrophobicContact CG2-CG 3.26Å
530	D	63.1	Low	77.8	Confident	100 Å²	100	90.6 Å²	90.6	54%	0.535	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-71.7	-18.1	-176.7	-72	-24.7	0	0	0	113.6	N528 R532 R540	N528-D530 PolarHBondContact O-N 2.93Å; D530-R532 VanDerWaalsContact C-N 3.32Å; D530-R540 IonicContact OD1-CZ 3.45Å; D530-R540 IonicContact OD1-NE 3.74Å; D530-R540 IonicContact OD1-NH1 3.6Å; D530-R540 PolarHBondContact OD1-NH1 2.74Å
531	L	64.2	Low	78	Confident	131 Å²	131	85.9 Å²	85.9	69%	0.686	42%	0.416	S	S	*	.	G	3₁₀ helix	trans	-84.4	-0.8	175.7	-58.1	175.8	0	0	0	113.4	N528 T529 P533	N528-L531 PolarHBondContact O-N 3.49Å; T529-L531 PolarHBondContact O-N 3.12Å; L531-P533 WeakPolarHBondContact O-CD 3.47Å
532	R	62	Low	78.4	Confident	133 Å²	133	87.1 Å²	87.1	50%	0.502	42%	0.416	S	S	.	.			trans	-113	64.8	-175	-62.6	-179.4	-174.9	161.8	8.4	112.3	D525 T529 D530 K534 Y535	D525-R532 IonicContact OD1-CZ 3.74Å; D525-R532 IonicContact OD1-NH1 2.94Å; D525-R532 PolarHBondContact OD1-NH1 2.81Å; D525-R532 VanDerWaalsContact OD1-NH1 3.08Å; D525-R532 IonicContact OD1-NH2 2.75Å; D525-R532 PolarHBondContact OD1-NH2 2.86Å; T529-R532 PolarHBondContact O-N 3.25Å; D530-R532 VanDerWaalsContact C-N 3.32Å; R532-K534 PolarHBondContact O-N 3.07Å; R532-Y535 PolarHBondContact O-N 3.43Å
533	P	60.9	Low	78.7	Confident	85 Å²	85	83.5 Å²	83.5	55%	0.552	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-13.9	-173.6	25.6	-35.9	0	0	0	115.1	L531 Y535	L531-P533 WeakPolarHBondContact O-CD 3.47Å; P533-Y535 VanDerWaalsContact C-N 3.26Å; P533-Y535 PolarHBondContact O-N 2.91Å
534	K	64.4	Low	79.2	Confident	217 Å²	217	80.3 Å²	80.3	94%	0.943	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-9.7	173.3	-67.1	-178.1	179.9	174.5	0	114.2	R532	R532-K534 PolarHBondContact O-N 3.07Å
535	Y	70.2	Confident	79.6	Confident	155 Å²	155	79.6 Å²	79.6	61%	0.608	37%	0.37	S	S	*	.	S	Bend	trans	-148.2	84.3	175	-169	-101.6	0	0	0	110.8	R532 P533	R532-Y535 PolarHBondContact O-N 3.43Å; P533-Y535 VanDerWaalsContact C-N 3.26Å; P533-Y535 PolarHBondContact O-N 2.91Å
536	L	79.7	Confident	80.2	Confident	25 Å²	25	78.3 Å²	78.3	13%	0.131	36%	0.361	C	S	.	.			trans	-73.7	128.2	175.1	-61.5	174.5	0	0	0	110.1	I541 W544 V556	L536-I541 HydrophobicContact CB-CD1 3.96Å; L536-I541 HydrophobicContact CB-CG1 4.11Å; L536-W544 HydrophobicContact CD1-CH2 3.84Å; L536-W544 HydrophobicContact CD1-CZ2 4.24Å; L536-V556 HydrophobicContact CD1-CG1 3.72Å; L536-V556 HydrophobicContact CD2-CB 4.38Å; L536-V556 HydrophobicContact CD2-CG1 4.07Å; L536-V556 HydrophobicContact CD2-CG2 4.47Å; L536-V556 HydrophobicContact CG-CG1 4.47Å
537	P	82.3	Confident	81	Confident	38 Å²	38	75.4 Å²	75.4	25%	0.247	35%	0.354	C	S	.	.			trans	-64.5	140.1	175.4	-19.2	29.8	0	0	0	111.7	T529 R539 R540 I541	T529-P537 HydrophobicContact CG2-CG 3.26Å; P537-R539 PolarHBondContact O-N 2.83Å; P537-R539 VanDerWaalsContact O-N 3.13Å; P537-R540 WeakPolarHBondContact O-CB 3.26Å; P537-R540 PolarHBondContact O-N 3.14Å; P537-I541 PolarHBondContact O-N 3.44Å
538	I	85.9	Confident	81.6	Confident	82 Å²	82	69.3 Å²	69.3	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-56.4	-33.3	176.4	-60.3	173	0	0	0	111.2	R540 I541 K542 F667	I538-R540 PolarHBondContact O-N 3.12Å; I538-I541 PolarHBondContact O-N 2.76Å; I538-K542 VanDerWaalsContact O-CB 3.29Å; I538-K542 WeakPolarHBondContact O-CB 3.49Å; I538-K542 PolarHBondContact O-N 3.47Å; I538-F667 HydrophobicContact CG2-CD1 4.39Å; I538-F667 HydrophobicContact CG2-CD2 4.34Å; I538-F667 HydrophobicContact CG2-CE1 4.07Å; I538-F667 HydrophobicContact CG2-CE2 4.02Å; I538-F667 HydrophobicContact CG2-CZ 3.87Å
539	R	86	Confident	82.5	Confident	99 Å²	99	71.5 Å²	71.5	37%	0.374	34%	0.34	S	S	.	.	H	α-helix	trans	-57.2	-45.5	172.5	-63.6	-166.8	-169.9	-149.6	7.4	112.2	E381 F382 P537 K542 R543	E381-R539 PolarHBondContact O-NH1 2.82Å; F382-R539 HydrophobicContact CE1-CB 4.05Å; F382-R539 WeakPolarHBondContact CE1-O 3.36Å; F382-R539 HydrophobicContact CZ-CB 4.49Å; F382-R539 VanDerWaalsContact CZ-O 3.31Å; F382-R539 WeakPolarHBondContact CZ-O 3.42Å; P537-R539 PolarHBondContact O-N 2.83Å; P537-R539 VanDerWaalsContact O-N 3.13Å; R539-K542 WeakPolarHBondContact O-CB 3.5Å; R539-K542 PolarHBondContact O-N 2.82Å; R539-R543 PolarHBondContact O-N 3.16Å; R539-R543 VanDerWaalsContact O-N 3.13Å
540	R	88.7	Confident	83.7	Confident	33 Å²	33	71.2 Å²	71.2	13%	0.125	34%	0.336	C	S	.	.	H	α-helix	trans	-63.4	-45	178.8	-175	169.4	167.6	-174.4	-9.2	110.9	D530 P537 I538 K542 R543 W544 D554	D530-R540 IonicContact OD1-CZ 3.45Å; D530-R540 IonicContact OD1-NE 3.74Å; D530-R540 IonicContact OD1-NH1 3.6Å; D530-R540 PolarHBondContact OD1-NH1 2.74Å; P537-R540 WeakPolarHBondContact O-CB 3.26Å; P537-R540 PolarHBondContact O-N 3.14Å; I538-R540 PolarHBondContact O-N 3.12Å; R540-K542 PolarHBondContact O-N 2.65Å; R540-R543 WeakPolarHBondContact O-CB 3.42Å; R540-R543 PolarHBondContact O-N 3.34Å; R540-W544 VanDerWaalsContact O-CD1 3.23Å; R540-W544 PolarHBondContact O-NE1 2.88Å; R540-D554 WeakPolarHBondContact CG-OD2 3.46Å; R540-D554 IonicContact CZ-OD1 3.69Å; R540-D554 IonicContact CZ-OD2 3.96Å; R540-D554 IonicContact NE-OD1 2.67Å; R540-D554 IonicContact NE-OD2 3.41Å; R540-D554 PolarHBondContact NE-OD2 2.76Å; R540-D554 IonicContact NH2-OD1 3.94Å; R540-D554 PolarHBondContact NH2-OD1 3.17Å; R540-D554 IonicContact NH2-OD2 2.69Å; R540-D554 PolarHBondContact NH2-OD2 3.42Å
541	I	91.9	Very high	85.3	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.015	31%	0.31	C	S	.	.	H	α-helix	trans	-66.9	-35.6	177.6	-53.9	166.3	0	0	0	111.9	L536 P537 I538 W544 Y663 L666 F667	L536-I541 HydrophobicContact CB-CD1 3.96Å; L536-I541 HydrophobicContact CB-CG1 4.11Å; P537-I541 PolarHBondContact O-N 3.44Å; I538-I541 PolarHBondContact O-N 2.76Å; I541-W544 HydrophobicContact CG1-CH2 4.35Å; I541-W544 HydrophobicContact CG1-CZ3 4.45Å; I541-W544 HydrophobicContact CG2-CE3 4Å; I541-W544 HydrophobicContact CG2-CZ3 4.18Å; I541-W544 WeakPolarHBondContact O-CB 3.38Å; I541-W544 PolarHBondContact O-N 3.2Å; I541-Y663 HydrophobicContact CG2-CD2 4.25Å; I541-Y663 HydrophobicContact CG2-CE2 3.59Å; I541-Y663 PolarHBondContact O-OH 3Å; I541-L666 HydrophobicContact CD1-CB 4.23Å; I541-L666 WeakPolarHBondContact CD1-O 3.18Å; I541-L666 HydrophobicContact CG2-CB 4.44Å; I541-F667 HydrophobicContact CG2-CB 4.32Å; I541-F667 HydrophobicContact CG2-CD2 4.06Å
542	K	92.5	Very high	86.8	Confident	71 Å²	71	60.9 Å²	60.9	31%	0.309	28%	0.281	S	S	.	.	H	α-helix	trans	-60.8	-44	174.5	-173.1	-177.4	-177	-175.8	0	111.4	E381 I538 R539 R540 W544 S545 F546 F667	E381-K542 WeakPolarHBondContact OE1-CE 3.4Å; E381-K542 IonicContact OE1-NZ 3.59Å; E381-K542 PolarHBondContact OE1-NZ 3.25Å; E381-K542 IonicContact OE2-NZ 2.83Å; E381-K542 PolarHBondContact OE2-NZ 3.13Å; I538-K542 VanDerWaalsContact O-CB 3.29Å; I538-K542 WeakPolarHBondContact O-CB 3.49Å; I538-K542 PolarHBondContact O-N 3.47Å; R539-K542 WeakPolarHBondContact O-CB 3.5Å; R539-K542 PolarHBondContact O-N 2.82Å; R540-K542 PolarHBondContact O-N 2.65Å; K542-W544 PolarHBondContact O-N 3.12Å; K542-S545 WeakPolarHBondContact O-CB 3.31Å; K542-S545 PolarHBondContact O-N 2.81Å; K542-S545 PolarHBondContact O-OG 2.93Å; K542-F546 HydrophobicContact CG-CE1 4.21Å; K542-F546 HydrophobicContact CG-CZ 4.36Å; K542-F667 HydrophobicContact CB-CE2 3.88Å; K542-F667 HydrophobicContact CG-CE2 4.26Å
543	R	93.5	Very high	88.4	Confident	73 Å²	73	61.5 Å²	61.5	28%	0.275	29%	0.288	S	S	.	.	H	α-helix	trans	-57.1	-35.2	178.4	-168.7	177.4	172.9	122.6	15.4	112.6	Y379 F382 R539 R540 S545 F546 E550	Y379-R543 HydrophobicContact CE1-CG 4.42Å; F382-R543 HydrophobicContact CE1-CB 3.91Å; F382-R543 HydrophobicContact CE1-CG 4.4Å; F382-R543 HydrophobicContact CZ-CB 3.95Å; R539-R543 PolarHBondContact O-N 3.16Å; R539-R543 VanDerWaalsContact O-N 3.13Å; R540-R543 WeakPolarHBondContact O-CB 3.42Å; R540-R543 PolarHBondContact O-N 3.34Å; R543-S545 PolarHBondContact O-N 3.25Å; R543-F546 HydrophobicContact CG-CD2 4.19Å; R543-F546 WeakPolarHBondContact O-CB 3.29Å; R543-F546 PolarHBondContact O-N 2.85Å; R543-F546 VanDerWaalsContact O-N 3.11Å; R543-E550 HydrophobicContact CG-CB 4.33Å; R543-E550 HydrophobicContact CG-CG 4.25Å; R543-E550 IonicContact CZ-OE1 2.86Å; R543-E550 IonicContact CZ-OE2 3.63Å; R543-E550 IonicContact NE-OE1 3.47Å; R543-E550 PolarHBondContact NE-OE1 3.45Å; R543-E550 IonicContact NE-OE2 2.66Å; R543-E550 PolarHBondContact NE-OE2 3.17Å; R543-E550 IonicContact NH2-OE1 3.33Å; R543-E550 PolarHBondContact NH2-OE1 2.75Å; R543-E550 IonicContact NH2-OE2 3.76Å; R543-E550 PolarHBondContact NH2-OE2 3.29Å; R543-E550 WeakPolarHBondContact O-CB 3.41Å
544	W	95.6	Very high	89.9	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.008	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-25.7	176.2	-55.8	-12.6	0	0	0	114.2	L536 R540 I541 K542 F546 L551 D554 Y654 Y663 L666	L536-W544 HydrophobicContact CD1-CH2 3.84Å; L536-W544 HydrophobicContact CD1-CZ2 4.24Å; R540-W544 VanDerWaalsContact O-CD1 3.23Å; R540-W544 PolarHBondContact O-NE1 2.88Å; I541-W544 HydrophobicContact CG1-CH2 4.35Å; I541-W544 HydrophobicContact CG1-CZ3 4.45Å; I541-W544 HydrophobicContact CG2-CE3 4Å; I541-W544 HydrophobicContact CG2-CZ3 4.18Å; I541-W544 WeakPolarHBondContact O-CB 3.38Å; I541-W544 PolarHBondContact O-N 3.2Å; K542-W544 PolarHBondContact O-N 3.12Å; W544-F546 VanDerWaalsContact C-N 3.34Å; W544-L551 HydrophobicContact CB-CB 4.28Å; W544-L551 HydrophobicContact CB-CD1 3.88Å; W544-L551 HydrophobicContact CD2-CD1 3.99Å; W544-L551 HydrophobicContact CE3-CD1 4Å; W544-L551 HydrophobicContact CG-CD1 3.95Å; W544-D554 PolarHBondContact NE1-OD2 2.77Å; W544-Y654 PolarHBondContact O-OH 3.02Å; W544-Y654 VanDerWaalsContact O-OH 3.13Å; W544-Y663 HydrophobicContact CB-CE2 4.4Å; W544-Y663 HydrophobicContact CE3-CD2 4.35Å; W544-Y663 HydrophobicContact CE3-CE2 4.09Å; W544-L666 HydrophobicContact CZ3-CD1 4.14Å
545	S	95.3	Very high	91.3	Very high	45 Å²	45	52.3 Å²	52.3	32%	0.315	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-16	178.8	72.4	0	0	0	0	114	K542 R543 Y654	K542-S545 WeakPolarHBondContact O-CB 3.31Å; K542-S545 PolarHBondContact O-N 2.81Å; K542-S545 PolarHBondContact O-OG 2.93Å; R543-S545 PolarHBondContact O-N 3.25Å; S545-Y654 PolarHBondContact O-OH 3.08Å
546	F	95.4	Very high	92.3	Very high	39 Å²	39	45.9 Å²	45.9	17%	0.171	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-38.8	-175.1	-63.4	-11.7	0	0	0	111.7	Q378 Y379 F382 K542 R543 W544	Q378-F546 HydrophobicContact CG-CB 4.49Å; Q378-F546 HydrophobicContact CG-CD1 3.91Å; Q378-F546 HydrophobicContact CG-CD2 3.61Å; Q378-F546 HydrophobicContact CG-CE1 3.9Å; Q378-F546 HydrophobicContact CG-CE2 3.57Å; Q378-F546 HydrophobicContact CG-CG 3.77Å; Q378-F546 HydrophobicContact CG-CZ 3.71Å; Q378-F546 WeakPolarHBondContact O-CE2 3.25Å; Q378-F546 WeakPolarHBondContact O-CZ 3.43Å; Y379-F546 HydrophobicContact CD1-CD2 4.34Å; Y379-F546 HydrophobicContact CD1-CE2 4.37Å; Y379-F546 AromaticContact CE1-CD2 3.74Å; Y379-F546 HydrophobicContact CE1-CD2 3.74Å; Y379-F546 HydrophobicContact CE1-CE2 4.2Å; Y379-F546 HydrophobicContact CE2-CD2 4.14Å; Y379-F546 AromaticContact CZ-CD2 3.62Å; F382-F546 HydrophobicContact CD2-CE2 4.13Å; F382-F546 AromaticContact CE2-CE2 3.48Å; F382-F546 HydrophobicContact CE2-CE2 3.48Å; F382-F546 VanDerWaalsContact CE2-CE2 3.48Å; F382-F546 AromaticContact CE2-CZ 3.64Å; F382-F546 HydrophobicContact CE2-CZ 3.64Å; F382-F546 HydrophobicContact CZ-CE2 4.05Å; F382-F546 HydrophobicContact CZ-CZ 4.2Å; K542-F546 HydrophobicContact CG-CE1 4.21Å; K542-F546 HydrophobicContact CG-CZ 4.36Å; R543-F546 HydrophobicContact CG-CD2 4.19Å; R543-F546 WeakPolarHBondContact O-CB 3.29Å; R543-F546 PolarHBondContact O-N 2.85Å; R543-F546 VanDerWaalsContact O-N 3.11Å; W544-F546 VanDerWaalsContact C-N 3.34Å
547	S	95.8	Very high	93	Very high	31 Å²	31	44.7 Å²	44.7	22%	0.217	22%	0.22	C	C	.	.			trans	-163.3	158.3	167.3	71.2	0	0	0	0	111.7	H549 E550 L551 Y654	S547-H549 PolarHBondContact O-N 2.85Å; S547-H549 VanDerWaalsContact O-N 3.12Å; S547-H549 PolarHBondContact OG-N 3.16Å; S547-E550 PolarHBondContact O-N 3.03Å; S547-E550 PolarHBondContact OG-N 3.18Å; S547-L551 PolarHBondContact O-N 3.13Å; S547-Y654 WeakPolarHBondContact CA-OH 3.18Å; S547-Y654 PolarHBondContact N-OH 3.23Å
548	I	97.2	Very high	93.6	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-55.7	-27	169.3	-166.6	178.6	0	0	0	112.4	E550 L551 L552 F646 M649 K650 Y654	I548-E550 PolarHBondContact O-N 2.85Å; I548-L551 PolarHBondContact O-N 2.86Å; I548-L552 HydrophobicContact CD1-CD1 4.07Å; I548-L552 HydrophobicContact CG1-CD1 3.73Å; I548-L552 HydrophobicContact CG1-CG 3.97Å; I548-L552 WeakPolarHBondContact O-CB 3.49Å; I548-L552 VanDerWaalsContact O-CG 3.24Å; I548-L552 WeakPolarHBondContact O-CG 3.12Å; I548-L552 PolarHBondContact O-N 2.92Å; I548-F646 HydrophobicContact CG2-CE1 4.2Å; I548-F646 HydrophobicContact CG2-CE2 4.03Å; I548-F646 HydrophobicContact CG2-CZ 3.51Å; I548-M649 HydrophobicContact CD1-CB 3.94Å; I548-K650 HydrophobicContact CD1-CB 4.3Å; I548-K650 HydrophobicContact CG2-CB 4.06Å; I548-K650 HydrophobicContact CG2-CD 4Å; I548-K650 HydrophobicContact CG2-CG 3.85Å; I548-Y654 HydrophobicContact CB-CD1 4.27Å; I548-Y654 HydrophobicContact CB-CD2 3.66Å; I548-Y654 HydrophobicContact CB-CE2 3.93Å; I548-Y654 HydrophobicContact CB-CG 3.84Å; I548-Y654 HydrophobicContact CD1-CG 4.41Å; I548-Y654 HydrophobicContact CG1-CD2 3.86Å; I548-Y654 HydrophobicContact CG1-CE2 4.49Å; I548-Y654 HydrophobicContact CG1-CG 4.14Å; I548-Y654 VanDerWaalsContact N-CZ 3.31Å; I548-Y654 PolarHBondContact N-OH 3.46Å
549	H	96.6	Very high	94	Very high	105 Å²	105	45.8 Å²	45.8	49%	0.486	22%	0.22	S	C	.	.	H	α-helix	trans	-66.4	-35	174.4	-59.1	-87.9	0	0	0	112.4	S547 K553 F646	S547-H549 PolarHBondContact O-N 2.85Å; S547-H549 VanDerWaalsContact O-N 3.12Å; S547-H549 PolarHBondContact OG-N 3.16Å; H549-K553 WeakPolarHBondContact O-CB 3.22Å; H549-K553 PolarHBondContact O-N 3.2Å; H549-K553 VanDerWaalsContact O-N 3.12Å; H549-F646 AromaticContact CE1-CE1 3.5Å; H549-F646 AromaticContact CE1-CZ 3.19Å; H549-F646 WeakPolarHBondContact CE1-CZ 3.39Å; H549-F646 AromaticContact ND1-CZ 3.52Å; H549-F646 AromaticContact NE2-CE1 3.66Å; H549-F646 AromaticContact NE2-CZ 3.52Å
550	E	96.6	Very high	94.3	Very high	27 Å²	27	42.8 Å²	42.8	13%	0.126	21%	0.211	C	C	.	.	H	α-helix	trans	-76	-36.9	175.6	-73	-68.2	175.4	0	0	111.6	Y379 R543 S547 I548 D554	Y379-E550 WeakPolarHBondContact OH-CG 3.4Å; R543-E550 HydrophobicContact CG-CB 4.33Å; R543-E550 HydrophobicContact CG-CG 4.25Å; R543-E550 IonicContact CZ-OE1 2.86Å; R543-E550 IonicContact CZ-OE2 3.63Å; R543-E550 IonicContact NE-OE1 3.47Å; R543-E550 PolarHBondContact NE-OE1 3.45Å; R543-E550 IonicContact NE-OE2 2.66Å; R543-E550 PolarHBondContact NE-OE2 3.17Å; R543-E550 IonicContact NH2-OE1 3.33Å; R543-E550 PolarHBondContact NH2-OE1 2.75Å; R543-E550 IonicContact NH2-OE2 3.76Å; R543-E550 PolarHBondContact NH2-OE2 3.29Å; R543-E550 WeakPolarHBondContact O-CB 3.41Å; S547-E550 PolarHBondContact O-N 3.03Å; S547-E550 PolarHBondContact OG-N 3.18Å; I548-E550 PolarHBondContact O-N 2.85Å; E550-D554 PolarHBondContact O-N 2.82Å
551	L	96.8	Very high	94.7	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61.7	-46.5	173	178	66.1	0	0	0	112.3	W544 S547 I548 G557 L558 F561 Y654 F657	W544-L551 HydrophobicContact CB-CB 4.28Å; W544-L551 HydrophobicContact CB-CD1 3.88Å; W544-L551 HydrophobicContact CD2-CD1 3.99Å; W544-L551 HydrophobicContact CE3-CD1 4Å; W544-L551 HydrophobicContact CG-CD1 3.95Å; S547-L551 PolarHBondContact O-N 3.13Å; I548-L551 PolarHBondContact O-N 2.86Å; L551-G557 WeakPolarHBondContact CD1-O 3.28Å; L551-G557 CarbonylContact O-C 3.6Å; L551-L558 PolarHBondContact O-N 2.89Å; L551-F561 HydrophobicContact CD1-CB 4.42Å; L551-F561 HydrophobicContact CD2-CB 4.01Å; L551-F561 HydrophobicContact CD2-CD1 4.01Å; L551-F561 HydrophobicContact CD2-CD2 4.04Å; L551-F561 HydrophobicContact CD2-CE1 4.49Å; L551-F561 HydrophobicContact CD2-CG 3.77Å; L551-F561 HydrophobicContact CG-CB 4.34Å; L551-Y654 HydrophobicContact CB-CE2 4.23Å; L551-Y654 HydrophobicContact CD2-CD2 3.69Å; L551-Y654 HydrophobicContact CD2-CE2 3.96Å; L551-F657 HydrophobicContact CD1-CD1 4.47Å; L551-F657 HydrophobicContact CD1-CE1 3.7Å; L551-F657 HydrophobicContact CD1-CZ 4.32Å; L551-F657 HydrophobicContact CD2-CD1 3.79Å; L551-F657 HydrophobicContact CD2-CE1 3.86Å; L551-F657 HydrophobicContact CG-CE1 4.47Å
552	L	96.5	Very high	94.9	Very high	14 Å²	14	43.5 Å²	43.5	7%	0.073	22%	0.215	C	C	.	.	H	α-helix	trans	-78.3	-19	-177.5	-65.2	175.2	0	0	0	113.8	I548 L558 F561 L574 W577 F646	I548-L552 HydrophobicContact CD1-CD1 4.07Å; I548-L552 HydrophobicContact CG1-CD1 3.73Å; I548-L552 HydrophobicContact CG1-CG 3.97Å; I548-L552 WeakPolarHBondContact O-CB 3.49Å; I548-L552 VanDerWaalsContact O-CG 3.24Å; I548-L552 WeakPolarHBondContact O-CG 3.12Å; I548-L552 PolarHBondContact O-N 2.92Å; L552-L558 HydrophobicContact CD2-CD1 3.47Å; L552-L558 VanDerWaalsContact CD2-CD1 3.47Å; L552-F561 HydrophobicContact CD2-CD1 3.89Å; L552-F561 HydrophobicContact CD2-CE1 4.16Å; L552-L574 HydrophobicContact CD2-CD1 3.52Å; L552-W577 HydrophobicContact CB-CH2 4.09Å; L552-W577 HydrophobicContact CB-CZ3 4.13Å; L552-W577 HydrophobicContact CD1-CD2 4.46Å; L552-W577 HydrophobicContact CD1-CE3 4.19Å; L552-W577 HydrophobicContact CD1-CH2 3.99Å; L552-W577 HydrophobicContact CD1-CZ2 4.26Å; L552-W577 HydrophobicContact CD1-CZ3 3.95Å; L552-W577 HydrophobicContact CD2-CZ3 4.43Å; L552-W577 HydrophobicContact CG-CZ3 4.41Å; L552-F646 HydrophobicContact CD1-CD2 4.41Å; L552-F646 HydrophobicContact CD1-CE2 3.88Å
553	K	94.8	Very high	95.1	Very high	147 Å²	147	45 Å²	45	64%	0.639	22%	0.219	S	C	*	.	H	α-helix	trans	-78.8	-28.2	174.1	178.4	-177	175.2	-169	0	112.2	H549 P555	H549-K553 WeakPolarHBondContact O-CB 3.22Å; H549-K553 PolarHBondContact O-N 3.2Å; H549-K553 VanDerWaalsContact O-N 3.12Å; K553-P555 WeakPolarHBondContact O-CD 3.38Å
554	D	93.1	Very high	95.2	Very high	20 Å²	20	42.4 Å²	42.4	11%	0.107	21%	0.209	C	C	.	.	S	Bend	trans	-80.7	119.6	175.1	-171.4	-45.8	0	0	0	110.3	R540 W544 E550 V556 G557 L558	R540-D554 WeakPolarHBondContact CG-OD2 3.46Å; R540-D554 IonicContact CZ-OD1 3.69Å; R540-D554 IonicContact CZ-OD2 3.96Å; R540-D554 IonicContact NE-OD1 2.67Å; R540-D554 IonicContact NE-OD2 3.41Å; R540-D554 PolarHBondContact NE-OD2 2.76Å; R540-D554 IonicContact NH2-OD1 3.94Å; R540-D554 PolarHBondContact NH2-OD1 3.17Å; R540-D554 IonicContact NH2-OD2 2.69Å; R540-D554 PolarHBondContact NH2-OD2 3.42Å; W544-D554 PolarHBondContact NE1-OD2 2.77Å; E550-D554 PolarHBondContact O-N 2.82Å; D554-V556 VanDerWaalsContact C-N 3.26Å; D554-V556 PolarHBondContact O-N 3.48Å; D554-V556 PolarHBondContact OD1-N 3.21Å; D554-G557 PolarHBondContact O-N 3.25Å; D554-G557 PolarHBondContact OD1-N 3.09Å; D554-G557 VanDerWaalsContact OD1-N 3.09Å; D554-L558 VanDerWaalsContact O-CB 3.3Å; D554-L558 WeakPolarHBondContact O-CB 3.48Å; D554-L558 PolarHBondContact O-N 3.48Å
555	P	92.8	Very high	95.2	Very high	89 Å²	89	42.3 Å²	42.3	58%	0.578	21%	0.209	S	C	*	.	H	α-helix	trans	-58.6	-34.7	-179.3	-26.1	35.5	0	0	0	113.9	K553 E559	K553-P555 WeakPolarHBondContact O-CD 3.38Å; P555-E559 WeakPolarHBondContact O-CG 3.48Å; P555-E559 PolarHBondContact O-N 3.25Å
556	V	91.7	Very high	95.2	Very high	20 Å²	20	43.8 Å²	43.8	12%	0.121	21%	0.211	C	C	.	.	H	α-helix	trans	-83.9	-32.3	-179.4	-173	0	0	0	0	110.9	L536 D554 L558 E559 E560	L536-V556 HydrophobicContact CD1-CG1 3.72Å; L536-V556 HydrophobicContact CD2-CB 4.38Å; L536-V556 HydrophobicContact CD2-CG1 4.07Å; L536-V556 HydrophobicContact CD2-CG2 4.47Å; L536-V556 HydrophobicContact CG-CG1 4.47Å; D554-V556 VanDerWaalsContact C-N 3.26Å; D554-V556 PolarHBondContact O-N 3.48Å; D554-V556 PolarHBondContact OD1-N 3.21Å; V556-L558 VanDerWaalsContact C-N 3.33Å; V556-E559 PolarHBondContact O-N 2.88Å; V556-E560 PolarHBondContact O-N 3.34Å
557	G	93.6	Very high	95.1	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-60.2	-44.5	168.6	0	0	0	0	0	111.8	L551 D554 F561	L551-G557 WeakPolarHBondContact CD1-O 3.28Å; L551-G557 CarbonylContact O-C 3.6Å; D554-G557 PolarHBondContact O-N 3.25Å; D554-G557 PolarHBondContact OD1-N 3.09Å; D554-G557 VanDerWaalsContact OD1-N 3.09Å; G557-F561 VanDerWaalsContact O-CB 3.24Å; G557-F561 WeakPolarHBondContact O-CB 3.41Å; G557-F561 PolarHBondContact O-N 2.81Å
558	L	95.3	Very high	95	Very high	34 Å²	34	50 Å²	50	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-61.2	-46.2	174.5	-177.7	65.5	0	0	0	112.3	L551 L552 D554 V556 F561 Q562 L574 Q578	L551-L558 PolarHBondContact O-N 2.89Å; L552-L558 HydrophobicContact CD2-CD1 3.47Å; L552-L558 VanDerWaalsContact CD2-CD1 3.47Å; D554-L558 VanDerWaalsContact O-CB 3.3Å; D554-L558 WeakPolarHBondContact O-CB 3.48Å; D554-L558 PolarHBondContact O-N 3.48Å; V556-L558 VanDerWaalsContact C-N 3.33Å; L558-F561 PolarHBondContact O-N 2.69Å; L558-Q562 WeakPolarHBondContact O-CB 3.38Å; L558-Q562 PolarHBondContact O-N 3.2Å; L558-L574 HydrophobicContact CD1-CD1 3.95Å; L558-L574 HydrophobicContact CD1-CD2 4.2Å; L558-L574 HydrophobicContact CD1-CG 4.47Å; L558-Q578 HydrophobicContact CD1-CG 4.49Å
559	E	94	Very high	94.6	Very high	108 Å²	108	58.8 Å²	58.8	51%	0.505	27%	0.273	S	S	.	.	H	α-helix	trans	-61.5	-47.8	176.2	-82	-175.4	-145.4	0	0	113.3	P555 V556 Q562 R563	P555-E559 WeakPolarHBondContact O-CG 3.48Å; P555-E559 PolarHBondContact O-N 3.25Å; V556-E559 PolarHBondContact O-N 2.88Å; E559-Q562 PolarHBondContact O-N 3.21Å; E559-R563 WeakPolarHBondContact O-CB 3.47Å; E559-R563 PolarHBondContact O-N 3.45Å; E559-R563 IonicContact OE2-NH2 3.3Å
560	E	93.4	Very high	94.4	Very high	37 Å²	37	54.8 Å²	54.8	17%	0.173	26%	0.257	C	S	.	.	H	α-helix	trans	-70.5	-32.6	180	-65.8	-59.3	162	0	0	112.2	V556 R563 W564 L666	V556-E560 PolarHBondContact O-N 3.34Å; E560-R563 IonicContact OE1-CZ 3.1Å; E560-R563 IonicContact OE1-NH1 2.95Å; E560-R563 PolarHBondContact OE1-NH1 2.62Å; E560-R563 IonicContact OE2-CZ 3.86Å; E560-R563 IonicContact OE2-NH1 3.7Å; E560-R563 PolarHBondContact OE2-NH1 2.81Å; E560-W564 WeakPolarHBondContact O-CB 3.43Å; E560-W564 PolarHBondContact O-N 3.09Å; E560-L666 HydrophobicContact CB-CD1 4.31Å; E560-L666 HydrophobicContact CG-CD1 4.06Å
561	F	96.6	Very high	94.4	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.3	-47.2	172.7	-176.3	-133.4	0	0	0	111.2	L551 L552 G557 L558 R563 W564 L565 L574 F657	L551-F561 HydrophobicContact CD1-CB 4.42Å; L551-F561 HydrophobicContact CD2-CB 4.01Å; L551-F561 HydrophobicContact CD2-CD1 4.01Å; L551-F561 HydrophobicContact CD2-CD2 4.04Å; L551-F561 HydrophobicContact CD2-CE1 4.49Å; L551-F561 HydrophobicContact CD2-CG 3.77Å; L551-F561 HydrophobicContact CG-CB 4.34Å; L552-F561 HydrophobicContact CD2-CD1 3.89Å; L552-F561 HydrophobicContact CD2-CE1 4.16Å; G557-F561 VanDerWaalsContact O-CB 3.24Å; G557-F561 WeakPolarHBondContact O-CB 3.41Å; G557-F561 PolarHBondContact O-N 2.81Å; L558-F561 PolarHBondContact O-N 2.69Å; F561-R563 PolarHBondContact O-N 2.78Å; F561-W564 HydrophobicContact CD2-CE3 4.07Å; F561-W564 HydrophobicContact CE2-CE3 4.05Å; F561-W564 HydrophobicContact CE2-CZ3 4.07Å; F561-W564 PolarHBondContact O-N 3.4Å; F561-W564 VanDerWaalsContact O-N 3.13Å; F561-L565 HydrophobicContact CD1-CD1 4.22Å; F561-L565 HydrophobicContact CD2-CD1 4.5Å; F561-L565 HydrophobicContact CD2-CG 4.3Å; F561-L565 HydrophobicContact CE1-CD1 3.92Å; F561-L565 HydrophobicContact CE2-CD1 4.22Å; F561-L565 HydrophobicContact CE2-CD2 4Å; F561-L565 HydrophobicContact CE2-CG 4.08Å; F561-L565 HydrophobicContact CZ-CD1 3.93Å; F561-L565 HydrophobicContact CZ-CD2 4.16Å; F561-L565 HydrophobicContact CZ-CG 4.26Å; F561-L565 WeakPolarHBondContact O-CG 3.3Å; F561-L565 PolarHBondContact O-N 3.26Å; F561-L574 HydrophobicContact CD1-CD2 3.84Å; F561-L574 HydrophobicContact CE1-CD2 4.29Å; F561-F657 HydrophobicContact CB-CE2 4.42Å; F561-F657 HydrophobicContact CB-CZ 4.4Å; F561-F657 HydrophobicContact CD2-CB 3.81Å; F561-F657 HydrophobicContact CD2-CD1 4.06Å; F561-F657 AromaticContact CD2-CD2 3.82Å; F561-F657 HydrophobicContact CD2-CD2 3.82Å; F561-F657 HydrophobicContact CD2-CE2 4.39Å; F561-F657 AromaticContact CD2-CG 3.62Å; F561-F657 HydrophobicContact CD2-CG 3.62Å; F561-F657 HydrophobicContact CE2-CB 3.8Å; F561-F657 HydrophobicContact CE2-CG 4.14Å
562	Q	96.6	Very high	94.3	Very high	51 Å²	51	55.7 Å²	55.7	24%	0.238	26%	0.262	C	S	.	.	H	α-helix	trans	-58.8	-48.5	175.5	-171	-173.9	-42.6	0	0	111.5	L558 E559 W564 L565 E566 L574	L558-Q562 WeakPolarHBondContact O-CB 3.38Å; L558-Q562 PolarHBondContact O-N 3.2Å; E559-Q562 PolarHBondContact O-N 3.21Å; Q562-W564 PolarHBondContact O-N 2.8Å; Q562-L565 PolarHBondContact O-N 3.01Å; Q562-L565 VanDerWaalsContact O-N 3.15Å; Q562-E566 HydrophobicContact CG-CG 4.49Å; Q562-E566 PolarHBondContact NE2-OE1 3.46Å; Q562-E566 VanDerWaalsContact O-CG 3.31Å; Q562-E566 WeakPolarHBondContact O-CG 3.48Å; Q562-E566 PolarHBondContact O-N 2.82Å; Q562-L574 HydrophobicContact CB-CD2 3.73Å; Q562-L574 HydrophobicContact CG-CD2 4.18Å
563	R	95.1	Very high	94.3	Very high	101 Å²	101	55.6 Å²	55.6	38%	0.381	26%	0.262	S	S	.	.	H	α-helix	trans	-64.5	-19.9	178.7	-165.2	-174.9	-59.3	139.5	4	113.4	E559 E560 F561 K567	E559-R563 WeakPolarHBondContact O-CB 3.47Å; E559-R563 PolarHBondContact O-N 3.45Å; E559-R563 IonicContact OE2-NH2 3.3Å; E560-R563 IonicContact OE1-CZ 3.1Å; E560-R563 IonicContact OE1-NH1 2.95Å; E560-R563 PolarHBondContact OE1-NH1 2.62Å; E560-R563 IonicContact OE2-CZ 3.86Å; E560-R563 IonicContact OE2-NH1 3.7Å; E560-R563 PolarHBondContact OE2-NH1 2.81Å; F561-R563 PolarHBondContact O-N 2.78Å; R563-K567 WeakPolarHBondContact O-CE 3.49Å
564	W	96.2	Very high	94.4	Very high	19 Å²	19	48.6 Å²	48.6	7%	0.072	23%	0.231	C	C	.	.	H	α-helix	trans	-83.1	-45.7	171.7	177.3	80.2	0	0	0	111.5	E560 F561 Q562 E566 K567 E568 S653 R656 F657	E560-W564 WeakPolarHBondContact O-CB 3.43Å; E560-W564 PolarHBondContact O-N 3.09Å; F561-W564 HydrophobicContact CD2-CE3 4.07Å; F561-W564 HydrophobicContact CE2-CE3 4.05Å; F561-W564 HydrophobicContact CE2-CZ3 4.07Å; F561-W564 PolarHBondContact O-N 3.4Å; F561-W564 VanDerWaalsContact O-N 3.13Å; Q562-W564 PolarHBondContact O-N 2.8Å; W564-E566 VanDerWaalsContact C-N 3.25Å; W564-E566 PolarHBondContact O-N 3.08Å; W564-K567 WeakPolarHBondContact O-CB 3.39Å; W564-K567 PolarHBondContact O-N 3.21Å; W564-E568 VanDerWaalsContact CH2-CD 3.47Å; W564-E568 HydrophobicContact CH2-CG 4.28Å; W564-E568 WeakPolarHBondContact CH2-OE2 3.28Å; W564-E568 HydrophobicContact CZ2-CG 3.95Å; W564-E568 WeakPolarHBondContact CZ2-OE1 3.33Å; W564-E568 VanDerWaalsContact CZ2-OE2 3.25Å; W564-E568 WeakPolarHBondContact CZ2-OE2 3.25Å; W564-E568 PolarHBondContact O-N 3.15Å; W564-S653 WeakPolarHBondContact CH2-O 3.34Å; W564-S653 VanDerWaalsContact CZ3-O 3.26Å; W564-S653 WeakPolarHBondContact CZ3-O 3.39Å; W564-R656 HydrophobicContact CH2-CB 3.45Å; W564-R656 VanDerWaalsContact CH2-CB 3.45Å; W564-R656 HydrophobicContact CZ2-CB 3.89Å; W564-F657 HydrophobicContact CB-CD2 3.93Å; W564-F657 HydrophobicContact CB-CE2 4.11Å; W564-F657 HydrophobicContact CD2-CB 4.21Å; W564-F657 AromaticContact CD2-CD2 3.75Å; W564-F657 HydrophobicContact CD2-CD2 3.75Å; W564-F657 HydrophobicContact CD2-CG 4.48Å; W564-F657 HydrophobicContact CE3-CB 3.77Å; W564-F657 AromaticContact CE3-CD2 3.84Å; W564-F657 HydrophobicContact CE3-CD2 3.84Å; W564-F657 HydrophobicContact CE3-CG 4.26Å; W564-F657 AromaticContact CG-CD2 3.78Å; W564-F657 HydrophobicContact CG-CD2 3.78Å; W564-F657 HydrophobicContact CG-CE2 4.35Å; W564-F657 HydrophobicContact CH2-CB 4.26Å; W564-F657 HydrophobicContact CZ3-CB 3.8Å
565	L	96.3	Very high	94.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59	-35.1	173.7	-65.4	173.7	0	0	0	112.8	F561 Q562 K567 E568 F569 S570 A571 L574	F561-L565 HydrophobicContact CD1-CD1 4.22Å; F561-L565 HydrophobicContact CD2-CD1 4.5Å; F561-L565 HydrophobicContact CD2-CG 4.3Å; F561-L565 HydrophobicContact CE1-CD1 3.92Å; F561-L565 HydrophobicContact CE2-CD1 4.22Å; F561-L565 HydrophobicContact CE2-CD2 4Å; F561-L565 HydrophobicContact CE2-CG 4.08Å; F561-L565 HydrophobicContact CZ-CD1 3.93Å; F561-L565 HydrophobicContact CZ-CD2 4.16Å; F561-L565 HydrophobicContact CZ-CG 4.26Å; F561-L565 WeakPolarHBondContact O-CG 3.3Å; F561-L565 PolarHBondContact O-N 3.26Å; Q562-L565 PolarHBondContact O-N 3.01Å; Q562-L565 VanDerWaalsContact O-N 3.15Å; L565-K567 PolarHBondContact O-N 3.17Å; L565-E568 CarbonylContact O-C 3.4Å; L565-E568 PolarHBondContact O-N 2.94Å; L565-E568 VanDerWaalsContact O-N 3.12Å; L565-F569 PolarHBondContact O-N 2.97Å; L565-S570 PolarHBondContact O-N 3.17Å; L565-A571 HydrophobicContact CB-CB 3.93Å; L565-L574 HydrophobicContact CD1-CB 3.68Å; L565-L574 HydrophobicContact CD1-CD2 3.73Å; L565-L574 HydrophobicContact CD1-CG 4.33Å
566	E	95.6	Very high	94.8	Very high	77 Å²	77	47 Å²	47	36%	0.36	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-23.9	175.9	-75.9	172.4	174.1	0	0	113.1	Q562 W564 A571 R575	Q562-E566 HydrophobicContact CG-CG 4.49Å; Q562-E566 PolarHBondContact NE2-OE1 3.46Å; Q562-E566 VanDerWaalsContact O-CG 3.31Å; Q562-E566 WeakPolarHBondContact O-CG 3.48Å; Q562-E566 PolarHBondContact O-N 2.82Å; W564-E566 VanDerWaalsContact C-N 3.25Å; W564-E566 PolarHBondContact O-N 3.08Å; E566-A571 HydrophobicContact CG-CB 3.61Å; E566-R575 IonicContact OE1-CZ 2.68Å; E566-R575 IonicContact OE1-NE 3.8Å; E566-R575 IonicContact OE1-NH2 3.75Å; E566-R575 PolarHBondContact OE1-NH2 3.12Å
567	K	93.7	Very high	95	Very high	133 Å²	133	47.8 Å²	47.8	58%	0.578	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-24.8	173.9	-62.1	166.8	-172.5	166.4	0	112.8	R563 W564 L565 F569	R563-K567 WeakPolarHBondContact O-CE 3.49Å; W564-K567 WeakPolarHBondContact O-CB 3.39Å; W564-K567 PolarHBondContact O-N 3.21Å; L565-K567 PolarHBondContact O-N 3.17Å; K567-F569 VanDerWaalsContact C-N 3.33Å
568	E	92	Very high	95.2	Very high	67 Å²	67	49.9 Å²	49.9	31%	0.313	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	6.3	172	-64.9	-149.4	139.1	0	0	113	W564 L565 S570 R656	W564-E568 VanDerWaalsContact CH2-CD 3.47Å; W564-E568 HydrophobicContact CH2-CG 4.28Å; W564-E568 WeakPolarHBondContact CH2-OE2 3.28Å; W564-E568 HydrophobicContact CZ2-CG 3.95Å; W564-E568 WeakPolarHBondContact CZ2-OE1 3.33Å; W564-E568 VanDerWaalsContact CZ2-OE2 3.25Å; W564-E568 WeakPolarHBondContact CZ2-OE2 3.25Å; W564-E568 PolarHBondContact O-N 3.15Å; L565-E568 CarbonylContact O-C 3.4Å; L565-E568 PolarHBondContact O-N 2.94Å; L565-E568 VanDerWaalsContact O-N 3.12Å; E568-S570 VanDerWaalsContact C-N 3.31Å; E568-S570 PolarHBondContact O-N 3.23Å; E568-R656 IonicContact OE1-CZ 2.59Å; E568-R656 IonicContact OE1-NE 2.63Å; E568-R656 IonicContact OE1-NH2 3.41Å; E568-R656 PolarHBondContact OE1-NH2 3.13Å; E568-R656 IonicContact OE2-CZ 3.85Å; E568-R656 IonicContact OE2-NE 2.73Å; E568-R656 PolarHBondContact OE2-NE 3.29Å; E568-R656 VanDerWaalsContact OE2-NE 3.09Å; E568-R656 IonicContact OE2-NH2 2.72Å; E568-R656 PolarHBondContact OE2-NH2 2.76Å
569	F	89.8	Confident	95.3	Very high	185 Å²	185	49.2 Å²	49.2	81%	0.811	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.5	44.8	-178.2	-56.3	-89.8	0	0	0	113.5	L565 K567	L565-F569 PolarHBondContact O-N 2.97Å; K567-F569 VanDerWaalsContact C-N 3.33Å
570	S	92.5	Very high	95.4	Very high	21 Å²	21	44.1 Å²	44.1	15%	0.147	20%	0.199	C	C	.	.			trans	-138.2	24.5	-176.5	52.4	0	0	0	0	114.4	L565 E568 E572 N573	L565-S570 PolarHBondContact O-N 3.17Å; E568-S570 VanDerWaalsContact C-N 3.31Å; E568-S570 PolarHBondContact O-N 3.23Å; S570-E572 WeakPolarHBondContact CA-OE1 3.44Å; S570-E572 VanDerWaalsContact CA-OE2 3.25Å; S570-E572 WeakPolarHBondContact CA-OE2 3.49Å; S570-N573 PolarHBondContact O-ND2 3.03Å
571	A	95.5	Very high	95.5	Very high	3 Å²	3	45.6 Å²	45.6	3%	0.025	21%	0.205	C	C	.	.			trans	-79.4	-21.2	-174.1	0	0	0	0	0	114.4	L565 E566 N573 L574 R575	L565-A571 HydrophobicContact CB-CB 3.93Å; E566-A571 HydrophobicContact CG-CB 3.61Å; A571-N573 PolarHBondContact O-N 2.92Å; A571-L574 PolarHBondContact O-N 3.19Å; A571-R575 WeakPolarHBondContact O-CG 3.29Å; A571-R575 PolarHBondContact O-N 3.39Å
572	E	95.7	Very high	95.5	Very high	44 Å²	44	50.3 Å²	50.3	21%	0.206	23%	0.234	C	C	.	.	H	α-helix	trans	-54.4	-38.7	178.4	64.7	-60.8	143.7	0	0	112.7	S570 L574 R575 F576 E609 I611	S570-E572 WeakPolarHBondContact CA-OE1 3.44Å; S570-E572 VanDerWaalsContact CA-OE2 3.25Å; S570-E572 WeakPolarHBondContact CA-OE2 3.49Å; E572-L574 VanDerWaalsContact C-N 3.33Å; E572-L574 PolarHBondContact O-N 2.79Å; E572-R575 PolarHBondContact O-N 3.28Å; E572-F576 WeakPolarHBondContact O-CB 3.4Å; E572-F576 PolarHBondContact O-N 3.14Å; E572-E609 HydrophobicContact CB-CB 3.99Å; E572-I611 HydrophobicContact CB-CG2 4.43Å; E572-I611 HydrophobicContact CG-CG2 4.24Å
573	N	95.8	Very high	95.5	Very high	12 Å²	12	48 Å²	48	6%	0.064	22%	0.223	C	C	.	.	H	α-helix	trans	-59.8	-41.7	175.8	-61	-59.4	0	0	0	112.4	S570 A571 W577 I645 M649	S570-N573 PolarHBondContact O-ND2 3.03Å; A571-N573 PolarHBondContact O-N 2.92Å; N573-W577 WeakPolarHBondContact O-CB 3.5Å; N573-W577 PolarHBondContact O-N 3.03Å; N573-W577 VanDerWaalsContact O-N 3.16Å; N573-I645 HydrophobicContact CB-CG2 3.77Å; N573-I645 VanDerWaalsContact O-CG2 3.28Å; N573-I645 WeakPolarHBondContact O-CG2 3.3Å; N573-M649 HydrophobicContact CB-CG 3.99Å; N573-M649 HydrophobicContact CB-SD 4.06Å
574	L	96.8	Very high	95.5	Very high	0 Å²	0	46 Å²	46	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-73.6	-41.7	178.8	179.9	59.3	0	0	0	111.2	L552 L558 F561 Q562 L565 A571 E572 W577 Q578 M649	L552-L574 HydrophobicContact CD2-CD1 3.52Å; L558-L574 HydrophobicContact CD1-CD1 3.95Å; L558-L574 HydrophobicContact CD1-CD2 4.2Å; L558-L574 HydrophobicContact CD1-CG 4.47Å; F561-L574 HydrophobicContact CD1-CD2 3.84Å; F561-L574 HydrophobicContact CE1-CD2 4.29Å; Q562-L574 HydrophobicContact CB-CD2 3.73Å; Q562-L574 HydrophobicContact CG-CD2 4.18Å; L565-L574 HydrophobicContact CD1-CB 3.68Å; L565-L574 HydrophobicContact CD1-CD2 3.73Å; L565-L574 HydrophobicContact CD1-CG 4.33Å; A571-L574 PolarHBondContact O-N 3.19Å; E572-L574 VanDerWaalsContact C-N 3.33Å; E572-L574 PolarHBondContact O-N 2.79Å; L574-W577 HydrophobicContact CD1-CE3 4.19Å; L574-W577 PolarHBondContact O-N 3.1Å; L574-Q578 HydrophobicContact CD1-CG 4.27Å; L574-Q578 HydrophobicContact CG-CG 4.38Å; L574-Q578 WeakPolarHBondContact O-CB 3.29Å; L574-Q578 VanDerWaalsContact O-CG 3.3Å; L574-Q578 WeakPolarHBondContact O-CG 3.49Å; L574-Q578 PolarHBondContact O-N 3.47Å; L574-Q578 PolarHBondContact O-OE1 3.5Å; L574-M649 HydrophobicContact CB-SD 3.88Å; L574-M649 HydrophobicContact CD1-CE 4.37Å; L574-M649 HydrophobicContact CD1-SD 4.19Å
575	R	97.1	Very high	95.3	Very high	74 Å²	74	48.4 Å²	48.4	28%	0.279	25%	0.248	S	C	.	.	H	α-helix	trans	-62.8	-41.9	177.8	-65.4	173.8	-174.6	147.9	2.8	112	E566 A571 E572 Q578 A579 Y602 E609	E566-R575 IonicContact OE1-CZ 2.68Å; E566-R575 IonicContact OE1-NE 3.8Å; E566-R575 IonicContact OE1-NH2 3.75Å; E566-R575 PolarHBondContact OE1-NH2 3.12Å; A571-R575 WeakPolarHBondContact O-CG 3.29Å; A571-R575 PolarHBondContact O-N 3.39Å; E572-R575 PolarHBondContact O-N 3.28Å; R575-Q578 PolarHBondContact O-N 2.9Å; R575-A579 WeakPolarHBondContact O-CB 3.33Å; R575-A579 PolarHBondContact O-N 3.05Å; R575-Y602 HydrophobicContact CB-CE1 4.12Å; R575-Y602 VanDerWaalsContact CB-OH 3.31Å; R575-Y602 WeakPolarHBondContact CB-OH 3.27Å; R575-E609 WeakPolarHBondContact CD-OE1 3.23Å; R575-E609 IonicContact CZ-OE1 2.73Å; R575-E609 IonicContact NE-OE1 3.69Å; R575-E609 IonicContact NH1-OE1 2.65Å; R575-E609 PolarHBondContact NH1-OE1 3.3Å
576	F	97.5	Very high	95.2	Very high	0 Å²	0	49 Å²	49	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-50.5	170.8	172.4	-104.6	0	0	0	111.6	E572 Q578 A579 C580 I598 Y602 L603 I611 F638 A641 I645	E572-F576 WeakPolarHBondContact O-CB 3.4Å; E572-F576 PolarHBondContact O-N 3.14Å; F576-Q578 PolarHBondContact O-N 3.13Å; F576-A579 WeakPolarHBondContact O-CB 3.05Å; F576-A579 PolarHBondContact O-N 2.74Å; F576-A579 VanDerWaalsContact O-N 3.14Å; F576-C580 PolarHBondContact O-N 3.27Å; F576-C580 PolarHBondContact O-SG 2.79Å; F576-C580 VanDerWaalsContact O-SG 3.33Å; F576-I598 HydrophobicContact CD2-CG2 4.03Å; F576-I598 HydrophobicContact CE2-CG2 3.86Å; F576-Y602 HydrophobicContact CB-CD1 3.84Å; F576-Y602 HydrophobicContact CB-CD2 4.3Å; F576-Y602 HydrophobicContact CB-CE1 4.01Å; F576-Y602 HydrophobicContact CB-CE2 4.46Å; F576-Y602 HydrophobicContact CB-CG 4.01Å; F576-Y602 HydrophobicContact CD2-CD1 4.49Å; F576-Y602 AromaticContact CD2-CD2 3.81Å; F576-Y602 HydrophobicContact CD2-CD2 3.81Å; F576-Y602 AromaticContact CD2-CG 3.8Å; F576-Y602 HydrophobicContact CD2-CG 3.8Å; F576-Y602 HydrophobicContact CG-CG 4.36Å; F576-L603 HydrophobicContact CE2-CD1 4.15Å; F576-L603 HydrophobicContact CZ-CD1 4.45Å; F576-I611 HydrophobicContact CB-CD1 4.44Å; F576-I611 HydrophobicContact CB-CG2 4.04Å; F576-I611 HydrophobicContact CD1-CD1 3.57Å; F576-I611 HydrophobicContact CD2-CD1 3.81Å; F576-I611 HydrophobicContact CE1-CD1 3.61Å; F576-I611 HydrophobicContact CE2-CD1 3.86Å; F576-I611 HydrophobicContact CG-CD1 3.66Å; F576-I611 HydrophobicContact CG-CG2 4.42Å; F576-I611 HydrophobicContact CZ-CD1 3.76Å; F576-F638 HydrophobicContact CE2-CD1 4.32Å; F576-F638 HydrophobicContact CZ-CB 4.24Å; F576-F638 HydrophobicContact CZ-CD1 4.42Å; F576-F638 HydrophobicContact CZ-CG 4.5Å; F576-A641 HydrophobicContact CE1-CB 4.13Å; F576-A641 HydrophobicContact CZ-CB 3.81Å; F576-I645 HydrophobicContact CD1-CB 4.21Å; F576-I645 HydrophobicContact CD1-CG1 3.99Å; F576-I645 HydrophobicContact CD1-CG2 4.23Å; F576-I645 HydrophobicContact CE1-CB 4.42Å; F576-I645 HydrophobicContact CE1-CG1 4.08Å
577	W	96.7	Very high	95.1	Very high	37 Å²	37	48 Å²	48	14%	0.14	25%	0.253	C	S	.	.	H	α-helix	trans	-61.6	-41	179.7	-179.5	85.1	0	0	0	112.7	L552 N573 L574 C580 Q581 F646 M649	L552-W577 HydrophobicContact CB-CH2 4.09Å; L552-W577 HydrophobicContact CB-CZ3 4.13Å; L552-W577 HydrophobicContact CD1-CD2 4.46Å; L552-W577 HydrophobicContact CD1-CE3 4.19Å; L552-W577 HydrophobicContact CD1-CH2 3.99Å; L552-W577 HydrophobicContact CD1-CZ2 4.26Å; L552-W577 HydrophobicContact CD1-CZ3 3.95Å; L552-W577 HydrophobicContact CD2-CZ3 4.43Å; L552-W577 HydrophobicContact CG-CZ3 4.41Å; N573-W577 WeakPolarHBondContact O-CB 3.5Å; N573-W577 PolarHBondContact O-N 3.03Å; N573-W577 VanDerWaalsContact O-N 3.16Å; L574-W577 HydrophobicContact CD1-CE3 4.19Å; L574-W577 PolarHBondContact O-N 3.1Å; W577-C580 PolarHBondContact O-N 3.06Å; W577-Q581 HydrophobicContact CD2-CG 4.31Å; W577-Q581 VanDerWaalsContact CE2-NE2 3.31Å; W577-Q581 HydrophobicContact CE3-CG 4.21Å; W577-Q581 HydrophobicContact CH2-CG 3.78Å; W577-Q581 HydrophobicContact CZ2-CG 3.87Å; W577-Q581 HydrophobicContact CZ3-CG 3.96Å; W577-Q581 WeakPolarHBondContact O-CG 3.43Å; W577-Q581 PolarHBondContact O-N 3.49Å; W577-Q581 VanDerWaalsContact O-N 3.17Å; W577-Q581 PolarHBondContact O-NE2 3.33Å; W577-F646 AromaticContact CD1-CD2 3.99Å; W577-F646 AromaticContact CE2-CD2 3.99Å; W577-F646 HydrophobicContact CZ2-CD2 4.49Å; W577-F646 HydrophobicContact CZ2-CE2 4.47Å; W577-F646 AromaticContact NE1-CD2 3.52Å; W577-M649 HydrophobicContact CB-CE 3.74Å; W577-M649 HydrophobicContact CD2-CE 4.5Å; W577-M649 HydrophobicContact CG-CE 3.91Å
578	Q	96.9	Very high	95	Very high	45 Å²	45	47.1 Å²	47.1	21%	0.21	25%	0.254	C	S	.	.	H	α-helix	trans	-60.8	-45.2	172.7	-73.8	166.5	-48.5	0	0	111.1	L558 L574 R575 F576 C580 Q581 V582	L558-Q578 HydrophobicContact CD1-CG 4.49Å; L574-Q578 HydrophobicContact CD1-CG 4.27Å; L574-Q578 HydrophobicContact CG-CG 4.38Å; L574-Q578 WeakPolarHBondContact O-CB 3.29Å; L574-Q578 VanDerWaalsContact O-CG 3.3Å; L574-Q578 WeakPolarHBondContact O-CG 3.49Å; L574-Q578 PolarHBondContact O-N 3.47Å; L574-Q578 PolarHBondContact O-OE1 3.5Å; R575-Q578 PolarHBondContact O-N 2.9Å; F576-Q578 PolarHBondContact O-N 3.13Å; Q578-C580 VanDerWaalsContact C-N 3.32Å; Q578-C580 PolarHBondContact O-N 3.45Å; Q578-Q581 WeakPolarHBondContact O-CB 3.5Å; Q578-Q581 PolarHBondContact O-N 2.54Å; Q578-V582 WeakPolarHBondContact O-CG2 3.4Å; Q578-V582 PolarHBondContact O-N 2.94Å
579	A	96.8	Very high	95	Very high	20 Å²	20	53.8 Å²	53.8	17%	0.165	28%	0.276	C	S	.	.	H	α-helix	trans	-63.2	-36	178.1	0	0	0	0	0	112.4	R575 F576 V582 L583 I598 Y602	R575-A579 WeakPolarHBondContact O-CB 3.33Å; R575-A579 PolarHBondContact O-N 3.05Å; F576-A579 WeakPolarHBondContact O-CB 3.05Å; F576-A579 PolarHBondContact O-N 2.74Å; F576-A579 VanDerWaalsContact O-N 3.14Å; A579-V582 PolarHBondContact O-N 3.24Å; A579-L583 WeakPolarHBondContact O-CB 3.2Å; A579-L583 PolarHBondContact O-N 3.37Å; A579-I598 HydrophobicContact CB-CD1 3.92Å; A579-I598 HydrophobicContact CB-CG1 3.92Å; A579-Y602 HydrophobicContact CB-CE2 4.37Å
580	C	96.8	Very high	95.2	Very high	1 Å²	1	48.8 Å²	48.8	1%	0.007	26%	0.256	C	S	.	.	H	α-helix	trans	-63	-37.5	170.8	-64.7	0	0	0	0	112.6	F576 W577 Q578 L583 K584 E642	F576-C580 PolarHBondContact O-N 3.27Å; F576-C580 PolarHBondContact O-SG 2.79Å; F576-C580 VanDerWaalsContact O-SG 3.33Å; W577-C580 PolarHBondContact O-N 3.06Å; Q578-C580 VanDerWaalsContact C-N 3.32Å; Q578-C580 PolarHBondContact O-N 3.45Å; C580-L583 PolarHBondContact O-N 2.87Å; C580-K584 WeakPolarHBondContact O-CG 3.32Å; C580-K584 PolarHBondContact O-N 3Å; C580-E642 HydrophobicContact CB-CB 4.41Å; C580-E642 HydrophobicContact CB-CG 3.98Å
581	Q	95.7	Very high	95.3	Very high	68 Å²	68	47.8 Å²	47.8	32%	0.318	25%	0.249	S	C	.	.	H	α-helix	trans	-66	-42.8	174	-53.4	-35.2	-61.7	0	0	111.6	W577 Q578 K584 G585 E642	W577-Q581 HydrophobicContact CD2-CG 4.31Å; W577-Q581 VanDerWaalsContact CE2-NE2 3.31Å; W577-Q581 HydrophobicContact CE3-CG 4.21Å; W577-Q581 HydrophobicContact CH2-CG 3.78Å; W577-Q581 HydrophobicContact CZ2-CG 3.87Å; W577-Q581 HydrophobicContact CZ3-CG 3.96Å; W577-Q581 WeakPolarHBondContact O-CG 3.43Å; W577-Q581 PolarHBondContact O-N 3.49Å; W577-Q581 VanDerWaalsContact O-N 3.17Å; W577-Q581 PolarHBondContact O-NE2 3.33Å; Q578-Q581 WeakPolarHBondContact O-CB 3.5Å; Q578-Q581 PolarHBondContact O-N 2.54Å; Q581-K584 PolarHBondContact O-N 3.26Å; Q581-G585 PolarHBondContact O-N 3.14Å; Q581-E642 PolarHBondContact NE2-OE1 3.38Å
582	V	96.1	Very high	95.1	Very high	99 Å²	99	54.7 Å²	54.7	60%	0.6	27%	0.274	S	S	*	.	H	α-helix	trans	-62.2	-43.3	177.1	174.7	0	0	0	0	111.2	Q578 A579 K584 G585 A586	Q578-V582 WeakPolarHBondContact O-CG2 3.4Å; Q578-V582 PolarHBondContact O-N 2.94Å; A579-V582 PolarHBondContact O-N 3.24Å; V582-K584 VanDerWaalsContact C-N 3.33Å; V582-K584 PolarHBondContact O-N 3.32Å; V582-G585 PolarHBondContact O-N 2.71Å; V582-G585 VanDerWaalsContact O-N 3.15Å; V582-A586 PolarHBondContact O-N 3.41Å
583	L	96.2	Very high	94.9	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-57.2	-43.8	175.3	175.3	68.1	0	0	0	112.4	A579 C580 G585 A586 V591 I595 I598 R635 F638	A579-L583 WeakPolarHBondContact O-CB 3.2Å; A579-L583 PolarHBondContact O-N 3.37Å; C580-L583 PolarHBondContact O-N 2.87Å; L583-G585 VanDerWaalsContact C-N 3.29Å; L583-G585 PolarHBondContact O-N 3.09Å; L583-A586 PolarHBondContact O-N 3.31Å; L583-V591 HydrophobicContact CD1-CG1 3.88Å; L583-I595 HydrophobicContact CD1-CG1 3.83Å; L583-I595 HydrophobicContact CD2-CG1 4.01Å; L583-I598 HydrophobicContact CB-CD1 4.01Å; L583-I598 HydrophobicContact CD2-CD1 4.32Å; L583-R635 PolarHBondContact O-NH1 3.11Å; L583-F638 HydrophobicContact CD2-CD2 3.54Å; L583-F638 HydrophobicContact CD2-CE2 3.76Å
584	K	95.2	Very high	94.9	Very high	60 Å²	60	59 Å²	59	26%	0.261	30%	0.297	S	S	.	.	H	α-helix	trans	-61.3	-38.8	177.7	-71.6	171.9	-174.1	179.6	0	111.5	C580 Q581 V582 R635 E642	C580-K584 WeakPolarHBondContact O-CG 3.32Å; C580-K584 PolarHBondContact O-N 3Å; Q581-K584 PolarHBondContact O-N 3.26Å; V582-K584 VanDerWaalsContact C-N 3.33Å; V582-K584 PolarHBondContact O-N 3.32Å; K584-R635 PolarHBondContact O-NH1 2.99Å; K584-E642 WeakPolarHBondContact CE-OE2 3.22Å; K584-E642 IonicContact NZ-OE1 3.33Å; K584-E642 PolarHBondContact NZ-OE1 3.11Å; K584-E642 IonicContact NZ-OE2 2.9Å; K584-E642 PolarHBondContact NZ-OE2 3.13Å
585	G	93.2	Very high	94.8	Very high	69 Å²	69	59.4 Å²	59.4	71%	0.711	30%	0.299	S	S	*	.	H	α-helix	trans	-81.9	-19.9	178.8	0	0	0	0	0	116.5	Q581 V582 L583	Q581-G585 PolarHBondContact O-N 3.14Å; V582-G585 PolarHBondContact O-N 2.71Å; V582-G585 VanDerWaalsContact O-N 3.15Å; L583-G585 VanDerWaalsContact C-N 3.29Å; L583-G585 PolarHBondContact O-N 3.09Å
586	A	93.2	Very high	94.6	Very high	14 Å²	14	58.3 Å²	58.3	12%	0.116	30%	0.297	C	S	.	.	S	Bend	trans	-59.7	152.5	-174.6	0	0	0	0	0	113.9	V582 L583 R635	V582-A586 PolarHBondContact O-N 3.41Å; L583-A586 PolarHBondContact O-N 3.31Å; A586-R635 PolarHBondContact O-NH1 3.36Å; A586-R635 PolarHBondContact O-NH2 3.19Å
587	P	94.1	Very high	94.4	Very high	56 Å²	56	62.1 Å²	62.1	36%	0.364	32%	0.318	S	S	.	.			trans	-69.4	149	172.3	31.5	-36.3	0	0	0	111.1	R589 E590	P587-R589 HydrophobicContact CB-CG 4.39Å; P587-R589 HydrophobicContact CG-CG 4.28Å; P587-R589 PolarHBondContact O-N 3.38Å; P587-E590 VanDerWaalsContact CD-OE2 3.3Å; P587-E590 WeakPolarHBondContact CD-OE2 3.5Å; P587-E590 HydrophobicContact CG-CB 4.27Å; P587-E590 HydrophobicContact CG-CG 4.28Å; P587-E590 VanDerWaalsContact CG-OE1 3.25Å; P587-E590 WeakPolarHBondContact CG-OE1 3.32Å; P587-E590 VanDerWaalsContact CG-OE2 3.26Å; P587-E590 WeakPolarHBondContact CG-OE2 3.29Å; P587-E590 PolarHBondContact O-N 3.01Å
588	L	92	Very high	94.4	Very high	114 Å²	114	60.6 Å²	60.6	60%	0.597	31%	0.313	S	S	*	.	H	α-helix	trans	-52.7	-35.4	-168.7	-176.2	61.4	0	0	0	114.3	E590 V591 P633	L588-E590 VanDerWaalsContact C-N 3.28Å; L588-E590 PolarHBondContact O-N 3.34Å; L588-V591 HydrophobicContact CD1-CG2 4.48Å; L588-V591 PolarHBondContact O-N 3.46Å; L588-P633 HydrophobicContact CD1-CG 4.12Å
589	R	92.3	Very high	94.3	Very high	206 Å²	206	60.1 Å²	60.1	78%	0.777	31%	0.309	S	S	*	.	H	α-helix	trans	-60.9	-29	177.5	67.9	-175.3	-171.5	-152.1	-5.3	114.5	P587	P587-R589 HydrophobicContact CB-CG 4.39Å; P587-R589 HydrophobicContact CG-CG 4.28Å; P587-R589 PolarHBondContact O-N 3.38Å
590	E	93.2	Very high	94.2	Very high	81 Å²	81	64.9 Å²	64.9	38%	0.379	33%	0.328	S	S	.	.	H	α-helix	trans	-94.7	-17.9	-176.6	-80.1	147	-129.2	0	0	112.5	P587 L588 R592 Q593 S594	P587-E590 VanDerWaalsContact CD-OE2 3.3Å; P587-E590 WeakPolarHBondContact CD-OE2 3.5Å; P587-E590 HydrophobicContact CG-CB 4.27Å; P587-E590 HydrophobicContact CG-CG 4.28Å; P587-E590 VanDerWaalsContact CG-OE1 3.25Å; P587-E590 WeakPolarHBondContact CG-OE1 3.32Å; P587-E590 VanDerWaalsContact CG-OE2 3.26Å; P587-E590 WeakPolarHBondContact CG-OE2 3.29Å; P587-E590 PolarHBondContact O-N 3.01Å; L588-E590 VanDerWaalsContact C-N 3.28Å; L588-E590 PolarHBondContact O-N 3.34Å; E590-R592 PolarHBondContact O-N 2.97Å; E590-Q593 PolarHBondContact O-N 3.25Å; E590-S594 WeakPolarHBondContact O-CB 3.43Å; E590-S594 PolarHBondContact O-N 3.3Å
591	V	93.3	Very high	94.1	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-54.7	-48.3	-174.2	-179.1	0	0	0	0	111.6	L583 L588 Q593 S594 I595 P633 R635	L583-V591 HydrophobicContact CD1-CG1 3.88Å; L588-V591 HydrophobicContact CD1-CG2 4.48Å; L588-V591 PolarHBondContact O-N 3.46Å; V591-Q593 PolarHBondContact O-N 3.14Å; V591-S594 PolarHBondContact O-N 3.46Å; V591-I595 HydrophobicContact CG1-CD1 4.09Å; V591-I595 HydrophobicContact CG1-CG1 4.44Å; V591-I595 VanDerWaalsContact O-CG1 3.31Å; V591-I595 WeakPolarHBondContact O-CG1 3.37Å; V591-I595 PolarHBondContact O-N 2.69Å; V591-P633 HydrophobicContact CB-CB 4.28Å; V591-P633 HydrophobicContact CB-CG 4.22Å; V591-P633 HydrophobicContact CG1-CB 3.94Å; V591-P633 HydrophobicContact CG1-CG 4.29Å; V591-R635 HydrophobicContact CG1-CG 3.87Å; V591-R635 HydrophobicContact CG2-CG 4.17Å
592	R	91.7	Very high	94.2	Very high	148 Å²	148	65.4 Å²	65.4	56%	0.558	33%	0.33	S	S	*	.	H	α-helix	trans	-60.7	-45.3	-178.7	-169.6	175.3	179.5	98.1	2.5	112.2	E590 I595 M596 P633	E590-R592 PolarHBondContact O-N 2.97Å; R592-I595 PolarHBondContact O-N 2.99Å; R592-M596 WeakPolarHBondContact O-CG 3.45Å; R592-M596 PolarHBondContact O-N 3.43Å; R592-P633 HydrophobicContact CB-CB 4.08Å
593	Q	92.7	Very high	94.1	Very high	118 Å²	118	62 Å²	62	55%	0.551	31%	0.308	S	S	*	.	H	α-helix	trans	-65.9	-41.6	178	-171.7	63.5	54.1	0	0	111.3	E590 V591 I595 M596 N597	E590-Q593 PolarHBondContact O-N 3.25Å; V591-Q593 PolarHBondContact O-N 3.14Å; Q593-I595 VanDerWaalsContact C-N 3.32Å; Q593-I595 PolarHBondContact O-N 3.38Å; Q593-M596 PolarHBondContact O-N 2.9Å; Q593-N597 PolarHBondContact NE2-OD1 3.43Å; Q593-N597 VanDerWaalsContact O-CG 3.22Å; Q593-N597 PolarHBondContact O-N 3.19Å; Q593-N597 PolarHBondContact O-OD1 3.2Å; Q593-N597 VanDerWaalsContact O-OD1 3.13Å
594	S	94.4	Very high	93.9	Very high	27 Å²	27	63 Å²	63	19%	0.189	32%	0.317	C	S	.	.	H	α-helix	trans	-62.8	-36.4	177.4	-170.9	0	0	0	0	112.4	E590 V591 I598	E590-S594 WeakPolarHBondContact O-CB 3.43Å; E590-S594 PolarHBondContact O-N 3.3Å; V591-S594 PolarHBondContact O-N 3.46Å; S594-I598 WeakPolarHBondContact O-CB 3.11Å; S594-I598 WeakPolarHBondContact O-CD1 3.49Å; S594-I598 WeakPolarHBondContact O-CG1 3.35Å; S594-I598 PolarHBondContact O-N 2.87Å
595	I	94.6	Very high	93.6	Very high	10 Å²	10	66.1 Å²	66.1	5%	0.051	34%	0.343	C	S	.	.	H	α-helix	trans	-63.7	-47.8	173.2	-63	170.1	0	0	0	110.7	L583 V591 R592 Q593 N597 I598 Y599 I625 P633 N634 F638	L583-I595 HydrophobicContact CD1-CG1 3.83Å; L583-I595 HydrophobicContact CD2-CG1 4.01Å; V591-I595 HydrophobicContact CG1-CD1 4.09Å; V591-I595 HydrophobicContact CG1-CG1 4.44Å; V591-I595 VanDerWaalsContact O-CG1 3.31Å; V591-I595 WeakPolarHBondContact O-CG1 3.37Å; V591-I595 PolarHBondContact O-N 2.69Å; R592-I595 PolarHBondContact O-N 2.99Å; Q593-I595 VanDerWaalsContact C-N 3.32Å; Q593-I595 PolarHBondContact O-N 3.38Å; I595-N597 VanDerWaalsContact C-N 3.32Å; I595-N597 PolarHBondContact O-N 3.05Å; I595-I598 PolarHBondContact O-N 3.37Å; I595-Y599 WeakPolarHBondContact O-CB 3.45Å; I595-Y599 PolarHBondContact O-N 3.08Å; I595-I625 HydrophobicContact CG2-CD1 3.72Å; I595-I625 HydrophobicContact CG2-CG1 3.75Å; I595-P633 HydrophobicContact CD1-CB 4.41Å; I595-N634 WeakPolarHBondContact CD1-O 3.25Å; I595-F638 HydrophobicContact CB-CE2 4.36Å; I595-F638 HydrophobicContact CG1-CE2 4.38Å; I595-F638 HydrophobicContact CG2-CE2 4.03Å; I595-F638 HydrophobicContact CG2-CZ 3.84Å
596	M	93.2	Very high	93.5	Very high	50 Å²	50	70.3 Å²	70.3	25%	0.246	35%	0.349	C	S	.	.	H	α-helix	trans	-59.5	-44.7	179.2	-60.5	-55.9	88.8	0	0	111.3	R592 Q593 Y599 Q600 I625	R592-M596 WeakPolarHBondContact O-CG 3.45Å; R592-M596 PolarHBondContact O-N 3.43Å; Q593-M596 PolarHBondContact O-N 2.9Å; M596-Y599 PolarHBondContact O-N 2.82Å; M596-Q600 WeakPolarHBondContact O-CB 3.42Å; M596-Q600 VanDerWaalsContact O-CG 3.25Å; M596-Q600 WeakPolarHBondContact O-CG 3.46Å; M596-Q600 PolarHBondContact O-N 3.21Å; M596-I625 HydrophobicContact CE-CG2 3.78Å
597	N	94.9	Very high	93.5	Very high	80 Å²	80	70.5 Å²	70.5	43%	0.428	35%	0.351	S	S	.	.	H	α-helix	trans	-62	-48.2	179.6	-67.6	7	0	0	0	111.8	Q593 I595 Y599 Q600 Q601	Q593-N597 PolarHBondContact NE2-OD1 3.43Å; Q593-N597 VanDerWaalsContact O-CG 3.22Å; Q593-N597 PolarHBondContact O-N 3.19Å; Q593-N597 PolarHBondContact O-OD1 3.2Å; Q593-N597 VanDerWaalsContact O-OD1 3.13Å; I595-N597 VanDerWaalsContact C-N 3.32Å; I595-N597 PolarHBondContact O-N 3.05Å; N597-Y599 PolarHBondContact O-N 3.42Å; N597-Q600 PolarHBondContact O-N 3.03Å; N597-Q601 WeakPolarHBondContact O-CB 3.47Å; N597-Q601 PolarHBondContact O-N 3.34Å
598	I	95.9	Very high	93.4	Very high	6 Å²	6	73.7 Å²	73.7	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-63.4	-43.3	179.3	-68	167.2	0	0	0	110.6	F576 A579 L583 S594 I595 Q601 Y602 F638	F576-I598 HydrophobicContact CD2-CG2 4.03Å; F576-I598 HydrophobicContact CE2-CG2 3.86Å; A579-I598 HydrophobicContact CB-CD1 3.92Å; A579-I598 HydrophobicContact CB-CG1 3.92Å; L583-I598 HydrophobicContact CB-CD1 4.01Å; L583-I598 HydrophobicContact CD2-CD1 4.32Å; S594-I598 WeakPolarHBondContact O-CB 3.11Å; S594-I598 WeakPolarHBondContact O-CD1 3.49Å; S594-I598 WeakPolarHBondContact O-CG1 3.35Å; S594-I598 PolarHBondContact O-N 2.87Å; I595-I598 PolarHBondContact O-N 3.37Å; I598-Q601 PolarHBondContact O-N 3.16Å; I598-Y602 HydrophobicContact CG2-CD2 4.06Å; I598-Y602 WeakPolarHBondContact O-CD2 3.39Å; I598-Y602 PolarHBondContact O-N 3.18Å; I598-Y602 VanDerWaalsContact O-N 3.07Å; I598-F638 HydrophobicContact CB-CE2 3.75Å; I598-F638 HydrophobicContact CB-CZ 3.81Å; I598-F638 HydrophobicContact CD1-CE2 4.12Å; I598-F638 HydrophobicContact CG2-CD1 4.46Å; I598-F638 HydrophobicContact CG2-CD2 4.02Å; I598-F638 HydrophobicContact CG2-CE1 4.05Å; I598-F638 HydrophobicContact CG2-CE2 3.54Å; I598-F638 HydrophobicContact CG2-CG 4.47Å; I598-F638 HydrophobicContact CG2-CZ 3.56Å
599	Y	94.4	Very high	93.5	Very high	35 Å²	35	70.2 Å²	70.2	14%	0.137	35%	0.349	C	S	.	.	H	α-helix	trans	-62.3	-46.4	177.1	-179.4	-109.4	0	0	0	111.8	I595 M596 N597 Q601 L603 A604 R622 I625	I595-Y599 WeakPolarHBondContact O-CB 3.45Å; I595-Y599 PolarHBondContact O-N 3.08Å; M596-Y599 PolarHBondContact O-N 2.82Å; N597-Y599 PolarHBondContact O-N 3.42Å; Y599-Q601 VanDerWaalsContact C-N 3.35Å; Y599-Q601 PolarHBondContact O-N 3.27Å; Y599-L603 HydrophobicContact CD2-CB 3.69Å; Y599-L603 HydrophobicContact CE2-CB 4.01Å; Y599-L603 CarbonylContact O-C 3.58Å; Y599-L603 PolarHBondContact O-N 2.85Å; Y599-A604 HydrophobicContact CE1-CB 4.33Å; Y599-A604 PolarHBondContact O-N 3.04Å; Y599-R622 HydrophobicContact CE2-CB 4.35Å; Y599-R622 WeakPolarHBondContact OH-CD 3.46Å; Y599-R622 WeakPolarHBondContact OH-CG 3.47Å; Y599-I625 HydrophobicContact CD1-CD1 4.48Å; Y599-I625 HydrophobicContact CD2-CD1 3.65Å; Y599-I625 HydrophobicContact CE2-CD1 4.38Å; Y599-I625 HydrophobicContact CG-CD1 3.71Å
600	Q	94.6	Very high	93.6	Very high	120 Å²	120	64.7 Å²	64.7	56%	0.561	34%	0.341	S	S	*	.	H	α-helix	trans	-65	-34.4	177.6	-72	174	10.9	0	0	113.3	M596 N597	M596-Q600 WeakPolarHBondContact O-CB 3.42Å; M596-Q600 VanDerWaalsContact O-CG 3.25Å; M596-Q600 WeakPolarHBondContact O-CG 3.46Å; M596-Q600 PolarHBondContact O-N 3.21Å; N597-Q600 PolarHBondContact O-N 3.03Å
601	Q	96.1	Very high	93.7	Very high	69 Å²	69	61.6 Å²	61.6	32%	0.322	33%	0.326	S	S	.	.	H	α-helix	trans	-75.7	-41.1	-178.9	-174.8	172.5	4.8	0	0	113	N597 I598 Y599 A607 V608 E609	N597-Q601 WeakPolarHBondContact O-CB 3.47Å; N597-Q601 PolarHBondContact O-N 3.34Å; I598-Q601 PolarHBondContact O-N 3.16Å; Y599-Q601 VanDerWaalsContact C-N 3.35Å; Y599-Q601 PolarHBondContact O-N 3.27Å; Q601-A607 WeakPolarHBondContact O-CB 3.41Å; Q601-V608 PolarHBondContact O-N 3.13Å; Q601-V608 VanDerWaalsContact O-N 3.1Å; Q601-E609 PolarHBondContact NE2-OE2 3.44Å; Q601-E609 PolarHBondContact O-N 2.8Å
602	Y	96.5	Very high	93.6	Very high	11 Å²	11	67.3 Å²	67.3	4%	0.043	36%	0.357	C	S	.	.	H	α-helix	trans	-119.1	-21.3	-166.8	-56.5	-80.3	0	0	0	116.2	R575 F576 A579 I598 E609 P610 I611	R575-Y602 HydrophobicContact CB-CE1 4.12Å; R575-Y602 VanDerWaalsContact CB-OH 3.31Å; R575-Y602 WeakPolarHBondContact CB-OH 3.27Å; F576-Y602 HydrophobicContact CB-CD1 3.84Å; F576-Y602 HydrophobicContact CB-CD2 4.3Å; F576-Y602 HydrophobicContact CB-CE1 4.01Å; F576-Y602 HydrophobicContact CB-CE2 4.46Å; F576-Y602 HydrophobicContact CB-CG 4.01Å; F576-Y602 HydrophobicContact CD2-CD1 4.49Å; F576-Y602 AromaticContact CD2-CD2 3.81Å; F576-Y602 HydrophobicContact CD2-CD2 3.81Å; F576-Y602 AromaticContact CD2-CG 3.8Å; F576-Y602 HydrophobicContact CD2-CG 3.8Å; F576-Y602 HydrophobicContact CG-CG 4.36Å; A579-Y602 HydrophobicContact CB-CE2 4.37Å; I598-Y602 HydrophobicContact CG2-CD2 4.06Å; I598-Y602 WeakPolarHBondContact O-CD2 3.39Å; I598-Y602 PolarHBondContact O-N 3.18Å; I598-Y602 VanDerWaalsContact O-N 3.07Å; Y602-E609 WeakPolarHBondContact CA-O 3.24Å; Y602-E609 HydrophobicContact CD1-CB 3.97Å; Y602-E609 VanDerWaalsContact CD1-O 3.31Å; Y602-E609 WeakPolarHBondContact CD1-O 3.36Å; Y602-E609 HydrophobicContact CE1-CB 4.02Å; Y602-P610 WeakPolarHBondContact O-CA 3.38Å; Y602-I611 HydrophobicContact CD1-CG2 4.02Å; Y602-I611 PolarHBondContact O-N 2.84Å
603	L	94.7	Very high	93.6	Very high	28 Å²	28	61.5 Å²	61.5	15%	0.147	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.3	-15.7	-166.1	-73.2	177.3	0	0	0	116.1	F576 Y599 I611 I613 V621 F638	F576-L603 HydrophobicContact CE2-CD1 4.15Å; F576-L603 HydrophobicContact CZ-CD1 4.45Å; Y599-L603 HydrophobicContact CD2-CB 3.69Å; Y599-L603 HydrophobicContact CE2-CB 4.01Å; Y599-L603 CarbonylContact O-C 3.58Å; Y599-L603 PolarHBondContact O-N 2.85Å; L603-I611 HydrophobicContact CD2-CD1 3.78Å; L603-I611 HydrophobicContact CD2-CG1 3.68Å; L603-I611 HydrophobicContact CG-CD1 4.26Å; L603-I611 HydrophobicContact CG-CG1 4.34Å; L603-I613 HydrophobicContact CD2-CD1 3.51Å; L603-I613 HydrophobicContact CD2-CG1 4.05Å; L603-V621 HydrophobicContact CD1-CG1 3.9Å; L603-F638 HydrophobicContact CD1-CD1 3.94Å; L603-F638 HydrophobicContact CD1-CE1 3.9Å
604	A	92.2	Very high	93.7	Very high	22 Å²	22	58.2 Å²	58.2	18%	0.182	32%	0.323	C	S	.	.	S	Bend	trans	-65.7	155.2	173.6	0	0	0	0	0	111.4	Y599 N606 A607	Y599-A604 HydrophobicContact CE1-CB 4.33Å; Y599-A604 PolarHBondContact O-N 3.04Å; A604-N606 PolarHBondContact O-N 2.83Å; A604-A607 WeakPolarHBondContact O-CB 3.23Å; A604-A607 PolarHBondContact O-N 2.9Å
605	P	89.2	Confident	93.6	Very high	125 Å²	125	61.4 Å²	61.4	81%	0.812	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-24.4	178.5	-27.3	35.8	0	0	0	114.9
606	N	91.1	Very high	93.6	Very high	156 Å²	156	69.4 Å²	69.4	83%	0.834	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	33.2	176.6	-58.6	-16.2	0	0	0	111.4	A604	A604-N606 PolarHBondContact O-N 2.83Å
607	A	93	Very high	93.6	Very high	19 Å²	19	68.4 Å²	68.4	16%	0.157	37%	0.37	C	S	.	.			trans	-57.2	145.2	178.7	0	0	0	0	0	112.3	Q601 A604 P610	Q601-A607 WeakPolarHBondContact O-CB 3.41Å; A604-A607 WeakPolarHBondContact O-CB 3.23Å; A604-A607 PolarHBondContact O-N 2.9Å; A607-P610 HydrophobicContact CB-CB 4.13Å
608	V	92.2	Very high	93.5	Very high	123 Å²	123	66.2 Å²	66.2	75%	0.745	36%	0.363	S	S	*	.	S	Bend	trans	-79	-34.5	-179.4	-176.1	0	0	0	0	111.2	Q601	Q601-V608 PolarHBondContact O-N 3.13Å; Q601-V608 VanDerWaalsContact O-N 3.1Å
609	E	93.7	Very high	93.4	Very high	40 Å²	40	68.5 Å²	68.5	19%	0.187	38%	0.375	C	S	.	.	S	Bend	trans	-129.1	67.8	178	-69.5	178.9	91.6	0	0	109.5	E572 R575 Q601 Y602 I611	E572-E609 HydrophobicContact CB-CB 3.99Å; R575-E609 WeakPolarHBondContact CD-OE1 3.23Å; R575-E609 IonicContact CZ-OE1 2.73Å; R575-E609 IonicContact NE-OE1 3.69Å; R575-E609 IonicContact NH1-OE1 2.65Å; R575-E609 PolarHBondContact NH1-OE1 3.3Å; Q601-E609 PolarHBondContact NE2-OE2 3.44Å; Q601-E609 PolarHBondContact O-N 2.8Å; Y602-E609 WeakPolarHBondContact CA-O 3.24Å; Y602-E609 HydrophobicContact CD1-CB 3.97Å; Y602-E609 VanDerWaalsContact CD1-O 3.31Å; Y602-E609 WeakPolarHBondContact CD1-O 3.36Å; Y602-E609 HydrophobicContact CE1-CB 4.02Å; E609-I611 PolarHBondContact O-N 2.91Å
610	P	94	Very high	93.2	Very high	91 Å²	91	70.4 Å²	70.4	59%	0.591	39%	0.387	S	S	*	.			trans	-64.5	124	-172.5	25.9	-34.1	0	0	0	112.3	Y602 A607	Y602-P610 WeakPolarHBondContact O-CA 3.38Å; A607-P610 HydrophobicContact CB-CB 4.13Å
611	I	95	Very high	93.1	Very high	16 Å²	16	64.8 Å²	64.8	8%	0.082	36%	0.361	C	S	.	.			trans	-90.1	149.9	179.5	58.4	165.8	0	0	0	113	E572 F576 Y602 L603 E609 I613 I645	E572-I611 HydrophobicContact CB-CG2 4.43Å; E572-I611 HydrophobicContact CG-CG2 4.24Å; F576-I611 HydrophobicContact CB-CD1 4.44Å; F576-I611 HydrophobicContact CB-CG2 4.04Å; F576-I611 HydrophobicContact CD1-CD1 3.57Å; F576-I611 HydrophobicContact CD2-CD1 3.81Å; F576-I611 HydrophobicContact CE1-CD1 3.61Å; F576-I611 HydrophobicContact CE2-CD1 3.86Å; F576-I611 HydrophobicContact CG-CD1 3.66Å; F576-I611 HydrophobicContact CG-CG2 4.42Å; F576-I611 HydrophobicContact CZ-CD1 3.76Å; Y602-I611 HydrophobicContact CD1-CG2 4.02Å; Y602-I611 PolarHBondContact O-N 2.84Å; L603-I611 HydrophobicContact CD2-CD1 3.78Å; L603-I611 HydrophobicContact CD2-CG1 3.68Å; L603-I611 HydrophobicContact CG-CD1 4.26Å; L603-I611 HydrophobicContact CG-CG1 4.34Å; E609-I611 PolarHBondContact O-N 2.91Å; I611-I613 HydrophobicContact CD1-CG2 4.01Å; I611-I613 HydrophobicContact CG1-CG2 4.4Å; I611-I613 PolarHBondContact O-N 2.87Å; I611-I645 HydrophobicContact CB-CD1 4.19Å; I611-I645 HydrophobicContact CD1-CD1 4.2Å; I611-I645 HydrophobicContact CD1-CG1 3.85Å
612	N	91.1	Very high	92.9	Very high	120 Å²	120	65.6 Å²	65.6	64%	0.642	36%	0.361	S	S	*	.			trans	-85.4	99.3	179.9	-176.6	18.1	0	0	0	111.6	I645	N612-I645 WeakPolarHBondContact O-CD1 3.41Å
613	I	92.9	Very high	92.5	Very high	25 Å²	25	72 Å²	72	13%	0.128	39%	0.386	C	S	.	.			trans	-130.3	157.8	174.1	62.6	164	0	0	0	113.1	L603 I611 S615 I617 A618 A641 I645	L603-I613 HydrophobicContact CD2-CD1 3.51Å; L603-I613 HydrophobicContact CD2-CG1 4.05Å; I611-I613 HydrophobicContact CD1-CG2 4.01Å; I611-I613 HydrophobicContact CG1-CG2 4.4Å; I611-I613 PolarHBondContact O-N 2.87Å; I613-S615 PolarHBondContact O-N 3.08Å; I613-I617 HydrophobicContact CD1-CB 4.35Å; I613-I617 HydrophobicContact CD1-CG2 4.15Å; I613-A618 HydrophobicContact CD1-CB 3.84Å; I613-A618 HydrophobicContact CG1-CB 4.22Å; I613-A641 HydrophobicContact CD1-CB 4.1Å; I613-I645 HydrophobicContact CG2-CD1 3.55Å; I613-I645 HydrophobicContact CG2-CG1 3.73Å
614	D	93.6	Very high	92.1	Very high	50 Å²	50	74 Å²	74	27%	0.267	39%	0.394	S	S	.	.			trans	-57.3	131.9	171.9	-176.5	-52.4	0	0	0	110.5	R616 I617 A618 H644	D614-R616 PolarHBondContact O-N 3.18Å; D614-R616 VanDerWaalsContact O-N 3.14Å; D614-R616 WeakPolarHBondContact OD1-CB 3.19Å; D614-R616 VanDerWaalsContact OD1-CG 3.25Å; D614-R616 WeakPolarHBondContact OD1-CG 3.42Å; D614-R616 IonicContact OD1-CZ 2.76Å; D614-R616 PolarHBondContact OD1-N 3.43Å; D614-R616 IonicContact OD1-NE 3.08Å; D614-R616 PolarHBondContact OD1-NE 2.96Å; D614-R616 IonicContact OD1-NH2 3.59Å; D614-R616 IonicContact OD2-CZ 2.74Å; D614-R616 VanDerWaalsContact OD2-CZ 3.3Å; D614-R616 IonicContact OD2-NE 2.71Å; D614-R616 PolarHBondContact OD2-NE 3.4Å; D614-R616 VanDerWaalsContact OD2-NE 3.1Å; D614-R616 IonicContact OD2-NH2 3.63Å; D614-R616 PolarHBondContact OD2-NH2 2.86Å; D614-I617 HydrophobicContact CB-CD1 4.13Å; D614-I617 HydrophobicContact CB-CG1 4.19Å; D614-I617 WeakPolarHBondContact O-CA 3.41Å; D614-I617 WeakPolarHBondContact O-CB 3.12Å; D614-I617 PolarHBondContact O-N 2.97Å; D614-A618 PolarHBondContact O-N 3.16Å; D614-A618 VanDerWaalsContact O-N 3.1Å; D614-H644 PolarHBondContact N-CE1 2.65Å; D614-H644 PolarHBondContact N-ND1 3.4Å
615	S	92.3	Very high	91.9	Very high	93 Å²	93	74.4 Å²	74.4	65%	0.65	39%	0.393	S	S	*	.	H	α-helix	trans	-58.5	-29.5	-176	56.6	0	0	0	0	113.3	I613 I617 A618 D619	I613-S615 PolarHBondContact O-N 3.08Å; S615-I617 VanDerWaalsContact C-N 3.28Å; S615-I617 PolarHBondContact O-N 2.9Å; S615-A618 PolarHBondContact O-N 3.22Å; S615-D619 WeakPolarHBondContact O-CB 3.44Å; S615-D619 PolarHBondContact O-N 3.04Å
616	R	95	Very high	91.6	Very high	179 Å²	179	72.6 Å²	72.6	68%	0.675	38%	0.376	S	S	*	.	H	α-helix	trans	-66.7	-31	175.4	-55.1	171.5	-62.6	135.9	-0	112	D614 L620	D614-R616 PolarHBondContact O-N 3.18Å; D614-R616 VanDerWaalsContact O-N 3.14Å; D614-R616 WeakPolarHBondContact OD1-CB 3.19Å; D614-R616 VanDerWaalsContact OD1-CG 3.25Å; D614-R616 WeakPolarHBondContact OD1-CG 3.42Å; D614-R616 IonicContact OD1-CZ 2.76Å; D614-R616 PolarHBondContact OD1-N 3.43Å; D614-R616 IonicContact OD1-NE 3.08Å; D614-R616 PolarHBondContact OD1-NE 2.96Å; D614-R616 IonicContact OD1-NH2 3.59Å; D614-R616 IonicContact OD2-CZ 2.74Å; D614-R616 VanDerWaalsContact OD2-CZ 3.3Å; D614-R616 IonicContact OD2-NE 2.71Å; D614-R616 PolarHBondContact OD2-NE 3.4Å; D614-R616 VanDerWaalsContact OD2-NE 3.1Å; D614-R616 IonicContact OD2-NH2 3.63Å; D614-R616 PolarHBondContact OD2-NH2 2.86Å; R616-L620 WeakPolarHBondContact O-CB 3.46Å; R616-L620 PolarHBondContact O-N 2.7Å; R616-L620 VanDerWaalsContact O-N 3.08Å
617	I	94.1	Very high	91	Very high	29 Å²	29	68.9 Å²	68.9	15%	0.149	36%	0.356	C	S	.	.	H	α-helix	trans	-79.6	-42.3	177.2	-58.3	178.3	0	0	0	109.7	I613 D614 S615 D619 L620 V621 A640 A641 H644	I613-I617 HydrophobicContact CD1-CB 4.35Å; I613-I617 HydrophobicContact CD1-CG2 4.15Å; D614-I617 HydrophobicContact CB-CD1 4.13Å; D614-I617 HydrophobicContact CB-CG1 4.19Å; D614-I617 WeakPolarHBondContact O-CA 3.41Å; D614-I617 WeakPolarHBondContact O-CB 3.12Å; D614-I617 PolarHBondContact O-N 2.97Å; S615-I617 VanDerWaalsContact C-N 3.28Å; S615-I617 PolarHBondContact O-N 2.9Å; I617-D619 VanDerWaalsContact C-N 3.3Å; I617-D619 PolarHBondContact O-N 3.33Å; I617-L620 WeakPolarHBondContact O-CB 3.49Å; I617-L620 PolarHBondContact O-N 2.82Å; I617-L620 VanDerWaalsContact O-N 3.14Å; I617-V621 HydrophobicContact CG2-CG2 4.45Å; I617-V621 WeakPolarHBondContact O-CG2 3.5Å; I617-V621 PolarHBondContact O-N 2.54Å; I617-A640 HydrophobicContact CG2-CB 3.95Å; I617-A641 HydrophobicContact CG2-CB 3.89Å; I617-H644 HydrophobicContact CD1-CB 4.07Å
618	A	92.5	Very high	89.4	Confident	34 Å²	34	76.8 Å²	76.8	28%	0.281	39%	0.39	S	S	.	.	H	α-helix	trans	-56.4	-45.7	172.1	0	0	0	0	0	111.4	I613 D614 S615 L620 V621 R622	I613-A618 HydrophobicContact CD1-CB 3.84Å; I613-A618 HydrophobicContact CG1-CB 4.22Å; D614-A618 PolarHBondContact O-N 3.16Å; D614-A618 VanDerWaalsContact O-N 3.1Å; S615-A618 PolarHBondContact O-N 3.22Å; A618-L620 PolarHBondContact O-N 2.75Å; A618-V621 PolarHBondContact O-N 3.33Å; A618-R622 VanDerWaalsContact O-CB 3.24Å; A618-R622 WeakPolarHBondContact O-CB 3.34Å; A618-R622 PolarHBondContact O-N 2.88Å
619	D	92.4	Very high	88.1	Confident	54 Å²	54	75.3 Å²	75.3	29%	0.289	39%	0.385	S	S	.	.	H	α-helix	trans	-65	-35.6	175.6	-114.2	16.9	0	0	0	113.5	S615 I617 R622 R623	S615-D619 WeakPolarHBondContact O-CB 3.44Å; S615-D619 PolarHBondContact O-N 3.04Å; I617-D619 VanDerWaalsContact C-N 3.3Å; I617-D619 PolarHBondContact O-N 3.33Å; D619-R622 IonicContact OD1-CZ 3.85Å; D619-R622 IonicContact OD1-NE 3.09Å; D619-R622 PolarHBondContact OD1-NE 2.82Å; D619-R622 IonicContact OD1-NH2 3.39Å; D619-R622 PolarHBondContact OD1-NH2 3.02Å; D619-R622 IonicContact OD2-NH2 3.09Å; D619-R623 WeakPolarHBondContact O-CB 3.2Å; D619-R623 WeakPolarHBondContact O-CD 3.4Å; D619-R623 WeakPolarHBondContact O-CG 3.46Å; D619-R623 PolarHBondContact O-N 2.86Å; D619-R623 PolarHBondContact O-NE 3.16Å; D619-R623 IonicContact OD2-CZ 3.83Å; D619-R623 IonicContact OD2-NE 2.68Å; D619-R623 IonicContact OD2-NH2 3.46Å; D619-R623 PolarHBondContact OD2-NH2 3.12Å
620	L	91.9	Very high	86.6	Confident	75 Å²	75	75.8 Å²	75.8	39%	0.393	39%	0.389	S	S	.	.	H	α-helix	trans	-65.8	-50.6	176.1	176.8	63.6	0	0	0	111.1	R616 I617 A618 R622 R623 Q624 A640	R616-L620 WeakPolarHBondContact O-CB 3.46Å; R616-L620 PolarHBondContact O-N 2.7Å; R616-L620 VanDerWaalsContact O-N 3.08Å; I617-L620 WeakPolarHBondContact O-CB 3.49Å; I617-L620 PolarHBondContact O-N 2.82Å; I617-L620 VanDerWaalsContact O-N 3.14Å; A618-L620 PolarHBondContact O-N 2.75Å; L620-R622 VanDerWaalsContact C-N 3.33Å; L620-R622 PolarHBondContact O-N 2.87Å; L620-R623 PolarHBondContact O-N 2.97Å; L620-Q624 WeakPolarHBondContact O-CG 3.29Å; L620-Q624 PolarHBondContact O-N 3.34Å; L620-A640 HydrophobicContact CD2-CB 4.22Å
621	V	92.3	Very high	85.2	Confident	1 Å²	1	77.7 Å²	77.7	1%	0.006	40%	0.399	C	S	.	.	H	α-helix	trans	-58.8	-47.1	177.7	173.7	0	0	0	0	110.2	L603 I617 A618 R623 Q624 I625 F638 A641	L603-V621 HydrophobicContact CD1-CG1 3.9Å; I617-V621 HydrophobicContact CG2-CG2 4.45Å; I617-V621 WeakPolarHBondContact O-CG2 3.5Å; I617-V621 PolarHBondContact O-N 2.54Å; A618-V621 PolarHBondContact O-N 3.33Å; V621-R623 PolarHBondContact O-N 3.26Å; V621-Q624 PolarHBondContact O-N 3.06Å; V621-I625 HydrophobicContact CG1-CD1 3.91Å; V621-I625 WeakPolarHBondContact O-CG1 3.45Å; V621-I625 PolarHBondContact O-N 2.82Å; V621-I625 VanDerWaalsContact O-N 3.12Å; V621-F638 HydrophobicContact CG1-CD1 3.5Å; V621-F638 HydrophobicContact CG1-CE1 3.51Å; V621-F638 HydrophobicContact CG2-CD1 4.48Å; V621-A641 HydrophobicContact CG2-CB 4.1Å
622	R	91.1	Very high	84.1	Confident	86 Å²	86	81.7 Å²	81.7	33%	0.325	42%	0.424	S	S	.	.	H	α-helix	trans	-58.4	-48.9	178	-178.4	176.6	66.6	75.2	-6.2	111.8	Y599 A618 D619 L620 Q624 I625 D626	Y599-R622 HydrophobicContact CE2-CB 4.35Å; Y599-R622 WeakPolarHBondContact OH-CD 3.46Å; Y599-R622 WeakPolarHBondContact OH-CG 3.47Å; A618-R622 VanDerWaalsContact O-CB 3.24Å; A618-R622 WeakPolarHBondContact O-CB 3.34Å; A618-R622 PolarHBondContact O-N 2.88Å; D619-R622 IonicContact OD1-CZ 3.85Å; D619-R622 IonicContact OD1-NE 3.09Å; D619-R622 PolarHBondContact OD1-NE 2.82Å; D619-R622 IonicContact OD1-NH2 3.39Å; D619-R622 PolarHBondContact OD1-NH2 3.02Å; D619-R622 IonicContact OD2-NH2 3.09Å; L620-R622 VanDerWaalsContact C-N 3.33Å; L620-R622 PolarHBondContact O-N 2.87Å; R622-Q624 VanDerWaalsContact C-N 3.29Å; R622-Q624 PolarHBondContact O-N 3.24Å; R622-I625 WeakPolarHBondContact O-CB 3.35Å; R622-I625 PolarHBondContact O-N 3.5Å; R622-D626 VanDerWaalsContact CG-OD2 3.3Å; R622-D626 WeakPolarHBondContact CG-OD2 3.23Å; R622-D626 IonicContact NH1-OD2 3.75Å; R622-D626 PolarHBondContact NH1-OD2 2.77Å; R622-D626 WeakPolarHBondContact O-CB 3.42Å; R622-D626 PolarHBondContact O-N 3.03Å
623	R	88.9	Confident	83.5	Confident	147 Å²	147	77.5 Å²	77.5	56%	0.555	40%	0.404	S	S	*	.	H	α-helix	trans	-60.9	-35.1	176.1	-69.6	168.4	-148.4	-178.7	5.1	113	D619 L620 V621 I625 D627	D619-R623 WeakPolarHBondContact O-CB 3.2Å; D619-R623 WeakPolarHBondContact O-CD 3.4Å; D619-R623 WeakPolarHBondContact O-CG 3.46Å; D619-R623 PolarHBondContact O-N 2.86Å; D619-R623 PolarHBondContact O-NE 3.16Å; D619-R623 IonicContact OD2-CZ 3.83Å; D619-R623 IonicContact OD2-NE 2.68Å; D619-R623 IonicContact OD2-NH2 3.46Å; D619-R623 PolarHBondContact OD2-NH2 3.12Å; L620-R623 PolarHBondContact O-N 2.97Å; V621-R623 PolarHBondContact O-N 3.26Å; R623-I625 PolarHBondContact O-N 2.8Å; R623-D627 WeakPolarHBondContact O-CB 3.49Å; R623-D627 PolarHBondContact O-N 3.31Å
624	Q	86.4	Confident	83.2	Confident	70 Å²	70	79 Å²	79	33%	0.327	41%	0.412	S	S	.	.	H	α-helix	trans	-72.6	-14.7	175.7	-70.9	-179	5.8	0	0	113.9	L620 V621 R622 C637	L620-Q624 WeakPolarHBondContact O-CG 3.29Å; L620-Q624 PolarHBondContact O-N 3.34Å; V621-Q624 PolarHBondContact O-N 3.06Å; R622-Q624 VanDerWaalsContact C-N 3.29Å; R622-Q624 PolarHBondContact O-N 3.24Å; Q624-C637 PolarHBondContact OE1-O 2.95Å
625	I	86.3	Confident	83.1	Confident	29 Å²	29	79.3 Å²	79.3	15%	0.149	41%	0.41	C	S	.	.	H	α-helix	trans	-95.5	-40.3	175.5	-74.7	173.1	0	0	0	111	I595 M596 Y599 V621 R622 R623 D627 F638	I595-I625 HydrophobicContact CG2-CD1 3.72Å; I595-I625 HydrophobicContact CG2-CG1 3.75Å; M596-I625 HydrophobicContact CE-CG2 3.78Å; Y599-I625 HydrophobicContact CD1-CD1 4.48Å; Y599-I625 HydrophobicContact CD2-CD1 3.65Å; Y599-I625 HydrophobicContact CE2-CD1 4.38Å; Y599-I625 HydrophobicContact CG-CD1 3.71Å; V621-I625 HydrophobicContact CG1-CD1 3.91Å; V621-I625 WeakPolarHBondContact O-CG1 3.45Å; V621-I625 PolarHBondContact O-N 2.82Å; V621-I625 VanDerWaalsContact O-N 3.12Å; R622-I625 WeakPolarHBondContact O-CB 3.35Å; R622-I625 PolarHBondContact O-N 3.5Å; R623-I625 PolarHBondContact O-N 2.8Å; I625-D627 VanDerWaalsContact C-N 3.28Å; I625-D627 PolarHBondContact O-N 2.95Å; I625-F638 HydrophobicContact CD1-CE1 4.06Å; I625-F638 HydrophobicContact CD1-CZ 4.16Å
626	D	83.5	Confident	83.1	Confident	88 Å²	88	80.8 Å²	80.8	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-72.4	-16	178.6	-63.4	-15.6	0	0	0	112.9	R622 E628	R622-D626 VanDerWaalsContact CG-OD2 3.3Å; R622-D626 WeakPolarHBondContact CG-OD2 3.23Å; R622-D626 IonicContact NH1-OD2 3.75Å; R622-D626 PolarHBondContact NH1-OD2 2.77Å; R622-D626 WeakPolarHBondContact O-CB 3.42Å; R622-D626 PolarHBondContact O-N 3.03Å; D626-E628 PolarHBondContact O-N 2.74Å
627	D	78.1	Confident	82.9	Confident	77 Å²	77	72.4 Å²	72.4	41%	0.412	37%	0.371	S	S	.	.			trans	-73.8	89.1	-178.4	-175.8	2.5	0	0	0	112.7	R623 I625 S629 N630	R623-D627 WeakPolarHBondContact O-CB 3.49Å; R623-D627 PolarHBondContact O-N 3.31Å; I625-D627 VanDerWaalsContact C-N 3.28Å; I625-D627 PolarHBondContact O-N 2.95Å; D627-S629 PolarHBondContact O-N 3.06Å; D627-S629 VanDerWaalsContact O-N 3.13Å; D627-S629 VanDerWaalsContact OD1-CB 3.26Å; D627-S629 WeakPolarHBondContact OD1-CB 3.27Å; D627-S629 PolarHBondContact OD1-N 3.36Å; D627-S629 PolarHBondContact OD1-OG 3.35Å; D627-S629 PolarHBondContact OD2-OG 2.97Å; D627-N630 WeakPolarHBondContact O-CB 3.48Å; D627-N630 PolarHBondContact O-N 2.82Å; D627-N630 VanDerWaalsContact O-N 3.09Å
628	E	60.9	Low	83	Confident	185 Å²	185	71.2 Å²	71.2	86%	0.864	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-18.5	176.7	-61.4	-166.8	137.7	0	0	114.3	D626 N630	D626-E628 PolarHBondContact O-N 2.74Å; E628-N630 PolarHBondContact O-N 3.11Å
629	S	64	Low	83.1	Confident	92 Å²	92	74.7 Å²	74.7	64%	0.643	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-23.1	176.2	79.4	0	0	0	0	112.3	D627 T631	D627-S629 PolarHBondContact O-N 3.06Å; D627-S629 VanDerWaalsContact O-N 3.13Å; D627-S629 VanDerWaalsContact OD1-CB 3.26Å; D627-S629 WeakPolarHBondContact OD1-CB 3.27Å; D627-S629 PolarHBondContact OD1-N 3.36Å; D627-S629 PolarHBondContact OD1-OG 3.35Å; D627-S629 PolarHBondContact OD2-OG 2.97Å; S629-T631 VanDerWaalsContact C-N 3.29Å; S629-T631 PolarHBondContact O-N 3.36Å
630	N	62	Low	83.2	Confident	51 Å²	51	73.8 Å²	73.8	27%	0.273	38%	0.375	S	S	.	.			trans	-80.4	74.6	-176.2	-158.1	-0.9	0	0	0	112	D627 E628 T632	D627-N630 WeakPolarHBondContact O-CB 3.48Å; D627-N630 PolarHBondContact O-N 2.82Å; D627-N630 VanDerWaalsContact O-N 3.09Å; E628-N630 PolarHBondContact O-N 3.11Å; N630-T632 PolarHBondContact O-N 2.9Å; N630-T632 VanDerWaalsContact O-N 3.1Å; N630-T632 PolarHBondContact OD1-O 3.45Å; N630-T632 PolarHBondContact OD1-OG1 2.89Å
631	T	65.4	Low	83.4	Confident	130 Å²	130	70.2 Å²	70.2	80%	0.798	36%	0.356	S	S	*	.			trans	-55.9	-25.3	178.1	-59.7	0	0	0	0	112.6	S629	S629-T631 VanDerWaalsContact C-N 3.29Å; S629-T631 PolarHBondContact O-N 3.36Å
632	T	71.4	Confident	83.6	Confident	100 Å²	100	71 Å²	71	61%	0.613	36%	0.36	S	S	*	.	S	Bend	trans	-97.2	117.6	176.2	46.6	0	0	0	0	111.7	N630 N634	N630-T632 PolarHBondContact O-N 2.9Å; N630-T632 VanDerWaalsContact O-N 3.1Å; N630-T632 PolarHBondContact OD1-O 3.45Å; N630-T632 PolarHBondContact OD1-OG1 2.89Å; T632-N634 PolarHBondContact O-N 3.45Å; T632-N634 VanDerWaalsContact O-N 3.12Å
633	P	78.5	Confident	83.9	Confident	33 Å²	33	73.9 Å²	73.9	21%	0.214	38%	0.377	C	S	.	.			trans	-67.5	114.9	-177.8	27.5	-34.5	0	0	0	111.7	L588 V591 R592 I595 R635	L588-P633 HydrophobicContact CD1-CG 4.12Å; V591-P633 HydrophobicContact CB-CB 4.28Å; V591-P633 HydrophobicContact CB-CG 4.22Å; V591-P633 HydrophobicContact CG1-CB 3.94Å; V591-P633 HydrophobicContact CG1-CG 4.29Å; R592-P633 HydrophobicContact CB-CB 4.08Å; I595-P633 HydrophobicContact CD1-CB 4.41Å; P633-R635 PolarHBondContact O-N 3.4Å
634	N	85.7	Confident	84.2	Confident	56 Å²	56	70.2 Å²	70.2	30%	0.299	37%	0.366	S	S	.	.			trans	-75.4	109.3	-177.3	-179.2	15.1	0	0	0	112.2	I595 T632 Y636 C637	I595-N634 WeakPolarHBondContact CD1-O 3.25Å; T632-N634 PolarHBondContact O-N 3.45Å; T632-N634 VanDerWaalsContact O-N 3.12Å; N634-Y636 PolarHBondContact O-N 3.43Å; N634-Y636 VanDerWaalsContact O-N 3.12Å; N634-Y636 PolarHBondContact OD1-N 3.27Å; N634-C637 WeakPolarHBondContact O-CB 3.27Å; N634-C637 PolarHBondContact O-N 3.34Å; N634-C637 PolarHBondContact O-SG 3.08Å
635	R	91.6	Very high	84.7	Confident	57 Å²	57	66.9 Å²	66.9	22%	0.215	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-21.9	175.1	-66.4	170.6	174.3	-80.4	-3	114.8	L583 K584 A586 V591 P633	L583-R635 PolarHBondContact O-NH1 3.11Å; K584-R635 PolarHBondContact O-NH1 2.99Å; A586-R635 PolarHBondContact O-NH1 3.36Å; A586-R635 PolarHBondContact O-NH2 3.19Å; V591-R635 HydrophobicContact CG1-CG 3.87Å; V591-R635 HydrophobicContact CG2-CG 4.17Å; P633-R635 PolarHBondContact O-N 3.4Å
636	Y	92.7	Very high	85.2	Confident	123 Å²	123	66.9 Å²	66.9	48%	0.482	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	12.5	-174.3	-53.8	-80.9	0	0	0	112.7	N634 F638 E639	N634-Y636 PolarHBondContact O-N 3.43Å; N634-Y636 VanDerWaalsContact O-N 3.12Å; N634-Y636 PolarHBondContact OD1-N 3.27Å; Y636-F638 PolarHBondContact O-N 3.5Å; Y636-F638 VanDerWaalsContact O-N 3.07Å; Y636-E639 VanDerWaalsContact O-CB 3.25Å; Y636-E639 WeakPolarHBondContact O-CB 3.41Å; Y636-E639 PolarHBondContact O-N 3.48Å
637	C	91.8	Very high	85.7	Confident	4 Å²	4	68.6 Å²	68.6	3%	0.027	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-21	-177.5	63.7	0	0	0	0	114.9	Q624 N634	Q624-C637 PolarHBondContact OE1-O 2.95Å; N634-C637 WeakPolarHBondContact O-CB 3.27Å; N634-C637 PolarHBondContact O-N 3.34Å; N634-C637 PolarHBondContact O-SG 3.08Å
638	F	95.5	Very high	86.5	Confident	3 Å²	3	67.6 Å²	67.6	1%	0.013	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.2	-0.4	176.6	-60.3	-62.6	0	0	0	114.1	F576 L583 I595 I598 L603 V621 I625 Y636 A640 A641 E642	F576-F638 HydrophobicContact CE2-CD1 4.32Å; F576-F638 HydrophobicContact CZ-CB 4.24Å; F576-F638 HydrophobicContact CZ-CD1 4.42Å; F576-F638 HydrophobicContact CZ-CG 4.5Å; L583-F638 HydrophobicContact CD2-CD2 3.54Å; L583-F638 HydrophobicContact CD2-CE2 3.76Å; I595-F638 HydrophobicContact CB-CE2 4.36Å; I595-F638 HydrophobicContact CG1-CE2 4.38Å; I595-F638 HydrophobicContact CG2-CE2 4.03Å; I595-F638 HydrophobicContact CG2-CZ 3.84Å; I598-F638 HydrophobicContact CB-CE2 3.75Å; I598-F638 HydrophobicContact CB-CZ 3.81Å; I598-F638 HydrophobicContact CD1-CE2 4.12Å; I598-F638 HydrophobicContact CG2-CD1 4.46Å; I598-F638 HydrophobicContact CG2-CD2 4.02Å; I598-F638 HydrophobicContact CG2-CE1 4.05Å; I598-F638 HydrophobicContact CG2-CE2 3.54Å; I598-F638 HydrophobicContact CG2-CG 4.47Å; I598-F638 HydrophobicContact CG2-CZ 3.56Å; L603-F638 HydrophobicContact CD1-CD1 3.94Å; L603-F638 HydrophobicContact CD1-CE1 3.9Å; V621-F638 HydrophobicContact CG1-CD1 3.5Å; V621-F638 HydrophobicContact CG1-CE1 3.51Å; V621-F638 HydrophobicContact CG2-CD1 4.48Å; I625-F638 HydrophobicContact CD1-CE1 4.06Å; I625-F638 HydrophobicContact CD1-CZ 4.16Å; Y636-F638 PolarHBondContact O-N 3.5Å; Y636-F638 VanDerWaalsContact O-N 3.07Å; F638-A640 VanDerWaalsContact C-N 3.32Å; F638-A640 PolarHBondContact O-N 2.83Å; F638-A640 VanDerWaalsContact O-N 3.16Å; F638-A641 CarbonylContact O-C 3.6Å; F638-A641 WeakPolarHBondContact O-CA 3.46Å; F638-A641 WeakPolarHBondContact O-CB 3.35Å; F638-A641 PolarHBondContact O-N 3.49Å; F638-E642 WeakPolarHBondContact O-CB 3.27Å; F638-E642 PolarHBondContact O-N 3.26Å
639	E	94.8	Very high	88.1	Confident	107 Å²	107	58.8 Å²	58.8	50%	0.5	31%	0.307	S	S	.	.	H	α-helix	trans	-54.1	-42.5	-167.9	-177.5	166.4	-119.8	0	0	113.7	Y636 E642 E643	Y636-E639 VanDerWaalsContact O-CB 3.25Å; Y636-E639 WeakPolarHBondContact O-CB 3.41Å; Y636-E639 PolarHBondContact O-N 3.48Å; E639-E642 PolarHBondContact O-N 3.26Å; E639-E643 WeakPolarHBondContact O-CB 3.46Å; E639-E643 PolarHBondContact O-N 2.98Å
640	A	94.8	Very high	89.7	Confident	36 Å²	36	58.9 Å²	58.9	30%	0.298	30%	0.296	S	S	.	.	H	α-helix	trans	-69.7	-30.4	177	0	0	0	0	0	113.9	I617 L620 F638 H644	I617-A640 HydrophobicContact CG2-CB 3.95Å; L620-A640 HydrophobicContact CD2-CB 4.22Å; F638-A640 VanDerWaalsContact C-N 3.32Å; F638-A640 PolarHBondContact O-N 2.83Å; F638-A640 VanDerWaalsContact O-N 3.16Å; A640-H644 PolarHBondContact O-N 3.07Å
641	A	96.4	Very high	91.2	Very high	0 Å²	0	59.6 Å²	59.6	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-78	-39.6	174.7	0	0	0	0	0	111.1	F576 I613 I617 V621 F638 H644 I645	F576-A641 HydrophobicContact CE1-CB 4.13Å; F576-A641 HydrophobicContact CZ-CB 3.81Å; I613-A641 HydrophobicContact CD1-CB 4.1Å; I617-A641 HydrophobicContact CG2-CB 3.89Å; V621-A641 HydrophobicContact CG2-CB 4.1Å; F638-A641 CarbonylContact O-C 3.6Å; F638-A641 WeakPolarHBondContact O-CA 3.46Å; F638-A641 WeakPolarHBondContact O-CB 3.35Å; F638-A641 PolarHBondContact O-N 3.49Å; A641-H644 PolarHBondContact O-N 3.29Å; A641-I645 WeakPolarHBondContact O-CB 3.38Å; A641-I645 WeakPolarHBondContact O-CG1 3.39Å; A641-I645 PolarHBondContact O-N 3.07Å
642	E	96.4	Very high	92.6	Very high	18 Å²	18	56.8 Å²	56.8	8%	0.084	29%	0.285	C	S	.	.	H	α-helix	trans	-61.2	-45.6	174.7	-174.6	-167.9	153.1	0	0	111.7	C580 Q581 K584 F638 E639 H644 F646	C580-E642 HydrophobicContact CB-CB 4.41Å; C580-E642 HydrophobicContact CB-CG 3.98Å; Q581-E642 PolarHBondContact NE2-OE1 3.38Å; K584-E642 WeakPolarHBondContact CE-OE2 3.22Å; K584-E642 IonicContact NZ-OE1 3.33Å; K584-E642 PolarHBondContact NZ-OE1 3.11Å; K584-E642 IonicContact NZ-OE2 2.9Å; K584-E642 PolarHBondContact NZ-OE2 3.13Å; F638-E642 WeakPolarHBondContact O-CB 3.27Å; F638-E642 PolarHBondContact O-N 3.26Å; E639-E642 PolarHBondContact O-N 3.26Å; E642-H644 PolarHBondContact O-N 3.27Å; E642-F646 WeakPolarHBondContact O-CB 3.33Å; E642-F646 PolarHBondContact O-N 3.38Å
643	E	96.1	Very high	93.8	Very high	146 Å²	146	52.4 Å²	52.4	68%	0.682	26%	0.259	S	S	*	.	H	α-helix	trans	-61.8	-42.8	175.2	-176.1	176	-156.3	0	0	111.5	E639 F646 H647	E639-E643 WeakPolarHBondContact O-CB 3.46Å; E639-E643 PolarHBondContact O-N 2.98Å; E643-F646 PolarHBondContact O-N 2.99Å; E643-H647 WeakPolarHBondContact O-CB 3.27Å; E643-H647 PolarHBondContact O-N 2.91Å
644	H	96.2	Very high	94.7	Very high	69 Å²	69	51.8 Å²	51.8	32%	0.319	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-49	179.3	-170.5	-169.3	0	0	0	111.9	D614 I617 A640 A641 E642 F646 H647 L648	D614-H644 PolarHBondContact N-CE1 2.65Å; D614-H644 PolarHBondContact N-ND1 3.4Å; I617-H644 HydrophobicContact CD1-CB 4.07Å; A640-H644 PolarHBondContact O-N 3.07Å; A641-H644 PolarHBondContact O-N 3.29Å; E642-H644 PolarHBondContact O-N 3.27Å; H644-F646 VanDerWaalsContact C-N 3.33Å; H644-F646 PolarHBondContact O-N 2.97Å; H644-H647 PolarHBondContact O-N 2.79Å; H644-L648 PolarHBondContact O-N 2.84Å
645	I	96.2	Very high	95.2	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-64.5	-38	176.8	-68.1	-56.5	0	0	0	111.6	N573 F576 I611 N612 I613 A641 H647 L648 M649	N573-I645 HydrophobicContact CB-CG2 3.77Å; N573-I645 VanDerWaalsContact O-CG2 3.28Å; N573-I645 WeakPolarHBondContact O-CG2 3.3Å; F576-I645 HydrophobicContact CD1-CB 4.21Å; F576-I645 HydrophobicContact CD1-CG1 3.99Å; F576-I645 HydrophobicContact CD1-CG2 4.23Å; F576-I645 HydrophobicContact CE1-CB 4.42Å; F576-I645 HydrophobicContact CE1-CG1 4.08Å; I611-I645 HydrophobicContact CB-CD1 4.19Å; I611-I645 HydrophobicContact CD1-CD1 4.2Å; I611-I645 HydrophobicContact CD1-CG1 3.85Å; N612-I645 WeakPolarHBondContact O-CD1 3.41Å; I613-I645 HydrophobicContact CG2-CD1 3.55Å; I613-I645 HydrophobicContact CG2-CG1 3.73Å; A641-I645 WeakPolarHBondContact O-CB 3.38Å; A641-I645 WeakPolarHBondContact O-CG1 3.39Å; A641-I645 PolarHBondContact O-N 3.07Å; I645-H647 VanDerWaalsContact C-N 3.35Å; I645-H647 PolarHBondContact O-N 3.23Å; I645-L648 HydrophobicContact CD1-CD2 4.27Å; I645-L648 PolarHBondContact O-N 3.17Å; I645-M649 HydrophobicContact CG2-CE 4.24Å; I645-M649 WeakPolarHBondContact O-CG 3.05Å; I645-M649 PolarHBondContact O-N 2.82Å
646	F	96.1	Very high	95.4	Very high	30 Å²	30	52.9 Å²	52.9	13%	0.132	26%	0.258	C	S	.	.	H	α-helix	trans	-62.6	-40.8	173.7	-175.2	-96.4	0	0	0	112	I548 H549 L552 W577 E642 E643 H644 K650	I548-F646 HydrophobicContact CG2-CE1 4.2Å; I548-F646 HydrophobicContact CG2-CE2 4.03Å; I548-F646 HydrophobicContact CG2-CZ 3.51Å; H549-F646 AromaticContact CE1-CE1 3.5Å; H549-F646 AromaticContact CE1-CZ 3.19Å; H549-F646 WeakPolarHBondContact CE1-CZ 3.39Å; H549-F646 AromaticContact ND1-CZ 3.52Å; H549-F646 AromaticContact NE2-CE1 3.66Å; H549-F646 AromaticContact NE2-CZ 3.52Å; L552-F646 HydrophobicContact CD1-CD2 4.41Å; L552-F646 HydrophobicContact CD1-CE2 3.88Å; W577-F646 AromaticContact CD1-CD2 3.99Å; W577-F646 AromaticContact CE2-CD2 3.99Å; W577-F646 HydrophobicContact CZ2-CD2 4.49Å; W577-F646 HydrophobicContact CZ2-CE2 4.47Å; W577-F646 AromaticContact NE1-CD2 3.52Å; E642-F646 WeakPolarHBondContact O-CB 3.33Å; E642-F646 PolarHBondContact O-N 3.38Å; E643-F646 PolarHBondContact O-N 2.99Å; H644-F646 VanDerWaalsContact C-N 3.33Å; H644-F646 PolarHBondContact O-N 2.97Å; F646-K650 HydrophobicContact CE1-CD 4.05Å; F646-K650 WeakPolarHBondContact O-CB 3.34Å; F646-K650 PolarHBondContact O-N 3.46Å
647	H	95.4	Very high	95.6	Very high	124 Å²	124	47 Å²	47	57%	0.574	24%	0.235	S	C	*	.	H	α-helix	trans	-66	-39.6	174.9	-162.6	106	0	0	0	112.3	E643 H644 I645 K650 S651	E643-H647 WeakPolarHBondContact O-CB 3.27Å; E643-H647 PolarHBondContact O-N 2.91Å; H644-H647 PolarHBondContact O-N 2.79Å; I645-H647 VanDerWaalsContact C-N 3.35Å; I645-H647 PolarHBondContact O-N 3.23Å; H647-K650 PolarHBondContact O-N 3.27Å; H647-S651 WeakPolarHBondContact O-CB 3.48Å; H647-S651 PolarHBondContact O-N 2.74Å; H647-S651 PolarHBondContact O-OG 2.93Å
648	L	94.8	Very high	95.8	Very high	55 Å²	55	48.9 Å²	48.9	29%	0.288	24%	0.244	S	C	.	.	H	α-helix	trans	-60.9	-53.2	175.4	-179.3	62	0	0	0	111.2	H644 I645 K650 S651 D652	H644-L648 PolarHBondContact O-N 2.84Å; I645-L648 HydrophobicContact CD1-CD2 4.27Å; I645-L648 PolarHBondContact O-N 3.17Å; L648-K650 VanDerWaalsContact C-N 3.3Å; L648-K650 PolarHBondContact O-N 3.2Å; L648-S651 PolarHBondContact O-N 3.5Å; L648-S651 PolarHBondContact O-OG 3.15Å; L648-S651 VanDerWaalsContact O-OG 3.09Å; L648-D652 PolarHBondContact O-N 2.98Å; L648-D652 VanDerWaalsContact O-N 3.08Å
649	M	95.3	Very high	95.8	Very high	0 Å²	0	56 Å²	56	0%	0	27%	0.27	C	S	.	.	I	π-helix	trans	-59.7	-38.6	176	-69.5	-166.7	-64.7	0	0	112.6	I548 N573 L574 W577 I645 S651 S653 Y654	I548-M649 HydrophobicContact CD1-CB 3.94Å; N573-M649 HydrophobicContact CB-CG 3.99Å; N573-M649 HydrophobicContact CB-SD 4.06Å; L574-M649 HydrophobicContact CB-SD 3.88Å; L574-M649 HydrophobicContact CD1-CE 4.37Å; L574-M649 HydrophobicContact CD1-SD 4.19Å; W577-M649 HydrophobicContact CB-CE 3.74Å; W577-M649 HydrophobicContact CD2-CE 4.5Å; W577-M649 HydrophobicContact CG-CE 3.91Å; I645-M649 HydrophobicContact CG2-CE 4.24Å; I645-M649 WeakPolarHBondContact O-CG 3.05Å; I645-M649 PolarHBondContact O-N 2.82Å; M649-S651 VanDerWaalsContact C-N 3.35Å; M649-S653 PolarHBondContact O-N 2.86Å; M649-Y654 VanDerWaalsContact O-CB 3.23Å; M649-Y654 WeakPolarHBondContact O-CB 3.39Å; M649-Y654 PolarHBondContact O-N 2.84Å
650	K	95.9	Very high	95.8	Very high	95 Å²	95	51.6 Å²	51.6	41%	0.413	25%	0.252	S	S	.	.	I	π-helix	trans	-68.3	-30.4	179.4	-177.4	172.7	-180	173.3	0	113.4	I548 F646 H647 L648	I548-K650 HydrophobicContact CD1-CB 4.3Å; I548-K650 HydrophobicContact CG2-CB 4.06Å; I548-K650 HydrophobicContact CG2-CD 4Å; I548-K650 HydrophobicContact CG2-CG 3.85Å; F646-K650 HydrophobicContact CE1-CD 4.05Å; F646-K650 WeakPolarHBondContact O-CB 3.34Å; F646-K650 PolarHBondContact O-N 3.46Å; H647-K650 PolarHBondContact O-N 3.27Å; L648-K650 VanDerWaalsContact C-N 3.3Å; L648-K650 PolarHBondContact O-N 3.2Å
651	S	94.8	Very high	95.8	Very high	65 Å²	65	54.6 Å²	54.6	46%	0.455	26%	0.263	S	S	.	.	I	π-helix	trans	-90.3	-43.8	-175.8	51	0	0	0	0	113.2	H647 L648 M649 C655	H647-S651 WeakPolarHBondContact O-CB 3.48Å; H647-S651 PolarHBondContact O-N 2.74Å; H647-S651 PolarHBondContact O-OG 2.93Å; L648-S651 PolarHBondContact O-N 3.5Å; L648-S651 PolarHBondContact O-OG 3.15Å; L648-S651 VanDerWaalsContact O-OG 3.09Å; M649-S651 VanDerWaalsContact C-N 3.35Å; S651-C655 PolarHBondContact O-SG 3.47Å
652	D	95.1	Very high	95.6	Very high	71 Å²	71	56.3 Å²	56.3	38%	0.38	27%	0.273	S	S	.	.	I	π-helix	trans	-100.7	-70.1	176.6	-171.6	55.1	0	0	0	113.1	L648 Y654 C655 R656	L648-D652 PolarHBondContact O-N 2.98Å; L648-D652 VanDerWaalsContact O-N 3.08Å; D652-Y654 PolarHBondContact O-N 3.36Å; D652-C655 CarbonylContact O-C 3.55Å; D652-C655 WeakPolarHBondContact O-CA 3.32Å; D652-C655 WeakPolarHBondContact O-CB 3.35Å; D652-C655 PolarHBondContact O-N 2.89Å; D652-R656 PolarHBondContact O-N 2.83Å; D652-R656 WeakPolarHBondContact OD1-CD 3.46Å; D652-R656 WeakPolarHBondContact OD2-CD 3.43Å; D652-R656 IonicContact OD2-CZ 3.7Å; D652-R656 IonicContact OD2-NE 2.76Å; D652-R656 IonicContact OD2-NH1 3.77Å; D652-R656 PolarHBondContact OD2-NH1 2.96Å
653	S	96.1	Very high	95.4	Very high	8 Å²	8	56.2 Å²	56.2	6%	0.056	27%	0.272	C	S	.	.	I	π-helix	trans	-59.9	-43.7	-163.3	-37.7	0	0	0	0	113.4	W564 M649 R656 F657	W564-S653 WeakPolarHBondContact CH2-O 3.34Å; W564-S653 VanDerWaalsContact CZ3-O 3.26Å; W564-S653 WeakPolarHBondContact CZ3-O 3.39Å; M649-S653 PolarHBondContact O-N 2.86Å; S653-R656 PolarHBondContact O-N 3.46Å; S653-F657 WeakPolarHBondContact O-CB 3.41Å; S653-F657 PolarHBondContact O-N 3.25Å
654	Y	97.2	Very high	95.3	Very high	21 Å²	21	54.6 Å²	54.6	8%	0.082	26%	0.26	C	S	.	.	H	α-helix	trans	-64.2	-43.3	174.6	172	-103.3	0	0	0	112.2	W544 S545 S547 I548 L551 M649 D652 R656 F657 L658	W544-Y654 PolarHBondContact O-OH 3.02Å; W544-Y654 VanDerWaalsContact O-OH 3.13Å; S545-Y654 PolarHBondContact O-OH 3.08Å; S547-Y654 WeakPolarHBondContact CA-OH 3.18Å; S547-Y654 PolarHBondContact N-OH 3.23Å; I548-Y654 HydrophobicContact CB-CD1 4.27Å; I548-Y654 HydrophobicContact CB-CD2 3.66Å; I548-Y654 HydrophobicContact CB-CE2 3.93Å; I548-Y654 HydrophobicContact CB-CG 3.84Å; I548-Y654 HydrophobicContact CD1-CG 4.41Å; I548-Y654 HydrophobicContact CG1-CD2 3.86Å; I548-Y654 HydrophobicContact CG1-CE2 4.49Å; I548-Y654 HydrophobicContact CG1-CG 4.14Å; I548-Y654 VanDerWaalsContact N-CZ 3.31Å; I548-Y654 PolarHBondContact N-OH 3.46Å; L551-Y654 HydrophobicContact CB-CE2 4.23Å; L551-Y654 HydrophobicContact CD2-CD2 3.69Å; L551-Y654 HydrophobicContact CD2-CE2 3.96Å; M649-Y654 VanDerWaalsContact O-CB 3.23Å; M649-Y654 WeakPolarHBondContact O-CB 3.39Å; M649-Y654 PolarHBondContact O-N 2.84Å; D652-Y654 PolarHBondContact O-N 3.36Å; Y654-R656 PolarHBondContact O-N 3.21Å; Y654-F657 PolarHBondContact O-N 2.84Å; Y654-L658 HydrophobicContact CD1-CD1 4.43Å; Y654-L658 HydrophobicContact CE1-CD1 3.75Å; Y654-L658 HydrophobicContact CE2-CD1 4.1Å; Y654-L658 HydrophobicContact CE2-CD2 4.41Å; Y654-L658 HydrophobicContact CE2-CG 4.24Å; Y654-L658 PolarHBondContact O-N 3.41Å; Y654-L658 VanDerWaalsContact O-N 3.09Å
655	C	96	Very high	95	Very high	37 Å²	37	55.6 Å²	55.6	25%	0.25	27%	0.265	C	S	.	.	H	α-helix	trans	-65	-28.5	177.4	-68	0	0	0	0	112.6	S651 D652 R659	S651-C655 PolarHBondContact O-SG 3.47Å; D652-C655 CarbonylContact O-C 3.55Å; D652-C655 WeakPolarHBondContact O-CA 3.32Å; D652-C655 WeakPolarHBondContact O-CB 3.35Å; D652-C655 PolarHBondContact O-N 2.89Å; C655-R659 VanDerWaalsContact O-CD 3.31Å; C655-R659 WeakPolarHBondContact O-CD 3.46Å; C655-R659 VanDerWaalsContact O-CG 3.31Å; C655-R659 WeakPolarHBondContact O-CG 3.42Å; C655-R659 VanDerWaalsContact O-CZ 3.31Å; C655-R659 PolarHBondContact O-NE 3Å; C655-R659 PolarHBondContact O-NH1 3.24Å
656	R	96.5	Very high	94.7	Very high	99 Å²	99	57.8 Å²	57.8	37%	0.374	28%	0.276	S	S	.	.	H	α-helix	trans	-78.5	-44.8	172.1	-72.6	166	65	161.9	5.6	111.9	W564 E568 D652 S653 Y654 L658 R659 S660	W564-R656 HydrophobicContact CH2-CB 3.45Å; W564-R656 VanDerWaalsContact CH2-CB 3.45Å; W564-R656 HydrophobicContact CZ2-CB 3.89Å; E568-R656 IonicContact OE1-CZ 2.59Å; E568-R656 IonicContact OE1-NE 2.63Å; E568-R656 IonicContact OE1-NH2 3.41Å; E568-R656 PolarHBondContact OE1-NH2 3.13Å; E568-R656 IonicContact OE2-CZ 3.85Å; E568-R656 IonicContact OE2-NE 2.73Å; E568-R656 PolarHBondContact OE2-NE 3.29Å; E568-R656 VanDerWaalsContact OE2-NE 3.09Å; E568-R656 IonicContact OE2-NH2 2.72Å; E568-R656 PolarHBondContact OE2-NH2 2.76Å; D652-R656 PolarHBondContact O-N 2.83Å; D652-R656 WeakPolarHBondContact OD1-CD 3.46Å; D652-R656 WeakPolarHBondContact OD2-CD 3.43Å; D652-R656 IonicContact OD2-CZ 3.7Å; D652-R656 IonicContact OD2-NE 2.76Å; D652-R656 IonicContact OD2-NH1 3.77Å; D652-R656 PolarHBondContact OD2-NH1 2.96Å; S653-R656 PolarHBondContact O-N 3.46Å; Y654-R656 PolarHBondContact O-N 3.21Å; R656-L658 PolarHBondContact O-N 3.44Å; R656-R659 CarbonylContact O-C 3.49Å; R656-R659 PolarHBondContact O-N 3.39Å; R656-S660 PolarHBondContact O-N 2.9Å
657	F	97.1	Very high	94.2	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-54.2	-47.9	177	175.6	-107.5	0	0	0	112.4	L551 F561 W564 S653 Y654 R659 S660 Y663	L551-F657 HydrophobicContact CD1-CD1 4.47Å; L551-F657 HydrophobicContact CD1-CE1 3.7Å; L551-F657 HydrophobicContact CD1-CZ 4.32Å; L551-F657 HydrophobicContact CD2-CD1 3.79Å; L551-F657 HydrophobicContact CD2-CE1 3.86Å; L551-F657 HydrophobicContact CG-CE1 4.47Å; F561-F657 HydrophobicContact CB-CE2 4.42Å; F561-F657 HydrophobicContact CB-CZ 4.4Å; F561-F657 HydrophobicContact CD2-CB 3.81Å; F561-F657 HydrophobicContact CD2-CD1 4.06Å; F561-F657 AromaticContact CD2-CD2 3.82Å; F561-F657 HydrophobicContact CD2-CD2 3.82Å; F561-F657 HydrophobicContact CD2-CE2 4.39Å; F561-F657 AromaticContact CD2-CG 3.62Å; F561-F657 HydrophobicContact CD2-CG 3.62Å; F561-F657 HydrophobicContact CE2-CB 3.8Å; F561-F657 HydrophobicContact CE2-CG 4.14Å; W564-F657 HydrophobicContact CB-CD2 3.93Å; W564-F657 HydrophobicContact CB-CE2 4.11Å; W564-F657 HydrophobicContact CD2-CB 4.21Å; W564-F657 AromaticContact CD2-CD2 3.75Å; W564-F657 HydrophobicContact CD2-CD2 3.75Å; W564-F657 HydrophobicContact CD2-CG 4.48Å; W564-F657 HydrophobicContact CE3-CB 3.77Å; W564-F657 AromaticContact CE3-CD2 3.84Å; W564-F657 HydrophobicContact CE3-CD2 3.84Å; W564-F657 HydrophobicContact CE3-CG 4.26Å; W564-F657 AromaticContact CG-CD2 3.78Å; W564-F657 HydrophobicContact CG-CD2 3.78Å; W564-F657 HydrophobicContact CG-CE2 4.35Å; W564-F657 HydrophobicContact CH2-CB 4.26Å; W564-F657 HydrophobicContact CZ3-CB 3.8Å; S653-F657 WeakPolarHBondContact O-CB 3.41Å; S653-F657 PolarHBondContact O-N 3.25Å; Y654-F657 PolarHBondContact O-N 2.84Å; F657-R659 PolarHBondContact O-N 3.22Å; F657-S660 WeakPolarHBondContact O-CB 3.36Å; F657-S660 PolarHBondContact O-N 3.1Å; F657-S660 PolarHBondContact O-OG 3.29Å; F657-Y663 AromaticContact CE1-CD2 3.96Å; F657-Y663 HydrophobicContact CE1-CD2 3.96Å; F657-Y663 HydrophobicContact CZ-CD2 4.38Å; F657-Y663 WeakPolarHBondContact O-CB 3.35Å
658	L	95.9	Very high	93.7	Very high	42 Å²	42	61.5 Å²	61.5	22%	0.22	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-20.7	178	-66.6	-175.6	0	0	0	114.2	Y654 R656 Y663	Y654-L658 HydrophobicContact CD1-CD1 4.43Å; Y654-L658 HydrophobicContact CE1-CD1 3.75Å; Y654-L658 HydrophobicContact CE2-CD1 4.1Å; Y654-L658 HydrophobicContact CE2-CD2 4.41Å; Y654-L658 HydrophobicContact CE2-CG 4.24Å; Y654-L658 PolarHBondContact O-N 3.41Å; Y654-L658 VanDerWaalsContact O-N 3.09Å; R656-L658 PolarHBondContact O-N 3.44Å; L658-Y663 HydrophobicContact CD2-CD1 4.21Å; L658-Y663 HydrophobicContact CD2-CD2 4.07Å; L658-Y663 HydrophobicContact CD2-CE1 4.09Å; L658-Y663 HydrophobicContact CD2-CE2 3.94Å; L658-Y663 HydrophobicContact CD2-CG 4.22Å; L658-Y663 WeakPolarHBondContact O-CD1 3.38Å
659	R	95.3	Very high	92.7	Very high	152 Å²	152	60.9 Å²	60.9	57%	0.574	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-13.2	175.1	-62.6	172.7	-168	132.8	0.6	112.8	C655 R656 F657	C655-R659 VanDerWaalsContact O-CD 3.31Å; C655-R659 WeakPolarHBondContact O-CD 3.46Å; C655-R659 VanDerWaalsContact O-CG 3.31Å; C655-R659 WeakPolarHBondContact O-CG 3.42Å; C655-R659 VanDerWaalsContact O-CZ 3.31Å; C655-R659 PolarHBondContact O-NE 3Å; C655-R659 PolarHBondContact O-NH1 3.24Å; R656-R659 CarbonylContact O-C 3.49Å; R656-R659 PolarHBondContact O-N 3.39Å; F657-R659 PolarHBondContact O-N 3.22Å
660	S	94.9	Very high	90.9	Very high	16 Å²	16	66.4 Å²	66.4	11%	0.112	32%	0.323	C	S	.	.	S	Bend	trans	-67	156.8	-174.6	76.5	0	0	0	0	113.1	R656 F657 V662 Y663 R664	R656-S660 PolarHBondContact O-N 2.9Å; F657-S660 WeakPolarHBondContact O-CB 3.36Å; F657-S660 PolarHBondContact O-N 3.1Å; F657-S660 PolarHBondContact O-OG 3.29Å; S660-V662 PolarHBondContact O-N 2.92Å; S660-V662 PolarHBondContact OG-N 2.99Å; S660-Y663 PolarHBondContact O-N 3.01Å; S660-Y663 PolarHBondContact OG-N 3.32Å; S660-R664 WeakPolarHBondContact O-CG 3.47Å; S660-R664 PolarHBondContact O-N 2.91Å; S660-R664 VanDerWaalsContact O-N 3.16Å
661	D	93.6	Very high	88.8	Confident	98 Å²	98	70.1 Å²	70.1	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-64.5	-25.4	170.8	-69.5	-52.7	0	0	0	113.3	R664 E665	D661-R664 PolarHBondContact O-N 3.16Å; D661-R664 IonicContact OD1-CZ 2.65Å; D661-R664 IonicContact OD1-NE 2.8Å; D661-R664 PolarHBondContact OD1-NE 3.28Å; D661-R664 IonicContact OD1-NH2 3.73Å; D661-R664 PolarHBondContact OD1-NH2 3.19Å; D661-R664 IonicContact OD2-NH2 3.43Å; D661-E665 WeakPolarHBondContact O-CB 3.48Å; D661-E665 WeakPolarHBondContact O-CG 3.47Å; D661-E665 PolarHBondContact O-N 3.16Å
662	V	92.2	Very high	86.3	Confident	36 Å²	36	74.2 Å²	74.2	22%	0.218	35%	0.349	C	S	.	.	H	α-helix	trans	-64	-52.1	176.4	-178.8	0	0	0	0	110.5	S660 R664 E665 L666	S660-V662 PolarHBondContact O-N 2.92Å; S660-V662 PolarHBondContact OG-N 2.99Å; V662-R664 VanDerWaalsContact C-N 3.31Å; V662-R664 PolarHBondContact O-N 3.25Å; V662-E665 PolarHBondContact O-N 3.08Å; V662-L666 HydrophobicContact CG1-CD1 4.13Å; V662-L666 VanDerWaalsContact O-N 3.08Å; V662-L666 PolarHBondContact O-N 3.49Å; V662-L666 VanDerWaalsContact O-CG 3.31Å; V662-L666 WeakPolarHBondContact O-CG 3.24Å
663	Y	93.5	Very high	83.3	Confident	17 Å²	17	80.2 Å²	80.2	7%	0.067	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-39.6	176.7	-173.8	-102.4	0	0	0	111.6	I541 W544 F657 L658 S660 L666 F667	I541-Y663 HydrophobicContact CG2-CD2 4.25Å; I541-Y663 HydrophobicContact CG2-CE2 3.59Å; I541-Y663 PolarHBondContact O-OH 3Å; W544-Y663 HydrophobicContact CB-CE2 4.4Å; W544-Y663 HydrophobicContact CE3-CD2 4.35Å; W544-Y663 HydrophobicContact CE3-CE2 4.09Å; F657-Y663 AromaticContact CE1-CD2 3.96Å; F657-Y663 HydrophobicContact CE1-CD2 3.96Å; F657-Y663 HydrophobicContact CZ-CD2 4.38Å; F657-Y663 WeakPolarHBondContact O-CB 3.35Å; L658-Y663 HydrophobicContact CD2-CD1 4.21Å; L658-Y663 HydrophobicContact CD2-CD2 4.07Å; L658-Y663 HydrophobicContact CD2-CE1 4.09Å; L658-Y663 HydrophobicContact CD2-CE2 3.94Å; L658-Y663 HydrophobicContact CD2-CG 4.22Å; L658-Y663 WeakPolarHBondContact O-CD1 3.38Å; S660-Y663 PolarHBondContact O-N 3.01Å; S660-Y663 PolarHBondContact OG-N 3.32Å; Y663-L666 PolarHBondContact O-N 3.3Å; Y663-F667 HydrophobicContact CE1-CD2 4.32Å; Y663-F667 WeakPolarHBondContact O-CB 3.42Å; Y663-F667 PolarHBondContact O-N 3.19Å
664	R	92.5	Very high	80.4	Confident	112 Å²	112	85.5 Å²	85.5	42%	0.423	41%	0.408	S	S	.	.	H	α-helix	trans	-70.7	-30.6	179.2	-65.5	-169.9	-58	-171.3	-0.4	114.2	S660 D661 V662 R668	S660-R664 WeakPolarHBondContact O-CG 3.47Å; S660-R664 PolarHBondContact O-N 2.91Å; S660-R664 VanDerWaalsContact O-N 3.16Å; D661-R664 PolarHBondContact O-N 3.16Å; D661-R664 IonicContact OD1-CZ 2.65Å; D661-R664 IonicContact OD1-NE 2.8Å; D661-R664 PolarHBondContact OD1-NE 3.28Å; D661-R664 IonicContact OD1-NH2 3.73Å; D661-R664 PolarHBondContact OD1-NH2 3.19Å; D661-R664 IonicContact OD2-NH2 3.43Å; V662-R664 VanDerWaalsContact C-N 3.31Å; V662-R664 PolarHBondContact O-N 3.25Å; R664-R668 VanDerWaalsContact O-NE 3.15Å; R664-R668 PolarHBondContact O-NE 2.82Å; R664-R668 PolarHBondContact O-N 3.09Å; R664-R668 WeakPolarHBondContact O-CG 3.15Å; R664-R668 VanDerWaalsContact O-CG 3.24Å; R664-R668 WeakPolarHBondContact O-CD 3.46Å
665	E	90.5	Very high	77.4	Confident	89 Å²	89	94.7 Å²	94.7	42%	0.416	45%	0.449	S	S	.	.	H	α-helix	trans	-73	-45.1	172.8	-78.2	-173.5	-178.9	0	0	111	D661 V662 F667 R668 G669 K672	D661-E665 WeakPolarHBondContact O-CB 3.48Å; D661-E665 WeakPolarHBondContact O-CG 3.47Å; D661-E665 PolarHBondContact O-N 3.16Å; V662-E665 PolarHBondContact O-N 3.08Å; E665-F667 PolarHBondContact O-N 3.27Å; E665-R668 PolarHBondContact O-N 3.4Å; E665-G669 PolarHBondContact O-N 2.61Å; E665-K672 WeakPolarHBondContact OE1-CE 3.4Å; E665-K672 IonicContact OE1-NZ 2.65Å; E665-K672 PolarHBondContact OE1-NZ 3.04Å; E665-K672 WeakPolarHBondContact OE2-CE 3.48Å; E665-K672 IonicContact OE2-NZ 2.64Å; E665-K672 PolarHBondContact OE2-NZ 2.91Å
666	L	89.1	Confident	74.4	Confident	46 Å²	46	101.4 Å²	101.4	24%	0.241	47%	0.474	C	S	.	.	H	α-helix	trans	-58.2	-47.5	176.2	-70.5	171.3	0	0	0	111.3	I541 W544 E560 V662 Y663 R668 G669	I541-L666 HydrophobicContact CD1-CB 4.23Å; I541-L666 WeakPolarHBondContact CD1-O 3.18Å; I541-L666 HydrophobicContact CG2-CB 4.44Å; W544-L666 HydrophobicContact CZ3-CD1 4.14Å; E560-L666 HydrophobicContact CB-CD1 4.31Å; E560-L666 HydrophobicContact CG-CD1 4.06Å; V662-L666 HydrophobicContact CG1-CD1 4.13Å; V662-L666 VanDerWaalsContact O-N 3.08Å; V662-L666 PolarHBondContact O-N 3.49Å; V662-L666 VanDerWaalsContact O-CG 3.31Å; V662-L666 WeakPolarHBondContact O-CG 3.24Å; Y663-L666 PolarHBondContact O-N 3.3Å; L666-R668 PolarHBondContact O-N 3.09Å; L666-R668 VanDerWaalsContact C-N 3.29Å; L666-G669 PolarHBondContact O-N 3.5Å
667	F	87	Confident	71.3	Confident	82 Å²	82	104.6 Å²	104.6	36%	0.36	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-26.8	-178.9	-164.4	-83.8	0	0	0	113.8	I538 I541 K542 Y663 E665	I538-F667 HydrophobicContact CG2-CD1 4.39Å; I538-F667 HydrophobicContact CG2-CD2 4.34Å; I538-F667 HydrophobicContact CG2-CE1 4.07Å; I538-F667 HydrophobicContact CG2-CE2 4.02Å; I538-F667 HydrophobicContact CG2-CZ 3.87Å; I541-F667 HydrophobicContact CG2-CB 4.32Å; I541-F667 HydrophobicContact CG2-CD2 4.06Å; K542-F667 HydrophobicContact CB-CE2 3.88Å; K542-F667 HydrophobicContact CG-CE2 4.26Å; Y663-F667 HydrophobicContact CE1-CD2 4.32Å; Y663-F667 WeakPolarHBondContact O-CB 3.42Å; Y663-F667 PolarHBondContact O-N 3.19Å; E665-F667 PolarHBondContact O-N 3.27Å
668	R	84.2	Confident	68.3	Low	151 Å²	151	112.7 Å²	112.7	57%	0.57	53%	0.531	S	S	*	.	H	α-helix	trans	-77.7	-26.1	174.7	-71.3	172.6	-142.1	-92.7	7.4	113.5	R664 E665 L666 D670	R664-R668 VanDerWaalsContact O-NE 3.15Å; R664-R668 PolarHBondContact O-NE 2.82Å; R664-R668 PolarHBondContact O-N 3.09Å; R664-R668 WeakPolarHBondContact O-CG 3.15Å; R664-R668 VanDerWaalsContact O-CG 3.24Å; R664-R668 WeakPolarHBondContact O-CD 3.46Å; E665-R668 PolarHBondContact O-N 3.4Å; L666-R668 PolarHBondContact O-N 3.09Å; L666-R668 VanDerWaalsContact C-N 3.29Å; R668-D670 VanDerWaalsContact C-N 3.28Å; R668-D670 HydrophobicContact CB-CB 4.45Å; R668-D670 WeakPolarHBondContact CB-OD2 3.1Å; R668-D670 VanDerWaalsContact CD-OD2 3.28Å; R668-D670 WeakPolarHBondContact CD-OD2 3.1Å; R668-D670 PolarHBondContact O-N 3.06Å
669	G	72.8	Confident	65.1	Low	42 Å²	42	121.6 Å²	121.6	43%	0.433	56%	0.561	S	S	.	*	T	Hydrogen-bonded Turn	trans	71.3	18.4	-173.5	0	0	0	0	0	114.7	E665 L666 K671	E665-G669 PolarHBondContact O-N 2.61Å; L666-G669 PolarHBondContact O-N 3.5Å; G669-K671 PolarHBondContact O-N 3.3Å; G669-K671 VanDerWaalsContact O-N 3.15Å
670	D	58.2	Low	62.3	Low	115 Å²	115	120.5 Å²	120.5	62%	0.615	58%	0.577	S	S	*	*			trans	-66.8	109.4	-173	-88.7	-50.7	0	0	0	112.9	R668 K672	R668-D670 VanDerWaalsContact C-N 3.28Å; R668-D670 HydrophobicContact CB-CB 4.45Å; R668-D670 WeakPolarHBondContact CB-OD2 3.1Å; R668-D670 VanDerWaalsContact CD-OD2 3.28Å; R668-D670 WeakPolarHBondContact CD-OD2 3.1Å; R668-D670 PolarHBondContact O-N 3.06Å; D670-K672 PolarHBondContact O-N 3.1Å
671	K	51.9	Low	59.4	Low	174 Å²	174	125.8 Å²	125.8	76%	0.757	61%	0.614	S	S	*	*			trans	-71.2	90.8	178.3	-66.2	176.6	-177.1	171.5	0	111.2	G669 K673	G669-K671 PolarHBondContact O-N 3.3Å; G669-K671 VanDerWaalsContact O-N 3.15Å; K671-K673 PolarHBondContact O-N 3Å
672	K	41.5	Very low	56.6	Low	150 Å²	150	124.5 Å²	124.5	65%	0.652	62%	0.624	S	S	*	*			trans	-55.1	98.3	172.4	-89.5	176.8	175.5	164.8	0	112.1	E665 D670 S674	E665-K672 WeakPolarHBondContact OE1-CE 3.4Å; E665-K672 IonicContact OE1-NZ 2.65Å; E665-K672 PolarHBondContact OE1-NZ 3.04Å; E665-K672 WeakPolarHBondContact OE2-CE 3.48Å; E665-K672 IonicContact OE2-NZ 2.64Å; E665-K672 PolarHBondContact OE2-NZ 2.91Å; D670-K672 PolarHBondContact O-N 3.1Å; K672-S674 PolarHBondContact O-N 3.33Å
673	K	32.7	Very low	54.1	Low	197 Å²	197	131 Å²	131	86%	0.857	66%	0.656	S	S	*	*			trans	-72.4	103.9	169.2	-72.5	-178.7	177.9	176.6	0	109.9	K671 K675	K671-K673 PolarHBondContact O-N 3Å; K673-K675 PolarHBondContact O-N 3.25Å
674	S	34.8	Very low	51.2	Low	119 Å²	119	137.3 Å²	137.3	83%	0.832	69%	0.691	S	S	*	*			trans	-60.8	107.2	176.1	-56.1	0	0	0	0	112	K672 K676	K672-S674 PolarHBondContact O-N 3.33Å; S674-K676 PolarHBondContact O-N 3.05Å
675	K	33.9	Very low	48.6	Very low	214 Å²	214	137.8 Å²	137.8	93%	0.93	71%	0.711	S	S	*	*			trans	-77.1	119	171.9	-116.1	-178.4	178.7	-179.2	0	109.7	K673	K673-K675 PolarHBondContact O-N 3.25Å
676	K	34.9	Very low	45.8	Very low	179 Å²	179	141 Å²	141	78%	0.778	73%	0.731	S	S	*	*			trans	-93	124.1	-178.1	-172	175.4	179.7	179.6	0	111.5	S674	S674-K676 PolarHBondContact O-N 3.05Å
677	Q	31	Very low	43.3	Very low	165 Å²	165	146.2 Å²	146.2	77%	0.771	77%	0.765	S	S	*	*			trans	32.1	125.8	154.9	-61.1	169.2	-59.6	0	0	119.8
678	Q	32.8	Very low	40.6	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	79%	0.785	S	S	*	*			trans	-145.1	105.7	150.4	-152.3	169.5	33.5	0	0	114.4
679	R	30.2	Very low	38.3	Very low	230 Å²	230	145.4 Å²	145.4	87%	0.868	80%	0.799	S	S	*	*			trans	53.8	108.6	145.5	-56.4	170.3	83.6	176.2	7.6	120.5
680	S	36.3	Very low	36.5	Very low	128 Å²	128	150.5 Å²	150.5	90%	0.895	82%	0.816	S	S	*	*				-147.1	157.4	117.2	58.5	0	0	0	0	109.3
681	S	33.9	Very low	35.3	Very low	128 Å²	128	150.8 Å²	150.8	90%	0.895	83%	0.827	S	S	*	*			trans	-126.5	143.2	-163.3	50	0	0	0	0	113.2
682	G	34.8	Very low	34.5	Very low	71 Å²	71	147.7 Å²	147.7	73%	0.732	83%	0.827	S	S	*	*			trans	-165	67.8	-175.2	0	0	0	0	0	117.8
683	I	40.1	Very low	34.1	Very low	173 Å²	173	144 Å²	144	89%	0.887	83%	0.831	S	S	*	*			trans	71.8	155.7	153	-58.8	176.1	0	0	0	117.2
684	N	31.5	Very low	34.2	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	83%	0.833	S	S	*	*			trans	-107.8	154	-165.1	-51.8	-35.1	0	0	0	113.8
685	S	37.9	Very low	34	Very low	122 Å²	122	139.1 Å²	139.1	85%	0.853	83%	0.831	S	S	*	*			trans	-151.6	131.8	141.5	56.6	0	0	0	0	110.6
686	N	31.9	Very low	34.1	Very low	156 Å²	156	135.7 Å²	135.7	83%	0.834	83%	0.827	S	S	*	*			trans	-98.6	140.5	-179.4	-67.4	-24.6	0	0	0	110.8
687	T	36.2	Very low	33.8	Very low	155 Å²	155	130.8 Å²	130.8	95%	0.951	83%	0.827	S	S	*	*			trans	-160.9	145	138	23	0	0	0	0	110.2
688	S	31.7	Very low	33.8	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	83%	0.825	S	S	*	*			trans	-108.8	147.1	-176.4	52.8	0	0	0	0	112.7
689	A	35.7	Very low	33.6	Very low	104 Å²	104	129 Å²	129	86%	0.86	83%	0.827	S	S	*	*			trans	-133.2	153.3	167.8	0	0	0	0	0	110.8
690	L	34.6	Very low	33.6	Very low	150 Å²	150	124.1 Å²	124.1	79%	0.785	82%	0.823	S	S	*	*			trans	-110.1	147.8	-169.7	-88.5	64.8	0	0	0	112.8
691	S	32.5	Very low	33.3	Very low	121 Å²	121	123.3 Å²	123.3	85%	0.846	81%	0.812	S	S	*	*			trans	66.9	165.1	155.3	81.6	0	0	0	0	116.1
692	S	35.1	Very low	33.1	Very low	109 Å²	109	121.5 Å²	121.5	76%	0.762	81%	0.805	S	S	*	*			cis	-157.2	157.1	6.4	58.2	0	0	0	0	112.1
693	G	33	Very low	32.9	Very low	71 Å²	71	123 Å²	123	73%	0.732	80%	0.8	S	S	*	*			trans	95.8	132.8	146	0	0	0	0	0	118.1
694	P	34.8	Very low	32.5	Very low	138 Å²	138	120.8 Å²	120.8	90%	0.896	80%	0.795	S	S	*	*			trans	-96.5	152.8	179.2	37.1	-33.9	0	0	0	114.1
695	G	32.2	Very low	32.4	Very low	77 Å²	77	119.7 Å²	119.7	79%	0.794	79%	0.789	S	S	*	*			trans	-110.6	146	169.1	0	0	0	0	0	112.2
696	V	34.6	Very low	32	Very low	142 Å²	142	123.6 Å²	123.6	86%	0.861	79%	0.791	S	S	*	*			trans	-77.8	134.1	-176.8	178.3	0	0	0	0	111.3
697	G	28.7	Very low	32.1	Very low	75 Å²	75	121.4 Å²	121.4	77%	0.773	78%	0.783	S	S	*	*			trans	-114.8	117.3	172.7	0	0	0	0	0	112
698	T	30.4	Very low	31.7	Very low	118 Å²	118	117.7 Å²	117.7	72%	0.724	78%	0.775	S	S	*	*			trans	-103.8	109.3	175.3	-55.6	0	0	0	0	109.7	V700	T698-V700 HydrophobicContact CG2-CG2 4.21Å
699	Q	28.8	Very low	31.8	Very low	180 Å²	180	119.3 Å²	119.3	84%	0.841	77%	0.774	S	S	*	*			trans	-83.5	128.6	166.7	-73.7	-172.7	-20.5	0	0	109.9
700	V	31.3	Very low	31.5	Very low	128 Å²	128	126.9 Å²	126.9	78%	0.776	79%	0.792	S	S	*	*			trans	-109.4	92.5	172.8	-178.5	0	0	0	0	108.6	T698 A702	T698-V700 HydrophobicContact CG2-CG2 4.21Å; V700-A702 PolarHBondContact O-N 2.93Å
701	T	28.7	Very low	31.4	Very low	110 Å²	110	125.8 Å²	125.8	68%	0.675	79%	0.792	S	S	*	*			trans	-87.6	98.2	177.3	-49.4	0	0	0	0	109.9	T703	T701-T703 PolarHBondContact O-N 2.93Å; T701-T703 PolarHBondContact O-OG1 3.13Å
702	A	30.9	Very low	31.3	Very low	91 Å²	91	126 Å²	126	75%	0.752	79%	0.789	S	S	*	*			trans	-72.5	82.5	-178.2	0	0	0	0	0	112.3	V700 V704	V700-A702 PolarHBondContact O-N 2.93Å; A702-V704 PolarHBondContact O-N 3.04Å
703	T	29.8	Very low	31.1	Very low	101 Å²	101	126.9 Å²	126.9	62%	0.62	79%	0.791	S	S	*	*			trans	-81.8	103.7	179.2	-49.6	0	0	0	0	110.3	T701 N705	T701-T703 PolarHBondContact O-N 2.93Å; T701-T703 PolarHBondContact O-OG1 3.13Å; T703-N705 PolarHBondContact O-N 3.28Å
704	V	32.7	Very low	31	Very low	128 Å²	128	130.2 Å²	130.2	78%	0.776	79%	0.794	S	S	*	*			trans	-81	83.4	177.9	-175.2	0	0	0	0	110	A702 F706	A702-V704 PolarHBondContact O-N 3.04Å; V704-F706 PolarHBondContact O-N 3.09Å
705	N	29.1	Very low	30.7	Very low	126 Å²	126	129.8 Å²	129.8	67%	0.674	79%	0.788	S	S	*	*			trans	-70.9	114.9	172.6	-81.8	-9.6	0	0	0	110.8	T703 T707	T703-N705 PolarHBondContact O-N 3.28Å; N705-T707 VanDerWaalsContact C-N 3.34Å; N705-T707 PolarHBondContact O-N 3.48Å; N705-T707 VanDerWaalsContact O-N 3.13Å
706	F	30.1	Very low	30.6	Very low	203 Å²	203	133.3 Å²	133.3	89%	0.89	79%	0.787	S	S	*	*			trans	-83.4	76.8	171.4	-126.6	-84	0	0	0	110	V704 G708	V704-F706 PolarHBondContact O-N 3.09Å; F706-G708 PolarHBondContact O-N 3.13Å
707	T	33.8	Very low	30.3	Very low	111 Å²	111	132.6 Å²	132.6	68%	0.681	78%	0.782	S	S	*	*			trans	-78.1	110.4	171	50.9	0	0	0	0	109.9	N705	N705-T707 VanDerWaalsContact C-N 3.34Å; N705-T707 PolarHBondContact O-N 3.48Å; N705-T707 VanDerWaalsContact O-N 3.13Å
708	G	26.9	Very low	30.5	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	78%	0.783	S	S	*	*			trans	-64	147.4	162.6	0	0	0	0	0	110.7	F706	F706-G708 PolarHBondContact O-N 3.13Å
709	I	33.8	Very low	30.5	Very low	147 Å²	147	138.7 Å²	138.7	75%	0.754	79%	0.788	S	S	*	*			trans	-120	124.3	173.7	-61.5	175.1	0	0	0	107.1
710	E	29.9	Very low	30.6	Very low	263 Å²	263	134.9 Å²	134.9	100%	1.229	78%	0.783	S	S	*	*			trans	29.5	0	162.5	-57	-176.4	143.3	0	0	118.6

Retrieved 710 of 710 residues in 1397 ms (Link to these results)

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