A0A068JIX3_RAT Loading...

Estrogen receptor

The steroid hormones and their receptors are involved in the regulation of eukaryotic gene expression and affect cellular proliferation and differentiation in target tissues.

AlphaFold DB , UniProt , Accession A0A068JIX3, Species RAT (Rattus norvegicus, Rat), Gene Esr1, Length 618 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.9	Very low	34.5	Very low	236 Å²	236	126.7 Å²	126.7	100%	1.163	69%	0.694	S	S	*	*				0	138.6	0	-74.3	166.5	166.7	0	0	108.2	M3	M1-M3 PolarHBondContact O-N 2.74Å
2	T	24.5	Very low	37.3	Very low	137 Å²	137	122.4 Å²	122.4	84%	0.84	67%	0.667	S	S	*	*			trans	-78.3	114	176.7	42.7	0	0	0	0	110.2	T4	T2-T4 PolarHBondContact O-N 3.25Å
3	M	25.5	Very low	39.7	Very low	178 Å²	178	115.3 Å²	115.3	88%	0.877	63%	0.634	S	S	*	*			trans	-74.8	114.6	172.3	-77.8	-64.7	176.9	0	0	109.9	M1 L5	M1-M3 PolarHBondContact O-N 2.74Å; M3-L5 PolarHBondContact O-N 2.85Å
4	T	25.9	Very low	41.8	Very low	114 Å²	114	107.1 Å²	107.1	70%	0.699	59%	0.589	S	S	*	*			trans	-73.1	116.5	172.4	40	0	0	0	0	109.7	T2 H6	T2-T4 PolarHBondContact O-N 3.25Å; T4-H6 VanDerWaalsContact C-N 3.33Å; T4-H6 PolarHBondContact O-N 2.8Å
5	L	29.3	Very low	43.4	Very low	170 Å²	170	103.1 Å²	103.1	89%	0.89	57%	0.566	S	S	*	*			trans	-68.3	89.2	172.6	-79.6	164.8	0	0	0	110	M3 T7	M3-L5 PolarHBondContact O-N 2.85Å; L5-T7 PolarHBondContact O-N 3.43Å; L5-T7 VanDerWaalsContact O-N 3.13Å
6	H	28.3	Very low	45.4	Very low	162 Å²	162	104.3 Å²	104.3	75%	0.75	57%	0.566	S	S	*	*			trans	-71.8	101.8	168.2	-102	-72.7	0	0	0	109.9	T4 K8	T4-H6 VanDerWaalsContact C-N 3.33Å; T4-H6 PolarHBondContact O-N 2.8Å; H6-K8 PolarHBondContact O-N 2.81Å
7	T	30.8	Very low	47.5	Very low	138 Å²	138	101.7 Å²	101.7	85%	0.847	55%	0.55	S	S	*	.			trans	-71.2	67.2	166.1	41.3	0	0	0	0	110.9	L5	L5-T7 PolarHBondContact O-N 3.43Å; L5-T7 VanDerWaalsContact O-N 3.13Å
8	K	37.5	Very low	48.9	Very low	128 Å²	128	96.8 Å²	96.8	56%	0.557	52%	0.523	S	S	*	.	P	Polyproline II helix	trans	-57.4	139.1	158.5	-71.9	-174.2	179.4	-176.5	0	107.9	H6 D561	H6-K8 PolarHBondContact O-N 2.81Å; K8-D561 IonicContact NZ-OD2 2.73Å; K8-D561 PolarHBondContact NZ-OD2 3.2Å
9	A	42.6	Very low	50.3	Low	64 Å²	64	98.2 Å²	98.2	53%	0.529	53%	0.526	S	S	.	.	P	Polyproline II helix	trans	-66.8	146.5	167.4	0	0	0	0	0	109.6	M12	A9-M12 HydrophobicContact CB-CG 3.91Å; A9-M12 HydrophobicContact CB-SD 4.44Å; A9-M12 VanDerWaalsContact O-CG 3.24Å; A9-M12 WeakPolarHBondContact O-CG 3.47Å
10	S	46.6	Very low	51	Low	64 Å²	64	95.1 Å²	95.1	45%	0.448	52%	0.518	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	140.9	179.6	-166.7	0	0	0	0	111.2	L572	S10-L572 WeakPolarHBondContact OG-CD1 3.47Å
11	G	56.6	Low	50.8	Low	3 Å²	3	97.5 Å²	97.5	3%	0.031	53%	0.53	C	S	.	.	T	Hydrogen-bonded Turn	trans	74	17.6	176.6	0	0	0	0	0	115.1	L14 L15 E565	G11-L14 PolarHBondContact O-N 3.48Å; G11-L15 VanDerWaalsContact O-CB 3.24Å; G11-L15 WeakPolarHBondContact O-CB 3.47Å; G11-L15 WeakPolarHBondContact O-CD1 3.05Å; G11-L15 WeakPolarHBondContact O-CG 3.29Å; G11-L15 PolarHBondContact O-N 2.65Å; G11-E565 WeakPolarHBondContact CA-OE2 3.46Å
12	M	68.8	Low	51.1	Low	75 Å²	75	95.4 Å²	95.4	37%	0.369	52%	0.518	S	S	.	.	H	α-helix	trans	-67.7	-39.9	-179	-80.8	-67.2	-60.5	0	0	113	A9 L15 H16 E565	A9-M12 HydrophobicContact CB-CG 3.91Å; A9-M12 HydrophobicContact CB-SD 4.44Å; A9-M12 VanDerWaalsContact O-CG 3.24Å; A9-M12 WeakPolarHBondContact O-CG 3.47Å; M12-L15 PolarHBondContact O-N 2.73Å; M12-L15 HydrophobicContact SD-CD1 4.39Å; M12-H16 WeakPolarHBondContact O-CB 3.25Å; M12-H16 PolarHBondContact O-CD2 3.43Å; M12-H16 VanDerWaalsContact O-CD2 3.26Å; M12-H16 PolarHBondContact O-N 2.98Å; M12-E565 PolarHBondContact N-OE1 3.48Å; M12-E565 PolarHBondContact N-OE2 2.76Å; M12-E565 VanDerWaalsContact N-OE2 3.14Å
13	A	68.3	Low	51.7	Low	30 Å²	30	94.3 Å²	94.3	25%	0.248	51%	0.506	C	S	.	.	H	α-helix	trans	-66.8	-42.2	173.8	0	0	0	0	0	110.9	H16 Q17 E565	A13-H16 PolarHBondContact O-N 2.87Å; A13-Q17 WeakPolarHBondContact O-CB 3.43Å; A13-Q17 PolarHBondContact O-N 3.23Å; A13-E565 WeakPolarHBondContact CA-OE2 3.24Å; A13-E565 WeakPolarHBondContact CB-OE1 3.32Å; A13-E565 WeakPolarHBondContact CB-OE2 3.11Å; A13-E565 VanDerWaalsContact N-CD 3.3Å; A13-E565 PolarHBondContact N-OE1 3.47Å; A13-E565 PolarHBondContact N-OE2 2.84Å
14	L	68.9	Low	51.8	Low	1 Å²	1	94.1 Å²	94.1	1%	0.005	50%	0.503	C	S	.	.	H	α-helix	trans	-61	-45.3	174	178.2	62.3	0	0	0	111.9	G11 Q17 I18 I363 V381 L384 E385 L562 E565 M566	G11-L14 PolarHBondContact O-N 3.48Å; L14-Q17 PolarHBondContact O-N 3.41Å; L14-I18 HydrophobicContact CD1-CD1 3.84Å; L14-I18 HydrophobicContact CD1-CG1 4.19Å; L14-I18 HydrophobicContact CG-CD1 3.83Å; L14-I18 VanDerWaalsContact O-CG1 3.31Å; L14-I18 WeakPolarHBondContact O-CG1 3.34Å; L14-I18 PolarHBondContact O-N 3.25Å; L14-I363 HydrophobicContact CD1-CD1 3.63Å; L14-I363 HydrophobicContact CD1-CG1 3.94Å; L14-V381 HydrophobicContact CD2-CB 4.39Å; L14-V381 HydrophobicContact CD2-CG1 3.94Å; L14-V381 HydrophobicContact CD2-CG2 4.32Å; L14-V381 HydrophobicContact CG-CG2 4.43Å; L14-L384 HydrophobicContact CD1-CD1 4.33Å; L14-E385 HydrophobicContact CD2-CG 3.84Å; L14-L562 HydrophobicContact CB-CD1 4.28Å; L14-E565 PolarHBondContact N-OE2 2.74Å; L14-M566 HydrophobicContact CB-SD 4.44Å; L14-M566 HydrophobicContact CD1-SD 4Å; L14-M566 HydrophobicContact CD2-CE 4.45Å; L14-M566 HydrophobicContact CD2-SD 3.76Å; L14-M566 HydrophobicContact CG-SD 4.28Å
15	L	65.6	Low	52	Low	46 Å²	46	94.3 Å²	94.3	24%	0.241	51%	0.506	C	S	.	.	H	α-helix	trans	-60.2	-47.2	175.7	-80.8	165.1	0	0	0	111.6	G11 M12 Q17 I18 Q19 L377 V381	G11-L15 VanDerWaalsContact O-CB 3.24Å; G11-L15 WeakPolarHBondContact O-CB 3.47Å; G11-L15 WeakPolarHBondContact O-CD1 3.05Å; G11-L15 WeakPolarHBondContact O-CG 3.29Å; G11-L15 PolarHBondContact O-N 2.65Å; M12-L15 PolarHBondContact O-N 2.73Å; M12-L15 HydrophobicContact SD-CD1 4.39Å; L15-Q17 VanDerWaalsContact C-N 3.3Å; L15-Q17 PolarHBondContact O-N 3.01Å; L15-I18 PolarHBondContact O-N 2.7Å; L15-Q19 VanDerWaalsContact O-CB 3.3Å; L15-Q19 WeakPolarHBondContact O-CB 3.1Å; L15-Q19 VanDerWaalsContact O-CG 3.31Å; L15-Q19 WeakPolarHBondContact O-CG 3.34Å; L15-Q19 PolarHBondContact O-N 2.89Å; L15-L377 HydrophobicContact CD2-CD1 4.21Å; L15-L377 HydrophobicContact CD2-CD2 3.66Å; L15-L377 HydrophobicContact CD2-CG 3.76Å; L15-V381 HydrophobicContact CD2-CG2 3.68Å; L15-V381 HydrophobicContact CG-CG2 4.09Å
16	H	75.2	Confident	52	Low	122 Å²	122	94.3 Å²	94.3	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-59.2	-40.5	174.3	-91.2	-75	0	0	0	111.9	M12 A13 G20	M12-H16 WeakPolarHBondContact O-CB 3.25Å; M12-H16 PolarHBondContact O-CD2 3.43Å; M12-H16 VanDerWaalsContact O-CD2 3.26Å; M12-H16 PolarHBondContact O-N 2.98Å; A13-H16 PolarHBondContact O-N 2.87Å; H16-G20 WeakPolarHBondContact O-CA 3.28Å; H16-G20 PolarHBondContact O-N 3.14Å
17	Q	81.4	Confident	51.9	Low	61 Å²	61	93.9 Å²	93.9	29%	0.285	51%	0.509	S	S	.	.	H	α-helix	trans	-73.1	-29.7	-179.6	-160.2	64	16.4	0	0	113	A13 L14 L15 I363 K367	A13-Q17 WeakPolarHBondContact O-CB 3.43Å; A13-Q17 PolarHBondContact O-N 3.23Å; L14-Q17 PolarHBondContact O-N 3.41Å; L15-Q17 VanDerWaalsContact C-N 3.3Å; L15-Q17 PolarHBondContact O-N 3.01Å; Q17-I363 HydrophobicContact CB-CD1 4.01Å; Q17-I363 HydrophobicContact CB-CG2 4.41Å; Q17-I363 HydrophobicContact CG-CB 4.37Å; Q17-I363 HydrophobicContact CG-CD1 3.7Å; Q17-I363 HydrophobicContact CG-CG2 4.08Å; Q17-K367 PolarHBondContact O-NZ 3.18Å
18	I	72.3	Confident	51.7	Low	13 Å²	13	98.2 Å²	98.2	7%	0.067	51%	0.51	C	S	.	.	H	α-helix	trans	-76.2	-44.5	172.2	-63.7	162.9	0	0	0	110.8	L14 L15 G20 I363 K367 L377 V381 L384	L14-I18 HydrophobicContact CD1-CD1 3.84Å; L14-I18 HydrophobicContact CD1-CG1 4.19Å; L14-I18 HydrophobicContact CG-CD1 3.83Å; L14-I18 VanDerWaalsContact O-CG1 3.31Å; L14-I18 WeakPolarHBondContact O-CG1 3.34Å; L14-I18 PolarHBondContact O-N 3.25Å; L15-I18 PolarHBondContact O-N 2.7Å; I18-G20 VanDerWaalsContact C-N 3.29Å; I18-G20 PolarHBondContact O-N 2.54Å; I18-I363 HydrophobicContact CG1-CG2 3.78Å; I18-K367 WeakPolarHBondContact O-CE 3.44Å; I18-K367 PolarHBondContact O-NZ 3.32Å; I18-L377 HydrophobicContact CB-CD1 4.03Å; I18-L377 HydrophobicContact CD1-CD1 4.45Å; I18-L377 HydrophobicContact CG2-CD1 3.4Å; I18-V381 HydrophobicContact CD1-CB 4.48Å; I18-V381 HydrophobicContact CD1-CG2 3.57Å; I18-L384 HydrophobicContact CD1-CD1 3.83Å; I18-L384 HydrophobicContact CG1-CD1 4.15Å
19	Q	75	Confident	51.3	Low	124 Å²	124	97.6 Å²	97.6	58%	0.579	52%	0.519	S	S	*	.	H	α-helix	trans	-72	-21.4	178.4	-69.6	-179.6	-20.1	0	0	113.4	L15 N21 L377	L15-Q19 VanDerWaalsContact O-CB 3.3Å; L15-Q19 WeakPolarHBondContact O-CB 3.1Å; L15-Q19 VanDerWaalsContact O-CG 3.31Å; L15-Q19 WeakPolarHBondContact O-CG 3.34Å; L15-Q19 PolarHBondContact O-N 2.89Å; Q19-N21 PolarHBondContact O-N 3.15Å; Q19-N21 VanDerWaalsContact O-N 3.13Å; Q19-L377 HydrophobicContact CG-CD2 3.85Å
20	G	64.6	Low	50.4	Low	35 Å²	35	103 Å²	103	36%	0.361	53%	0.534	S	S	.	.			trans	-61.4	110.5	173.6	0	0	0	0	0	111.8	H16 I18 K367	H16-G20 WeakPolarHBondContact O-CA 3.28Å; H16-G20 PolarHBondContact O-N 3.14Å; I18-G20 VanDerWaalsContact C-N 3.29Å; I18-G20 PolarHBondContact O-N 2.54Å; G20-K367 PolarHBondContact O-NZ 3.34Å
21	N	47.1	Very low	49.4	Very low	147 Å²	147	107.8 Å²	107.8	79%	0.786	55%	0.553	S	S	*	*			trans	-85.9	156	154.8	-84.3	-13.4	0	0	0	109.4	Q19	Q19-N21 PolarHBondContact O-N 3.15Å; Q19-N21 VanDerWaalsContact O-N 3.13Å
22	E	39.4	Very low	48	Very low	192 Å²	192	116.5 Å²	116.5	90%	0.897	59%	0.59	S	S	*	*			trans	70	105.5	176.4	-46.5	-156.2	151.5	0	0	115.4
23	L	36.8	Very low	46	Very low	114 Å²	114	120.9 Å²	120.9	60%	0.597	61%	0.612	S	S	*	*			trans	-81.8	138.8	148.9	-70.2	167.1	0	0	0	107.1
24	E	26.8	Very low	44	Very low	174 Å²	174	125.1 Å²	125.1	81%	0.813	64%	0.637	S	S	*	*			trans	-56.4	131.5	168.1	-82.2	-164.2	109.6	0	0	110.2	L26	E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.5Å
25	P	30.6	Very low	42	Very low	118 Å²	118	133.4 Å²	133.4	77%	0.766	68%	0.678	S	S	*	*			trans	-73.1	91.3	171.2	30.2	-32.7	0	0	0	109.1	N27	P25-N27 PolarHBondContact O-N 3.03Å
26	L	28	Very low	40.3	Very low	170 Å²	170	139.5 Å²	139.5	89%	0.89	71%	0.705	S	S	*	*			trans	-63	80.9	170.1	-89.6	170.7	0	0	0	110.5	E24 R28	E24-L26 VanDerWaalsContact C-N 3.34Å; E24-L26 PolarHBondContact O-N 3.5Å; L26-R28 PolarHBondContact O-N 3.02Å; L26-R28 VanDerWaalsContact O-N 3.09Å
27	N	27.7	Very low	37.9	Very low	152 Å²	152	145.5 Å²	145.5	81%	0.813	72%	0.723	S	S	*	*			trans	-81	91.5	-169.4	-166.3	-2.8	0	0	0	110.8	P25	P25-N27 PolarHBondContact O-N 3.03Å
28	R	26.9	Very low	35.2	Very low	229 Å²	229	147.2 Å²	147.2	86%	0.864	75%	0.747	S	S	*	*			trans	-125.3	144.7	164.5	-99.5	-173.2	167.1	-176.7	-3.5	110.7	L26	L26-R28 PolarHBondContact O-N 3.02Å; L26-R28 VanDerWaalsContact O-N 3.09Å
29	P	27.7	Very low	33.1	Very low	115 Å²	115	155.5 Å²	155.5	75%	0.747	79%	0.79	S	S	*	*			trans	-75	145.5	-162.1	29.2	-36	0	0	0	113.5	L31	P29-L31 PolarHBondContact O-N 3.04Å
30	Q	24.9	Very low	30.8	Very low	178 Å²	178	152.9 Å²	152.9	83%	0.832	80%	0.797	S	S	*	*			trans	-66.8	111.6	169.8	-70.8	-175	-10.9	0	0	110.9	K32	Q30-K32 PolarHBondContact O-N 3.24Å
31	L	25.1	Very low	28.9	Very low	165 Å²	165	160.8 Å²	160.8	86%	0.864	82%	0.824	S	S	*	*			trans	-77.3	100.2	160.6	-83.4	165.6	0	0	0	109.2	P29 M33	P29-L31 PolarHBondContact O-N 3.04Å; L31-M33 PolarHBondContact O-N 3.09Å
32	K	26.8	Very low	28	Very low	185 Å²	185	159.7 Å²	159.7	80%	0.804	82%	0.823	S	S	*	*			trans	-66.6	122.6	166.3	-74.6	-177.5	175.3	179.8	0	109.5	Q30	Q30-K32 PolarHBondContact O-N 3.24Å
33	M	26.6	Very low	27.4	Very low	168 Å²	168	161.7 Å²	161.7	83%	0.828	82%	0.824	S	S	*	*			trans	-128.8	141.6	161.1	-83.3	-65.4	-62.4	0	0	109.3	L31	L31-M33 PolarHBondContact O-N 3.09Å
34	P	27	Very low	27.2	Very low	118 Å²	118	162 Å²	162	77%	0.766	83%	0.83	S	S	*	*			trans	-82.6	147.5	-172.3	-9.4	28.1	0	0	0	112.6
35	M	26.2	Very low	27.1	Very low	176 Å²	176	161.3 Å²	161.3	87%	0.867	83%	0.832	S	S	*	*			trans	-93.7	112.6	165.4	-177.9	-175.6	78.4	0	0	109
36	E	29.5	Very low	26.9	Very low	174 Å²	174	162.6 Å²	162.6	81%	0.813	83%	0.832	S	S	*	*			trans	172.9	115.7	147.5	-104.2	177.1	-158.8	0	0	113.1
37	R	25.1	Very low	26.9	Very low	248 Å²	248	159.8 Å²	159.8	94%	0.936	83%	0.827	S	S	*	*			trans	-165.2	145.9	130.3	-118.4	178.4	-178.4	78.8	-0.1	111.6
38	A	25.9	Very low	26.9	Very low	97 Å²	97	162.1 Å²	162.1	80%	0.802	83%	0.83	S	S	*	*			trans	-79.4	155.9	176.5	0	0	0	0	0	112.1
39	L	27.6	Very low	27.3	Very low	186 Å²	186	156.8 Å²	156.8	97%	0.974	83%	0.825	S	S	*	*			trans	-73.3	135.9	169.1	-73.2	163.2	0	0	0	110.2
40	G	25.9	Very low	27.2	Very low	69 Å²	69	156.3 Å²	156.3	71%	0.711	83%	0.83	S	S	*	*			trans	-160.2	88.2	-176.7	0	0	0	0	0	113.6
41	E	26.4	Very low	27.3	Very low	201 Å²	201	153.2 Å²	153.2	94%	0.939	82%	0.823	S	S	*	*			trans	58	174.1	161.2	-57.6	-158.9	132.9	0	0	119.5
42	V	27.7	Very low	27.4	Very low	124 Å²	124	154 Å²	154	75%	0.752	82%	0.82	S	S	*	*			trans	-127.9	133.6	-160.1	177.2	0	0	0	0	110.1
43	Y	27.2	Very low	27.4	Very low	234 Å²	234	151.5 Å²	151.5	92%	0.918	82%	0.816	S	S	*	*			trans	-146.7	153.2	149.4	-128.9	-89.7	0	0	0	110.6
44	V	31.2	Very low	27.5	Very low	120 Å²	120	154.4 Å²	154.4	73%	0.727	82%	0.819	S	S	*	*			trans	-120.7	127.4	-179.6	176.6	0	0	0	0	108.6
45	D	25	Very low	28	Very low	161 Å²	161	154.4 Å²	154.4	86%	0.861	82%	0.819	S	S	*	*			trans	-152.7	-179.1	146.8	-145.6	-21.1	0	0	0	110.8
46	N	27.3	Very low	28.1	Very low	144 Å²	144	155.4 Å²	155.4	77%	0.77	82%	0.822	S	S	*	*			trans	-113.9	-177.5	-144.6	-157.1	-7.2	0	0	0	114.1
47	S	27.3	Very low	28.2	Very low	111 Å²	111	150.4 Å²	150.4	78%	0.776	82%	0.816	S	S	*	*			trans	88.6	140.8	167.8	80	0	0	0	0	119.3
48	K	27.8	Very low	28.3	Very low	201 Å²	201	143.9 Å²	143.9	87%	0.874	82%	0.815	S	S	*	*			trans	-117.7	177.8	176.1	-70.3	-179.8	176.3	178.5	0	107.9
49	P	35	Very low	28.4	Very low	118 Å²	118	143.3 Å²	143.3	77%	0.766	81%	0.811	S	S	*	*			cis	-126.9	172.4	-13.5	27.2	-6.8	0	0	0	113.9
50	A	26.3	Very low	28.5	Very low	104 Å²	104	145.1 Å²	145.1	86%	0.86	81%	0.806	S	S	*	*			trans	-140.2	152.1	152	0	0	0	0	0	109.9
51	V	26.8	Very low	28.5	Very low	113 Å²	113	149.6 Å²	149.6	69%	0.685	81%	0.809	S	S	*	*			trans	-126.3	145.6	-173.8	171.5	0	0	0	0	108.3
52	F	26.7	Very low	28.5	Very low	182 Å²	182	149.9 Å²	149.9	80%	0.798	81%	0.807	S	S	*	*				174.6	128.4	125.7	-100.8	-73.5	0	0	0	114.7
53	N	27.9	Very low	28.7	Very low	133 Å²	133	150 Å²	150	71%	0.711	80%	0.804	S	S	*	*			trans	22.6	138.2	154.4	-59.6	7.6	0	0	0	123.4
54	Y	28.1	Very low	28.8	Very low	229 Å²	229	143.1 Å²	143.1	90%	0.898	80%	0.795	S	S	*	*			trans	-105.3	159.9	140.5	-106.2	-111.4	0	0	0	109.5
55	P	36.3	Very low	28.7	Very low	117 Å²	117	142.6 Å²	142.6	76%	0.76	80%	0.804	S	S	*	*			trans	-91.4	162.5	-170.9	36.1	-36.4	0	0	0	115.4
56	E	29.7	Very low	28.9	Very low	198 Å²	198	140.1 Å²	140.1	93%	0.925	81%	0.805	S	S	*	*			trans	-70.2	162.9	165.3	-58.9	164.1	122.4	0	0	111.1
57	G	30.1	Very low	28.9	Very low	68 Å²	68	138.3 Å²	138.3	70%	0.701	81%	0.811	S	S	*	*			cis	169.8	-174.1	-1.9	0	0	0	0	0	112.2
58	A	28.6	Very low	29	Very low	111 Å²	111	138.1 Å²	138.1	92%	0.917	82%	0.816	S	S	*	*			trans	71	132.1	179.7	0	0	0	0	0	116.3
59	A	27.9	Very low	29	Very low	86 Å²	86	133.5 Å²	133.5	71%	0.711	82%	0.815	S	S	*	*			cis	-155.1	-171	-5.8	0	0	0	0	0	108.3
60	Y	29.3	Very low	28.6	Very low	223 Å²	223	132.5 Å²	132.5	88%	0.875	82%	0.817	S	S	*	*			cis	-147	-161.4	8.8	30.5	-115.4	0	0	0	111.6
61	E	26.5	Very low	28.8	Very low	163 Å²	163	132.9 Å²	132.9	76%	0.762	82%	0.82	S	S	*	*			trans	-81.3	151.2	-159.4	-55.2	169.2	114.4	0	0	117.4
62	F	26.6	Very low	28.8	Very low	207 Å²	207	130.8 Å²	130.8	91%	0.908	82%	0.821	S	S	*	*				-152.8	130.8	120.4	-138.3	-91.1	0	0	0	111
63	N	30.6	Very low	29	Very low	127 Å²	127	127.2 Å²	127.2	68%	0.679	83%	0.825	S	S	*	*			trans	-82.2	141.5	175.9	-74.5	-48.4	0	0	0	110.2
64	A	29.9	Very low	29.1	Very low	89 Å²	89	126.5 Å²	126.5	74%	0.736	83%	0.831	S	S	*	*			cis	77.2	98.9	40.8	0	0	0	0	0	114.1
65	A	29.5	Very low	29.1	Very low	110 Å²	110	119.8 Å²	119.8	91%	0.909	82%	0.823	S	S	*	*			trans	-156.7	131.8	159.8	0	0	0	0	0	110
66	A	29.8	Very low	29.6	Very low	108 Å²	108	120.1 Å²	120.1	89%	0.893	83%	0.825	S	S	*	*			trans	-133.1	134.5	168.3	0	0	0	0	0	108.6
67	A	27.1	Very low	29.7	Very low	107 Å²	107	116.1 Å²	116.1	88%	0.884	81%	0.814	S	S	*	*			trans	-148.3	151	177.4	0	0	0	0	0	110.2
68	A	27.9	Very low	29.7	Very low	106 Å²	106	123.5 Å²	123.5	88%	0.876	82%	0.822	S	S	*	*			trans	-100.1	173.4	-170	0	0	0	0	0	113.7
69	A	28.1	Very low	29.7	Very low	104 Å²	104	121.4 Å²	121.4	86%	0.86	81%	0.811	S	S	*	*			trans	-80.1	156.7	-171.4	0	0	0	0	0	115.4
70	A	27.1	Very low	29.9	Very low	97 Å²	97	126.1 Å²	126.1	80%	0.802	82%	0.819	S	S	*	*			trans	-158.6	144.3	155.6	0	0	0	0	0	111.9
71	A	29.8	Very low	29.9	Very low	113 Å²	113	120.7 Å²	120.7	93%	0.934	81%	0.813	S	S	*	*			trans	62	147	172.9	0	0	0	0	0	118.3
72	G	27	Very low	30	Very low	69 Å²	69	118 Å²	118	71%	0.711	81%	0.812	S	S	*	*			cis	168.2	145.6	-10.3	0	0	0	0	0	113.4
73	A	30.8	Very low	30.3	Very low	107 Å²	107	115.5 Å²	115.5	88%	0.884	81%	0.807	S	S	*	*			trans	66.7	149.3	-179.7	0	0	0	0	0	116.1
74	S	31.2	Very low	30.1	Very low	118 Å²	118	115.7 Å²	115.7	83%	0.825	81%	0.812	S	S	*	*			cis	-150.8	154.9	-3.8	41.3	0	0	0	0	111.8
75	A	28.3	Very low	30.2	Very low	88 Å²	88	122.9 Å²	122.9	73%	0.727	82%	0.822	S	S	*	*			trans	-81.4	177.1	172.4	0	0	0	0	0	111.6
76	P	45.7	Very low	30.3	Very low	124 Å²	124	120.4 Å²	120.4	81%	0.805	81%	0.808	S	S	*	*			cis	-140.9	-166.6	47.4	34.8	-11.5	0	0	0	114.9
77	V	31.6	Very low	31.3	Very low	114 Å²	114	122.2 Å²	122.2	69%	0.691	81%	0.81	S	S	*	*			cis	-162	168.6	-44.2	152	0	0	0	0	106.5
78	Y	31.5	Very low	31.3	Very low	223 Å²	223	120.9 Å²	120.9	88%	0.875	81%	0.807	S	S	*	*			trans	83.8	125.2	178.9	-71.3	-78.7	0	0	0	117
79	G	28.6	Very low	31.5	Very low	67 Å²	67	121.4 Å²	121.4	69%	0.691	80%	0.804	S	S	*	*			cis	175.3	150.6	-10.9	0	0	0	0	0	115.1
80	Q	30.4	Very low	31.7	Very low	185 Å²	185	125.7 Å²	125.7	86%	0.864	81%	0.806	S	S	*	*			trans	35.1	136.6	145	-86.9	170.3	-22.7	0	0	120.9
81	S	30.7	Very low	31.8	Very low	109 Å²	109	125.7 Å²	125.7	76%	0.762	81%	0.806	S	S	*	*			cis	-152.4	171.9	25	-83.7	0	0	0	0	114.4
82	S	28.3	Very low	31.9	Very low	105 Å²	105	125.1 Å²	125.1	73%	0.734	80%	0.802	S	S	*	*			trans	-70	169	169.7	53.2	0	0	0	0	113.2
83	I	31.6	Very low	32	Very low	156 Å²	156	126.1 Å²	126.1	80%	0.8	80%	0.803	S	S	*	*				-161.7	154.1	84.3	-86.7	163.6	0	0	0	111.1
84	T	28.3	Very low	32.1	Very low	130 Å²	130	131.3 Å²	131.3	80%	0.798	81%	0.807	S	S	*	*			trans	-132.4	124.7	175.2	-50.7	0	0	0	0	111.6
85	Y	32.2	Very low	31.9	Very low	240 Å²	240	129.3 Å²	129.3	94%	0.941	80%	0.804	S	S	*	*			trans	-177.9	158.9	158.7	-94.5	-70.7	0	0	0	105.5
86	G	30.4	Very low	32.1	Very low	59 Å²	59	130.1 Å²	130.1	61%	0.608	81%	0.811	S	S	*	*			cis	161.2	135.2	1.6	0	0	0	0	0	107.3
87	P	51.3	Low	31.3	Very low	145 Å²	145	131.3 Å²	131.3	94%	0.942	81%	0.811	S	S	*	*			trans	-82.5	152.5	-167.8	32.5	-36	0	0	0	114.2
88	G	27.1	Very low	31.2	Very low	79 Å²	79	130.9 Å²	130.9	81%	0.814	81%	0.812	S	S	*	*			trans	-164.4	158	175.1	0	0	0	0	0	112
89	S	32	Very low	31.2	Very low	118 Å²	118	127.9 Å²	127.9	83%	0.825	81%	0.811	S	S	*	*			trans	-122.6	-174.9	-166.8	-58.9	0	0	0	0	112.9
90	E	31	Very low	31.3	Very low	193 Å²	193	128.2 Å²	128.2	90%	0.902	81%	0.814	S	S	*	*			trans	79.3	161.7	167.7	-53.3	-177.2	174.9	0	0	117.5
91	A	30.3	Very low	31.2	Very low	97 Å²	97	124.4 Å²	124.4	80%	0.802	81%	0.814	S	S	*	*			cis	-173.3	121.7	-47.6	0	0	0	0	0	110.7
92	A	31.3	Very low	31.1	Very low	102 Å²	102	129 Å²	129	84%	0.843	82%	0.821	S	S	*	*			trans	-168.7	138.4	159.2	0	0	0	0	0	109.9
93	A	29.6	Very low	31.8	Very low	89 Å²	89	129.4 Å²	129.4	74%	0.736	82%	0.821	S	S	*	*			cis	111.8	67.8	9.8	0	0	0	0	0	116.4
94	F	32.4	Very low	31.7	Very low	217 Å²	217	130 Å²	130	95%	0.952	82%	0.82	S	S	*	*			trans	-158.1	137.1	151	-77.4	-77.9	0	0	0	105.4
95	G	28	Very low	31.8	Very low	75 Å²	75	130.8 Å²	130.8	77%	0.773	82%	0.819	S	S	*	*			cis	108.9	128.4	10.8	0	0	0	0	0	110.7
96	A	31.1	Very low	31.6	Very low	105 Å²	105	127 Å²	127	87%	0.868	82%	0.815	S	S	*	*			cis	-165	-174	-14.7	0	0	0	0	0	106.9
97	N	29.8	Very low	31.4	Very low	150 Å²	150	129 Å²	129	80%	0.802	82%	0.82	S	S	*	*			cis	-164.9	143.8	-0.6	-177	11.9	0	0	0	108.7
98	S	29.2	Very low	30.3	Very low	104 Å²	104	128.9 Å²	128.9	73%	0.727	82%	0.816	S	S	*	*			trans	-169.9	112.2	153.8	-177.4	0	0	0	0	114.8
99	L	31.6	Very low	30.3	Very low	161 Å²	161	130.4 Å²	130.4	84%	0.843	81%	0.814	S	S	*	*			trans	10.8	132.5	141.9	-51.9	170.4	0	0	0	119.2
100	G	29.8	Very low	30.7	Very low	73 Å²	73	130.3 Å²	130.3	75%	0.753	81%	0.81	S	S	*	*			cis	167.5	-165.9	-1.8	0	0	0	0	0	114.3
101	A	28.2	Very low	30.9	Very low	105 Å²	105	126.4 Å²	126.4	87%	0.868	80%	0.804	S	S	*	*			trans	78.6	128.6	173.3	0	0	0	0	0	120.4
102	F	30.5	Very low	31	Very low	207 Å²	207	128 Å²	128	91%	0.908	81%	0.807	S	S	*	*			trans	-131	168.9	164.8	-81.4	-70.1	0	0	0	106.3
103	P	42.4	Very low	31	Very low	112 Å²	112	131.3 Å²	131.3	73%	0.727	81%	0.809	S	S	*	*			cis	-147.4	169.3	27.5	43	-22.3	0	0	0	119.9
104	Q	28.4	Very low	31.1	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	82%	0.816	S	S	*	*			trans	43.1	121.1	142.2	-66.3	-173.2	3	0	0	125
105	L	31.6	Very low	31	Very low	148 Å²	148	133 Å²	133	78%	0.775	81%	0.811	S	S	*	*				50.6	117.8	124	-59.4	168.8	0	0	0	122.3
106	N	26.9	Very low	31	Very low	161 Å²	161	136.9 Å²	136.9	86%	0.861	81%	0.814	S	S	*	*				-171.9	156.5	119.4	-107.6	-36.1	0	0	0	116.5
107	S	27.6	Very low	30.9	Very low	101 Å²	101	140.4 Å²	140.4	71%	0.706	81%	0.812	S	S	*	*			trans	48.7	103.8	151.7	62.7	0	0	0	0	124.6
108	V	27.6	Very low	31.2	Very low	142 Å²	142	138.5 Å²	138.5	86%	0.861	81%	0.808	S	S	*	*				49.3	115.8	118.2	-178.3	0	0	0	0	122.5
109	S	28.2	Very low	31.5	Very low	111 Å²	111	139 Å²	139	78%	0.776	81%	0.809	S	S	*	*			trans	69.9	158.2	149.6	-144.6	0	0	0	0	118.9
110	P	39.8	Very low	31.7	Very low	116 Å²	116	137.3 Å²	137.3	75%	0.753	81%	0.807	S	S	*	*			cis	-124	-163.3	-1.2	43.6	-27.9	0	0	0	114.9
111	S	34.9	Very low	31.7	Very low	111 Å²	111	142.5 Å²	142.5	78%	0.776	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-64	148.2	-172.9	-42.8	0	0	0	0	116.9
112	P	33.1	Very low	31.8	Very low	130 Å²	130	145.3 Å²	145.3	84%	0.844	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-86.7	164.4	163.4	35.8	-33.5	0	0	0	113.1
113	L	29.7	Very low	31.7	Very low	171 Å²	171	141 Å²	141	90%	0.895	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-93.6	160.6	-170.7	-70.4	163	0	0	0	114.4
114	M	31.9	Very low	31.5	Very low	178 Å²	178	141.1 Å²	141.1	88%	0.877	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-61.3	132.3	169	-81.3	-76.7	-179.3	0	0	112.1
115	L	29.9	Very low	31.5	Very low	163 Å²	163	142.8 Å²	142.8	85%	0.853	81%	0.812	S	S	*	*			trans	-113.3	109.6	170.7	-108.2	163.7	0	0	0	109.5
116	L	28.3	Very low	31.4	Very low	158 Å²	158	143.6 Å²	143.6	83%	0.827	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.9	133.3	175.1	-78	81.6	0	0	0	110.4
117	H	29.2	Very low	31.7	Very low	179 Å²	179	143.6 Å²	143.6	83%	0.829	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-84.9	143.2	162.9	-90.1	81.3	0	0	0	110.8
118	P	36.1	Very low	32.1	Very low	110 Å²	110	144.8 Å²	144.8	71%	0.714	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-80.6	153.4	175.5	33.3	-34.9	0	0	0	112.4
119	P	35	Very low	32.2	Very low	115 Å²	115	145.7 Å²	145.7	75%	0.747	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-77.4	158.3	173.3	33.2	-35.4	0	0	0	112.5
120	P	36.8	Very low	32.2	Very low	124 Å²	124	143.9 Å²	143.9	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-72.9	148	179.4	30.3	-35.4	0	0	0	113.1
121	Q	30.7	Very low	31.8	Very low	183 Å²	183	147.3 Å²	147.3	86%	0.855	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-76.4	142	175.3	-69.4	-76.6	2.6	0	0	111.7
122	L	30.1	Very low	31.5	Very low	164 Å²	164	151.1 Å²	151.1	86%	0.859	82%	0.821	S	S	*	*			trans	-124.1	143	166.7	-74.7	173.4	0	0	0	110
123	S	28.1	Very low	31.2	Very low	117 Å²	117	151.3 Å²	151.3	82%	0.818	82%	0.819	S	S	*	*			trans	-81.4	153.4	-170.7	41.5	0	0	0	0	113.6
124	P	38.5	Very low	31.4	Very low	113 Å²	113	148.8 Å²	148.8	73%	0.734	81%	0.813	S	S	*	*			trans	-98.9	134.8	-166.2	35.7	-33.1	0	0	0	114.2
125	F	28	Very low	31.2	Very low	203 Å²	203	151.3 Å²	151.3	89%	0.89	81%	0.814	S	S	*	*			trans	-154.9	139.8	152.7	-99.6	-68.4	0	0	0	113
126	L	29.1	Very low	31.1	Very low	165 Å²	165	153.6 Å²	153.6	86%	0.864	81%	0.813	S	S	*	*			trans	72.1	129.1	165.6	-59.7	171.3	0	0	0	120
127	H	32.5	Very low	31.2	Very low	161 Å²	161	154 Å²	154	75%	0.745	82%	0.815	S	S	*	*			trans	-90.7	167.2	165.5	-83.6	24.3	0	0	0	111.1
128	P	36.7	Very low	31	Very low	126 Å²	126	153 Å²	153	82%	0.818	81%	0.811	S	S	*	*				-136.3	166.8	105.2	37	-26.4	0	0	0	114.8
129	H	30.3	Very low	30.5	Very low	162 Å²	162	155.9 Å²	155.9	75%	0.75	82%	0.82	S	S	*	*			trans	-84.6	150.9	-169.7	-57.2	-93.8	0	0	0	114.7
130	G	27.2	Very low	30.3	Very low	73 Å²	73	158.4 Å²	158.4	75%	0.753	82%	0.822	S	S	*	*			trans	-125.2	135.1	158.1	0	0	0	0	0	110.6
131	H	31.4	Very low	30.4	Very low	187 Å²	187	157 Å²	157	87%	0.866	81%	0.813	S	S	*	*			trans	-92	138.6	173.3	-75.1	15.3	0	0	0	110.5
132	Q	28.9	Very low	30.2	Very low	191 Å²	191	153.5 Å²	153.5	89%	0.893	81%	0.809	S	S	*	*			trans	-110.6	151.7	170.8	-71	-173.1	-8	0	0	110.9
133	V	26.2	Very low	30	Very low	134 Å²	134	149.1 Å²	149.1	81%	0.812	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-96.1	128	-179.5	-179.6	0	0	0	0	109.3
134	P	34.1	Very low	30.1	Very low	118 Å²	118	153.9 Å²	153.9	77%	0.766	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-71.1	146.6	176.4	-18	32	0	0	0	113.2
135	Y	27.5	Very low	29.7	Very low	231 Å²	231	152.9 Å²	152.9	91%	0.906	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-78.9	152.7	164	-88.7	-109.3	0	0	0	110.7
136	Y	27.6	Very low	29.7	Very low	211 Å²	211	149.8 Å²	149.8	83%	0.827	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-100.4	148.8	170.2	-130.5	-96.7	0	0	0	110.3	E138	Y136-E138 HydrophobicContact CD1-CG 4.24Å
137	L	30.2	Very low	29.8	Very low	166 Å²	166	151.6 Å²	151.6	87%	0.869	79%	0.792	S	S	*	*			trans	-147.1	114.7	176	-143.3	169.2	0	0	0	107.5
138	E	25.6	Very low	29.5	Very low	160 Å²	160	149.2 Å²	149.2	75%	0.748	78%	0.784	S	S	*	*			trans	-92.7	136.7	-174.9	-69.5	173.5	99.6	0	0	111.8	Y136	Y136-E138 HydrophobicContact CD1-CG 4.24Å
139	N	26.9	Very low	29.2	Very low	169 Å²	169	149.8 Å²	149.8	90%	0.904	79%	0.786	S	S	*	*			trans	-165	134.8	135.2	-100.4	-29	0	0	0	112
140	E	29.1	Very low	29.1	Very low	169 Å²	169	145.4 Å²	145.4	79%	0.79	78%	0.784	S	S	*	*			trans	-53.2	176.8	175.3	-71.8	-73.6	88.5	0	0	116.3
141	P	39.8	Very low	29.8	Very low	95 Å²	95	147.9 Å²	147.9	62%	0.617	79%	0.787	S	S	*	*			cis	-139.2	171.7	-33.9	34.8	-18.1	0	0	0	114.3
142	S	26.3	Very low	30.7	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	78%	0.781	S	S	*	*				153.9	121.3	125	-69.9	0	0	0	0	117.5
143	A	25.1	Very low	30.8	Very low	72 Å²	72	139.3 Å²	139.3	60%	0.595	77%	0.772	S	S	*	*			trans	71.1	154.8	134.6	0	0	0	0	0	123.6
144	Y	31.5	Very low	30.9	Very low	218 Å²	218	143.4 Å²	143.4	86%	0.855	78%	0.779	S	S	*	*			trans	68.4	107.9	172.2	-43	-69.2	0	0	0	115.6
145	A	30	Very low	30.6	Very low	92 Å²	92	147.4 Å²	147.4	76%	0.76	78%	0.781	S	S	*	*				73.2	136.4	71.6	0	0	0	0	0	113.2
146	V	28.4	Very low	30.7	Very low	137 Å²	137	147.6 Å²	147.6	83%	0.83	78%	0.78	S	S	*	*			cis	-153.3	-173.2	1	107	0	0	0	0	110.9
147	R	29.7	Very low	30.7	Very low	203 Å²	203	142.4 Å²	142.4	77%	0.766	78%	0.775	S	S	*	*			trans	-46.5	174.8	178.8	-51.5	167.1	144.7	-88.9	-5.2	116.3
148	D	27.1	Very low	30.4	Very low	111 Å²	111	142.3 Å²	142.3	59%	0.594	78%	0.775	S	S	*	*			cis	-166.9	-176.5	24.4	-141.5	-41	0	0	0	114.7
149	T	29.6	Very low	31	Very low	138 Å²	138	139.3 Å²	139.3	85%	0.847	77%	0.772	S	S	*	*			trans	75	160.1	162.3	58.4	0	0	0	0	119.8
150	G	28.1	Very low	31.5	Very low	70 Å²	70	138.3 Å²	138.3	72%	0.722	77%	0.766	S	S	*	*			trans	-141.8	-114.6	-165.7	0	0	0	0	0	117.9
151	P	43.3	Very low	31.7	Very low	125 Å²	125	135.5 Å²	135.5	81%	0.812	76%	0.757	S	S	*	*				-111	-163.9	-128.7	46	-38.4	0	0	0	112.9
152	P	49	Very low	31.4	Very low	114 Å²	114	140.3 Å²	140.3	74%	0.74	76%	0.762	S	S	*	*			cis	-142.6	178.2	2.4	44.7	-26.3	0	0	0	118.2
153	A	31.3	Very low	31.8	Very low	85 Å²	85	144.7 Å²	144.7	70%	0.702	76%	0.763	S	S	*	*			trans	53.1	132.2	140.2	0	0	0	0	0	123.8
154	F	28.6	Very low	32.4	Very low	219 Å²	219	148 Å²	148	96%	0.961	77%	0.766	S	S	*	*			trans	-143.6	160.7	133.7	-101.7	-74.5	0	0	0	110.5
155	Y	28.2	Very low	32.4	Very low	203 Å²	203	144.9 Å²	144.9	80%	0.796	76%	0.764	S	S	*	*			trans	-149.6	127.5	-162.4	-179.3	-88.5	0	0	0	111.8
156	R	29.8	Very low	32.5	Very low	234 Å²	234	143.7 Å²	143.7	88%	0.883	76%	0.761	S	S	*	*			trans	179	146.4	136.4	-104	178.9	-166.3	-145.1	0.6	114.6
157	S	28.1	Very low	32.8	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	76%	0.762	S	S	*	*			trans	-80.1	174.4	163.2	-39.5	0	0	0	0	111.7
158	N	23.8	Very low	32.8	Very low	163 Å²	163	145.2 Å²	145.2	87%	0.872	76%	0.757	S	S	*	*			trans	-132.7	146.9	153.5	-161.5	11	0	0	0	110.3
159	S	37.2	Very low	33.1	Very low	98 Å²	98	150.3 Å²	150.3	69%	0.685	77%	0.768	S	S	*	*			trans	-166.3	127.5	-172.5	57	0	0	0	0	112.3
160	D	37.2	Very low	33.1	Very low	148 Å²	148	151.1 Å²	151.1	79%	0.791	77%	0.767	S	S	*	*			trans	-173.5	152.3	163.3	-126.4	15.8	0	0	0	109.2
161	N	33.3	Very low	33.1	Very low	110 Å²	110	153.9 Å²	153.9	59%	0.588	78%	0.775	S	S	*	*			cis	-147.7	-144.1	-6.9	-148.2	-45.5	0	0	0	105.3
162	R	33	Very low	32.5	Very low	195 Å²	195	153 Å²	153	74%	0.736	77%	0.772	S	S	*	*			cis	-159.8	96.7	-0.8	-145.6	173.6	-150.8	-152.3	6.3	114
163	R	36.1	Very low	31.8	Very low	201 Å²	201	153.3 Å²	153.3	76%	0.758	78%	0.776	S	S	*	*			trans	69.8	168.1	157.2	-53	177	174.6	-179.3	-3.8	116.8
164	Q	37.2	Very low	31.8	Very low	142 Å²	142	153.9 Å²	153.9	66%	0.664	78%	0.776	S	S	*	*			cis	-153.9	143.6	10.7	-154.5	147.2	-24.1	0	0	115.2
165	N	31.9	Very low	32.1	Very low	152 Å²	152	150.9 Å²	150.9	81%	0.813	76%	0.764	S	S	*	*			trans	55.7	150	158.2	-67	4.9	0	0	0	121.3
166	G	32	Very low	32.9	Very low	67 Å²	67	150.7 Å²	150.7	69%	0.691	77%	0.768	S	S	*	*			cis	168.3	165.9	-7.4	0	0	0	0	0	114.4
167	R	34	Very low	32.9	Very low	229 Å²	229	142.7 Å²	142.7	86%	0.864	76%	0.758	S	S	*	*			trans	71.6	126.4	-175.4	-61.7	-157.6	149.1	141.9	-1.6	115.4
168	E	31.1	Very low	33.7	Very low	143 Å²	143	146.3 Å²	146.3	67%	0.668	77%	0.769	S	S	*	*			cis	114.4	117.2	30.8	-84.8	173.9	146.1	0	0	108.9
169	R	32	Very low	34	Very low	217 Å²	217	146.8 Å²	146.8	82%	0.819	77%	0.768	S	S	*	*				68.6	132.9	76.6	-81.3	-170.9	173.8	-174	-1.4	112.7
170	L	30.2	Very low	34.5	Very low	155 Å²	155	149.7 Å²	149.7	81%	0.812	77%	0.774	S	S	*	*			cis	-149	169.2	-8.4	-54	96	0	0	0	109.3
171	S	27.5	Very low	34.3	Very low	129 Å²	129	151.3 Å²	151.3	90%	0.902	78%	0.779	S	S	*	*			trans	-173.5	173.9	137.4	48.4	0	0	0	0	111.7
172	S	31.1	Very low	34.9	Very low	106 Å²	106	153.8 Å²	153.8	74%	0.741	79%	0.787	S	S	*	*			trans	-136.7	155.2	-160.5	55.2	0	0	0	0	114.7
173	S	34.9	Very low	35.4	Very low	120 Å²	120	149.1 Å²	149.1	84%	0.839	79%	0.785	S	S	*	*			trans	47.1	120.6	157.3	-53.7	0	0	0	0	118.2
174	S	30.7	Very low	36	Very low	98 Å²	98	144.2 Å²	144.2	69%	0.685	79%	0.787	S	S	*	*				-166.4	168.8	63.5	-158.3	0	0	0	0	113.5
175	E	34.2	Very low	36.8	Very low	155 Å²	155	146.1 Å²	146.1	72%	0.724	79%	0.793	S	S	*	*			trans	32.9	125.4	153.3	-74.5	169.6	111.1	0	0	124	G177	E175-G177 PolarHBondContact O-N 2.73Å
176	K	45.1	Very low	38.8	Very low	200 Å²	200	145.2 Å²	145.2	87%	0.87	78%	0.784	S	S	*	*			trans	44.6	68.6	136	-62.8	176.6	-178.2	163.9	0	117.8
177	G	30.4	Very low	41.2	Very low	65 Å²	65	146.5 Å²	146.5	67%	0.67	78%	0.779	S	S	*	*			trans	-111.8	131.5	157.5	0	0	0	0	0	111.3	E175 M179	E175-G177 PolarHBondContact O-N 2.73Å; G177-M179 PolarHBondContact O-N 2.92Å
178	N	44.9	Very low	44	Very low	179 Å²	179	140.7 Å²	140.7	96%	0.957	76%	0.757	S	S	*	*			trans	-74.4	107.7	172.6	-142.4	12.3	0	0	0	108.1
179	M	30.2	Very low	47.2	Very low	174 Å²	174	139.1 Å²	139.1	86%	0.857	75%	0.746	S	S	*	*			trans	-121.5	138.2	-177.4	-88.3	-65.6	-170.2	0	0	112.5	G177 M181	G177-M179 PolarHBondContact O-N 2.92Å; M179-M181 PolarHBondContact O-N 2.83Å
180	I	47.8	Very low	50.3	Low	158 Å²	158	128.8 Å²	128.8	81%	0.81	71%	0.707	S	S	*	*			trans	-63.9	112.4	-179	-62.8	157.5	0	0	0	109	E182	I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 2.83Å
181	M	33.3	Very low	53.4	Low	182 Å²	182	124.1 Å²	124.1	90%	0.897	69%	0.69	S	S	*	*			trans	-80.2	89.2	165.6	-171.4	147.4	71.3	0	0	109.2	M179 S183	M179-M181 PolarHBondContact O-N 2.83Å; M181-S183 PolarHBondContact O-N 3.01Å
182	E	46	Very low	56.8	Low	162 Å²	162	118.1 Å²	118.1	76%	0.757	65%	0.648	S	S	*	*			trans	-60.2	106.6	173.3	-175.9	169.6	-158.4	0	0	109.6	I180 A184	I180-E182 VanDerWaalsContact C-N 3.33Å; I180-E182 PolarHBondContact O-N 2.83Å; E182-A184 PolarHBondContact O-N 3.12Å; E182-A184 VanDerWaalsContact O-N 3.07Å
183	S	42	Very low	59.9	Low	97 Å²	97	113.3 Å²	113.3	68%	0.678	61%	0.614	S	S	*	*			trans	-67	111.2	-180	49.3	0	0	0	0	109.8	M181 K185	M181-S183 PolarHBondContact O-N 3.01Å; S183-K185 PolarHBondContact O-N 2.8Å
184	A	49	Very low	62.8	Low	98 Å²	98	113.4 Å²	113.4	81%	0.81	61%	0.605	S	S	*	*			trans	-55.6	105.2	-175.6	0	0	0	0	0	111	E182 E186	E182-A184 PolarHBondContact O-N 3.12Å; E182-A184 VanDerWaalsContact O-N 3.07Å; A184-E186 PolarHBondContact O-N 2.88Å
185	K	55.3	Low	65.9	Low	182 Å²	182	109.8 Å²	109.8	79%	0.791	58%	0.578	S	S	*	*			trans	-67.7	105.4	177.5	-68.8	170.4	-174.3	160	0	108.4	S183 T187	S183-K185 PolarHBondContact O-N 2.8Å; K185-T187 PolarHBondContact O-N 3.42Å
186	E	73.7	Confident	68.8	Low	133 Å²	133	109 Å²	109	62%	0.621	57%	0.57	S	S	*	*			trans	-47.5	111	175.4	-171.8	-166.6	-179.6	0	0	110.3	A184 R188	A184-E186 PolarHBondContact O-N 2.88Å; E186-R188 PolarHBondContact O-N 2.64Å; E186-R188 IonicContact OE1-CZ 3.96Å; E186-R188 IonicContact OE1-NE 3.64Å; E186-R188 PolarHBondContact OE1-NE 3.09Å; E186-R188 IonicContact OE1-NH1 2.7Å; E186-R188 IonicContact OE1-NH2 2.67Å; E186-R188 PolarHBondContact OE1-NH2 3.01Å; E186-R188 IonicContact OE2-CZ 3.48Å; E186-R188 IonicContact OE2-NE 2.64Å; E186-R188 PolarHBondContact OE2-NE 3.48Å; E186-R188 IonicContact OE2-NH2 2.69Å; E186-R188 PolarHBondContact OE2-NH2 3.5Å
187	T	82.8	Confident	71.3	Confident	94 Å²	94	100.6 Å²	100.6	58%	0.577	54%	0.538	S	S	*	.			trans	-75.7	83.8	-168.6	36.7	0	0	0	0	111.3	K185 Y189	K185-T187 PolarHBondContact O-N 3.42Å; T187-Y189 WeakPolarHBondContact O-CD2 3.46Å; T187-Y189 VanDerWaalsContact O-CE2 3.23Å; T187-Y189 WeakPolarHBondContact O-CE2 3.49Å
188	R	92.7	Very high	74.3	Confident	107 Å²	107	100.5 Å²	100.5	40%	0.404	53%	0.527	S	S	.	.			trans	-65.9	139.6	177.6	-59.4	-55.3	-171.3	144.6	-4.7	111.4	E186 A197 W205	E186-R188 PolarHBondContact O-N 2.64Å; E186-R188 IonicContact OE1-CZ 3.96Å; E186-R188 IonicContact OE1-NE 3.64Å; E186-R188 PolarHBondContact OE1-NE 3.09Å; E186-R188 IonicContact OE1-NH1 2.7Å; E186-R188 IonicContact OE1-NH2 2.67Å; E186-R188 PolarHBondContact OE1-NH2 3.01Å; E186-R188 IonicContact OE2-CZ 3.48Å; E186-R188 IonicContact OE2-NE 2.64Å; E186-R188 PolarHBondContact OE2-NE 3.48Å; E186-R188 IonicContact OE2-NH2 2.69Å; E186-R188 PolarHBondContact OE2-NH2 3.5Å; R188-A197 HydrophobicContact CB-CB 4.32Å; R188-A197 VanDerWaalsContact O-CB 3.29Å; R188-A197 WeakPolarHBondContact O-CB 3.41Å; R188-A197 PolarHBondContact O-N 2.89Å; R188-W205 HydrophobicContact CB-CD2 4.04Å; R188-W205 HydrophobicContact CB-CE3 3.96Å; R188-W205 HydrophobicContact CB-CG 4.38Å; R188-W205 HydrophobicContact CB-CZ3 4.43Å; R188-W205 HydrophobicContact CG-CD2 4.09Å; R188-W205 HydrophobicContact CG-CE3 4.18Å; R188-W205 HydrophobicContact CG-CH2 4.37Å; R188-W205 HydrophobicContact CG-CZ2 4.29Å; R188-W205 HydrophobicContact CG-CZ3 4.31Å
189	Y	96.6	Very high	76.6	Confident	111 Å²	111	92.7 Å²	92.7	44%	0.435	49%	0.488	S	S	.	.	B	Isolated β-bridge	trans	-101.7	155.5	177.8	-65.2	-84	0	0	0	112	T187 A191 N194 Y196	T187-Y189 WeakPolarHBondContact O-CD2 3.46Å; T187-Y189 VanDerWaalsContact O-CE2 3.23Å; T187-Y189 WeakPolarHBondContact O-CE2 3.49Å; Y189-A191 PolarHBondContact O-N 3.23Å; Y189-N194 WeakPolarHBondContact CB-OD1 3.43Å; Y189-N194 WeakPolarHBondContact CD1-O 3.43Å; Y189-Y196 HydrophobicContact CD1-CD1 4.17Å; Y189-Y196 HydrophobicContact CD1-CE1 4.41Å; Y189-Y196 AromaticContact CE1-CD1 3.69Å; Y189-Y196 HydrophobicContact CE1-CD1 3.69Å; Y189-Y196 AromaticContact CE1-CE1 3.5Å; Y189-Y196 HydrophobicContact CE1-CE1 3.5Å; Y189-Y196 VanDerWaalsContact CE1-CE1 3.5Å; Y189-Y196 AromaticContact CZ-CE1 3.88Å
190	C	97.6	Very high	79.7	Confident	0 Å²	0	89.1 Å²	89.1	0%	0	47%	0.466	C	S	.	.			trans	-76.8	114.5	-179.6	174.4	0	0	0	0	111.1	V192 C193 N194 D195 W205 S206 C207	C190-V192 PolarHBondContact O-N 2.92Å; C190-C193 PolarHBondContact O-N 3.39Å; C190-C193 VanDerWaalsContact SG-SG 3.68Å; C190-N194 WeakPolarHBondContact O-CA 3.38Å; C190-N194 PolarHBondContact O-N 2.95Å; C190-D195 WeakPolarHBondContact CB-O 3.47Å; C190-D195 PolarHBondContact N-O 3.04Å; C190-W205 WeakPolarHBondContact CA-O 3.4Å; C190-S206 VanDerWaalsContact SG-CA 3.59Å; C190-C207 HydrophobicContact CB-CB 3.99Å; C190-C207 PolarHBondContact SG-N 3.44Å; C190-C207 VanDerWaalsContact SG-N 3.38Å; C190-C207 VanDerWaalsContact SG-SG 3.65Å
191	A	96.6	Very high	81.9	Confident	56 Å²	56	83.3 Å²	83.3	46%	0.463	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-25.6	-178.3	0	0	0	0	0	114.6	Y189 W205 V253	Y189-A191 PolarHBondContact O-N 3.23Å; A191-W205 PolarHBondContact N-O 2.82Å; A191-W205 VanDerWaalsContact N-O 3.07Å; A191-V253 HydrophobicContact CB-CB 4.03Å; A191-V253 HydrophobicContact CB-CG1 4.02Å; A191-V253 HydrophobicContact CB-CG2 4.21Å
192	V	97.4	Very high	84.8	Confident	4 Å²	4	77.9 Å²	77.9	2%	0.024	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-29.8	-179	-177.4	0	0	0	0	113.7	C190 C210 I234 R246 K249 V253 M255	C190-V192 PolarHBondContact O-N 2.92Å; V192-C210 HydrophobicContact CB-CB 4.31Å; V192-C210 HydrophobicContact CG1-CB 4.44Å; V192-C210 HydrophobicContact CG2-CB 4.5Å; V192-I234 HydrophobicContact CG1-CG2 4.4Å; V192-I234 VanDerWaalsContact O-CG2 3.31Å; V192-I234 WeakPolarHBondContact O-CG2 3.32Å; V192-R246 HydrophobicContact CG1-CG 4.4Å; V192-K249 HydrophobicContact CG1-CB 4.33Å; V192-K249 HydrophobicContact CG1-CG 4.34Å; V192-V253 HydrophobicContact CG2-CG2 3.62Å; V192-M255 HydrophobicContact CG2-SD 3.75Å
193	C	96.7	Very high	86.9	Confident	4 Å²	4	71.4 Å²	71.4	3%	0.027	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	-154	9.9	-168.9	69.3	0	0	0	0	116.9	C190 D195 C207 I234 D235 K236 R239	C190-C193 PolarHBondContact O-N 3.39Å; C190-C193 VanDerWaalsContact SG-SG 3.68Å; C193-D195 PolarHBondContact O-N 3.34Å; C193-C207 VanDerWaalsContact SG-SG 3.66Å; C193-I234 WeakPolarHBondContact CA-O 3.46Å; C193-I234 HydrophobicContact CB-CG2 4.14Å; C193-D235 CarbonylContact O-C 3.2Å; C193-K236 PolarHBondContact O-N 3.08Å; C193-R239 HydrophobicContact CB-CB 4.33Å; C193-R239 PolarHBondContact SG-NH1 3.43Å
194	N	95.4	Very high	89.5	Confident	122 Å²	122	67.3 Å²	67.3	65%	0.652	35%	0.353	S	S	*	.	S	Bend	trans	54.3	13.4	179.3	-131.9	30.9	0	0	0	117.4	Y189 C190	Y189-N194 WeakPolarHBondContact CB-OD1 3.43Å; Y189-N194 WeakPolarHBondContact CD1-O 3.43Å; C190-N194 WeakPolarHBondContact O-CA 3.38Å; C190-N194 PolarHBondContact O-N 2.95Å
195	D	95.8	Very high	91.8	Very high	23 Å²	23	68 Å²	68	12%	0.123	34%	0.335	C	S	.	.	S	Bend	trans	-72.9	160.4	164.6	-163.6	10.7	0	0	0	110.6	C190 C193 A197 C207 K236 R239	C190-D195 WeakPolarHBondContact CB-O 3.47Å; C190-D195 PolarHBondContact N-O 3.04Å; C193-D195 PolarHBondContact O-N 3.34Å; D195-A197 PolarHBondContact O-N 3.09Å; D195-C207 HydrophobicContact CB-CB 4.32Å; D195-K236 HydrophobicContact CB-CB 4.19Å; D195-K236 HydrophobicContact CB-CD 4.16Å; D195-K236 HydrophobicContact CB-CG 4.07Å; D195-K236 VanDerWaalsContact OD1-CD 3.32Å; D195-K236 WeakPolarHBondContact OD1-CD 3.42Å; D195-K236 WeakPolarHBondContact OD1-CE 3.34Å; D195-K236 IonicContact OD1-NZ 3.01Å; D195-K236 PolarHBondContact OD1-NZ 3.14Å; D195-R239 IonicContact OD2-CZ 3.31Å; D195-R239 IonicContact OD2-NH1 3.41Å; D195-R239 PolarHBondContact OD2-NH1 2.85Å; D195-R239 IonicContact OD2-NH2 3.11Å; D195-R239 PolarHBondContact OD2-NH2 2.85Å
196	Y	96.5	Very high	93.8	Very high	137 Å²	137	59.3 Å²	59.3	54%	0.537	30%	0.297	S	S	.	.	B	Isolated β-bridge	trans	-57.7	131.6	-179.1	-65.5	-70.1	0	0	0	111.9	Y189 C207	Y189-Y196 HydrophobicContact CD1-CD1 4.17Å; Y189-Y196 HydrophobicContact CD1-CE1 4.41Å; Y189-Y196 AromaticContact CE1-CD1 3.69Å; Y189-Y196 HydrophobicContact CE1-CD1 3.69Å; Y189-Y196 AromaticContact CE1-CE1 3.5Å; Y189-Y196 HydrophobicContact CE1-CE1 3.5Å; Y189-Y196 VanDerWaalsContact CE1-CE1 3.5Å; Y189-Y196 AromaticContact CZ-CE1 3.88Å; Y196-C207 WeakPolarHBondContact O-CB 3.31Å
197	A	96.3	Very high	94.9	Very high	24 Å²	24	53.2 Å²	53.2	20%	0.198	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-77	132.9	177.3	0	0	0	0	0	110.6	R188 D195 G199 W205 S206	R188-A197 HydrophobicContact CB-CB 4.32Å; R188-A197 VanDerWaalsContact O-CB 3.29Å; R188-A197 WeakPolarHBondContact O-CB 3.41Å; R188-A197 PolarHBondContact O-N 2.89Å; D195-A197 PolarHBondContact O-N 3.09Å; A197-G199 VanDerWaalsContact C-N 3.34Å; A197-W205 HydrophobicContact CB-CB 4.23Å; A197-W205 HydrophobicContact CB-CE3 4.29Å; A197-S206 CarbonylContact C-O 3.59Å; A197-S206 WeakPolarHBondContact CA-O 3.47Å
198	S	94.8	Very high	95.6	Very high	63 Å²	63	53 Å²	53	44%	0.441	26%	0.262	S	S	.	.			trans	-85.4	-12.3	172.9	56.4	0	0	0	0	112.5	H201 S206 E208	S198-H201 PolarHBondContact OG-NE2 3.44Å; S198-S206 PolarHBondContact N-O 3.01Å; S198-S206 PolarHBondContact OG-O 3.13Å; S198-E208 WeakPolarHBondContact CB-OE1 3.3Å; S198-E208 PolarHBondContact OG-N 3.08Å; S198-E208 PolarHBondContact OG-OE1 2.71Å
199	G	92.8	Very high	95.8	Very high	15 Å²	15	49.7 Å²	49.7	16%	0.155	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	162.8	-169.6	-179.9	0	0	0	0	0	112.6	A197 H201 S206	A197-G199 VanDerWaalsContact C-N 3.34Å; G199-H201 PolarHBondContact N-NE2 3.24Å; G199-H201 PolarHBondContact O-CD2 2.81Å; G199-H201 VanDerWaalsContact O-CD2 3.28Å; G199-S206 PolarHBondContact O-N 3.16Å
200	Y	93.9	Very high	95.8	Very high	100 Å²	100	44.4 Å²	44.4	39%	0.392	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	108.2	175.5	-158.8	-99.3	0	0	0	109.1	G203 V204 W205 R261	Y200-G203 VanDerWaalsContact CE1-C 3.43Å; Y200-G203 WeakPolarHBondContact CE1-O 3.08Å; Y200-G203 VanDerWaalsContact CZ-C 3.42Å; Y200-G203 PolarHBondContact OH-O 2.96Å; Y200-V204 CarbonylContact C-O 3.49Å; Y200-V204 WeakPolarHBondContact CA-O 3.47Å; Y200-W205 AromaticContact CD2-CD1 3.84Å; Y200-W205 AromaticContact CD2-CD2 3.95Å; Y200-W205 HydrophobicContact CD2-CD2 3.95Å; Y200-W205 AromaticContact CD2-CE2 3.86Å; Y200-W205 AromaticContact CD2-CG 3.94Å; Y200-W205 HydrophobicContact CD2-CG 3.94Å; Y200-W205 HydrophobicContact CD2-CZ2 4.5Å; Y200-W205 AromaticContact CD2-NE1 3.79Å; Y200-R261 PolarHBondContact OH-NH1 3.02Å; Y200-R261 PolarHBondContact OH-NH2 3.23Å
201	H	94.4	Very high	95.8	Very high	35 Å²	35	47.1 Å²	47.1	16%	0.162	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	135.2	-173.2	-54	-79.9	0	0	0	110.2	S198 G199 G203 V204 S206 E208 K211	S198-H201 PolarHBondContact OG-NE2 3.44Å; G199-H201 PolarHBondContact N-NE2 3.24Å; G199-H201 PolarHBondContact O-CD2 2.81Å; G199-H201 VanDerWaalsContact O-CD2 3.28Å; H201-G203 PolarHBondContact O-N 2.84Å; H201-V204 PolarHBondContact N-O 3.13Å; H201-V204 PolarHBondContact O-N 2.84Å; H201-V204 VanDerWaalsContact O-N 3.11Å; H201-V204 VanDerWaalsContact O-O 3.13Å; H201-S206 PolarHBondContact CD2-O 3.27Å; H201-S206 PolarHBondContact CD2-OG 3.03Å; H201-E208 IonicContact CE1-OE1 3.11Å; H201-E208 IonicContact NE2-OE1 3.06Å; H201-K211 HydrophobicContact CB-CB 4.2Å; H201-K211 HydrophobicContact CB-CG 4Å; H201-K211 VanDerWaalsContact CE1-CE 3.45Å; H201-K211 WeakPolarHBondContact CE1-CE 3.45Å; H201-K211 PolarHBondContact CE1-NZ 2.79Å; H201-K211 WeakPolarHBondContact ND1-CD 3.47Å; H201-K211 VanDerWaalsContact ND1-CE 3.29Å; H201-K211 WeakPolarHBondContact ND1-CE 3.34Å
202	Y	93.8	Very high	95.7	Very high	69 Å²	69	46.4 Å²	46.4	27%	0.271	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.9	19.8	178.8	-59.7	-77.2	0	0	0	115.6	K211 F214 K215 I218 M255 M256	Y202-K211 HydrophobicContact CE2-CG 4.1Å; Y202-F214 HydrophobicContact CD1-CD1 4Å; Y202-F214 AromaticContact CD1-CE1 3.95Å; Y202-F214 HydrophobicContact CD1-CE1 3.95Å; Y202-F214 AromaticContact CD2-CD1 3.75Å; Y202-F214 HydrophobicContact CD2-CD1 3.75Å; Y202-F214 HydrophobicContact CD2-CE1 4.41Å; Y202-F214 HydrophobicContact CE1-CD1 4.45Å; Y202-F214 HydrophobicContact CE2-CD1 4.22Å; Y202-F214 AromaticContact CG-CD1 3.63Å; Y202-F214 HydrophobicContact CG-CD1 3.63Å; Y202-F214 AromaticContact CG-CE1 3.82Å; Y202-F214 HydrophobicContact CG-CE1 3.82Å; Y202-K215 HydrophobicContact CE2-CB 4.47Å; Y202-K215 WeakPolarHBondContact OH-CB 3.3Å; Y202-K215 WeakPolarHBondContact OH-CG 3.4Å; Y202-I218 HydrophobicContact CD1-CD1 4.35Å; Y202-I218 HydrophobicContact CE1-CD1 3.97Å; Y202-M255 HydrophobicContact CD2-CE 3.8Å; Y202-M255 HydrophobicContact CG-CE 4.26Å; Y202-M255 CarbonylContact O-C 3.57Å; Y202-M255 WeakPolarHBondContact O-CA 3.39Å; Y202-M256 PolarHBondContact O-N 2.81Å
203	G	91.8	Very high	95.7	Very high	26 Å²	26	46.6 Å²	46.6	27%	0.268	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	108.1	-2.8	-179.8	0	0	0	0	0	115.6	Y200 H201	Y200-G203 VanDerWaalsContact CE1-C 3.43Å; Y200-G203 WeakPolarHBondContact CE1-O 3.08Å; Y200-G203 VanDerWaalsContact CZ-C 3.42Å; Y200-G203 PolarHBondContact OH-O 2.96Å; H201-G203 PolarHBondContact O-N 2.84Å
204	V	95.4	Very high	95.6	Very high	10 Å²	10	46.4 Å²	46.4	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	158.5	-175.8	-43.5	0	0	0	0	112.9	Y200 H201 S206 V253 M255	Y200-V204 CarbonylContact C-O 3.49Å; Y200-V204 WeakPolarHBondContact CA-O 3.47Å; H201-V204 PolarHBondContact N-O 3.13Å; H201-V204 PolarHBondContact O-N 2.84Å; H201-V204 VanDerWaalsContact O-N 3.11Å; H201-V204 VanDerWaalsContact O-O 3.13Å; V204-S206 PolarHBondContact O-N 3.17Å; V204-V253 HydrophobicContact CG1-CG2 4.13Å; V204-V253 WeakPolarHBondContact CG1-O 3.12Å; V204-V253 HydrophobicContact CG2-CG2 4.24Å; V204-M255 HydrophobicContact CB-CG 4.42Å; V204-M255 HydrophobicContact CG1-CG 4Å; V204-M255 HydrophobicContact CG2-CE 4.4Å; V204-M255 HydrophobicContact CG2-CG 3.49Å; V204-M255 VanDerWaalsContact CG2-CG 3.49Å; V204-M255 HydrophobicContact CG2-SD 4.01Å
205	W	96.8	Very high	95.6	Very high	112 Å²	112	45.3 Å²	45.3	42%	0.424	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	117.7	165.9	-71.2	104.5	0	0	0	110.1	R188 C190 A191 A197 Y200	R188-W205 HydrophobicContact CB-CD2 4.04Å; R188-W205 HydrophobicContact CB-CE3 3.96Å; R188-W205 HydrophobicContact CB-CG 4.38Å; R188-W205 HydrophobicContact CB-CZ3 4.43Å; R188-W205 HydrophobicContact CG-CD2 4.09Å; R188-W205 HydrophobicContact CG-CE3 4.18Å; R188-W205 HydrophobicContact CG-CH2 4.37Å; R188-W205 HydrophobicContact CG-CZ2 4.29Å; R188-W205 HydrophobicContact CG-CZ3 4.31Å; C190-W205 WeakPolarHBondContact CA-O 3.4Å; A191-W205 PolarHBondContact N-O 2.82Å; A191-W205 VanDerWaalsContact N-O 3.07Å; A197-W205 HydrophobicContact CB-CB 4.23Å; A197-W205 HydrophobicContact CB-CE3 4.29Å; Y200-W205 AromaticContact CD2-CD1 3.84Å; Y200-W205 AromaticContact CD2-CD2 3.95Å; Y200-W205 HydrophobicContact CD2-CD2 3.95Å; Y200-W205 AromaticContact CD2-CE2 3.86Å; Y200-W205 AromaticContact CD2-CG 3.94Å; Y200-W205 HydrophobicContact CD2-CG 3.94Å; Y200-W205 HydrophobicContact CD2-CZ2 4.5Å; Y200-W205 AromaticContact CD2-NE1 3.79Å
206	S	97	Very high	95.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	157.7	-177.4	87.1	0	0	0	0	113.9	C190 A197 S198 G199 H201 V204	C190-S206 VanDerWaalsContact SG-CA 3.59Å; A197-S206 CarbonylContact C-O 3.59Å; A197-S206 WeakPolarHBondContact CA-O 3.47Å; S198-S206 PolarHBondContact N-O 3.01Å; S198-S206 PolarHBondContact OG-O 3.13Å; G199-S206 PolarHBondContact O-N 3.16Å; H201-S206 PolarHBondContact CD2-O 3.27Å; H201-S206 PolarHBondContact CD2-OG 3.03Å; V204-S206 PolarHBondContact O-N 3.17Å
207	C	97.7	Very high	95.3	Very high	5 Å²	5	45.4 Å²	45.4	3%	0.034	23%	0.233	C	C	.	.			trans	-83.7	155.2	171.7	65.4	0	0	0	0	110.8	C190 C193 D195 Y196 G209 C210 K211 R239	C190-C207 HydrophobicContact CB-CB 3.99Å; C190-C207 PolarHBondContact SG-N 3.44Å; C190-C207 VanDerWaalsContact SG-N 3.38Å; C190-C207 VanDerWaalsContact SG-SG 3.65Å; C193-C207 VanDerWaalsContact SG-SG 3.66Å; D195-C207 HydrophobicContact CB-CB 4.32Å; Y196-C207 WeakPolarHBondContact O-CB 3.31Å; C207-G209 PolarHBondContact O-N 3.24Å; C207-G209 VanDerWaalsContact O-N 3.09Å; C207-C210 PolarHBondContact O-N 3.42Å; C207-C210 PolarHBondContact SG-N 3.3Å; C207-K211 PolarHBondContact O-N 2.95Å; C207-R239 PolarHBondContact SG-NH1 3.17Å
208	E	97.1	Very high	95	Very high	91 Å²	91	45.2 Å²	45.2	43%	0.425	23%	0.229	S	C	.	.	H	α-helix	trans	-50.4	-37.6	175.1	-69.8	-56.5	116.4	0	0	112.5	S198 H201 C210 K211 A212	S198-E208 WeakPolarHBondContact CB-OE1 3.3Å; S198-E208 PolarHBondContact OG-N 3.08Å; S198-E208 PolarHBondContact OG-OE1 2.71Å; H201-E208 IonicContact CE1-OE1 3.11Å; H201-E208 IonicContact NE2-OE1 3.06Å; E208-C210 VanDerWaalsContact C-N 3.33Å; E208-C210 PolarHBondContact O-N 3.24Å; E208-K211 PolarHBondContact O-N 3.23Å; E208-K211 VanDerWaalsContact OE1-CD 3.29Å; E208-K211 WeakPolarHBondContact OE1-CD 3.27Å; E208-K211 IonicContact OE1-NZ 2.64Å; E208-K211 PolarHBondContact OE1-NZ 2.87Å; E208-K211 VanDerWaalsContact OE2-CD 3.27Å; E208-K211 WeakPolarHBondContact OE2-CD 3.38Å; E208-K211 WeakPolarHBondContact OE2-CE 3.38Å; E208-K211 IonicContact OE2-NZ 3.97Å; E208-K211 PolarHBondContact OE2-NZ 2.85Å; E208-A212 VanDerWaalsContact O-CB 3.23Å; E208-A212 WeakPolarHBondContact O-CB 3.46Å; E208-A212 PolarHBondContact O-N 3.1Å
209	G	96.8	Very high	94.5	Very high	36 Å²	36	48.4 Å²	48.4	37%	0.371	24%	0.237	S	C	.	.	H	α-helix	trans	-61	-35.2	178.3	0	0	0	0	0	114.2	C207 F213 R246	C207-G209 PolarHBondContact O-N 3.24Å; C207-G209 VanDerWaalsContact O-N 3.09Å; G209-F213 WeakPolarHBondContact O-CB 3.22Å; G209-F213 PolarHBondContact O-N 2.83Å; G209-R246 PolarHBondContact O-NH2 3Å
210	C	97.6	Very high	93.6	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-87.6	-39.6	177.5	-74	0	0	0	0	112.4	V192 C207 E208 A212 F213 F214 R246	V192-C210 HydrophobicContact CB-CB 4.31Å; V192-C210 HydrophobicContact CG1-CB 4.44Å; V192-C210 HydrophobicContact CG2-CB 4.5Å; C207-C210 PolarHBondContact O-N 3.42Å; C207-C210 PolarHBondContact SG-N 3.3Å; E208-C210 VanDerWaalsContact C-N 3.33Å; E208-C210 PolarHBondContact O-N 3.24Å; C210-A212 PolarHBondContact O-N 2.85Å; C210-F213 PolarHBondContact O-N 3.1Å; C210-F214 VanDerWaalsContact O-CB 3.31Å; C210-F214 WeakPolarHBondContact O-CB 3.18Å; C210-F214 PolarHBondContact O-N 2.83Å; C210-R246 PolarHBondContact SG-NH2 3.17Å
211	K	96.6	Very high	92	Very high	58 Å²	58	52.8 Å²	52.8	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-50.9	-52.6	168.6	172.2	-158.1	-173.4	-176.1	0	112	H201 Y202 C207 E208 K215	H201-K211 HydrophobicContact CB-CB 4.2Å; H201-K211 HydrophobicContact CB-CG 4Å; H201-K211 VanDerWaalsContact CE1-CE 3.45Å; H201-K211 WeakPolarHBondContact CE1-CE 3.45Å; H201-K211 PolarHBondContact CE1-NZ 2.79Å; H201-K211 WeakPolarHBondContact ND1-CD 3.47Å; H201-K211 VanDerWaalsContact ND1-CE 3.29Å; H201-K211 WeakPolarHBondContact ND1-CE 3.34Å; Y202-K211 HydrophobicContact CE2-CG 4.1Å; C207-K211 PolarHBondContact O-N 2.95Å; E208-K211 PolarHBondContact O-N 3.23Å; E208-K211 VanDerWaalsContact OE1-CD 3.29Å; E208-K211 WeakPolarHBondContact OE1-CD 3.27Å; E208-K211 IonicContact OE1-NZ 2.64Å; E208-K211 PolarHBondContact OE1-NZ 2.87Å; E208-K211 VanDerWaalsContact OE2-CD 3.27Å; E208-K211 WeakPolarHBondContact OE2-CD 3.38Å; E208-K211 WeakPolarHBondContact OE2-CE 3.38Å; E208-K211 IonicContact OE2-NZ 3.97Å; E208-K211 PolarHBondContact OE2-NZ 2.85Å; K211-K215 WeakPolarHBondContact O-CB 3.47Å; K211-K215 PolarHBondContact O-N 3.19Å
212	A	95.7	Very high	91	Very high	40 Å²	40	54.1 Å²	54.1	33%	0.331	28%	0.275	S	S	.	.	H	α-helix	trans	-72.7	-29.9	-177.9	0	0	0	0	0	113.3	E208 C210 R216	E208-A212 VanDerWaalsContact O-CB 3.23Å; E208-A212 WeakPolarHBondContact O-CB 3.46Å; E208-A212 PolarHBondContact O-N 3.1Å; C210-A212 PolarHBondContact O-N 2.85Å; A212-R216 PolarHBondContact O-NH1 2.75Å
213	F	96.8	Very high	90.4	Very high	8 Å²	8	56.8 Å²	56.8	4%	0.035	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-57.8	170.6	170.5	-104.8	0	0	0	110.3	G209 C210 K215 R216 S217 Y224 Q243 R246 L247	G209-F213 WeakPolarHBondContact O-CB 3.22Å; G209-F213 PolarHBondContact O-N 2.83Å; C210-F213 PolarHBondContact O-N 3.1Å; F213-K215 VanDerWaalsContact C-N 3.29Å; F213-K215 PolarHBondContact O-N 3.29Å; F213-R216 PolarHBondContact O-N 3.46Å; F213-S217 PolarHBondContact O-N 3.5Å; F213-S217 VanDerWaalsContact O-N 3.08Å; F213-S217 PolarHBondContact O-OG 2.65Å; F213-S217 VanDerWaalsContact O-OG 3.08Å; F213-Y224 AromaticContact CE2-CE2 3.91Å; F213-Y224 HydrophobicContact CE2-CE2 3.91Å; F213-Y224 HydrophobicContact CZ-CD2 4.35Å; F213-Y224 AromaticContact CZ-CE2 3.78Å; F213-Y224 HydrophobicContact CZ-CE2 3.78Å; F213-Q243 HydrophobicContact CE2-CB 4.21Å; F213-Q243 HydrophobicContact CE2-CG 4.27Å; F213-Q243 HydrophobicContact CZ-CB 4.31Å; F213-Q243 WeakPolarHBondContact CZ-O 3.48Å; F213-R246 HydrophobicContact CD1-CG 3.94Å; F213-R246 HydrophobicContact CE1-CB 3.99Å; F213-R246 HydrophobicContact CE1-CG 3.61Å; F213-R246 HydrophobicContact CZ-CB 4.21Å; F213-R246 HydrophobicContact CZ-CG 4.22Å; F213-L247 HydrophobicContact CE1-CB 4.02Å; F213-L247 HydrophobicContact CE1-CD1 4.49Å; F213-L247 HydrophobicContact CZ-CB 4.08Å
214	F	95.6	Very high	90.4	Very high	0 Å²	0	58 Å²	58	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-55.1	-43.1	-179.7	-172	-108.4	0	0	0	112	Y202 C210 R216 S217 I218 L247 C250 Y251 M255	Y202-F214 HydrophobicContact CD1-CD1 4Å; Y202-F214 AromaticContact CD1-CE1 3.95Å; Y202-F214 HydrophobicContact CD1-CE1 3.95Å; Y202-F214 AromaticContact CD2-CD1 3.75Å; Y202-F214 HydrophobicContact CD2-CD1 3.75Å; Y202-F214 HydrophobicContact CD2-CE1 4.41Å; Y202-F214 HydrophobicContact CE1-CD1 4.45Å; Y202-F214 HydrophobicContact CE2-CD1 4.22Å; Y202-F214 AromaticContact CG-CD1 3.63Å; Y202-F214 HydrophobicContact CG-CD1 3.63Å; Y202-F214 AromaticContact CG-CE1 3.82Å; Y202-F214 HydrophobicContact CG-CE1 3.82Å; C210-F214 VanDerWaalsContact O-CB 3.31Å; C210-F214 WeakPolarHBondContact O-CB 3.18Å; C210-F214 PolarHBondContact O-N 2.83Å; F214-R216 VanDerWaalsContact C-N 3.31Å; F214-R216 PolarHBondContact O-N 3.25Å; F214-S217 PolarHBondContact O-N 2.59Å; F214-I218 HydrophobicContact CD1-CD1 3.78Å; F214-I218 HydrophobicContact CD1-CG2 4.35Å; F214-I218 HydrophobicContact CD2-CG2 4.15Å; F214-I218 HydrophobicContact CE1-CD1 3.62Å; F214-I218 HydrophobicContact CE1-CG2 4Å; F214-I218 HydrophobicContact CE2-CG2 3.8Å; F214-I218 HydrophobicContact CG-CG2 4.42Å; F214-I218 HydrophobicContact CZ-CD1 4.34Å; F214-I218 HydrophobicContact CZ-CG2 3.7Å; F214-I218 WeakPolarHBondContact O-CG1 3.43Å; F214-I218 WeakPolarHBondContact O-CG2 3.29Å; F214-I218 PolarHBondContact O-N 3.22Å; F214-L247 HydrophobicContact CD2-CD1 4.01Å; F214-L247 HydrophobicContact CE2-CD1 4.29Å; F214-C250 HydrophobicContact CD2-CB 3.52Å; F214-C250 HydrophobicContact CE2-CB 3.94Å; F214-C250 HydrophobicContact CG-CB 4.4Å; F214-Y251 AromaticContact CE2-CD1 3.9Å; F214-Y251 HydrophobicContact CE2-CD1 3.9Å; F214-Y251 AromaticContact CE2-CE1 3.54Å; F214-Y251 HydrophobicContact CE2-CE1 3.54Å; F214-Y251 HydrophobicContact CZ-CD1 4.25Å; F214-Y251 AromaticContact CZ-CE1 3.83Å; F214-Y251 HydrophobicContact CZ-CE1 3.83Å; F214-M255 HydrophobicContact CB-CE 3.94Å; F214-M255 HydrophobicContact CB-SD 4.39Å; F214-M255 HydrophobicContact CD1-CB 4.04Å; F214-M255 HydrophobicContact CD1-CE 3.94Å; F214-M255 HydrophobicContact CD2-CB 4.1Å; F214-M255 HydrophobicContact CE1-CB 3.73Å; F214-M255 HydrophobicContact CE2-CB 3.79Å; F214-M255 HydrophobicContact CG-CB 4.22Å; F214-M255 HydrophobicContact CG-CE 3.98Å; F214-M255 HydrophobicContact CG-SD 4.29Å; F214-M255 VanDerWaalsContact CZ-C 3.41Å; F214-M255 HydrophobicContact CZ-CB 3.6Å; F214-M255 WeakPolarHBondContact CZ-O 3.44Å
215	K	93.5	Very high	90.2	Very high	99 Å²	99	65.7 Å²	65.7	43%	0.43	33%	0.329	S	S	.	.	H	α-helix	trans	-53.1	-44.2	174.7	-176.3	178.5	173.8	-173.5	0	112.8	Y202 K211 F213 Q219	Y202-K215 HydrophobicContact CE2-CB 4.47Å; Y202-K215 WeakPolarHBondContact OH-CB 3.3Å; Y202-K215 WeakPolarHBondContact OH-CG 3.4Å; K211-K215 WeakPolarHBondContact O-CB 3.47Å; K211-K215 PolarHBondContact O-N 3.19Å; F213-K215 VanDerWaalsContact C-N 3.29Å; F213-K215 PolarHBondContact O-N 3.29Å; K215-Q219 VanDerWaalsContact O-CB 3.3Å; K215-Q219 WeakPolarHBondContact O-CB 3.47Å; K215-Q219 WeakPolarHBondContact O-CG 3.23Å; K215-Q219 PolarHBondContact O-N 3.42Å; K215-Q219 PolarHBondContact O-OE1 3.26Å
216	R	93.8	Very high	90	Very high	149 Å²	149	61.5 Å²	61.5	56%	0.562	32%	0.316	S	S	*	.	H	α-helix	trans	-70.9	-44.6	179.2	-68.8	-169.6	-61.2	-91.2	5.4	111.4	A212 F213 F214 I218 Q219 G220	A212-R216 PolarHBondContact O-NH1 2.75Å; F213-R216 PolarHBondContact O-N 3.46Å; F214-R216 VanDerWaalsContact C-N 3.31Å; F214-R216 PolarHBondContact O-N 3.25Å; R216-I218 PolarHBondContact O-N 2.66Å; R216-Q219 PolarHBondContact O-N 3.4Å; R216-G220 PolarHBondContact O-N 3.21Å
217	S	93.4	Very high	89.6	Confident	13 Å²	13	66.7 Å²	66.7	9%	0.091	35%	0.35	C	S	.	.	H	α-helix	trans	-62.6	-25.3	-178.8	-48.3	0	0	0	0	114.1	F213 F214 Y224	F213-S217 PolarHBondContact O-N 3.5Å; F213-S217 VanDerWaalsContact O-N 3.08Å; F213-S217 PolarHBondContact O-OG 2.65Å; F213-S217 VanDerWaalsContact O-OG 3.08Å; F214-S217 PolarHBondContact O-N 2.59Å; S217-Y224 WeakPolarHBondContact OG-CE2 3.45Å; S217-Y224 PolarHBondContact OG-OH 3.07Å
218	I	89.4	Confident	89.2	Confident	21 Å²	21	69.1 Å²	69.1	11%	0.108	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.4	4.9	176.2	73.8	-169.4	0	0	0	113.9	Y202 F214 R216 K257	Y202-I218 HydrophobicContact CD1-CD1 4.35Å; Y202-I218 HydrophobicContact CE1-CD1 3.97Å; F214-I218 HydrophobicContact CD1-CD1 3.78Å; F214-I218 HydrophobicContact CD1-CG2 4.35Å; F214-I218 HydrophobicContact CD2-CG2 4.15Å; F214-I218 HydrophobicContact CE1-CD1 3.62Å; F214-I218 HydrophobicContact CE1-CG2 4Å; F214-I218 HydrophobicContact CE2-CG2 3.8Å; F214-I218 HydrophobicContact CG-CG2 4.42Å; F214-I218 HydrophobicContact CZ-CD1 4.34Å; F214-I218 HydrophobicContact CZ-CG2 3.7Å; F214-I218 WeakPolarHBondContact O-CG1 3.43Å; F214-I218 WeakPolarHBondContact O-CG2 3.29Å; F214-I218 PolarHBondContact O-N 3.22Å; R216-I218 PolarHBondContact O-N 2.66Å; I218-K257 HydrophobicContact CB-CD 4.23Å; I218-K257 HydrophobicContact CD1-CB 4.07Å; I218-K257 HydrophobicContact CD1-CD 4.39Å; I218-K257 HydrophobicContact CD1-CG 3.97Å; I218-K257 HydrophobicContact CG1-CD 4.27Å; I218-K257 HydrophobicContact CG1-CG 4.38Å; I218-K257 WeakPolarHBondContact O-CE 3.49Å; I218-K257 PolarHBondContact O-NZ 2.8Å
219	Q	83.8	Confident	88.9	Confident	130 Å²	130	70 Å²	70	61%	0.607	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	-13.6	-177.2	-73.8	-171.2	-35.9	0	0	114.6	K215 R216	K215-Q219 VanDerWaalsContact O-CB 3.3Å; K215-Q219 WeakPolarHBondContact O-CB 3.47Å; K215-Q219 WeakPolarHBondContact O-CG 3.23Å; K215-Q219 PolarHBondContact O-N 3.42Å; K215-Q219 PolarHBondContact O-OE1 3.26Å; R216-Q219 PolarHBondContact O-N 3.4Å
220	G	75.1	Confident	88.5	Confident	39 Å²	39	72 Å²	72	40%	0.402	38%	0.384	S	S	.	.	S	Bend	trans	-135.9	160.6	170.2	0	0	0	0	0	111.9	R216 N222	R216-G220 PolarHBondContact O-N 3.21Å; G220-N222 PolarHBondContact O-N 3.36Å; G220-N222 VanDerWaalsContact O-N 3.11Å; G220-N222 PolarHBondContact O-ND2 3.1Å
221	H	59.1	Low	88.2	Confident	167 Å²	167	80 Å²	80	77%	0.773	42%	0.422	S	S	*	.			trans	-65.4	106.8	173.3	-148.2	-72.6	0	0	0	108.9	D223	H221-D223 IonicContact CE1-OD1 2.71Å; H221-D223 PolarHBondContact CE1-OD1 3.45Å; H221-D223 IonicContact CE1-OD2 3.61Å; H221-D223 PolarHBondContact CE1-OD2 2.93Å; H221-D223 VanDerWaalsContact CE1-OD2 3.31Å; H221-D223 IonicContact CG-OD2 2.75Å; H221-D223 IonicContact ND1-OD1 2.66Å; H221-D223 PolarHBondContact ND1-OD1 3.2Å; H221-D223 IonicContact ND1-OD2 2.65Å; H221-D223 PolarHBondContact ND1-OD2 3.3Å
222	N	74.4	Confident	88.1	Confident	63 Å²	63	79.1 Å²	79.1	34%	0.337	42%	0.422	S	S	.	.			trans	-131.5	84.9	-172.2	-80.8	-102.4	0	0	0	110	G220 Y224	G220-N222 PolarHBondContact O-N 3.36Å; G220-N222 VanDerWaalsContact O-N 3.11Å; G220-N222 PolarHBondContact O-ND2 3.1Å; N222-Y224 VanDerWaalsContact C-N 3.26Å; N222-Y224 HydrophobicContact CB-CD1 4.34Å; N222-Y224 HydrophobicContact CB-CE1 3.74Å; N222-Y224 HydrophobicContact CB-CE2 4.03Å; N222-Y224 PolarHBondContact O-N 2.82Å; N222-Y224 WeakPolarHBondContact OD1-CE1 3.48Å; N222-Y224 PolarHBondContact OD1-OH 2.84Å
223	D	80.5	Confident	88	Confident	126 Å²	126	81 Å²	81	67%	0.674	43%	0.43	S	S	*	.			trans	-80.5	71	-176.8	-52.5	-73.6	0	0	0	111.2	H221 M225	H221-D223 IonicContact CE1-OD1 2.71Å; H221-D223 PolarHBondContact CE1-OD1 3.45Å; H221-D223 IonicContact CE1-OD2 3.61Å; H221-D223 PolarHBondContact CE1-OD2 2.93Å; H221-D223 VanDerWaalsContact CE1-OD2 3.31Å; H221-D223 IonicContact CG-OD2 2.75Å; H221-D223 IonicContact ND1-OD1 2.66Å; H221-D223 PolarHBondContact ND1-OD1 3.2Å; H221-D223 IonicContact ND1-OD2 2.65Å; H221-D223 PolarHBondContact ND1-OD2 3.3Å; D223-M225 PolarHBondContact O-N 2.98Å
224	Y	92.6	Very high	88	Confident	50 Å²	50	81.7 Å²	81.7	20%	0.196	43%	0.433	C	S	.	.			trans	-69.4	104.6	179.4	-55.8	-42.3	0	0	0	111.1	F213 S217 N222 Q243 A244 L247	F213-Y224 AromaticContact CE2-CE2 3.91Å; F213-Y224 HydrophobicContact CE2-CE2 3.91Å; F213-Y224 HydrophobicContact CZ-CD2 4.35Å; F213-Y224 AromaticContact CZ-CE2 3.78Å; F213-Y224 HydrophobicContact CZ-CE2 3.78Å; S217-Y224 WeakPolarHBondContact OG-CE2 3.45Å; S217-Y224 PolarHBondContact OG-OH 3.07Å; N222-Y224 VanDerWaalsContact C-N 3.26Å; N222-Y224 HydrophobicContact CB-CD1 4.34Å; N222-Y224 HydrophobicContact CB-CE1 3.74Å; N222-Y224 HydrophobicContact CB-CE2 4.03Å; N222-Y224 PolarHBondContact O-N 2.82Å; N222-Y224 WeakPolarHBondContact OD1-CE1 3.48Å; N222-Y224 PolarHBondContact OD1-OH 2.84Å; Y224-Q243 HydrophobicContact CD1-CB 3.73Å; Y224-Q243 HydrophobicContact CD2-CB 3.92Å; Y224-Q243 HydrophobicContact CE1-CB 4.12Å; Y224-Q243 HydrophobicContact CE2-CB 4.26Å; Y224-Q243 HydrophobicContact CG-CB 3.65Å; Y224-A244 WeakPolarHBondContact O-CB 3.41Å; Y224-L247 HydrophobicContact CD2-CB 4.16Å; Y224-L247 HydrophobicContact CD2-CD2 3.81Å; Y224-L247 HydrophobicContact CE2-CB 4.45Å; Y224-L247 HydrophobicContact CE2-CD2 3.99Å
225	M	90.3	Very high	88	Confident	173 Å²	173	84.7 Å²	84.7	85%	0.852	45%	0.45	S	S	*	.			trans	-77.9	151.5	164.3	-66.6	-161.1	-75.8	0	0	111.5	D223	D223-M225 PolarHBondContact O-N 2.98Å
226	C	94.1	Very high	88	Confident	24 Å²	24	84.6 Å²	84.6	16%	0.162	45%	0.449	C	S	.	.			trans	-92.6	130.5	172.8	-176.3	0	0	0	0	109.7	A228 N230 C232 A244	C226-A228 PolarHBondContact O-N 3.47Å; C226-A228 PolarHBondContact SG-N 3.12Å; C226-A228 PolarHBondContact SG-O 3.36Å; C226-A228 VanDerWaalsContact SG-O 3.39Å; C226-N230 WeakPolarHBondContact CB-OD1 3.27Å; C226-C232 PolarHBondContact SG-SG 3.32Å; C226-A244 HydrophobicContact CB-CB 4.02Å
227	P	87.9	Confident	88	Confident	109 Å²	109	84.1 Å²	84.1	71%	0.708	46%	0.458	S	S	*	.	S	Bend	trans	-77	17.9	175.9	34.2	-37.7	0	0	0	113.3
228	A	89.3	Confident	87.9	Confident	55 Å²	55	89.4 Å²	89.4	46%	0.455	48%	0.476	S	S	.	.	S	Bend	trans	-159	-168.3	-171.7	0	0	0	0	0	110.5	C226 N230	C226-A228 PolarHBondContact O-N 3.47Å; C226-A228 PolarHBondContact SG-N 3.12Å; C226-A228 PolarHBondContact SG-O 3.36Å; C226-A228 VanDerWaalsContact SG-O 3.39Å; A228-N230 PolarHBondContact O-N 2.94Å
229	T	90.6	Very high	88.1	Confident	110 Å²	110	90.4 Å²	90.4	68%	0.675	48%	0.478	S	S	*	.	S	Bend	trans	-66.7	21.7	-175.3	57.1	0	0	0	0	116.2	Q231	T229-Q231 PolarHBondContact O-N 3.22Å
230	N	88.7	Confident	88.6	Confident	79 Å²	79	93 Å²	93	42%	0.422	49%	0.487	S	S	.	.	S	Bend	trans	59.7	8	-174.5	-81.4	-66.5	0	0	0	116.2	C226 A228 C245 R248	C226-N230 WeakPolarHBondContact CB-OD1 3.27Å; A228-N230 PolarHBondContact O-N 2.94Å; N230-C245 PolarHBondContact O-SG 3.16Å; N230-R248 PolarHBondContact O-NH1 3.41Å; N230-R248 PolarHBondContact OD1-NH2 2.91Å
231	Q	91.7	Very high	89.5	Confident	167 Å²	167	95.3 Å²	95.3	78%	0.78	50%	0.498	S	S	*	.			trans	-110.9	33.3	-176.7	-64.3	174.7	29.4	0	0	113.2	T229 T233	T229-Q231 PolarHBondContact O-N 3.22Å; Q231-T233 PolarHBondContact O-N 2.93Å
232	C	94.4	Very high	91.2	Very high	40 Å²	40	87.6 Å²	87.6	27%	0.27	46%	0.463	S	S	.	.			trans	-67.8	129.7	-178.3	-51.9	0	0	0	0	112.2	C226 I234 C242 C245	C226-C232 PolarHBondContact SG-SG 3.32Å; C232-I234 HydrophobicContact CB-CD1 4.5Å; C232-I234 WeakPolarHBondContact O-CG1 3.29Å; C232-C242 HydrophobicContact CB-CB 3.84Å; C232-C245 HydrophobicContact CB-CB 3.78Å; C232-C245 VanDerWaalsContact SG-SG 3.65Å
233	T	94.1	Very high	92.2	Very high	79 Å²	79	89.6 Å²	89.6	49%	0.485	47%	0.47	S	S	.	.			trans	-71.2	131	174.6	30.4	0	0	0	0	111.9	Q231 R238	Q231-T233 PolarHBondContact O-N 2.93Å; T233-R238 PolarHBondContact OG1-NH1 3.3Å; T233-R238 PolarHBondContact OG1-NH2 3.33Å
234	I	96.3	Very high	93	Very high	22 Å²	22	84 Å²	84	11%	0.113	44%	0.441	C	S	.	.			trans	-112.8	92.3	-170.4	-53.2	-57.5	0	0	0	110.2	V192 C193 C232 R239 C245 R246 K249	V192-I234 HydrophobicContact CG1-CG2 4.4Å; V192-I234 VanDerWaalsContact O-CG2 3.31Å; V192-I234 WeakPolarHBondContact O-CG2 3.32Å; C193-I234 WeakPolarHBondContact CA-O 3.46Å; C193-I234 HydrophobicContact CB-CG2 4.14Å; C232-I234 HydrophobicContact CB-CD1 4.5Å; C232-I234 WeakPolarHBondContact O-CG1 3.29Å; I234-R239 HydrophobicContact CG2-CB 3.92Å; I234-C245 HydrophobicContact CD1-CB 3.98Å; I234-R246 HydrophobicContact CD1-CB 4.08Å; I234-R246 HydrophobicContact CG2-CB 4.35Å; I234-R246 HydrophobicContact CG2-CG 4.07Å; I234-K249 HydrophobicContact CG1-CB 4.31Å
235	D	95.4	Very high	93.1	Very high	63 Å²	63	81.8 Å²	81.8	34%	0.337	43%	0.433	S	S	.	.			trans	-113.3	170	176.9	-41.3	-69.7	0	0	0	111.2	C193 N237 R238 R239	C193-D235 CarbonylContact O-C 3.2Å; D235-N237 PolarHBondContact O-N 3.22Å; D235-R238 PolarHBondContact O-N 3.42Å; D235-R238 VanDerWaalsContact O-N 3.09Å; D235-R238 IonicContact OD2-CZ 2.74Å; D235-R238 IonicContact OD2-NE 3.64Å; D235-R238 PolarHBondContact OD2-NE 3.47Å; D235-R238 IonicContact OD2-NH2 2.62Å; D235-R238 PolarHBondContact OD2-NH2 2.89Å; D235-R239 VanDerWaalsContact O-CB 3.22Å; D235-R239 WeakPolarHBondContact O-CB 3.3Å; D235-R239 WeakPolarHBondContact O-CG 3.46Å; D235-R239 PolarHBondContact O-N 3.35Å
236	K	93.4	Very high	93.5	Very high	97 Å²	97	74.6 Å²	74.6	42%	0.422	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-42.3	-40	173.3	-178	171.9	-176.7	149.5	0	113.9	C193 D195 R239	C193-K236 PolarHBondContact O-N 3.08Å; D195-K236 HydrophobicContact CB-CB 4.19Å; D195-K236 HydrophobicContact CB-CD 4.16Å; D195-K236 HydrophobicContact CB-CG 4.07Å; D195-K236 VanDerWaalsContact OD1-CD 3.32Å; D195-K236 WeakPolarHBondContact OD1-CD 3.42Å; D195-K236 WeakPolarHBondContact OD1-CE 3.34Å; D195-K236 IonicContact OD1-NZ 3.01Å; D195-K236 PolarHBondContact OD1-NZ 3.14Å; K236-R239 WeakPolarHBondContact O-CG 3.49Å; K236-R239 PolarHBondContact O-NE 3.17Å
237	N	93	Very high	93.6	Very high	139 Å²	139	74.6 Å²	74.6	74%	0.743	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-42.3	-178.3	-60.1	2.3	0	0	0	112	D235	D235-N237 PolarHBondContact O-N 3.22Å
238	R	91.5	Very high	93.9	Very high	124 Å²	124	74.1 Å²	74.1	47%	0.468	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-10.8	-173.6	-67.1	-169.1	-71.5	-164.2	-2.4	115.3	T233 D235 K240 S241	T233-R238 PolarHBondContact OG1-NH1 3.3Å; T233-R238 PolarHBondContact OG1-NH2 3.33Å; D235-R238 PolarHBondContact O-N 3.42Å; D235-R238 VanDerWaalsContact O-N 3.09Å; D235-R238 IonicContact OD2-CZ 2.74Å; D235-R238 IonicContact OD2-NE 3.64Å; D235-R238 PolarHBondContact OD2-NE 3.47Å; D235-R238 IonicContact OD2-NH2 2.62Å; D235-R238 PolarHBondContact OD2-NH2 2.89Å; R238-K240 PolarHBondContact O-N 2.74Å; R238-S241 WeakPolarHBondContact O-CB 3.5Å; R238-S241 PolarHBondContact O-N 3.21Å; R238-S241 PolarHBondContact O-OG 3.41Å
239	R	93.6	Very high	94.3	Very high	43 Å²	43	75.1 Å²	75.1	16%	0.162	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	2.4	176.3	69.1	-174	173.1	178.7	-2.9	116.2	C193 D195 C207 I234 D235 K236 R246	C193-R239 HydrophobicContact CB-CB 4.33Å; C193-R239 PolarHBondContact SG-NH1 3.43Å; D195-R239 IonicContact OD2-CZ 3.31Å; D195-R239 IonicContact OD2-NH1 3.41Å; D195-R239 PolarHBondContact OD2-NH1 2.85Å; D195-R239 IonicContact OD2-NH2 3.11Å; D195-R239 PolarHBondContact OD2-NH2 2.85Å; C207-R239 PolarHBondContact SG-NH1 3.17Å; I234-R239 HydrophobicContact CG2-CB 3.92Å; D235-R239 VanDerWaalsContact O-CB 3.22Å; D235-R239 WeakPolarHBondContact O-CB 3.3Å; D235-R239 WeakPolarHBondContact O-CG 3.46Å; D235-R239 PolarHBondContact O-N 3.35Å; K236-R239 WeakPolarHBondContact O-CG 3.49Å; K236-R239 PolarHBondContact O-NE 3.17Å; R239-R246 WeakPolarHBondContact O-CD 3.43Å; R239-R246 PolarHBondContact O-NH1 3.06Å
240	K	93.9	Very high	94.5	Very high	183 Å²	183	69.9 Å²	69.9	80%	0.796	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.9	-24.9	167.4	-69.5	-173.5	179	-178.2	0	112.7	R238 C242	R238-K240 PolarHBondContact O-N 2.74Å; K240-C242 PolarHBondContact O-N 2.99Å
241	S	94.2	Very high	94.9	Very high	89 Å²	89	71.9 Å²	71.9	62%	0.622	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-22.5	-168.6	-49.9	0	0	0	0	114.7	R238	R238-S241 WeakPolarHBondContact O-CB 3.5Å; R238-S241 PolarHBondContact O-N 3.21Å; R238-S241 PolarHBondContact O-OG 3.41Å
242	C	95.9	Very high	95	Very high	5 Å²	5	69.1 Å²	69.1	3%	0.034	33%	0.33	C	S	.	.			trans	-146	113.8	173.9	-177	0	0	0	0	110.6	C232 K240 C245 R246	C232-C242 HydrophobicContact CB-CB 3.84Å; K240-C242 PolarHBondContact O-N 2.99Å; C242-C245 HydrophobicContact CB-CB 4.33Å; C242-C245 PolarHBondContact SG-N 2.91Å; C242-C245 VanDerWaalsContact SG-N 3.44Å; C242-C245 PolarHBondContact SG-SG 3.36Å; C242-R246 WeakPolarHBondContact O-CB 3.47Å; C242-R246 PolarHBondContact O-N 3.36Å
243	Q	95.2	Very high	95.1	Very high	104 Å²	104	69.3 Å²	69.3	49%	0.486	33%	0.33	S	S	.	.	H	α-helix	trans	-74.8	-37.9	178.7	-65.6	173.1	-14	0	0	111.4	F213 Y224 R246 L247	F213-Q243 HydrophobicContact CE2-CB 4.21Å; F213-Q243 HydrophobicContact CE2-CG 4.27Å; F213-Q243 HydrophobicContact CZ-CB 4.31Å; F213-Q243 WeakPolarHBondContact CZ-O 3.48Å; Y224-Q243 HydrophobicContact CD1-CB 3.73Å; Y224-Q243 HydrophobicContact CD2-CB 3.92Å; Y224-Q243 HydrophobicContact CE1-CB 4.12Å; Y224-Q243 HydrophobicContact CE2-CB 4.26Å; Y224-Q243 HydrophobicContact CG-CB 3.65Å; Q243-R246 PolarHBondContact O-N 3.26Å; Q243-L247 PolarHBondContact O-N 3.39Å
244	A	96.1	Very high	95.1	Very high	8 Å²	8	67 Å²	67	7%	0.066	32%	0.321	C	S	.	.	H	α-helix	trans	-58.5	-57.8	179.7	0	0	0	0	0	112.6	Y224 C226 R246 L247 R248	Y224-A244 WeakPolarHBondContact O-CB 3.41Å; C226-A244 HydrophobicContact CB-CB 4.02Å; A244-R246 VanDerWaalsContact C-N 3.25Å; A244-R246 PolarHBondContact O-N 3.24Å; A244-L247 PolarHBondContact O-N 2.86Å; A244-R248 PolarHBondContact O-N 2.96Å
245	C	96.6	Very high	95	Very high	5 Å²	5	66 Å²	66	3%	0.034	32%	0.317	C	S	.	.	H	α-helix	trans	-63.9	-31.5	179.4	-60.9	0	0	0	0	111.9	N230 C232 I234 C242 K249	N230-C245 PolarHBondContact O-SG 3.16Å; C232-C245 HydrophobicContact CB-CB 3.78Å; C232-C245 VanDerWaalsContact SG-SG 3.65Å; I234-C245 HydrophobicContact CD1-CB 3.98Å; C242-C245 HydrophobicContact CB-CB 4.33Å; C242-C245 PolarHBondContact SG-N 2.91Å; C242-C245 VanDerWaalsContact SG-N 3.44Å; C242-C245 PolarHBondContact SG-SG 3.36Å; C245-K249 WeakPolarHBondContact O-CB 3.4Å; C245-K249 PolarHBondContact O-N 2.72Å
246	R	97.3	Very high	94.8	Very high	22 Å²	22	68 Å²	68	8%	0.083	33%	0.325	C	S	.	.	H	α-helix	trans	-68.4	-42.4	174	-174	-179.3	-174.5	-169.3	-7.3	112.6	V192 G209 C210 F213 I234 R239 C242 Q243 A244 K249 C250	V192-R246 HydrophobicContact CG1-CG 4.4Å; G209-R246 PolarHBondContact O-NH2 3Å; C210-R246 PolarHBondContact SG-NH2 3.17Å; F213-R246 HydrophobicContact CD1-CG 3.94Å; F213-R246 HydrophobicContact CE1-CB 3.99Å; F213-R246 HydrophobicContact CE1-CG 3.61Å; F213-R246 HydrophobicContact CZ-CB 4.21Å; F213-R246 HydrophobicContact CZ-CG 4.22Å; I234-R246 HydrophobicContact CD1-CB 4.08Å; I234-R246 HydrophobicContact CG2-CB 4.35Å; I234-R246 HydrophobicContact CG2-CG 4.07Å; R239-R246 WeakPolarHBondContact O-CD 3.43Å; R239-R246 PolarHBondContact O-NH1 3.06Å; C242-R246 WeakPolarHBondContact O-CB 3.47Å; C242-R246 PolarHBondContact O-N 3.36Å; Q243-R246 PolarHBondContact O-N 3.26Å; A244-R246 VanDerWaalsContact C-N 3.25Å; A244-R246 PolarHBondContact O-N 3.24Å; R246-K249 PolarHBondContact O-N 3.21Å; R246-C250 PolarHBondContact O-N 2.89Å; R246-C250 PolarHBondContact O-SG 2.81Å; R246-C250 VanDerWaalsContact O-SG 3.36Å
247	L	96.1	Very high	94.1	Very high	24 Å²	24	70.9 Å²	70.9	13%	0.126	34%	0.337	C	S	.	.	H	α-helix	trans	-66	-42.6	176.9	-179.5	58.9	0	0	0	110.7	F213 F214 Y224 Q243 A244 K249 C250 Y251	F213-L247 HydrophobicContact CE1-CB 4.02Å; F213-L247 HydrophobicContact CE1-CD1 4.49Å; F213-L247 HydrophobicContact CZ-CB 4.08Å; F214-L247 HydrophobicContact CD2-CD1 4.01Å; F214-L247 HydrophobicContact CE2-CD1 4.29Å; Y224-L247 HydrophobicContact CD2-CB 4.16Å; Y224-L247 HydrophobicContact CD2-CD2 3.81Å; Y224-L247 HydrophobicContact CE2-CB 4.45Å; Y224-L247 HydrophobicContact CE2-CD2 3.99Å; Q243-L247 PolarHBondContact O-N 3.39Å; A244-L247 PolarHBondContact O-N 2.86Å; L247-K249 VanDerWaalsContact C-N 3.3Å; L247-K249 PolarHBondContact O-N 2.96Å; L247-C250 WeakPolarHBondContact O-CB 3.35Å; L247-C250 PolarHBondContact O-N 3.12Å; L247-C250 VanDerWaalsContact O-N 3.16Å; L247-Y251 HydrophobicContact CD1-CD2 4.34Å; L247-Y251 HydrophobicContact CD1-CE2 3.73Å; L247-Y251 HydrophobicContact CD2-CE2 4.23Å; L247-Y251 HydrophobicContact CG-CD2 4.21Å; L247-Y251 HydrophobicContact CG-CE2 3.68Å; L247-Y251 VanDerWaalsContact O-CD2 3.31Å; L247-Y251 WeakPolarHBondContact O-CD2 3.38Å; L247-Y251 PolarHBondContact O-N 3.42Å; L247-Y251 VanDerWaalsContact O-N 3.17Å
248	R	95.4	Very high	92.9	Very high	98 Å²	98	66.5 Å²	66.5	37%	0.37	33%	0.325	S	S	.	.	H	α-helix	trans	-55.6	-46.4	170.3	-161.8	-176.8	-59.5	113.5	5.3	111	N230 A244 C250 Y251 E252	N230-R248 PolarHBondContact O-NH1 3.41Å; N230-R248 PolarHBondContact OD1-NH2 2.91Å; A244-R248 PolarHBondContact O-N 2.96Å; R248-C250 VanDerWaalsContact C-N 3.31Å; R248-C250 PolarHBondContact O-N 3.31Å; R248-Y251 PolarHBondContact O-N 3.27Å; R248-E252 HydrophobicContact CG-CG 4.49Å; R248-E252 WeakPolarHBondContact CG-OE1 3.46Å; R248-E252 WeakPolarHBondContact O-CG 3.37Å; R248-E252 PolarHBondContact O-N 2.82Å
249	K	96.6	Very high	91	Very high	76 Å²	76	63.9 Å²	63.9	33%	0.33	34%	0.337	S	S	.	.	H	α-helix	trans	-64.1	-31.5	178.2	-161.7	52.5	163.6	179.2	0	113.8	V192 I234 C245 R246 L247 E252 V253	V192-K249 HydrophobicContact CG1-CB 4.33Å; V192-K249 HydrophobicContact CG1-CG 4.34Å; I234-K249 HydrophobicContact CG1-CB 4.31Å; C245-K249 WeakPolarHBondContact O-CB 3.4Å; C245-K249 PolarHBondContact O-N 2.72Å; R246-K249 PolarHBondContact O-N 3.21Å; L247-K249 VanDerWaalsContact C-N 3.3Å; L247-K249 PolarHBondContact O-N 2.96Å; K249-E252 HydrophobicContact CD-CB 4.15Å; K249-E252 WeakPolarHBondContact CD-OE2 3.31Å; K249-E252 WeakPolarHBondContact CE-OE2 3.47Å; K249-E252 IonicContact NZ-OE2 2.73Å; K249-E252 PolarHBondContact NZ-OE2 3.26Å; K249-V253 WeakPolarHBondContact O-CG2 3.18Å; K249-V253 PolarHBondContact O-N 3.38Å
250	C	96.2	Very high	88.5	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	37%	0.367	C	S	.	.	H	α-helix	trans	-61.9	-45.3	169.9	-68.7	0	0	0	0	111.8	F214 R246 L247 R248 V253 M255	F214-C250 HydrophobicContact CD2-CB 3.52Å; F214-C250 HydrophobicContact CE2-CB 3.94Å; F214-C250 HydrophobicContact CG-CB 4.4Å; R246-C250 PolarHBondContact O-N 2.89Å; R246-C250 PolarHBondContact O-SG 2.81Å; R246-C250 VanDerWaalsContact O-SG 3.36Å; L247-C250 WeakPolarHBondContact O-CB 3.35Å; L247-C250 PolarHBondContact O-N 3.12Å; L247-C250 VanDerWaalsContact O-N 3.16Å; R248-C250 VanDerWaalsContact C-N 3.31Å; R248-C250 PolarHBondContact O-N 3.31Å; C250-V253 WeakPolarHBondContact O-CG2 3.42Å; C250-M255 HydrophobicContact CB-CB 4.2Å; C250-M255 HydrophobicContact CB-CG 4.24Å; C250-M255 HydrophobicContact CB-SD 3.77Å; C250-M255 VanDerWaalsContact O-CB 3.24Å; C250-M255 WeakPolarHBondContact O-CB 3.43Å; C250-M255 WeakPolarHBondContact O-CG 3.49Å; C250-M255 PolarHBondContact O-N 2.93Å
251	Y	95.3	Very high	86.4	Confident	122 Å²	122	68.6 Å²	68.6	48%	0.478	36%	0.36	S	S	.	.	H	α-helix	trans	-68.9	-42.4	177.4	-66.1	-56.1	0	0	0	112.4	F214 L247 R248 V253 G254	F214-Y251 AromaticContact CE2-CD1 3.9Å; F214-Y251 HydrophobicContact CE2-CD1 3.9Å; F214-Y251 AromaticContact CE2-CE1 3.54Å; F214-Y251 HydrophobicContact CE2-CE1 3.54Å; F214-Y251 HydrophobicContact CZ-CD1 4.25Å; F214-Y251 AromaticContact CZ-CE1 3.83Å; F214-Y251 HydrophobicContact CZ-CE1 3.83Å; L247-Y251 HydrophobicContact CD1-CD2 4.34Å; L247-Y251 HydrophobicContact CD1-CE2 3.73Å; L247-Y251 HydrophobicContact CD2-CE2 4.23Å; L247-Y251 HydrophobicContact CG-CD2 4.21Å; L247-Y251 HydrophobicContact CG-CE2 3.68Å; L247-Y251 VanDerWaalsContact O-CD2 3.31Å; L247-Y251 WeakPolarHBondContact O-CD2 3.38Å; L247-Y251 PolarHBondContact O-N 3.42Å; L247-Y251 VanDerWaalsContact O-N 3.17Å; R248-Y251 PolarHBondContact O-N 3.27Å; Y251-V253 VanDerWaalsContact C-N 3.25Å; Y251-V253 PolarHBondContact O-N 2.92Å; Y251-G254 WeakPolarHBondContact O-CA 3.42Å; Y251-G254 PolarHBondContact O-N 3.25Å
252	E	95.8	Very high	84.1	Confident	109 Å²	109	74.3 Å²	74.3	51%	0.509	37%	0.373	S	S	.	.	H	α-helix	trans	-54.4	-37.3	177.1	-75.5	168.9	-132.2	0	0	113.3	R248 K249 G254	R248-E252 HydrophobicContact CG-CG 4.49Å; R248-E252 WeakPolarHBondContact CG-OE1 3.46Å; R248-E252 WeakPolarHBondContact O-CG 3.37Å; R248-E252 PolarHBondContact O-N 2.82Å; K249-E252 HydrophobicContact CD-CB 4.15Å; K249-E252 WeakPolarHBondContact CD-OE2 3.31Å; K249-E252 WeakPolarHBondContact CE-OE2 3.47Å; K249-E252 IonicContact NZ-OE2 2.73Å; K249-E252 PolarHBondContact NZ-OE2 3.26Å; E252-G254 VanDerWaalsContact C-N 3.32Å
253	V	95.6	Very high	81.4	Confident	44 Å²	44	80.1 Å²	80.1	27%	0.267	40%	0.404	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-3.9	178	-56.9	0	0	0	0	113.6	A191 V192 V204 K249 C250 Y251 M255	A191-V253 HydrophobicContact CB-CB 4.03Å; A191-V253 HydrophobicContact CB-CG1 4.02Å; A191-V253 HydrophobicContact CB-CG2 4.21Å; V192-V253 HydrophobicContact CG2-CG2 3.62Å; V204-V253 HydrophobicContact CG1-CG2 4.13Å; V204-V253 WeakPolarHBondContact CG1-O 3.12Å; V204-V253 HydrophobicContact CG2-CG2 4.24Å; K249-V253 WeakPolarHBondContact O-CG2 3.18Å; K249-V253 PolarHBondContact O-N 3.38Å; C250-V253 WeakPolarHBondContact O-CG2 3.42Å; Y251-V253 VanDerWaalsContact C-N 3.25Å; Y251-V253 PolarHBondContact O-N 2.92Å; V253-M255 HydrophobicContact CG2-CG 4.12Å
254	G	93.3	Very high	79	Confident	29 Å²	29	86.2 Å²	86.2	30%	0.299	42%	0.422	S	S	.	.	T	Hydrogen-bonded Turn	trans	95.1	24.7	177.1	0	0	0	0	0	116.1	Y251 E252 M256	Y251-G254 WeakPolarHBondContact O-CA 3.42Å; Y251-G254 PolarHBondContact O-N 3.25Å; E252-G254 VanDerWaalsContact C-N 3.32Å; G254-M256 PolarHBondContact O-N 3.49Å
255	M	95.1	Very high	76.6	Confident	3 Å²	3	97.2 Å²	97.2	2%	0.015	46%	0.462	C	S	.	.			trans	-70.8	127.4	170.3	-60.3	-170.4	76.3	0	0	110.6	V192 Y202 V204 F214 C250 V253	V192-M255 HydrophobicContact CG2-SD 3.75Å; Y202-M255 HydrophobicContact CD2-CE 3.8Å; Y202-M255 HydrophobicContact CG-CE 4.26Å; Y202-M255 CarbonylContact O-C 3.57Å; Y202-M255 WeakPolarHBondContact O-CA 3.39Å; V204-M255 HydrophobicContact CB-CG 4.42Å; V204-M255 HydrophobicContact CG1-CG 4Å; V204-M255 HydrophobicContact CG2-CE 4.4Å; V204-M255 HydrophobicContact CG2-CG 3.49Å; V204-M255 VanDerWaalsContact CG2-CG 3.49Å; V204-M255 HydrophobicContact CG2-SD 4.01Å; F214-M255 HydrophobicContact CB-CE 3.94Å; F214-M255 HydrophobicContact CB-SD 4.39Å; F214-M255 HydrophobicContact CD1-CB 4.04Å; F214-M255 HydrophobicContact CD1-CE 3.94Å; F214-M255 HydrophobicContact CD2-CB 4.1Å; F214-M255 HydrophobicContact CE1-CB 3.73Å; F214-M255 HydrophobicContact CE2-CB 3.79Å; F214-M255 HydrophobicContact CG-CB 4.22Å; F214-M255 HydrophobicContact CG-CE 3.98Å; F214-M255 HydrophobicContact CG-SD 4.29Å; F214-M255 VanDerWaalsContact CZ-C 3.41Å; F214-M255 HydrophobicContact CZ-CB 3.6Å; F214-M255 WeakPolarHBondContact CZ-O 3.44Å; C250-M255 HydrophobicContact CB-CB 4.2Å; C250-M255 HydrophobicContact CB-CG 4.24Å; C250-M255 HydrophobicContact CB-SD 3.77Å; C250-M255 VanDerWaalsContact O-CB 3.24Å; C250-M255 WeakPolarHBondContact O-CB 3.43Å; C250-M255 WeakPolarHBondContact O-CG 3.49Å; C250-M255 PolarHBondContact O-N 2.93Å; V253-M255 HydrophobicContact CG2-CG 4.12Å
256	M	89.9	Confident	73.5	Confident	105 Å²	105	100.9 Å²	100.9	52%	0.517	50%	0.501	S	S	.	.			trans	-142.7	150.2	-173.6	59.9	-179.4	69.6	0	0	114.2	Y202 G254 G258	Y202-M256 PolarHBondContact O-N 2.81Å; G254-M256 PolarHBondContact O-N 3.49Å; M256-G258 VanDerWaalsContact C-N 3.31Å; M256-G258 PolarHBondContact O-N 3.44Å
257	K	80.3	Confident	70.4	Confident	156 Å²	156	103.4 Å²	103.4	68%	0.678	53%	0.534	S	S	*	.	S	Bend	trans	-83.8	61.4	-176.2	-168	-178.5	177.5	172.6	0	112.2	I218	I218-K257 HydrophobicContact CB-CD 4.23Å; I218-K257 HydrophobicContact CD1-CB 4.07Å; I218-K257 HydrophobicContact CD1-CD 4.39Å; I218-K257 HydrophobicContact CD1-CG 3.97Å; I218-K257 HydrophobicContact CG1-CD 4.27Å; I218-K257 HydrophobicContact CG1-CG 4.38Å; I218-K257 WeakPolarHBondContact O-CE 3.49Å; I218-K257 PolarHBondContact O-NZ 2.8Å
258	G	66.9	Low	67.8	Low	48 Å²	48	114.1 Å²	114.1	50%	0.495	57%	0.573	S	S	.	*			trans	160.2	69.1	179.4	0	0	0	0	0	112.8	M256 I260	M256-G258 VanDerWaalsContact C-N 3.31Å; M256-G258 PolarHBondContact O-N 3.44Å; G258-I260 PolarHBondContact O-N 3Å
259	G	52.7	Low	64.9	Low	68 Å²	68	118.3 Å²	118.3	70%	0.701	60%	0.599	S	S	*	*			trans	-72.8	57.3	-173	0	0	0	0	0	115.3
260	I	40.2	Very low	62.1	Low	157 Å²	157	121.7 Å²	121.7	81%	0.805	62%	0.62	S	S	*	*			trans	-101.4	109.5	169.2	-60.8	176	0	0	0	107.6	G258	G258-I260 PolarHBondContact O-N 3Å
261	R	49.9	Very low	59.2	Low	168 Å²	168	131.6 Å²	131.6	63%	0.634	66%	0.663	S	S	*	*			trans	-70.8	133.7	164.9	-95.9	-171.1	164.5	98.9	5	108.7	Y200 D263	Y200-R261 PolarHBondContact OH-NH1 3.02Å; Y200-R261 PolarHBondContact OH-NH2 3.23Å; R261-D263 PolarHBondContact O-N 3.07Å
262	K	46.4	Very low	56.2	Low	209 Å²	209	134.3 Å²	134.3	91%	0.909	68%	0.68	S	S	*	*			trans	-75.5	80.2	164.8	-173.3	174.8	-175.8	172.7	0	107.9	R264	K262-R264 PolarHBondContact O-N 3.29Å
263	D	39.5	Very low	53.2	Low	128 Å²	128	138.1 Å²	138.1	68%	0.684	70%	0.695	S	S	*	*			trans	-62.1	126.9	-169.8	-81	-33.8	0	0	0	112.7	R261 R265	R261-D263 PolarHBondContact O-N 3.07Å; D263-R265 PolarHBondContact O-N 2.96Å
264	R	44.6	Very low	50.2	Low	231 Å²	231	147.5 Å²	147.5	87%	0.872	73%	0.725	S	S	*	*	S	Bend	trans	-90.6	98.2	173.1	-85.3	-177.7	162.1	-177.9	-5.2	109.6	K262	K262-R264 PolarHBondContact O-N 3.29Å
265	R	44.9	Very low	47.2	Very low	239 Å²	239	155.8 Å²	155.8	90%	0.902	76%	0.756	S	S	*	*	S	Bend	trans	96.1	140.9	174.1	-59.9	171.8	-85.3	-141.3	0.6	114.8	D263	D263-R265 PolarHBondContact O-N 2.96Å
266	G	32	Very low	44.2	Very low	83 Å²	83	165.6 Å²	165.6	86%	0.856	79%	0.793	S	S	*	*			trans	100.3	123.7	-171.7	0	0	0	0	0	111.5
267	G	31.9	Very low	41.4	Very low	75 Å²	75	165.9 Å²	165.9	77%	0.773	80%	0.796	S	S	*	*			cis	135	94.7	-1.8	0	0	0	0	0	111.5
268	R	42.1	Very low	39	Very low	248 Å²	248	166 Å²	166	94%	0.936	81%	0.805	S	S	*	*			trans	0.1	112.4	172.9	-50.9	178.6	-162	175	4.8	117.1
269	M	33.4	Very low	37.4	Very low	186 Å²	186	170.6 Å²	170.6	92%	0.916	82%	0.817	S	S	*	*			trans	-143	134	139.8	-80.3	-149.1	77.2	0	0	110.4
270	L	38.4	Very low	36.4	Very low	147 Å²	147	176.3 Å²	176.3	77%	0.77	83%	0.826	S	S	*	*			trans	-78.2	153.5	175.2	-62.3	87.4	0	0	0	110.3
271	K	34.4	Very low	35.9	Very low	209 Å²	209	172.8 Å²	172.8	91%	0.909	83%	0.828	S	S	*	*			trans	-131.8	52.1	160.3	-155.2	-179.1	179.1	-179.1	0	113.3	K273	K271-K273 PolarHBondContact O-N 3.39Å
272	H	33.7	Very low	35.1	Very low	178 Å²	178	175.6 Å²	175.6	82%	0.824	84%	0.838	S	S	*	*			trans	-68.3	107.1	152.5	-93.4	-71.5	0	0	0	109.1
273	K	32.8	Very low	34.3	Very low	190 Å²	190	171.4 Å²	171.4	83%	0.826	83%	0.826	S	S	*	*			trans	-160.3	141.8	146.2	-143.7	167.9	-176.1	170.4	0	111.9	K271	K271-K273 PolarHBondContact O-N 3.39Å
274	R	32.9	Very low	33.8	Very low	240 Å²	240	173.1 Å²	173.1	91%	0.906	83%	0.83	S	S	*	*			trans	74.7	77.7	173.7	-60.1	-175.5	168.3	168	-4.1	117.2
275	Q	30.3	Very low	33.1	Very low	203 Å²	203	170.7 Å²	170.7	95%	0.949	83%	0.831	S	S	*	*			trans	-148.2	102	133.9	-160.5	170	18.3	0	0	109.1
276	R	30.4	Very low	32.4	Very low	210 Å²	210	163 Å²	163	79%	0.792	83%	0.826	S	S	*	*			trans	175	132.8	176.1	-174.6	179.7	-161.8	-82.7	2.7	106.6
277	D	31.9	Very low	32.3	Very low	110 Å²	110	165.2 Å²	165.2	59%	0.588	82%	0.823	S	S	*	*			cis	-101.5	177.4	-19.7	-54.7	-81.1	0	0	0	108.4
278	D	29.6	Very low	32.2	Very low	159 Å²	159	167.7 Å²	167.7	85%	0.85	83%	0.828	S	S	*	*				-161.1	174	77.2	-136.4	-33	0	0	0	112.6
279	L	33.9	Very low	31.6	Very low	145 Å²	145	159.6 Å²	159.6	76%	0.759	82%	0.822	S	S	*	*			trans	-132.4	170.8	-174.4	-150.7	76.2	0	0	0	112.6
280	E	31.1	Very low	31.4	Very low	188 Å²	188	158.1 Å²	158.1	88%	0.879	82%	0.818	S	S	*	*			trans	73.6	149.2	173.3	-46	-164.6	146.9	0	0	116.8
281	G	29.8	Very low	31.2	Very low	82 Å²	82	158.8 Å²	158.8	85%	0.845	82%	0.819	S	S	*	*			trans	150.6	80.3	-176	0	0	0	0	0	114.5
282	R	33	Very low	31.1	Very low	227 Å²	227	160.5 Å²	160.5	86%	0.857	82%	0.82	S	S	*	*			trans	-91.3	139.3	-164.7	-167.7	-168.8	169.9	-177.2	-2.6	114.3
283	N	29.2	Very low	30.9	Very low	121 Å²	121	156.8 Å²	156.8	65%	0.647	82%	0.82	S	S	*	*			trans	68	164.2	147.6	-90.5	54.7	0	0	0	124.6
284	E	29.8	Very low	30.7	Very low	164 Å²	164	151.4 Å²	151.4	77%	0.766	81%	0.811	S	S	*	*			trans	89.2	152.4	157.4	-64.9	-39.6	109	0	0	122.5
285	M	30.2	Very low	30.6	Very low	181 Å²	181	147 Å²	147	89%	0.892	81%	0.805	S	S	*	*			trans	-112.3	143.8	-172	174.7	94.6	77.4	0	0	109.6
286	G	29.6	Very low	30.6	Very low	78 Å²	78	143.9 Å²	143.9	80%	0.804	80%	0.795	S	S	*	*			trans	-166.3	120	177.2	0	0	0	0	0	115.5
287	T	29.8	Very low	30.6	Very low	128 Å²	128	144.9 Å²	144.9	79%	0.785	80%	0.799	S	S	*	*			trans	-83.6	145.3	-175.7	42.3	0	0	0	0	115.7
288	S	30.5	Very low	30.5	Very low	127 Å²	127	145.2 Å²	145.2	89%	0.888	81%	0.807	S	S	*	*			trans	60.5	131.8	139.5	-55.1	0	0	0	0	121.9
289	G	28.8	Very low	30.5	Very low	79 Å²	79	142.8 Å²	142.8	81%	0.814	80%	0.802	S	S	*	*			trans	173.4	105.4	165.1	0	0	0	0	0	115
290	D	30.3	Very low	30.6	Very low	155 Å²	155	141.6 Å²	141.6	83%	0.829	80%	0.803	S	S	*	*			trans	-61.6	165.5	170.5	-75.6	-70.1	0	0	0	113.7
291	M	33.3	Very low	30.7	Very low	160 Å²	160	140.2 Å²	140.2	79%	0.788	80%	0.801	S	S	*	*			cis	-163.2	155.3	3.7	-136.2	-162.3	-170.9	0	0	110.2
292	R	33	Very low	31.1	Very low	245 Å²	245	142.7 Å²	142.7	93%	0.925	80%	0.799	S	S	*	*				174.5	151.2	119.5	-96	169.2	-175.7	-172.5	0.9	113.9
293	A	28.4	Very low	31.2	Very low	100 Å²	100	137.4 Å²	137.4	83%	0.826	79%	0.787	S	S	*	*			trans	-68.2	169.1	-175.8	0	0	0	0	0	113.3
294	A	29.1	Very low	31.3	Very low	78 Å²	78	140.1 Å²	140.1	65%	0.645	79%	0.793	S	S	*	*			cis	-162.9	178	29.8	0	0	0	0	0	115.7
295	N	30.6	Very low	31.5	Very low	147 Å²	147	139.6 Å²	139.6	79%	0.786	79%	0.79	S	S	*	*			trans	101.2	116.5	151.9	-59.7	-33	0	0	0	120.7
296	L	31.1	Very low	31.7	Very low	138 Å²	138	136.4 Å²	136.4	72%	0.723	78%	0.781	S	S	*	*			trans	79.1	103.4	139.7	-64.7	166.2	0	0	0	121.1
297	W	30.4	Very low	32.6	Very low	231 Å²	231	140.9 Å²	140.9	88%	0.875	78%	0.778	S	S	*	*			trans	67.4	137.2	156.6	-72.3	-51.1	0	0	0	120.3
298	P	30	Very low	33.6	Very low	117 Å²	117	144.1 Å²	144.1	76%	0.76	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-73	129.8	166.5	-5.4	22.3	0	0	0	110.5
299	S	28.6	Very low	34.9	Very low	108 Å²	108	144.2 Å²	144.2	76%	0.755	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-60.6	134.1	159.1	-68	0	0	0	0	109.3	L301	S299-L301 PolarHBondContact O-N 2.89Å
300	P	35.6	Very low	36.8	Very low	120 Å²	120	140.8 Å²	140.8	78%	0.779	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-59.4	142	169.9	26.8	-33.6	0	0	0	109.2	V302	P300-V302 PolarHBondContact O-N 2.92Å
301	L	34.6	Very low	39.2	Very low	159 Å²	159	137.3 Å²	137.3	83%	0.832	72%	0.722	S	S	*	*			trans	-40	120.4	-174	-66	164.2	0	0	0	111.8	S299 I303	S299-L301 PolarHBondContact O-N 2.89Å; L301-I303 PolarHBondContact O-N 2.97Å
302	V	36.7	Very low	41.6	Very low	133 Å²	133	129.9 Å²	129.9	81%	0.806	69%	0.686	S	S	*	*			trans	-68.2	89.8	163.7	179.1	0	0	0	0	106.5	P300 K304	P300-V302 PolarHBondContact O-N 2.92Å; V302-K304 VanDerWaalsContact C-N 3.3Å; V302-K304 PolarHBondContact O-N 3.37Å
303	I	36.6	Very low	44.3	Very low	117 Å²	117	120.1 Å²	120.1	60%	0.6	65%	0.652	S	S	*	*			trans	-59.3	101.8	167.1	-59.8	178.3	0	0	0	105.3	L301 H305	L301-I303 PolarHBondContact O-N 2.97Å; I303-H305 PolarHBondContact O-CD2 3.08Å; I303-H305 PolarHBondContact O-N 3.41Å
304	K	29.7	Very low	47.3	Very low	178 Å²	178	119.9 Å²	119.9	77%	0.774	64%	0.644	S	S	*	*			trans	-62.6	90.7	160.4	-81.4	-176.9	175.2	176.9	0	105.7	V302 T306	V302-K304 VanDerWaalsContact C-N 3.3Å; V302-K304 PolarHBondContact O-N 3.37Å; K304-T306 PolarHBondContact O-N 2.78Å
305	H	35	Very low	50.4	Low	152 Å²	152	118.1 Å²	118.1	70%	0.704	62%	0.623	S	S	*	*			trans	-62.8	80.9	157	-70.1	-90.7	0	0	0	106.5	I303 K307	I303-H305 PolarHBondContact O-CD2 3.08Å; I303-H305 PolarHBondContact O-N 3.41Å; H305-K307 PolarHBondContact O-N 3.46Å
306	T	35.2	Very low	53.6	Low	114 Å²	114	114.6 Å²	114.6	70%	0.699	61%	0.607	S	S	*	*			trans	-56	98.7	157.5	37.8	0	0	0	0	105.1	K304 K308	K304-T306 PolarHBondContact O-N 2.78Å; T306-K308 PolarHBondContact O-N 2.99Å
307	K	47.1	Very low	56.7	Low	173 Å²	173	108.9 Å²	108.9	75%	0.752	58%	0.58	S	S	*	*			trans	-61.9	91.2	173.1	-71.7	-171.6	176.2	-172.1	0	107	H305 N309	H305-K307 PolarHBondContact O-N 3.46Å; K307-N309 VanDerWaalsContact C-N 3.33Å; K307-N309 PolarHBondContact O-N 3.35Å
308	K	50.8	Low	59.8	Low	195 Å²	195	101.6 Å²	101.6	85%	0.848	56%	0.558	S	S	*	*			trans	-55	107.3	155.7	-70.6	-176.2	177.9	-178.6	0	104.4	T306 S310	T306-K308 PolarHBondContact O-N 2.99Å; K308-S310 PolarHBondContact O-N 2.8Å
309	N	58.3	Low	63	Low	129 Å²	129	100.9 Å²	100.9	69%	0.69	55%	0.545	S	S	*	.			trans	-64	110.7	167.9	-72.8	-19.3	0	0	0	105	K307	K307-N309 VanDerWaalsContact C-N 3.33Å; K307-N309 PolarHBondContact O-N 3.35Å
310	S	69.1	Low	66.3	Low	7 Å²	7	95.8 Å²	95.8	5%	0.049	51%	0.509	C	S	.	.			trans	-49.2	133.1	177.9	155.1	0	0	0	0	109.1	K308 A312 L313 D374 H497	K308-S310 PolarHBondContact O-N 2.8Å; S310-A312 PolarHBondContact O-N 3.48Å; S310-A312 VanDerWaalsContact O-N 3.15Å; S310-A312 PolarHBondContact OG-N 2.84Å; S310-L313 PolarHBondContact O-N 3.11Å; S310-D374 VanDerWaalsContact CB-OD2 3.25Å; S310-D374 WeakPolarHBondContact CB-OD2 3.08Å; S310-D374 PolarHBondContact OG-OD2 3.36Å; S310-H497 VanDerWaalsContact CB-CE1 3.43Å; S310-H497 WeakPolarHBondContact CB-CE1 3.43Å; S310-H497 PolarHBondContact OG-CE1 3.05Å
311	P	79.8	Confident	69.3	Low	83 Å²	83	90.7 Å²	90.7	54%	0.539	48%	0.476	S	S	.	.	H	α-helix	trans	-56.4	-32.9	-178.7	22.4	-32.8	0	0	0	111.5	L313 S314	P311-L313 VanDerWaalsContact C-N 3.28Å; P311-L313 PolarHBondContact O-N 2.73Å; P311-S314 WeakPolarHBondContact O-CB 3.35Å; P311-S314 PolarHBondContact O-N 3.49Å; P311-S314 PolarHBondContact O-OG 3Å
312	A	83.8	Confident	72.3	Confident	4 Å²	4	85.9 Å²	85.9	3%	0.033	46%	0.455	C	S	.	.	H	α-helix	trans	-57.5	-35	176.5	0	0	0	0	0	114.1	S310 S314 M320 P370	S310-A312 PolarHBondContact O-N 3.48Å; S310-A312 VanDerWaalsContact O-N 3.15Å; S310-A312 PolarHBondContact OG-N 2.84Å; A312-S314 VanDerWaalsContact C-N 3.26Å; A312-S314 PolarHBondContact O-N 3.05Å; A312-M320 WeakPolarHBondContact O-CE 3.24Å; A312-P370 VanDerWaalsContact CB-C 3.42Å; A312-P370 HydrophobicContact CB-CB 3.58Å
313	L	89.1	Confident	75.2	Confident	40 Å²	40	81 Å²	81	21%	0.209	43%	0.429	C	S	.	.	H	α-helix	trans	-71.6	-23.8	178.4	-59.3	179.3	0	0	0	112.3	S310 P311 R500 V501 K504	S310-L313 PolarHBondContact O-N 3.11Å; P311-L313 VanDerWaalsContact C-N 3.28Å; P311-L313 PolarHBondContact O-N 2.73Å; L313-R500 HydrophobicContact CD1-CB 4.35Å; L313-R500 HydrophobicContact CD2-CB 3.96Å; L313-R500 WeakPolarHBondContact CD2-O 3.41Å; L313-V501 HydrophobicContact CD2-CG2 4.08Å; L313-K504 PolarHBondContact O-NZ 3.06Å
314	S	92.1	Very high	78.2	Confident	95 Å²	95	75.5 Å²	75.5	66%	0.664	40%	0.401	S	S	*	.	H	α-helix	trans	-82.1	-17.5	180	73.8	0	0	0	0	114.6	P311 A312	P311-S314 WeakPolarHBondContact O-CB 3.35Å; P311-S314 PolarHBondContact O-N 3.49Å; P311-S314 PolarHBondContact O-OG 3Å; A312-S314 VanDerWaalsContact C-N 3.26Å; A312-S314 PolarHBondContact O-N 3.05Å
315	L	94.3	Very high	81.4	Confident	40 Å²	40	70.7 Å²	70.7	21%	0.209	38%	0.383	C	S	.	.			trans	-61.5	149.2	-178.1	-57.4	179.5	0	0	0	112.5	Q319 M320 P370 K504	L315-Q319 HydrophobicContact CB-CB 4.05Å; L315-Q319 HydrophobicContact CD2-CB 4.27Å; L315-M320 HydrophobicContact CD1-CE 4.14Å; L315-M320 HydrophobicContact CD1-SD 4.3Å; L315-P370 HydrophobicContact CD1-CB 4Å; L315-P370 HydrophobicContact CD1-CG 4.16Å; L315-K504 WeakPolarHBondContact O-CE 3.25Å; L315-K504 PolarHBondContact O-NZ 3.5Å
316	T	97.1	Very high	84.4	Confident	73 Å²	73	68.7 Å²	68.7	45%	0.448	38%	0.378	S	S	.	.			trans	-73.7	170	162.4	68.2	0	0	0	0	111	Q319 M320	T316-Q319 PolarHBondContact O-N 3.04Å; T316-Q319 WeakPolarHBondContact OG1-CB 3.49Å; T316-Q319 VanDerWaalsContact OG1-CG 3.29Å; T316-Q319 WeakPolarHBondContact OG1-CG 3.24Å; T316-Q319 PolarHBondContact OG1-N 2.87Å; T316-Q319 PolarHBondContact OG1-OE1 3.08Å; T316-M320 WeakPolarHBondContact O-CB 3.46Å; T316-M320 PolarHBondContact O-N 3.29Å
317	A	96.9	Very high	87.3	Confident	18 Å²	18	63.3 Å²	63.3	15%	0.149	35%	0.345	C	S	.	.	H	α-helix	trans	-60.7	-47.2	175.6	0	0	0	0	0	111.7	Q319 M320 V321 T508 H511	A317-Q319 VanDerWaalsContact C-N 3.32Å; A317-Q319 PolarHBondContact O-N 3.22Å; A317-M320 WeakPolarHBondContact O-CB 3.2Å; A317-M320 PolarHBondContact O-N 2.99Å; A317-V321 WeakPolarHBondContact O-CG2 3.13Å; A317-V321 PolarHBondContact O-N 3.26Å; A317-T508 HydrophobicContact CB-CG2 4.25Å; A317-H511 HydrophobicContact CB-CB 3.76Å; A317-H511 VanDerWaalsContact CB-CD2 3.46Å; A317-H511 WeakPolarHBondContact CB-CD2 3.4Å; A317-H511 VanDerWaalsContact CB-CG 3.48Å
318	D	96.4	Very high	89.7	Confident	78 Å²	78	57.5 Å²	57.5	42%	0.417	32%	0.32	S	S	.	.	H	α-helix	trans	-62	-37.3	176.3	-58.8	-75.3	0	0	0	112.8	V321 S322 H511 K515	D318-V321 PolarHBondContact O-N 2.81Å; D318-S322 PolarHBondContact O-N 2.98Å; D318-H511 IonicContact OD2-NE2 2.78Å; D318-K515 IonicContact OD1-NZ 3.04Å; D318-K515 PolarHBondContact OD1-NZ 3.23Å
319	Q	97.6	Very high	91.8	Very high	103 Å²	103	50.3 Å²	50.3	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-68	-38.8	175.5	-74.9	172.3	-24.2	0	0	112.5	L315 T316 A317 A323	L315-Q319 HydrophobicContact CB-CB 4.05Å; L315-Q319 HydrophobicContact CD2-CB 4.27Å; T316-Q319 PolarHBondContact O-N 3.04Å; T316-Q319 WeakPolarHBondContact OG1-CB 3.49Å; T316-Q319 VanDerWaalsContact OG1-CG 3.29Å; T316-Q319 WeakPolarHBondContact OG1-CG 3.24Å; T316-Q319 PolarHBondContact OG1-N 2.87Å; T316-Q319 PolarHBondContact OG1-OE1 3.08Å; A317-Q319 VanDerWaalsContact C-N 3.32Å; A317-Q319 PolarHBondContact O-N 3.22Å; Q319-A323 WeakPolarHBondContact O-CB 3.42Å; Q319-A323 PolarHBondContact O-N 3.32Å
320	M	97.8	Very high	93.4	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-62.2	-45.4	173.3	-177.6	64.5	76.7	0	0	110.5	A312 L315 T316 A317 A323 L324 P370 K504 I505 T508	A312-M320 WeakPolarHBondContact O-CE 3.24Å; L315-M320 HydrophobicContact CD1-CE 4.14Å; L315-M320 HydrophobicContact CD1-SD 4.3Å; T316-M320 WeakPolarHBondContact O-CB 3.46Å; T316-M320 PolarHBondContact O-N 3.29Å; A317-M320 WeakPolarHBondContact O-CB 3.2Å; A317-M320 PolarHBondContact O-N 2.99Å; M320-A323 PolarHBondContact O-N 3.4Å; M320-L324 HydrophobicContact CG-CD1 4.25Å; M320-L324 WeakPolarHBondContact O-CB 3.45Å; M320-L324 VanDerWaalsContact O-CG 3.28Å; M320-L324 WeakPolarHBondContact O-CG 3.36Å; M320-L324 PolarHBondContact O-N 3.08Å; M320-L324 HydrophobicContact SD-CD1 4.4Å; M320-P370 HydrophobicContact CE-CB 4.18Å; M320-P370 HydrophobicContact SD-CB 3.79Å; M320-P370 HydrophobicContact SD-CG 3.78Å; M320-K504 HydrophobicContact CE-CB 4.49Å; M320-K504 HydrophobicContact CE-CG 3.64Å; M320-I505 HydrophobicContact SD-CG1 4.47Å; M320-T508 HydrophobicContact CB-CG2 4.19Å; M320-T508 HydrophobicContact CG-CG2 4.16Å
321	V	98.1	Very high	94.5	Very high	13 Å²	13	53 Å²	53	8%	0.079	31%	0.311	C	S	.	.	H	α-helix	trans	-63.8	-46.7	177.5	172.6	0	0	0	0	111.8	A317 D318 A323 L324 L325 E466 T508 L512	A317-V321 WeakPolarHBondContact O-CG2 3.13Å; A317-V321 PolarHBondContact O-N 3.26Å; D318-V321 PolarHBondContact O-N 2.81Å; V321-A323 PolarHBondContact O-N 3.46Å; V321-L324 PolarHBondContact O-N 3.5Å; V321-L325 HydrophobicContact CG1-CD1 3.83Å; V321-L325 HydrophobicContact CG1-CG 4.32Å; V321-L325 WeakPolarHBondContact O-CG 3.33Å; V321-L325 PolarHBondContact O-N 3.01Å; V321-E466 HydrophobicContact CG1-CB 3.73Å; V321-E466 HydrophobicContact CG1-CG 3.59Å; V321-T508 HydrophobicContact CG2-CG2 3.49Å; V321-T508 VanDerWaalsContact CG2-CG2 3.49Å; V321-L512 HydrophobicContact CG2-CD1 3.97Å; V321-L512 HydrophobicContact CG2-CD2 4.13Å; V321-L512 HydrophobicContact CG2-CG 4.21Å
322	S	98	Very high	95.2	Very high	58 Å²	58	49.6 Å²	49.6	41%	0.406	29%	0.288	S	S	.	.	H	α-helix	trans	-56.1	-54.3	175.5	-165.3	0	0	0	0	110.4	D318 L324 L325 D326	D318-S322 PolarHBondContact O-N 2.98Å; S322-L324 PolarHBondContact O-N 2.85Å; S322-L324 VanDerWaalsContact O-N 3.12Å; S322-L325 PolarHBondContact O-N 3.11Å; S322-D326 VanDerWaalsContact C-OD2 3.24Å; S322-D326 WeakPolarHBondContact O-CB 3.29Å; S322-D326 PolarHBondContact O-N 2.81Å; S322-D326 PolarHBondContact OG-OD2 2.74Å
323	A	97.8	Very high	95.6	Very high	31 Å²	31	56.7 Å²	56.7	26%	0.256	32%	0.315	S	S	.	.	H	α-helix	trans	-57.6	-32.6	-179.3	0	0	0	0	0	113.2	Q319 M320 V321 A327 P370	Q319-A323 WeakPolarHBondContact O-CB 3.42Å; Q319-A323 PolarHBondContact O-N 3.32Å; M320-A323 PolarHBondContact O-N 3.4Å; V321-A323 PolarHBondContact O-N 3.46Å; A323-A327 WeakPolarHBondContact O-CB 3.27Å; A323-A327 PolarHBondContact O-N 2.87Å; A323-A327 VanDerWaalsContact O-N 3.09Å; A323-P370 HydrophobicContact CB-CG 3.76Å
324	L	98.1	Very high	95.7	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-77.6	-33.1	175.8	-71.9	179.9	0	0	0	113.9	M320 V321 S322 V369 V469 S473	M320-L324 HydrophobicContact CG-CD1 4.25Å; M320-L324 WeakPolarHBondContact O-CB 3.45Å; M320-L324 VanDerWaalsContact O-CG 3.28Å; M320-L324 WeakPolarHBondContact O-CG 3.36Å; M320-L324 PolarHBondContact O-N 3.08Å; M320-L324 HydrophobicContact SD-CD1 4.4Å; V321-L324 PolarHBondContact O-N 3.5Å; S322-L324 PolarHBondContact O-N 2.85Å; S322-L324 VanDerWaalsContact O-N 3.12Å; L324-V369 HydrophobicContact CD2-CG1 4.15Å; L324-V369 HydrophobicContact CD2-CG2 4.4Å; L324-V469 HydrophobicContact CB-CB 4.02Å; L324-V469 HydrophobicContact CB-CG2 3.65Å; L324-S473 WeakPolarHBondContact CD2-OG 3.35Å
325	L	97.8	Very high	95.6	Very high	78 Å²	78	56.4 Å²	56.4	41%	0.408	30%	0.303	S	S	.	.	H	α-helix	trans	-71	-47.7	172	-68	168.7	0	0	0	110.9	V321 S322 A327 E328 E466 V469	V321-L325 HydrophobicContact CG1-CD1 3.83Å; V321-L325 HydrophobicContact CG1-CG 4.32Å; V321-L325 WeakPolarHBondContact O-CG 3.33Å; V321-L325 PolarHBondContact O-N 3.01Å; S322-L325 PolarHBondContact O-N 3.11Å; L325-A327 PolarHBondContact O-N 3.35Å; L325-E328 PolarHBondContact O-N 3.5Å; L325-E328 VanDerWaalsContact O-N 3.1Å; L325-E466 HydrophobicContact CD1-CG 4.37Å; L325-V469 HydrophobicContact CD2-CG1 4.08Å; L325-V469 HydrophobicContact CD2-CG2 4.1Å; L325-V469 HydrophobicContact CG-CG2 4.32Å
326	D	96.9	Very high	95.4	Very high	110 Å²	110	58.1 Å²	58.1	59%	0.588	31%	0.307	S	S	*	.	H	α-helix	trans	-62.6	-21.7	176.1	-62.7	-44.5	0	0	0	112.1	S322 R368	S322-D326 VanDerWaalsContact C-OD2 3.24Å; S322-D326 WeakPolarHBondContact O-CB 3.29Å; S322-D326 PolarHBondContact O-N 2.81Å; S322-D326 PolarHBondContact OG-OD2 2.74Å; D326-R368 PolarHBondContact O-NH1 2.96Å
327	A	97.3	Very high	94.7	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-13.4	175.4	0	0	0	0	0	114.7	A323 L325 R368	A323-A327 WeakPolarHBondContact O-CB 3.27Å; A323-A327 PolarHBondContact O-N 2.87Å; A323-A327 VanDerWaalsContact O-N 3.09Å; L325-A327 PolarHBondContact O-N 3.35Å; A327-R368 HydrophobicContact CB-CB 3.61Å; A327-R368 PolarHBondContact O-NE 2.86Å; A327-R368 PolarHBondContact O-NH1 3.41Å; A327-R368 PolarHBondContact O-NH2 3.49Å
328	E	97	Very high	93.8	Very high	51 Å²	51	61.1 Å²	61.1	24%	0.238	32%	0.323	C	S	.	.	P	Polyproline II helix	trans	-59.2	150	-172.3	-80.1	-61.6	95	0	0	113.5	L325 W365 R368 V469 K472	L325-E328 PolarHBondContact O-N 3.5Å; L325-E328 VanDerWaalsContact O-N 3.1Å; E328-W365 VanDerWaalsContact OE1-CD1 3.3Å; E328-W365 PolarHBondContact OE1-NE1 3.09Å; E328-R368 PolarHBondContact O-NH2 2.95Å; E328-V469 HydrophobicContact CG-CG1 3.77Å; E328-K472 IonicContact OE1-NZ 3.65Å; E328-K472 PolarHBondContact OE1-NZ 2.9Å; E328-K472 IonicContact OE2-NZ 3.53Å; E328-K472 PolarHBondContact OE2-NZ 3.42Å
329	P	94.7	Very high	93	Very high	43 Å²	43	62 Å²	62	28%	0.279	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-78	154.4	177.3	33.3	-34.1	0	0	0	111.5	H361	P329-H361 HydrophobicContact CB-CB 4Å
330	P	92.8	Very high	92	Very high	74 Å²	74	65.5 Å²	65.5	48%	0.481	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-67	154.2	173.3	30.6	-35.9	0	0	0	111.6	H361	P330-H361 WeakPolarHBondContact CG-ND1 3.36Å
331	L	90.9	Very high	90.9	Very high	119 Å²	119	71.1 Å²	71.1	62%	0.623	38%	0.381	S	S	*	.	P	Polyproline II helix	trans	-68	132.6	171.6	-66.3	175.3	0	0	0	110.6	P411	L331-P411 HydrophobicContact CB-CG 4.31Å
332	I	93.8	Very high	89.9	Confident	12 Å²	12	73 Å²	73	6%	0.062	39%	0.388	C	S	.	.			trans	-105.8	132.2	179.9	-51.7	-168.7	0	0	0	109.9	L354 R357 E358 H361 A410 P411	I332-L354 HydrophobicContact CB-CD1 4.22Å; I332-L354 HydrophobicContact CG2-CD1 3.95Å; I332-R357 HydrophobicContact CD1-CB 4.23Å; I332-R357 WeakPolarHBondContact CD1-O 3.39Å; I332-R357 HydrophobicContact CG2-CB 4.31Å; I332-R357 VanDerWaalsContact CG2-NH2 3.33Å; I332-E358 HydrophobicContact CB-CG 4.49Å; I332-E358 HydrophobicContact CD1-CB 4.34Å; I332-E358 HydrophobicContact CD1-CG 3.68Å; I332-E358 HydrophobicContact CG1-CG 4.26Å; I332-H361 HydrophobicContact CD1-CB 4.5Å; I332-H361 VanDerWaalsContact CD1-CD2 3.43Å; I332-H361 WeakPolarHBondContact CD1-CD2 3.47Å; I332-A410 WeakPolarHBondContact O-CB 3.46Å; I332-P411 WeakPolarHBondContact O-CD 3.35Å
333	Y	92.8	Very high	89	Confident	152 Å²	152	72.6 Å²	72.6	60%	0.596	39%	0.385	S	S	*	.			trans	-85.6	131.6	169.2	-70.2	-98.6	0	0	0	110.3	R357 P411 N412	Y333-R357 PolarHBondContact O-NH1 3.4Å; Y333-R357 PolarHBondContact O-NH2 3.16Å; Y333-P411 HydrophobicContact CD1-CB 4.2Å; Y333-P411 HydrophobicContact CE1-CB 3.76Å; Y333-P411 HydrophobicContact CE1-CG 4.3Å; Y333-N412 HydrophobicContact CD1-CB 4.17Å
334	S	92.8	Very high	87.8	Confident	7 Å²	7	72.9 Å²	72.9	5%	0.049	38%	0.381	C	S	.	.			trans	-72.1	161.3	174.2	71.4	0	0	0	0	111.6	Y336 N412 L413	S334-Y336 PolarHBondContact O-N 3.48Å; S334-Y336 VanDerWaalsContact O-N 3.1Å; S334-Y336 WeakPolarHBondContact OG-CB 3.39Å; S334-Y336 PolarHBondContact OG-N 3.34Å; S334-N412 PolarHBondContact N-OD1 3.39Å; S334-N412 PolarHBondContact O-ND2 2.98Å; S334-N412 PolarHBondContact OG-ND2 3.16Å; S334-N412 PolarHBondContact OG-OD1 3.1Å; S334-L413 WeakPolarHBondContact OG-CB 3.42Å
335	E	89.9	Confident	87	Confident	122 Å²	122	75 Å²	75	57%	0.57	40%	0.398	S	S	*	.			trans	-82.5	35.8	173.2	-69.9	167.6	-145.7	0	0	112.3	D337 L350 N353 R357	E335-D337 PolarHBondContact O-N 3.41Å; E335-L350 VanDerWaalsContact C-CD1 3.49Å; E335-L350 HydrophobicContact CB-CD1 4.35Å; E335-N353 PolarHBondContact OE1-ND2 2.94Å; E335-N353 PolarHBondContact OE1-OD1 2.94Å; E335-N353 PolarHBondContact OE2-ND2 3.3Å; E335-R357 IonicContact OE1-NH1 3.15Å; E335-R357 PolarHBondContact OE1-NH1 3.39Å
336	Y	88.1	Confident	86.3	Confident	76 Å²	76	73.6 Å²	73.6	30%	0.298	40%	0.395	S	S	.	.			trans	-70.2	123.3	-179.1	176.4	-124.2	0	0	0	111.6	S334 P338 F342 L350 N412 L413	S334-Y336 PolarHBondContact O-N 3.48Å; S334-Y336 VanDerWaalsContact O-N 3.1Å; S334-Y336 WeakPolarHBondContact OG-CB 3.39Å; S334-Y336 PolarHBondContact OG-N 3.34Å; Y336-P338 HydrophobicContact CD1-CG 4.22Å; Y336-P338 HydrophobicContact CE1-CB 4.27Å; Y336-P338 HydrophobicContact CE1-CG 3.78Å; Y336-F342 HydrophobicContact CD2-CE1 4.22Å; Y336-F342 AromaticContact CD2-CZ 3.85Å; Y336-F342 HydrophobicContact CD2-CZ 3.85Å; Y336-F342 HydrophobicContact CE2-CE1 4.03Å; Y336-F342 AromaticContact CE2-CE2 3.95Å; Y336-F342 HydrophobicContact CE2-CE2 3.95Å; Y336-F342 AromaticContact CE2-CZ 3.38Å; Y336-F342 HydrophobicContact CE2-CZ 3.38Å; Y336-L350 HydrophobicContact CD2-CD2 4Å; Y336-L350 HydrophobicContact CG-CD2 4.43Å; Y336-N412 VanDerWaalsContact CD1-O 3.28Å; Y336-N412 WeakPolarHBondContact CD1-O 3.46Å; Y336-L413 HydrophobicContact CD2-CD1 4.32Å; Y336-L413 HydrophobicContact CG-CD1 4.15Å
337	D	83.4	Confident	85.7	Confident	54 Å²	54	68.4 Å²	68.4	29%	0.289	37%	0.368	S	S	.	.			trans	-109.9	105.6	176.3	179.7	-8.7	0	0	0	109.5	E335 S339 R340	E335-D337 PolarHBondContact O-N 3.41Å; D337-S339 VanDerWaalsContact CG-OG 3.26Å; D337-S339 PolarHBondContact O-N 3.29Å; D337-S339 VanDerWaalsContact O-N 3.08Å; D337-S339 VanDerWaalsContact OD1-CB 3.31Å; D337-S339 WeakPolarHBondContact OD1-CB 3.31Å; D337-S339 PolarHBondContact OD1-N 3.03Å; D337-S339 PolarHBondContact OD1-OG 3.28Å; D337-S339 PolarHBondContact OD2-OG 2.91Å; D337-R340 HydrophobicContact CB-CG 4.22Å; D337-R340 PolarHBondContact O-N 3.07Å; D337-R340 VanDerWaalsContact O-N 3.15Å; D337-R340 IonicContact OD2-CZ 3.43Å; D337-R340 IonicContact OD2-NE 3.67Å; D337-R340 PolarHBondContact OD2-NE 2.99Å; D337-R340 IonicContact OD2-NH2 2.69Å; D337-R340 PolarHBondContact OD2-NH2 3.07Å
338	P	78.1	Confident	85.2	Confident	100 Å²	100	68.8 Å²	68.8	65%	0.649	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-12.5	-179.9	-22.6	33	0	0	0	115.1	Y336 R340	Y336-P338 HydrophobicContact CD1-CG 4.22Å; Y336-P338 HydrophobicContact CE1-CB 4.27Å; Y336-P338 HydrophobicContact CE1-CG 3.78Å; P338-R340 VanDerWaalsContact C-N 3.3Å
339	S	79.3	Confident	84.8	Confident	98 Å²	98	67.5 Å²	67.5	69%	0.685	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-10.8	177.1	74.5	0	0	0	0	113.5	D337	D337-S339 VanDerWaalsContact CG-OG 3.26Å; D337-S339 PolarHBondContact O-N 3.29Å; D337-S339 VanDerWaalsContact O-N 3.08Å; D337-S339 VanDerWaalsContact OD1-CB 3.31Å; D337-S339 WeakPolarHBondContact OD1-CB 3.31Å; D337-S339 PolarHBondContact OD1-N 3.03Å; D337-S339 PolarHBondContact OD1-OG 3.28Å; D337-S339 PolarHBondContact OD2-OG 2.91Å
340	R	76.2	Confident	84.6	Confident	175 Å²	175	66.4 Å²	66.4	66%	0.66	36%	0.361	S	S	*	.	S	Bend	trans	-104.6	131.6	-176.7	-59.5	-176.6	-163.9	-147.3	0.1	111.7	D337 P338	D337-R340 HydrophobicContact CB-CG 4.22Å; D337-R340 PolarHBondContact O-N 3.07Å; D337-R340 VanDerWaalsContact O-N 3.15Å; D337-R340 IonicContact OD2-CZ 3.43Å; D337-R340 IonicContact OD2-NE 3.67Å; D337-R340 PolarHBondContact OD2-NE 2.99Å; D337-R340 IonicContact OD2-NH2 2.69Å; D337-R340 PolarHBondContact OD2-NH2 3.07Å; P338-R340 VanDerWaalsContact C-N 3.3Å
341	P	75.8	Confident	84.6	Confident	119 Å²	119	63.8 Å²	63.8	77%	0.773	34%	0.343	S	S	*	.			trans	-70.2	144.5	172.3	30.4	-34.3	0	0	0	110.9	S343	P341-S343 PolarHBondContact O-N 3.48Å
342	F	76.8	Confident	84.6	Confident	54 Å²	54	58.4 Å²	58.4	24%	0.237	32%	0.315	C	S	.	.			trans	-73.2	115.6	175.4	-74.5	-64.6	0	0	0	111.8	Y336 M347 L350 L413 L415 I419 L423	Y336-F342 HydrophobicContact CD2-CE1 4.22Å; Y336-F342 AromaticContact CD2-CZ 3.85Å; Y336-F342 HydrophobicContact CD2-CZ 3.85Å; Y336-F342 HydrophobicContact CE2-CE1 4.03Å; Y336-F342 AromaticContact CE2-CE2 3.95Å; Y336-F342 HydrophobicContact CE2-CE2 3.95Å; Y336-F342 AromaticContact CE2-CZ 3.38Å; Y336-F342 HydrophobicContact CE2-CZ 3.38Å; F342-M347 HydrophobicContact CB-CE 4.2Å; F342-M347 HydrophobicContact CD1-CB 4.15Å; F342-M347 HydrophobicContact CD1-CE 4.03Å; F342-M347 HydrophobicContact CD2-CE 4.37Å; F342-M347 HydrophobicContact CE1-CE 4.48Å; F342-M347 HydrophobicContact CG-CE 3.97Å; F342-L350 HydrophobicContact CE1-CD2 4.04Å; F342-L413 HydrophobicContact CZ-CD1 4.38Å; F342-L415 HydrophobicContact CE2-CD2 4.44Å; F342-L415 HydrophobicContact CZ-CD2 4.15Å; F342-I419 HydrophobicContact CD2-CG2 4.06Å; F342-I419 HydrophobicContact CE2-CG2 4.22Å; F342-L423 HydrophobicContact CB-CD1 4.29Å
343	S	77.9	Confident	84.5	Confident	48 Å²	48	58.3 Å²	58.3	34%	0.336	32%	0.315	S	S	.	.			trans	-101.5	161.7	157.4	71.1	0	0	0	0	111.5	P341 A345 S346 M347	P341-S343 PolarHBondContact O-N 3.48Å; S343-A345 VanDerWaalsContact C-N 3.34Å; S343-A345 PolarHBondContact O-N 3.03Å; S343-S346 PolarHBondContact N-OG 3.45Å; S343-S346 PolarHBondContact O-N 3.26Å; S343-S346 VanDerWaalsContact O-N 3.08Å; S343-S346 PolarHBondContact O-OG 3.5Å; S343-S346 WeakPolarHBondContact OG-CB 3.49Å; S343-S346 PolarHBondContact OG-N 3.44Å; S343-S346 PolarHBondContact OG-OG 2.91Å; S343-M347 PolarHBondContact O-N 3.12Å
344	E	74.3	Confident	84.6	Confident	38 Å²	38	51.4 Å²	51.4	18%	0.178	29%	0.288	C	S	.	.	H	α-helix	trans	-44.9	-54.6	176.1	-167	-173.9	-170.6	0	0	112.6	M347 M348 K439 V441 V556	E344-M347 PolarHBondContact O-N 3.48Å; E344-M348 WeakPolarHBondContact O-CB 3.41Å; E344-M348 WeakPolarHBondContact O-CG 3.43Å; E344-M348 PolarHBondContact O-N 3.39Å; E344-K439 VanDerWaalsContact CB-O 3.32Å; E344-K439 WeakPolarHBondContact CB-O 3.37Å; E344-K439 VanDerWaalsContact CG-O 3.29Å; E344-K439 WeakPolarHBondContact CG-O 3.32Å; E344-V441 HydrophobicContact CG-CB 4.19Å; E344-V441 HydrophobicContact CG-CG1 3.95Å; E344-V441 HydrophobicContact CG-CG2 4.01Å; E344-V556 HydrophobicContact CG-CG1 4.27Å
345	A	79.9	Confident	84.7	Confident	43 Å²	43	52 Å²	52	36%	0.355	29%	0.293	S	S	.	.	H	α-helix	trans	-66.8	-37.5	-179.6	0	0	0	0	0	113.1	S343 G349 V556 V557	S343-A345 VanDerWaalsContact C-N 3.34Å; S343-A345 PolarHBondContact O-N 3.03Å; A345-G349 PolarHBondContact O-N 3.48Å; A345-V556 HydrophobicContact CB-CG1 4.1Å; A345-V556 WeakPolarHBondContact CB-O 3.35Å; A345-V557 VanDerWaalsContact O-CG1 3.29Å; A345-V557 WeakPolarHBondContact O-CG1 3.43Å
346	S	83.9	Confident	84.8	Confident	49 Å²	49	47.2 Å²	47.2	34%	0.343	27%	0.272	S	S	.	.	H	α-helix	trans	-68	-40	177.6	70.4	0	0	0	0	112.6	S343 G349 L350	S343-S346 PolarHBondContact N-OG 3.45Å; S343-S346 PolarHBondContact O-N 3.26Å; S343-S346 VanDerWaalsContact O-N 3.08Å; S343-S346 PolarHBondContact O-OG 3.5Å; S343-S346 WeakPolarHBondContact OG-CB 3.49Å; S343-S346 PolarHBondContact OG-N 3.44Å; S343-S346 PolarHBondContact OG-OG 2.91Å; S346-G349 PolarHBondContact O-N 3.38Å; S346-L350 WeakPolarHBondContact O-CB 3.36Å; S346-L350 PolarHBondContact O-N 2.69Å
347	M	84.5	Confident	85.1	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	27%	0.272	C	S	.	.	H	α-helix	trans	-68.9	-46.7	177.7	-179.1	177	-74.6	0	0	110.5	F342 S343 E344 G349 L350 L351 I419 I420 L423	F342-M347 HydrophobicContact CB-CE 4.2Å; F342-M347 HydrophobicContact CD1-CB 4.15Å; F342-M347 HydrophobicContact CD1-CE 4.03Å; F342-M347 HydrophobicContact CD2-CE 4.37Å; F342-M347 HydrophobicContact CE1-CE 4.48Å; F342-M347 HydrophobicContact CG-CE 3.97Å; S343-M347 PolarHBondContact O-N 3.12Å; E344-M347 PolarHBondContact O-N 3.48Å; M347-G349 VanDerWaalsContact C-N 3.32Å; M347-G349 PolarHBondContact O-N 2.8Å; M347-L350 PolarHBondContact O-N 2.67Å; M347-L351 HydrophobicContact CG-CD1 4.27Å; M347-L351 VanDerWaalsContact O-CG 3.31Å; M347-L351 WeakPolarHBondContact O-CG 3.46Å; M347-L351 PolarHBondContact O-N 2.83Å; M347-I419 HydrophobicContact CE-CG2 3.95Å; M347-I420 HydrophobicContact CE-CD1 3.93Å; M347-I420 HydrophobicContact SD-CD1 3.64Å; M347-L423 HydrophobicContact CE-CD1 3.48Å; M347-L423 VanDerWaalsContact CE-CD1 3.48Å; M347-L423 HydrophobicContact SD-CD1 4.08Å
348	M	87.2	Confident	85.7	Confident	8 Å²	8	46.3 Å²	46.3	4%	0.039	27%	0.265	C	S	.	.	H	α-helix	trans	-63.6	-38.1	176.1	-72.6	-52.4	-58.8	0	0	112.2	E344 L351 T352 V441 M444 M551 V557	E344-M348 WeakPolarHBondContact O-CB 3.41Å; E344-M348 WeakPolarHBondContact O-CG 3.43Å; E344-M348 PolarHBondContact O-N 3.39Å; M348-L351 PolarHBondContact O-N 3.35Å; M348-L351 HydrophobicContact SD-CD1 4.48Å; M348-T352 WeakPolarHBondContact O-CG2 3.41Å; M348-T352 PolarHBondContact O-N 3.34Å; M348-T352 PolarHBondContact O-OG1 2.89Å; M348-T352 VanDerWaalsContact O-OG1 3.11Å; M348-V441 HydrophobicContact CG-CB 4.38Å; M348-V441 HydrophobicContact CG-CG1 3.57Å; M348-V441 HydrophobicContact CG-CG2 3.94Å; M348-V441 HydrophobicContact SD-CB 4.33Å; M348-V441 HydrophobicContact SD-CG1 3.79Å; M348-V441 HydrophobicContact SD-CG2 4Å; M348-M444 HydrophobicContact SD-CE 4Å; M348-M444 HydrophobicContact SD-CG 4.43Å; M348-M551 HydrophobicContact CE-CG 4.26Å; M348-V557 HydrophobicContact CB-CG1 3.66Å; M348-V557 HydrophobicContact CB-CG2 4.26Å
349	G	88.5	Confident	86.5	Confident	24 Å²	24	41.6 Å²	41.6	25%	0.247	23%	0.234	C	C	.	.	H	α-helix	trans	-67.7	-38.7	179.7	0	0	0	0	0	112.4	A345 S346 M347 T352 N353	A345-G349 PolarHBondContact O-N 3.48Å; S346-G349 PolarHBondContact O-N 3.38Å; M347-G349 VanDerWaalsContact C-N 3.32Å; M347-G349 PolarHBondContact O-N 2.8Å; G349-T352 PolarHBondContact O-OG1 3.15Å; G349-N353 VanDerWaalsContact O-CB 3.24Å; G349-N353 WeakPolarHBondContact O-CB 3.36Å; G349-N353 PolarHBondContact O-N 2.92Å
350	L	89.9	Confident	87.2	Confident	20 Å²	20	38.8 Å²	38.8	11%	0.105	21%	0.213	C	C	.	.	H	α-helix	trans	-63.6	-40.8	172.8	-178.9	62.3	0	0	0	111.8	E335 Y336 F342 S346 M347 L354 L413	E335-L350 VanDerWaalsContact C-CD1 3.49Å; E335-L350 HydrophobicContact CB-CD1 4.35Å; Y336-L350 HydrophobicContact CD2-CD2 4Å; Y336-L350 HydrophobicContact CG-CD2 4.43Å; F342-L350 HydrophobicContact CE1-CD2 4.04Å; S346-L350 WeakPolarHBondContact O-CB 3.36Å; S346-L350 PolarHBondContact O-N 2.69Å; M347-L350 PolarHBondContact O-N 2.67Å; L350-L354 WeakPolarHBondContact O-CB 3.34Å; L350-L354 PolarHBondContact O-N 3.12Å; L350-L354 VanDerWaalsContact O-N 3.14Å; L350-L413 HydrophobicContact CD2-CD1 3.82Å; L350-L413 HydrophobicContact CD2-CD2 3.73Å; L350-L413 HydrophobicContact CD2-CG 4.44Å; L350-L413 HydrophobicContact CG-CD2 3.91Å
351	L	91.8	Very high	88.2	Confident	20 Å²	20	33.3 Å²	33.3	11%	0.105	20%	0.195	C	C	.	.	H	α-helix	trans	-72.4	-37.3	178.1	-68.2	177.2	0	0	0	112.8	M347 M348 A355 F409 L413 L415 M444	M347-L351 HydrophobicContact CG-CD1 4.27Å; M347-L351 VanDerWaalsContact O-CG 3.31Å; M347-L351 WeakPolarHBondContact O-CG 3.46Å; M347-L351 PolarHBondContact O-N 2.83Å; M348-L351 PolarHBondContact O-N 3.35Å; M348-L351 HydrophobicContact SD-CD1 4.48Å; L351-A355 WeakPolarHBondContact O-CB 3.31Å; L351-A355 PolarHBondContact O-N 3.29Å; L351-F409 HydrophobicContact CD2-CD1 3.46Å; L351-F409 VanDerWaalsContact CD2-CD1 3.46Å; L351-F409 HydrophobicContact CD2-CD2 4.47Å; L351-F409 HydrophobicContact CD2-CE1 3.61Å; L351-F409 HydrophobicContact CD2-CG 3.93Å; L351-F409 HydrophobicContact CD2-CZ 4.2Å; L351-L413 HydrophobicContact CD2-CD2 4.38Å; L351-L415 HydrophobicContact CD2-CD1 4.43Å; L351-M444 HydrophobicContact CD1-CE 3.72Å
352	T	92.3	Very high	89.2	Confident	6 Å²	6	28 Å²	28	4%	0.037	16%	0.16	C	C	.	.	H	α-helix	trans	-74.7	-35.5	177.2	56	0	0	0	0	112.5	M348 G349 A355 D356 L548 V557 L559 L563	M348-T352 WeakPolarHBondContact O-CG2 3.41Å; M348-T352 PolarHBondContact O-N 3.34Å; M348-T352 PolarHBondContact O-OG1 2.89Å; M348-T352 VanDerWaalsContact O-OG1 3.11Å; G349-T352 PolarHBondContact O-OG1 3.15Å; T352-A355 PolarHBondContact O-N 3.42Å; T352-D356 WeakPolarHBondContact O-CB 3.41Å; T352-D356 PolarHBondContact O-N 3.24Å; T352-L548 HydrophobicContact CG2-CD1 3.85Å; T352-V557 HydrophobicContact CG2-CG2 4.24Å; T352-L559 HydrophobicContact CG2-CD2 3.6Å; T352-L563 HydrophobicContact CG2-CD2 4.05Å
353	N	92.1	Very high	90	Very high	9 Å²	9	25.5 Å²	25.5	5%	0.048	15%	0.149	C	C	.	.	H	α-helix	trans	-57.5	-49.1	168.1	171.2	-85.7	0	0	0	111.7	E335 G349 A355 D356 R357 Y560	E335-N353 PolarHBondContact OE1-ND2 2.94Å; E335-N353 PolarHBondContact OE1-OD1 2.94Å; E335-N353 PolarHBondContact OE2-ND2 3.3Å; G349-N353 VanDerWaalsContact O-CB 3.24Å; G349-N353 WeakPolarHBondContact O-CB 3.36Å; G349-N353 PolarHBondContact O-N 2.92Å; N353-A355 PolarHBondContact O-N 3.07Å; N353-D356 PolarHBondContact O-N 3.05Å; N353-R357 WeakPolarHBondContact O-CG 3.19Å; N353-R357 PolarHBondContact O-N 3.24Å; N353-R357 VanDerWaalsContact O-N 3.13Å; N353-R357 PolarHBondContact OD1-NH1 2.9Å; N353-Y560 HydrophobicContact CB-CE2 4.08Å; N353-Y560 PolarHBondContact ND2-OH 3.02Å; N353-Y560 VanDerWaalsContact ND2-OH 3.11Å
354	L	93.9	Very high	90.8	Very high	7 Å²	7	24.5 Å²	24.5	4%	0.037	14%	0.14	C	C	.	.	H	α-helix	trans	-64.2	-41.1	179.2	-176.4	63.4	0	0	0	111.5	I332 L350 R357 E358 F409 A410 L413	I332-L354 HydrophobicContact CB-CD1 4.22Å; I332-L354 HydrophobicContact CG2-CD1 3.95Å; L350-L354 WeakPolarHBondContact O-CB 3.34Å; L350-L354 PolarHBondContact O-N 3.12Å; L350-L354 VanDerWaalsContact O-N 3.14Å; L354-R357 PolarHBondContact O-N 2.82Å; L354-E358 PolarHBondContact O-N 3.33Å; L354-F409 HydrophobicContact CD2-CB 3.88Å; L354-A410 HydrophobicContact CD1-CB 4.31Å; L354-A410 HydrophobicContact CD2-CB 4.1Å; L354-L413 HydrophobicContact CD2-CD2 4.5Å
355	A	95.1	Very high	91.9	Very high	19 Å²	19	22.8 Å²	22.8	16%	0.157	13%	0.132	C	C	.	.	H	α-helix	trans	-64.6	-42.1	177.9	0	0	0	0	0	113	L351 T352 N353 R357 E358 L359 L392 L563	L351-A355 WeakPolarHBondContact O-CB 3.31Å; L351-A355 PolarHBondContact O-N 3.29Å; T352-A355 PolarHBondContact O-N 3.42Å; N353-A355 PolarHBondContact O-N 3.07Å; A355-R357 VanDerWaalsContact C-N 3.35Å; A355-E358 PolarHBondContact O-N 3.39Å; A355-L359 WeakPolarHBondContact O-CB 3.48Å; A355-L359 WeakPolarHBondContact O-CG 3.42Å; A355-L359 PolarHBondContact O-N 3.12Å; A355-L392 HydrophobicContact CB-CD1 3.99Å; A355-L563 HydrophobicContact CB-CD1 4.5Å; A355-L563 HydrophobicContact CB-CD2 4.48Å
356	D	92.9	Very high	92.8	Very high	23 Å²	23	20.7 Å²	20.7	12%	0.123	12%	0.115	C	C	.	.	H	α-helix	trans	-63.7	-41.1	176.5	-167.8	76.4	0	0	0	111.7	T352 N353 L359 V360 Y560 L563	T352-D356 WeakPolarHBondContact O-CB 3.41Å; T352-D356 PolarHBondContact O-N 3.24Å; N353-D356 PolarHBondContact O-N 3.05Å; D356-L359 WeakPolarHBondContact O-CB 3.4Å; D356-L359 PolarHBondContact O-N 3.44Å; D356-V360 PolarHBondContact O-N 3.39Å; D356-Y560 HydrophobicContact CB-CD2 3.9Å; D356-Y560 HydrophobicContact CB-CG 4.14Å; D356-Y560 VanDerWaalsContact CG-CB 3.4Å; D356-Y560 WeakPolarHBondContact OD1-CB 3.48Å; D356-L563 HydrophobicContact CB-CB 4.18Å; D356-L563 WeakPolarHBondContact OD1-CB 3.36Å; D356-L563 PolarHBondContact OD1-N 2.96Å
357	R	93.3	Very high	93.3	Very high	81 Å²	81	21.1 Å²	21.1	31%	0.306	11%	0.11	S	C	.	.	H	α-helix	trans	-67.7	-39	175.2	-68.2	168.8	61.9	-149.7	-8.3	112	I332 Y333 E335 N353 L354 A355 V360 H361	I332-R357 HydrophobicContact CD1-CB 4.23Å; I332-R357 WeakPolarHBondContact CD1-O 3.39Å; I332-R357 HydrophobicContact CG2-CB 4.31Å; I332-R357 VanDerWaalsContact CG2-NH2 3.33Å; Y333-R357 PolarHBondContact O-NH1 3.4Å; Y333-R357 PolarHBondContact O-NH2 3.16Å; E335-R357 IonicContact OE1-NH1 3.15Å; E335-R357 PolarHBondContact OE1-NH1 3.39Å; N353-R357 WeakPolarHBondContact O-CG 3.19Å; N353-R357 PolarHBondContact O-N 3.24Å; N353-R357 VanDerWaalsContact O-N 3.13Å; N353-R357 PolarHBondContact OD1-NH1 2.9Å; L354-R357 PolarHBondContact O-N 2.82Å; A355-R357 VanDerWaalsContact C-N 3.35Å; R357-V360 PolarHBondContact O-N 3.25Å; R357-H361 PolarHBondContact O-CD2 2.91Å
358	E	95.8	Very high	93.9	Very high	29 Å²	29	26.5 Å²	26.5	14%	0.136	13%	0.131	C	C	.	.	H	α-helix	trans	-68.1	-32.4	172.9	-74.5	-165	175.6	0	0	112.8	I332 L354 A355 H361 M362 L392 R399	I332-E358 HydrophobicContact CB-CG 4.49Å; I332-E358 HydrophobicContact CD1-CB 4.34Å; I332-E358 HydrophobicContact CD1-CG 3.68Å; I332-E358 HydrophobicContact CG1-CG 4.26Å; L354-E358 PolarHBondContact O-N 3.33Å; A355-E358 PolarHBondContact O-N 3.39Å; E358-H361 PolarHBondContact O-N 3.21Å; E358-M362 WeakPolarHBondContact O-CB 3.36Å; E358-M362 PolarHBondContact O-N 2.64Å; E358-L392 HydrophobicContact CB-CD2 3.54Å; E358-R399 VanDerWaalsContact CD-NH2 3.29Å; E358-R399 IonicContact OE1-CZ 3.38Å; E358-R399 IonicContact OE1-NH1 3.61Å; E358-R399 PolarHBondContact OE1-NH1 3.34Å; E358-R399 IonicContact OE1-NH2 3.1Å; E358-R399 PolarHBondContact OE1-NH2 3.45Å; E358-R399 IonicContact OE2-NH2 2.76Å; E358-R399 PolarHBondContact OE2-NH2 2.96Å
359	L	95.4	Very high	94.4	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-59.8	-44.3	173.3	-81.4	167.3	0	0	0	112.3	A355 D356 H361 M362 I363 W388 L562 L563 M566	A355-L359 WeakPolarHBondContact O-CB 3.48Å; A355-L359 WeakPolarHBondContact O-CG 3.42Å; A355-L359 PolarHBondContact O-N 3.12Å; D356-L359 WeakPolarHBondContact O-CB 3.4Å; D356-L359 PolarHBondContact O-N 3.44Å; L359-H361 VanDerWaalsContact C-N 3.28Å; L359-H361 PolarHBondContact O-N 3.48Å; L359-M362 HydrophobicContact CD2-CE 3.87Å; L359-M362 HydrophobicContact CD2-SD 4.33Å; L359-M362 WeakPolarHBondContact O-CB 3.04Å; L359-M362 PolarHBondContact O-N 3.17Å; L359-M362 VanDerWaalsContact O-N 3.12Å; L359-I363 WeakPolarHBondContact O-CG1 3.36Å; L359-I363 PolarHBondContact O-N 2.87Å; L359-W388 HydrophobicContact CD1-CE3 4.29Å; L359-W388 HydrophobicContact CD2-CB 3.69Å; L359-W388 HydrophobicContact CD2-CD2 4.14Å; L359-W388 HydrophobicContact CD2-CE3 3.92Å; L359-W388 HydrophobicContact CD2-CG 4.09Å; L359-W388 HydrophobicContact CG-CE3 4.37Å; L359-L562 HydrophobicContact CB-CD2 3.91Å; L359-L562 HydrophobicContact CB-CG 4.47Å; L359-L563 HydrophobicContact CD1-CB 4.09Å; L359-L563 HydrophobicContact CD1-CD1 3.75Å; L359-M566 HydrophobicContact CD1-CB 4.49Å; L359-M566 HydrophobicContact CD1-CG 4.02Å; L359-M566 HydrophobicContact CD2-CE 4.24Å; L359-M566 HydrophobicContact CD2-CG 4.13Å
360	V	94.3	Very high	94.8	Very high	40 Å²	40	26 Å²	26	24%	0.242	12%	0.123	C	C	.	.	H	α-helix	trans	-57.8	-40.3	176.9	169	0	0	0	0	111.9	D356 R357 N364 L562	D356-V360 PolarHBondContact O-N 3.39Å; R357-V360 PolarHBondContact O-N 3.25Å; V360-N364 PolarHBondContact O-ND2 3.35Å; V360-N364 VanDerWaalsContact O-ND2 3.14Å; V360-L562 HydrophobicContact CG2-CD2 3.89Å
361	H	95.8	Very high	94.9	Very high	60 Å²	60	25.3 Å²	25.3	28%	0.278	12%	0.122	S	C	.	.	H	α-helix	trans	-79.4	-29	176.1	-72.7	-80.4	0	0	0	112.9	P329 P330 I332 R357 E358 L359 N364 W365	P329-H361 HydrophobicContact CB-CB 4Å; P330-H361 WeakPolarHBondContact CG-ND1 3.36Å; I332-H361 HydrophobicContact CD1-CB 4.5Å; I332-H361 VanDerWaalsContact CD1-CD2 3.43Å; I332-H361 WeakPolarHBondContact CD1-CD2 3.47Å; R357-H361 PolarHBondContact O-CD2 2.91Å; E358-H361 PolarHBondContact O-N 3.21Å; L359-H361 VanDerWaalsContact C-N 3.28Å; L359-H361 PolarHBondContact O-N 3.48Å; H361-N364 CarbonylContact O-C 3.56Å; H361-N364 PolarHBondContact O-N 3.14Å; H361-W365 WeakPolarHBondContact O-CB 3.39Å; H361-W365 PolarHBondContact O-N 2.86Å
362	M	97.4	Very high	95	Very high	6 Å²	6	24.4 Å²	24.4	3%	0.03	12%	0.117	C	C	.	.	H	α-helix	trans	-63.1	-41.4	174	-171.6	-162.8	-55.1	0	0	112.1	E358 L359 N364 W365 A366 L384 W388 I391 L392	E358-M362 WeakPolarHBondContact O-CB 3.36Å; E358-M362 PolarHBondContact O-N 2.64Å; L359-M362 HydrophobicContact CD2-CE 3.87Å; L359-M362 HydrophobicContact CD2-SD 4.33Å; L359-M362 WeakPolarHBondContact O-CB 3.04Å; L359-M362 PolarHBondContact O-N 3.17Å; L359-M362 VanDerWaalsContact O-N 3.12Å; M362-N364 VanDerWaalsContact C-N 3.29Å; M362-N364 PolarHBondContact O-N 2.97Å; M362-W365 HydrophobicContact CG-CE3 4.04Å; M362-W365 HydrophobicContact CG-CZ3 4.49Å; M362-W365 WeakPolarHBondContact O-CB 3.45Å; M362-W365 PolarHBondContact O-N 3.12Å; M362-W365 VanDerWaalsContact O-N 3.17Å; M362-A366 PolarHBondContact O-N 3.34Å; M362-L384 HydrophobicContact SD-CD2 4.34Å; M362-W388 HydrophobicContact CE-CB 4Å; M362-W388 VanDerWaalsContact CE-O 3.25Å; M362-W388 WeakPolarHBondContact CE-O 3.16Å; M362-W388 HydrophobicContact SD-CB 3.87Å; M362-I391 HydrophobicContact CE-CB 3.97Å; M362-I391 HydrophobicContact CE-CG2 4.03Å; M362-I391 HydrophobicContact CG-CB 4.45Å; M362-I391 HydrophobicContact CG-CG2 3.84Å; M362-I391 HydrophobicContact SD-CB 3.91Å; M362-I391 HydrophobicContact SD-CG1 4.35Å; M362-I391 HydrophobicContact SD-CG2 3.96Å; M362-L392 HydrophobicContact CE-CD2 3.47Å; M362-L392 VanDerWaalsContact CE-CD2 3.47Å; M362-L392 HydrophobicContact CE-CG 3.62Å
363	I	94.6	Very high	95.1	Very high	2 Å²	2	26.5 Å²	26.5	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-62.1	-40.5	177.3	-67	159.3	0	0	0	110.4	L14 Q17 I18 L359 A366 K367 L384 L562	L14-I363 HydrophobicContact CD1-CD1 3.63Å; L14-I363 HydrophobicContact CD1-CG1 3.94Å; Q17-I363 HydrophobicContact CB-CD1 4.01Å; Q17-I363 HydrophobicContact CB-CG2 4.41Å; Q17-I363 HydrophobicContact CG-CB 4.37Å; Q17-I363 HydrophobicContact CG-CD1 3.7Å; Q17-I363 HydrophobicContact CG-CG2 4.08Å; I18-I363 HydrophobicContact CG1-CG2 3.78Å; L359-I363 WeakPolarHBondContact O-CG1 3.36Å; L359-I363 PolarHBondContact O-N 2.87Å; I363-A366 PolarHBondContact O-N 3.17Å; I363-K367 WeakPolarHBondContact O-CG 3.49Å; I363-K367 PolarHBondContact O-N 2.93Å; I363-L384 HydrophobicContact CG1-CD1 4.33Å; I363-L562 HydrophobicContact CD1-CD1 4.23Å; I363-L562 HydrophobicContact CD1-CD2 4Å
364	N	93.9	Very high	95	Very high	28 Å²	28	29.5 Å²	29.5	15%	0.15	16%	0.155	C	C	.	.	H	α-helix	trans	-79.7	-16.2	176.7	-67.9	-48.7	0	0	0	114.1	V360 H361 M362 K367 R368	V360-N364 PolarHBondContact O-ND2 3.35Å; V360-N364 VanDerWaalsContact O-ND2 3.14Å; H361-N364 CarbonylContact O-C 3.56Å; H361-N364 PolarHBondContact O-N 3.14Å; M362-N364 VanDerWaalsContact C-N 3.29Å; M362-N364 PolarHBondContact O-N 2.97Å; N364-K367 PolarHBondContact OD1-NZ 3.45Å; N364-K367 VanDerWaalsContact OD1-NZ 3.08Å; N364-R368 PolarHBondContact O-NE 3.31Å; N364-R368 VanDerWaalsContact O-NE 3.12Å
365	W	98	Very high	94.9	Very high	1 Å²	1	29.6 Å²	29.6	0%	0.004	16%	0.156	C	C	.	.	H	α-helix	trans	-73	-49.3	163.7	162.9	85.5	0	0	0	110.4	E328 H361 M362 K367 R368 V369 I391 K472 L476	E328-W365 VanDerWaalsContact OE1-CD1 3.3Å; E328-W365 PolarHBondContact OE1-NE1 3.09Å; H361-W365 WeakPolarHBondContact O-CB 3.39Å; H361-W365 PolarHBondContact O-N 2.86Å; M362-W365 HydrophobicContact CG-CE3 4.04Å; M362-W365 HydrophobicContact CG-CZ3 4.49Å; M362-W365 WeakPolarHBondContact O-CB 3.45Å; M362-W365 PolarHBondContact O-N 3.12Å; M362-W365 VanDerWaalsContact O-N 3.17Å; W365-K367 PolarHBondContact O-N 3Å; W365-R368 WeakPolarHBondContact O-CA 3.41Å; W365-R368 WeakPolarHBondContact O-CB 3.4Å; W365-R368 PolarHBondContact O-N 3.38Å; W365-V369 HydrophobicContact CD2-CG2 4.2Å; W365-V369 HydrophobicContact CH2-CG2 4.17Å; W365-V369 HydrophobicContact CZ2-CG2 3.79Å; W365-V369 PolarHBondContact O-N 2.66Å; W365-I391 HydrophobicContact CE3-CG2 4.39Å; W365-I391 HydrophobicContact CH2-CD1 3.75Å; W365-I391 HydrophobicContact CH2-CG2 4.44Å; W365-I391 HydrophobicContact CZ3-CD1 3.96Å; W365-I391 HydrophobicContact CZ3-CG1 4.23Å; W365-I391 HydrophobicContact CZ3-CG2 4.02Å; W365-K472 HydrophobicContact CH2-CD 4.33Å; W365-K472 HydrophobicContact CH2-CG 3.86Å; W365-K472 HydrophobicContact CZ2-CB 4.24Å; W365-K472 HydrophobicContact CZ2-CD 3.63Å; W365-K472 HydrophobicContact CZ2-CG 3.56Å; W365-L476 HydrophobicContact CH2-CB 3.88Å; W365-L476 HydrophobicContact CH2-CD2 3.9Å; W365-L476 HydrophobicContact CH2-CG 4.44Å; W365-L476 HydrophobicContact CZ3-CB 4.11Å; W365-L476 HydrophobicContact CZ3-CD1 4.39Å; W365-L476 HydrophobicContact CZ3-CD2 3.73Å; W365-L476 HydrophobicContact CZ3-CG 4.29Å
366	A	97.4	Very high	94.6	Very high	0 Å²	0	30.8 Å²	30.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-59.2	-42.6	-178.8	0	0	0	0	0	112.6	M362 I363 R368 V369 F372 L384 L476	M362-A366 PolarHBondContact O-N 3.34Å; I363-A366 PolarHBondContact O-N 3.17Å; A366-R368 PolarHBondContact O-N 3.13Å; A366-R368 VanDerWaalsContact O-N 3.09Å; A366-V369 WeakPolarHBondContact O-CB 3.38Å; A366-V369 PolarHBondContact O-N 3.2Å; A366-F372 VanDerWaalsContact C-CD1 3.49Å; A366-F372 HydrophobicContact CB-CD1 4.13Å; A366-F372 HydrophobicContact CB-CE1 3.83Å; A366-F372 HydrophobicContact CB-CE2 4.39Å; A366-F372 HydrophobicContact CB-CZ 3.96Å; A366-F372 WeakPolarHBondContact O-CB 3.34Å; A366-F372 WeakPolarHBondContact O-CD1 3.21Å; A366-F372 WeakPolarHBondContact O-CG 3.24Å; A366-L384 HydrophobicContact CB-CD1 4.43Å; A366-L384 HydrophobicContact CB-CD2 3.89Å; A366-L384 HydrophobicContact CB-CG 4.46Å; A366-L476 HydrophobicContact CB-CD1 4.46Å; A366-L476 HydrophobicContact CB-CD2 3.86Å
367	K	95.6	Very high	94.5	Very high	58 Å²	58	32.2 Å²	32.2	25%	0.252	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-29.3	171.3	-71.3	174.9	-169.7	172.5	0	113.8	Q17 I18 G20 I363 N364 W365	Q17-K367 PolarHBondContact O-NZ 3.18Å; I18-K367 WeakPolarHBondContact O-CE 3.44Å; I18-K367 PolarHBondContact O-NZ 3.32Å; G20-K367 PolarHBondContact O-NZ 3.34Å; I363-K367 WeakPolarHBondContact O-CG 3.49Å; I363-K367 PolarHBondContact O-N 2.93Å; N364-K367 PolarHBondContact OD1-NZ 3.45Å; N364-K367 VanDerWaalsContact OD1-NZ 3.08Å; W365-K367 PolarHBondContact O-N 3Å
368	R	96.3	Very high	94.2	Very high	115 Å²	115	31.3 Å²	31.3	43%	0.434	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-12	-180	-66.8	-174.6	-75.8	157.4	-2.6	113.7	D326 A327 E328 N364 W365 A366 P370	D326-R368 PolarHBondContact O-NH1 2.96Å; A327-R368 HydrophobicContact CB-CB 3.61Å; A327-R368 PolarHBondContact O-NE 2.86Å; A327-R368 PolarHBondContact O-NH1 3.41Å; A327-R368 PolarHBondContact O-NH2 3.49Å; E328-R368 PolarHBondContact O-NH2 2.95Å; N364-R368 PolarHBondContact O-NE 3.31Å; N364-R368 VanDerWaalsContact O-NE 3.12Å; W365-R368 WeakPolarHBondContact O-CA 3.41Å; W365-R368 WeakPolarHBondContact O-CB 3.4Å; W365-R368 PolarHBondContact O-N 3.38Å; A366-R368 PolarHBondContact O-N 3.13Å; A366-R368 VanDerWaalsContact O-N 3.09Å; R368-P370 WeakPolarHBondContact O-CD 3.18Å
369	V	97.4	Very high	93.9	Very high	2 Å²	2	30 Å²	30	1%	0.012	16%	0.16	C	C	.	.	S	Bend	trans	-67.2	122.3	176	174.6	0	0	0	0	109.6	L324 W365 A366 G371 F372 L476	L324-V369 HydrophobicContact CD2-CG1 4.15Å; L324-V369 HydrophobicContact CD2-CG2 4.4Å; W365-V369 HydrophobicContact CD2-CG2 4.2Å; W365-V369 HydrophobicContact CH2-CG2 4.17Å; W365-V369 HydrophobicContact CZ2-CG2 3.79Å; W365-V369 PolarHBondContact O-N 2.66Å; A366-V369 WeakPolarHBondContact O-CB 3.38Å; A366-V369 PolarHBondContact O-N 3.2Å; V369-G371 PolarHBondContact O-N 2.96Å; V369-G371 VanDerWaalsContact O-N 3.16Å; V369-F372 HydrophobicContact CB-CB 4.14Å; V369-F372 HydrophobicContact CG1-CB 4.44Å; V369-F372 WeakPolarHBondContact O-CB 3.37Å; V369-F372 PolarHBondContact O-N 2.9Å; V369-F372 VanDerWaalsContact O-N 3.08Å; V369-L476 HydrophobicContact CB-CD2 4.3Å; V369-L476 HydrophobicContact CG1-CD2 4.41Å; V369-L476 HydrophobicContact CG2-CD2 4.06Å
370	P	96.4	Very high	93.8	Very high	18 Å²	18	31 Å²	31	12%	0.117	16%	0.164	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.3	121.6	-176.9	-28.7	37	0	0	0	112.7	A312 L315 M320 A323 R368 V501	A312-P370 VanDerWaalsContact CB-C 3.42Å; A312-P370 HydrophobicContact CB-CB 3.58Å; L315-P370 HydrophobicContact CD1-CB 4Å; L315-P370 HydrophobicContact CD1-CG 4.16Å; M320-P370 HydrophobicContact CE-CB 4.18Å; M320-P370 HydrophobicContact SD-CB 3.79Å; M320-P370 HydrophobicContact SD-CG 3.78Å; A323-P370 HydrophobicContact CB-CG 3.76Å; R368-P370 WeakPolarHBondContact O-CD 3.18Å; P370-V501 WeakPolarHBondContact O-CG1 3.18Å
371	G	92.8	Very high	93.6	Very high	7 Å²	7	29.6 Å²	29.6	7%	0.072	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	92.1	-11.4	177.8	0	0	0	0	0	115	V369 H497	V369-G371 PolarHBondContact O-N 2.96Å; V369-G371 VanDerWaalsContact O-N 3.16Å; G371-H497 PolarHBondContact O-NE2 3.06Å
372	F	95.1	Very high	93.2	Very high	1 Å²	1	27.1 Å²	27.1	0%	0.004	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-48.1	172.7	-179.9	-89.7	0	0	0	111.3	A366 V369 D374 L375 Q380 L383 L384 L476 L477	A366-F372 VanDerWaalsContact C-CD1 3.49Å; A366-F372 HydrophobicContact CB-CD1 4.13Å; A366-F372 HydrophobicContact CB-CE1 3.83Å; A366-F372 HydrophobicContact CB-CE2 4.39Å; A366-F372 HydrophobicContact CB-CZ 3.96Å; A366-F372 WeakPolarHBondContact O-CB 3.34Å; A366-F372 WeakPolarHBondContact O-CD1 3.21Å; A366-F372 WeakPolarHBondContact O-CG 3.24Å; V369-F372 HydrophobicContact CB-CB 4.14Å; V369-F372 HydrophobicContact CG1-CB 4.44Å; V369-F372 WeakPolarHBondContact O-CB 3.37Å; V369-F372 PolarHBondContact O-N 2.9Å; V369-F372 VanDerWaalsContact O-N 3.08Å; F372-D374 PolarHBondContact O-N 3.2Å; F372-D374 VanDerWaalsContact O-N 3.14Å; F372-L375 HydrophobicContact CD2-CD1 4.25Å; F372-L375 VanDerWaalsContact O-CB 3.27Å; F372-L375 WeakPolarHBondContact O-CB 3.47Å; F372-L375 PolarHBondContact O-N 3.28Å; F372-Q380 HydrophobicContact CD1-CG 4.17Å; F372-Q380 HydrophobicContact CE1-CB 3.86Å; F372-Q380 HydrophobicContact CE1-CG 3.69Å; F372-Q380 HydrophobicContact CE2-CB 4.34Å; F372-Q380 HydrophobicContact CE2-CG 4.4Å; F372-Q380 HydrophobicContact CZ-CB 3.61Å; F372-Q380 HydrophobicContact CZ-CG 3.84Å; F372-Q380 WeakPolarHBondContact CZ-O 3.48Å; F372-L383 HydrophobicContact CD2-CD1 4.35Å; F372-L383 HydrophobicContact CE2-CB 4.18Å; F372-L383 HydrophobicContact CE2-CD1 4.24Å; F372-L384 HydrophobicContact CE1-CD1 4.49Å; F372-L384 HydrophobicContact CZ-CD1 3.85Å; F372-L384 HydrophobicContact CZ-CG 4.03Å; F372-L476 HydrophobicContact CD2-CD1 4.42Å; F372-L476 HydrophobicContact CD2-CD2 3.72Å; F372-L476 HydrophobicContact CD2-CG 4.12Å; F372-L476 HydrophobicContact CE2-CD1 3.98Å; F372-L476 HydrophobicContact CE2-CD2 4.06Å; F372-L476 HydrophobicContact CE2-CG 4.19Å; F372-L476 HydrophobicContact CG-CD2 4.28Å; F372-L477 HydrophobicContact CD2-CD2 4.43Å
373	G	93	Very high	93	Very high	49 Å²	49	26.8 Å²	26.8	51%	0.505	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-10.4	177.3	0	0	0	0	0	115.2
374	D	90.9	Very high	92.9	Very high	73 Å²	73	26.8 Å²	26.8	39%	0.39	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-17.6	170.9	-72.1	-53.4	0	0	0	112.5	S310 F372	S310-D374 VanDerWaalsContact CB-OD2 3.25Å; S310-D374 WeakPolarHBondContact CB-OD2 3.08Å; S310-D374 PolarHBondContact OG-OD2 3.36Å; F372-D374 PolarHBondContact O-N 3.2Å; F372-D374 VanDerWaalsContact O-N 3.14Å
375	L	90.9	Very high	92.7	Very high	8 Å²	8	26.3 Å²	26.3	4%	0.042	14%	0.14	C	C	.	.	S	Bend	trans	-72.8	150.7	-179.9	-67.3	166.3	0	0	0	111.7	F372 D379 Q380 L383 E494 I498	F372-L375 HydrophobicContact CD2-CD1 4.25Å; F372-L375 VanDerWaalsContact O-CB 3.27Å; F372-L375 WeakPolarHBondContact O-CB 3.47Å; F372-L375 PolarHBondContact O-N 3.28Å; L375-D379 HydrophobicContact CB-CB 4.39Å; L375-D379 HydrophobicContact CD2-CB 4.4Å; L375-Q380 HydrophobicContact CB-CG 3.87Å; L375-Q380 PolarHBondContact O-NE2 3.35Å; L375-L383 HydrophobicContact CD1-CD1 3.67Å; L375-E494 HydrophobicContact CD2-CB 3.84Å; L375-I498 HydrophobicContact CD1-CG1 4.27Å; L375-I498 HydrophobicContact CD2-CD1 4.07Å; L375-I498 HydrophobicContact CD2-CG1 3.67Å
376	N	90	Very high	92.3	Very high	44 Å²	44	27.1 Å²	27.1	24%	0.235	15%	0.146	C	C	.	.			trans	-54.9	149.8	161.9	71.4	86.3	0	0	0	112.3	H378 D379 Q380 E494	N376-H378 PolarHBondContact O-N 3.07Å; N376-H378 WeakPolarHBondContact OD1-CB 3.29Å; N376-H378 PolarHBondContact OD1-N 2.76Å; N376-D379 PolarHBondContact ND2-OD2 2.91Å; N376-D379 PolarHBondContact O-N 3.19Å; N376-D379 PolarHBondContact OD1-N 3.38Å; N376-Q380 PolarHBondContact O-N 3.34Å; N376-Q380 VanDerWaalsContact O-N 3.07Å; N376-E494 PolarHBondContact N-OE2 3.34Å; N376-E494 PolarHBondContact ND2-OE2 3.12Å
377	L	89.7	Confident	92.1	Very high	53 Å²	53	27.2 Å²	27.2	28%	0.277	15%	0.146	S	C	.	.	H	α-helix	trans	-62	-26.8	-174	-178	58.9	0	0	0	113.9	L15 I18 Q19 V381	L15-L377 HydrophobicContact CD2-CD1 4.21Å; L15-L377 HydrophobicContact CD2-CD2 3.66Å; L15-L377 HydrophobicContact CD2-CG 3.76Å; I18-L377 HydrophobicContact CB-CD1 4.03Å; I18-L377 HydrophobicContact CD1-CD1 4.45Å; I18-L377 HydrophobicContact CG2-CD1 3.4Å; Q19-L377 HydrophobicContact CG-CD2 3.85Å; L377-V381 HydrophobicContact CD1-CG2 4.46Å; L377-V381 WeakPolarHBondContact O-CB 3.16Å; L377-V381 WeakPolarHBondContact O-CG2 3.19Å; L377-V381 PolarHBondContact O-N 2.9Å
378	H	88.1	Confident	92.1	Very high	63 Å²	63	24.5 Å²	24.5	29%	0.292	13%	0.134	S	C	.	.	H	α-helix	trans	-70.5	-45.7	178.1	176.3	66.3	0	0	0	111.4	N376 V381 H382	N376-H378 PolarHBondContact O-N 3.07Å; N376-H378 WeakPolarHBondContact OD1-CB 3.29Å; N376-H378 PolarHBondContact OD1-N 2.76Å; H378-V381 PolarHBondContact O-N 2.85Å; H378-H382 WeakPolarHBondContact O-CB 3.13Å; H378-H382 PolarHBondContact O-N 2.67Å
379	D	89.1	Confident	92.1	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-66.2	-37.1	173.7	-71.2	-10.4	0	0	0	111.4	L375 N376 H382 L383 L492 E493 E494	L375-D379 HydrophobicContact CB-CB 4.39Å; L375-D379 HydrophobicContact CD2-CB 4.4Å; N376-D379 PolarHBondContact ND2-OD2 2.91Å; N376-D379 PolarHBondContact O-N 3.19Å; N376-D379 PolarHBondContact OD1-N 3.38Å; D379-H382 PolarHBondContact O-N 2.94Å; D379-L383 WeakPolarHBondContact O-CB 3.23Å; D379-L383 VanDerWaalsContact O-CG 3.25Å; D379-L383 WeakPolarHBondContact O-CG 3.35Å; D379-L383 PolarHBondContact O-N 2.93Å; D379-L492 HydrophobicContact CB-CD2 3.82Å; D379-L492 VanDerWaalsContact OD1-CA 3.27Å; D379-L492 WeakPolarHBondContact OD1-CA 3.35Å; D379-L492 WeakPolarHBondContact OD1-CD2 3.29Å; D379-E493 PolarHBondContact OD1-N 3.23Å; D379-E493 PolarHBondContact OD2-N 2.91Å; D379-E493 VanDerWaalsContact OD2-N 3.1Å; D379-E494 PolarHBondContact OD2-N 3.26Å
380	Q	92.6	Very high	92.1	Very high	22 Å²	22	20.1 Å²	20.1	10%	0.103	12%	0.119	C	C	.	.	H	α-helix	trans	-59.9	-48.8	173.9	-69.7	-172.1	37.6	0	0	112.3	F372 L375 N376 L384	F372-Q380 HydrophobicContact CD1-CG 4.17Å; F372-Q380 HydrophobicContact CE1-CB 3.86Å; F372-Q380 HydrophobicContact CE1-CG 3.69Å; F372-Q380 HydrophobicContact CE2-CB 4.34Å; F372-Q380 HydrophobicContact CE2-CG 4.4Å; F372-Q380 HydrophobicContact CZ-CB 3.61Å; F372-Q380 HydrophobicContact CZ-CG 3.84Å; F372-Q380 WeakPolarHBondContact CZ-O 3.48Å; L375-Q380 HydrophobicContact CB-CG 3.87Å; L375-Q380 PolarHBondContact O-NE2 3.35Å; N376-Q380 PolarHBondContact O-N 3.34Å; N376-Q380 VanDerWaalsContact O-N 3.07Å; Q380-L384 PolarHBondContact O-N 2.76Å
381	V	90.3	Very high	92.1	Very high	12 Å²	12	19.6 Å²	19.6	7%	0.073	12%	0.115	C	C	.	.	H	α-helix	trans	-57	-53.5	173.9	160	0	0	0	0	110.3	L14 L15 I18 L377 H378 L383 L384 E385	L14-V381 HydrophobicContact CD2-CB 4.39Å; L14-V381 HydrophobicContact CD2-CG1 3.94Å; L14-V381 HydrophobicContact CD2-CG2 4.32Å; L14-V381 HydrophobicContact CG-CG2 4.43Å; L15-V381 HydrophobicContact CD2-CG2 3.68Å; L15-V381 HydrophobicContact CG-CG2 4.09Å; I18-V381 HydrophobicContact CD1-CB 4.48Å; I18-V381 HydrophobicContact CD1-CG2 3.57Å; L377-V381 HydrophobicContact CD1-CG2 4.46Å; L377-V381 WeakPolarHBondContact O-CB 3.16Å; L377-V381 WeakPolarHBondContact O-CG2 3.19Å; L377-V381 PolarHBondContact O-N 2.9Å; H378-V381 PolarHBondContact O-N 2.85Å; V381-L383 VanDerWaalsContact C-N 3.35Å; V381-L383 PolarHBondContact O-N 3.01Å; V381-L384 PolarHBondContact O-N 3.1Å; V381-L384 VanDerWaalsContact O-N 3.12Å; V381-E385 HydrophobicContact CG1-CG 4.08Å; V381-E385 WeakPolarHBondContact O-CG 3.32Å; V381-E385 PolarHBondContact O-N 2.89Å
382	H	87.7	Confident	92.4	Very high	7 Å²	7	20.3 Å²	20.3	3%	0.032	12%	0.117	C	C	.	.	H	α-helix	trans	-64.7	-36.7	-172.5	-172.4	49.1	0	0	0	113.2	H378 D379 E385 C386 L492	H378-H382 WeakPolarHBondContact O-CB 3.13Å; H378-H382 PolarHBondContact O-N 2.67Å; D379-H382 PolarHBondContact O-N 2.94Å; H382-E385 IonicContact ND1-OE2 2.71Å; H382-C386 PolarHBondContact CE1-SG 2.72Å; H382-C386 WeakPolarHBondContact O-CB 3.47Å; H382-C386 PolarHBondContact O-N 2.94Å; H382-C386 PolarHBondContact O-SG 3.03Å; H382-L492 HydrophobicContact CB-CD2 4.46Å
383	L	92.1	Very high	92.5	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.4	-38.1	175.6	-71.6	177.9	0	0	0	112.1	F372 L375 D379 V381 A387 L476 L477 S479 L492 I498	F372-L383 HydrophobicContact CD2-CD1 4.35Å; F372-L383 HydrophobicContact CE2-CB 4.18Å; F372-L383 HydrophobicContact CE2-CD1 4.24Å; L375-L383 HydrophobicContact CD1-CD1 3.67Å; D379-L383 WeakPolarHBondContact O-CB 3.23Å; D379-L383 VanDerWaalsContact O-CG 3.25Å; D379-L383 WeakPolarHBondContact O-CG 3.35Å; D379-L383 PolarHBondContact O-N 2.93Å; V381-L383 VanDerWaalsContact C-N 3.35Å; V381-L383 PolarHBondContact O-N 3.01Å; L383-A387 WeakPolarHBondContact O-CB 3.49Å; L383-A387 PolarHBondContact O-N 2.7Å; L383-L476 HydrophobicContact CB-CD1 4.44Å; L383-L477 HydrophobicContact CD1-CD2 4.2Å; L383-S479 WeakPolarHBondContact CA-OG 3.3Å; L383-S479 WeakPolarHBondContact CD2-OG 3.3Å; L383-S479 PolarHBondContact O-OG 3.37Å; L383-L492 HydrophobicContact CD2-CD1 4.07Å; L383-L492 HydrophobicContact CD2-CD2 4.09Å; L383-L492 HydrophobicContact CG-CD2 4.13Å; L383-I498 HydrophobicContact CD1-CD1 4.2Å
384	L	93.4	Very high	92.7	Very high	1 Å²	1	18.5 Å²	18.5	1%	0.005	10%	0.096	C	C	.	.	H	α-helix	trans	-69.7	-48.1	175.1	-79	165	0	0	0	111.8	L14 I18 M362 I363 A366 F372 Q380 V381 C386 A387 W388 L476 M566	L14-L384 HydrophobicContact CD1-CD1 4.33Å; I18-L384 HydrophobicContact CD1-CD1 3.83Å; I18-L384 HydrophobicContact CG1-CD1 4.15Å; M362-L384 HydrophobicContact SD-CD2 4.34Å; I363-L384 HydrophobicContact CG1-CD1 4.33Å; A366-L384 HydrophobicContact CB-CD1 4.43Å; A366-L384 HydrophobicContact CB-CD2 3.89Å; A366-L384 HydrophobicContact CB-CG 4.46Å; F372-L384 HydrophobicContact CE1-CD1 4.49Å; F372-L384 HydrophobicContact CZ-CD1 3.85Å; F372-L384 HydrophobicContact CZ-CG 4.03Å; Q380-L384 PolarHBondContact O-N 2.76Å; V381-L384 PolarHBondContact O-N 3.1Å; V381-L384 VanDerWaalsContact O-N 3.12Å; L384-C386 PolarHBondContact O-N 3.14Å; L384-A387 PolarHBondContact O-N 3.41Å; L384-W388 WeakPolarHBondContact O-CB 3.38Å; L384-W388 PolarHBondContact O-N 3.49Å; L384-L476 HydrophobicContact CD2-CD1 4.05Å; L384-L476 HydrophobicContact CG-CD1 4.32Å; L384-M566 HydrophobicContact CB-CE 4.45Å; L384-M566 WeakPolarHBondContact O-CE 3.42Å
385	E	90.3	Very high	93.1	Very high	19 Å²	19	15.6 Å²	15.6	9%	0.089	8%	0.083	C	C	.	.	H	α-helix	trans	-51.5	-42.1	172.7	-73.7	176.3	156.4	0	0	111.2	L14 V381 H382 W388 A569 H570	L14-E385 HydrophobicContact CD2-CG 3.84Å; V381-E385 HydrophobicContact CG1-CG 4.08Å; V381-E385 WeakPolarHBondContact O-CG 3.32Å; V381-E385 PolarHBondContact O-N 2.89Å; H382-E385 IonicContact ND1-OE2 2.71Å; E385-W388 VanDerWaalsContact O-CD1 3.27Å; E385-A569 HydrophobicContact CB-CB 4.22Å; E385-A569 HydrophobicContact CG-CB 3.94Å; E385-H570 PolarHBondContact O-CE1 2.88Å; E385-H570 PolarHBondContact O-NE2 2.98Å
386	C	89.1	Confident	93.4	Very high	18 Å²	18	15.9 Å²	15.9	12%	0.122	8%	0.084	C	C	.	.	H	α-helix	trans	-80	-29.9	-179.4	-66.4	0	0	0	0	114.4	H382 L384	H382-C386 PolarHBondContact CE1-SG 2.72Å; H382-C386 WeakPolarHBondContact O-CB 3.47Å; H382-C386 PolarHBondContact O-N 2.94Å; H382-C386 PolarHBondContact O-SG 3.03Å; L384-C386 PolarHBondContact O-N 3.14Å
387	A	94.2	Very high	93.8	Very high	1 Å²	1	13.8 Å²	13.8	1%	0.008	7%	0.073	C	C	.	.	H	α-helix	trans	-96.9	-23	-168.8	0	0	0	0	0	115.1	L383 L384 L389 E390 I391 I475 L476	L383-A387 WeakPolarHBondContact O-CB 3.49Å; L383-A387 PolarHBondContact O-N 2.7Å; L384-A387 PolarHBondContact O-N 3.41Å; A387-L389 PolarHBondContact O-N 3.29Å; A387-L389 VanDerWaalsContact O-N 3.16Å; A387-E390 WeakPolarHBondContact O-CA 3.36Å; A387-E390 WeakPolarHBondContact O-CB 3.39Å; A387-E390 PolarHBondContact O-N 2.93Å; A387-I391 HydrophobicContact CB-CG1 4.1Å; A387-I391 PolarHBondContact O-N 2.88Å; A387-I475 HydrophobicContact CB-CG2 4.39Å; A387-L476 HydrophobicContact CB-CD1 4.31Å
388	W	95.4	Very high	94.2	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.008	7%	0.073	C	C	.	.	H	α-helix	trans	-53.5	-48.4	-156.6	68.7	-85.9	0	0	0	114.8	L359 M362 L384 E385 E390 I391 L392 M545 L548 L563 M566 H570	L359-W388 HydrophobicContact CD1-CE3 4.29Å; L359-W388 HydrophobicContact CD2-CB 3.69Å; L359-W388 HydrophobicContact CD2-CD2 4.14Å; L359-W388 HydrophobicContact CD2-CE3 3.92Å; L359-W388 HydrophobicContact CD2-CG 4.09Å; L359-W388 HydrophobicContact CG-CE3 4.37Å; M362-W388 HydrophobicContact CE-CB 4Å; M362-W388 VanDerWaalsContact CE-O 3.25Å; M362-W388 WeakPolarHBondContact CE-O 3.16Å; M362-W388 HydrophobicContact SD-CB 3.87Å; L384-W388 WeakPolarHBondContact O-CB 3.38Å; L384-W388 PolarHBondContact O-N 3.49Å; E385-W388 VanDerWaalsContact O-CD1 3.27Å; W388-E390 VanDerWaalsContact C-N 3.3Å; W388-E390 PolarHBondContact O-N 2.69Å; W388-I391 WeakPolarHBondContact O-CB 3.4Å; W388-I391 PolarHBondContact O-N 2.86Å; W388-I391 VanDerWaalsContact O-N 3.1Å; W388-L392 HydrophobicContact CE3-CD1 3.78Å; W388-L392 HydrophobicContact CZ3-CD1 3.88Å; W388-L392 PolarHBondContact O-N 3.42Å; W388-M545 HydrophobicContact CH2-CE 4.46Å; W388-M545 HydrophobicContact CZ2-CE 3.55Å; W388-M545 HydrophobicContact CZ2-SD 3.84Å; W388-L548 HydrophobicContact CH2-CD2 3.87Å; W388-L563 HydrophobicContact CH2-CD1 3.58Å; W388-L563 HydrophobicContact CZ2-CD1 4.44Å; W388-L563 HydrophobicContact CZ3-CD1 3.65Å; W388-M566 HydrophobicContact CB-CE 3.67Å; W388-M566 HydrophobicContact CD2-CB 4.21Å; W388-M566 HydrophobicContact CG-CB 4.35Å; W388-M566 HydrophobicContact CG-CE 3.66Å; W388-M566 HydrophobicContact CZ2-CB 4.32Å; W388-M566 PolarHBondContact NE1-O 3.36Å; W388-M566 VanDerWaalsContact NE1-O 3.16Å; W388-H570 AromaticContact CD1-NE2 3.88Å; W388-H570 AromaticContact NE1-CD2 3.75Å; W388-H570 AromaticContact NE1-NE2 3.36Å; W388-H570 PolarHBondContact NE1-NE2 3.45Å
389	L	95.6	Very high	94.6	Very high	21 Å²	21	14 Å²	14	11%	0.11	7%	0.068	C	C	.	.	H	α-helix	trans	-70.2	-27.7	-178	-173.7	58.5	0	0	0	112.4	A387 L392 M393 S541 M545	A387-L389 PolarHBondContact O-N 3.29Å; A387-L389 VanDerWaalsContact O-N 3.16Å; L389-L392 HydrophobicContact CD1-CD1 4.44Å; L389-M393 HydrophobicContact CD1-CE 4.09Å; L389-M393 HydrophobicContact CD1-CG 4.45Å; L389-M393 HydrophobicContact CD2-CE 4.23Å; L389-M393 HydrophobicContact CG-CE 4.01Å; L389-M393 HydrophobicContact CG-SD 4.44Å; L389-M393 VanDerWaalsContact O-CB 3.31Å; L389-M393 WeakPolarHBondContact O-CB 3.4Å; L389-M393 VanDerWaalsContact O-CG 3.23Å; L389-M393 WeakPolarHBondContact O-CG 3.5Å; L389-M393 PolarHBondContact O-N 3.04Å; L389-S541 WeakPolarHBondContact CD2-O 3.39Å; L389-M545 HydrophobicContact CB-CE 3.98Å; L389-M545 HydrophobicContact CD2-CB 4.33Å; L389-M545 HydrophobicContact CD2-CE 3.86Å
390	E	96.7	Very high	95.1	Very high	4 Å²	4	14 Å²	14	2%	0.019	7%	0.068	C	C	.	.	H	α-helix	trans	-68.4	-36.7	170.4	-62.4	178.3	-89.2	0	0	111.8	A387 W388 M393 I394 I475 I537 R538 S541	A387-E390 WeakPolarHBondContact O-CA 3.36Å; A387-E390 WeakPolarHBondContact O-CB 3.39Å; A387-E390 PolarHBondContact O-N 2.93Å; W388-E390 VanDerWaalsContact C-N 3.3Å; W388-E390 PolarHBondContact O-N 2.69Å; E390-M393 PolarHBondContact O-N 3.46Å; E390-I394 WeakPolarHBondContact O-CG2 3.34Å; E390-I394 PolarHBondContact O-N 3.17Å; E390-I475 HydrophobicContact CB-CG2 3.44Å; E390-I475 VanDerWaalsContact CB-CG2 3.44Å; E390-I475 HydrophobicContact CG-CG2 4.38Å; E390-I537 HydrophobicContact CB-CG2 3.84Å; E390-I537 HydrophobicContact CG-CG2 4.19Å; E390-R538 VanDerWaalsContact CD-NH2 3.31Å; E390-R538 IonicContact OE1-CZ 2.68Å; E390-R538 IonicContact OE1-NE 2.63Å; E390-R538 PolarHBondContact OE1-NE 2.71Å; E390-R538 IonicContact OE1-NH2 2.65Å; E390-R538 PolarHBondContact OE1-NH2 3.33Å; E390-R538 WeakPolarHBondContact OE2-CA 3.41Å; E390-R538 IonicContact OE2-CZ 3.16Å; E390-R538 IonicContact OE2-NE 2.72Å; E390-R538 PolarHBondContact OE2-NE 3.41Å; E390-R538 IonicContact OE2-NH2 2.76Å; E390-R538 PolarHBondContact OE2-NH2 2.78Å; E390-R538 VanDerWaalsContact OE2-NH2 3.1Å; E390-S541 VanDerWaalsContact CG-CB 3.45Å
391	I	97.8	Very high	95.2	Very high	7 Å²	7	14.2 Å²	14.2	4%	0.036	7%	0.069	C	C	.	.	H	α-helix	trans	-69.4	-41.3	177	-60	-64.9	0	0	0	111.2	M362 W365 A387 W388 I394 G395 K472 I475 L476	M362-I391 HydrophobicContact CE-CB 3.97Å; M362-I391 HydrophobicContact CE-CG2 4.03Å; M362-I391 HydrophobicContact CG-CB 4.45Å; M362-I391 HydrophobicContact CG-CG2 3.84Å; M362-I391 HydrophobicContact SD-CB 3.91Å; M362-I391 HydrophobicContact SD-CG1 4.35Å; M362-I391 HydrophobicContact SD-CG2 3.96Å; W365-I391 HydrophobicContact CE3-CG2 4.39Å; W365-I391 HydrophobicContact CH2-CD1 3.75Å; W365-I391 HydrophobicContact CH2-CG2 4.44Å; W365-I391 HydrophobicContact CZ3-CD1 3.96Å; W365-I391 HydrophobicContact CZ3-CG1 4.23Å; W365-I391 HydrophobicContact CZ3-CG2 4.02Å; A387-I391 HydrophobicContact CB-CG1 4.1Å; A387-I391 PolarHBondContact O-N 2.88Å; W388-I391 WeakPolarHBondContact O-CB 3.4Å; W388-I391 PolarHBondContact O-N 2.86Å; W388-I391 VanDerWaalsContact O-N 3.1Å; I391-I394 WeakPolarHBondContact O-CG2 3.25Å; I391-G395 PolarHBondContact O-N 3.27Å; I391-G395 VanDerWaalsContact O-N 3.17Å; I391-K472 HydrophobicContact CD1-CG 4.01Å; I391-K472 WeakPolarHBondContact CD1-O 3.23Å; I391-K472 HydrophobicContact CG2-CG 4.34Å; I391-I475 HydrophobicContact CD1-CB 3.81Å; I391-I475 HydrophobicContact CD1-CG2 3.51Å; I391-I475 HydrophobicContact CG1-CG2 4.06Å; I391-L476 HydrophobicContact CD1-CB 4.3Å
392	L	97.7	Very high	95.4	Very high	22 Å²	22	21.1 Å²	21.1	12%	0.115	10%	0.101	C	C	.	.	H	α-helix	trans	-61.8	-47.9	171.3	-63.4	-176.4	0	0	0	110.7	A355 E358 M362 W388 L389 G395 L396	A355-L392 HydrophobicContact CB-CD1 3.99Å; E358-L392 HydrophobicContact CB-CD2 3.54Å; M362-L392 HydrophobicContact CE-CD2 3.47Å; M362-L392 VanDerWaalsContact CE-CD2 3.47Å; M362-L392 HydrophobicContact CE-CG 3.62Å; W388-L392 HydrophobicContact CE3-CD1 3.78Å; W388-L392 HydrophobicContact CZ3-CD1 3.88Å; W388-L392 PolarHBondContact O-N 3.42Å; L389-L392 HydrophobicContact CD1-CD1 4.44Å; L392-G395 PolarHBondContact O-N 2.73Å; L392-L396 WeakPolarHBondContact O-CB 3.48Å; L392-L396 PolarHBondContact O-N 3.33Å
393	M	97.8	Very high	95.7	Very high	12 Å²	12	23.9 Å²	23.9	6%	0.059	11%	0.113	C	C	.	.	H	α-helix	trans	-64.9	-42.8	-178.2	-76	-175.5	176.7	0	0	113.2	L389 E390 G395 L396 V397 I447 L451 M540 S541	L389-M393 HydrophobicContact CD1-CE 4.09Å; L389-M393 HydrophobicContact CD1-CG 4.45Å; L389-M393 HydrophobicContact CD2-CE 4.23Å; L389-M393 HydrophobicContact CG-CE 4.01Å; L389-M393 HydrophobicContact CG-SD 4.44Å; L389-M393 VanDerWaalsContact O-CB 3.31Å; L389-M393 WeakPolarHBondContact O-CB 3.4Å; L389-M393 VanDerWaalsContact O-CG 3.23Å; L389-M393 WeakPolarHBondContact O-CG 3.5Å; L389-M393 PolarHBondContact O-N 3.04Å; E390-M393 PolarHBondContact O-N 3.46Å; M393-G395 VanDerWaalsContact C-N 3.32Å; M393-G395 PolarHBondContact O-N 2.83Å; M393-L396 PolarHBondContact O-N 2.86Å; M393-V397 WeakPolarHBondContact O-CB 3.48Å; M393-V397 WeakPolarHBondContact O-CG2 3.49Å; M393-V397 PolarHBondContact O-N 3.45Å; M393-I447 HydrophobicContact CE-CG2 4.09Å; M393-L451 HydrophobicContact CB-CD2 4.09Å; M393-L451 HydrophobicContact CG-CD2 4.04Å; M393-L451 HydrophobicContact SD-CD2 4.36Å; M393-M540 HydrophobicContact CE-CB 4.48Å; M393-M540 WeakPolarHBondContact CE-O 3.5Å; M393-M540 VanDerWaalsContact SD-C 3.52Å; M393-M540 HydrophobicContact SD-CB 3.61Å; M393-S541 PolarHBondContact SD-N 3.46Å; M393-S541 VanDerWaalsContact SD-N 3.44Å
394	I	98.2	Very high	95.7	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-66.2	-35.7	176.2	-160.2	178.5	0	0	0	111.4	E390 I391 V397 W398 F458 F468 L471 K472 I475 I537	E390-I394 WeakPolarHBondContact O-CG2 3.34Å; E390-I394 PolarHBondContact O-N 3.17Å; I391-I394 WeakPolarHBondContact O-CG2 3.25Å; I394-V397 PolarHBondContact O-N 2.86Å; I394-W398 WeakPolarHBondContact O-CB 3.49Å; I394-W398 PolarHBondContact O-N 3.09Å; I394-F458 HydrophobicContact CD1-CE2 4.35Å; I394-F458 HydrophobicContact CD1-CZ 4.07Å; I394-F458 HydrophobicContact CG1-CE2 3.86Å; I394-F458 HydrophobicContact CG1-CZ 3.92Å; I394-F468 HydrophobicContact CD1-CD2 4.39Å; I394-F468 HydrophobicContact CD1-CE2 4.44Å; I394-F468 HydrophobicContact CG1-CD2 4.31Å; I394-F468 HydrophobicContact CG1-CE2 4.05Å; I394-F468 HydrophobicContact CG2-CE2 4.3Å; I394-L471 HydrophobicContact CD1-CB 4.03Å; I394-K472 HydrophobicContact CG2-CB 4.36Å; I394-K472 HydrophobicContact CG2-CG 4.03Å; I394-I475 HydrophobicContact CB-CD1 4.04Å; I394-I475 HydrophobicContact CD1-CD1 3.72Å; I394-I475 HydrophobicContact CG1-CD1 4.4Å; I394-I475 HydrophobicContact CG2-CD1 4.01Å; I394-I537 HydrophobicContact CB-CD1 4.1Å; I394-I537 HydrophobicContact CD1-CD1 3.9Å; I394-I537 HydrophobicContact CG1-CD1 3.81Å
395	G	98.1	Very high	95.4	Very high	11 Å²	11	30.4 Å²	30.4	11%	0.113	16%	0.163	C	C	.	.	H	α-helix	trans	-68.2	-34.2	175.4	0	0	0	0	0	113.9	I391 L392 M393 R399	I391-G395 PolarHBondContact O-N 3.27Å; I391-G395 VanDerWaalsContact O-N 3.17Å; L392-G395 PolarHBondContact O-N 2.73Å; M393-G395 VanDerWaalsContact C-N 3.32Å; M393-G395 PolarHBondContact O-N 2.83Å; G395-R399 WeakPolarHBondContact O-CB 3.47Å; G395-R399 PolarHBondContact O-N 3.45Å; G395-R399 VanDerWaalsContact O-N 3.12Å; G395-R399 PolarHBondContact O-NE 2.88Å
396	L	98	Very high	95.6	Very high	14 Å²	14	33.2 Å²	33.2	7%	0.073	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-47.2	171.8	176.1	61.4	0	0	0	111.5	L392 M393 W398 R399 S400 L407 L408 F409 L451	L392-L396 WeakPolarHBondContact O-CB 3.48Å; L392-L396 PolarHBondContact O-N 3.33Å; M393-L396 PolarHBondContact O-N 2.86Å; L396-W398 VanDerWaalsContact C-N 3.31Å; L396-W398 PolarHBondContact O-N 3.13Å; L396-R399 PolarHBondContact O-N 2.98Å; L396-S400 VanDerWaalsContact O-CB 3.32Å; L396-S400 WeakPolarHBondContact O-CB 3.39Å; L396-S400 PolarHBondContact O-N 2.98Å; L396-S400 PolarHBondContact O-OG 3.46Å; L396-L407 HydrophobicContact CD1-CB 4.32Å; L396-L407 HydrophobicContact CD2-CD1 4.35Å; L396-L408 WeakPolarHBondContact CD1-O 3.49Å; L396-F409 HydrophobicContact CD1-CB 4.36Å; L396-F409 HydrophobicContact CD1-CD1 3.87Å; L396-F409 HydrophobicContact CD1-CD2 4.11Å; L396-F409 HydrophobicContact CD1-CE1 4.17Å; L396-F409 HydrophobicContact CD1-CE2 4.38Å; L396-F409 HydrophobicContact CD1-CG 3.85Å; L396-F409 HydrophobicContact CD1-CZ 4.42Å; L396-F409 HydrophobicContact CD2-CD1 3.98Å; L396-F409 HydrophobicContact CD2-CE1 3.48Å; L396-F409 VanDerWaalsContact CD2-CE1 3.48Å; L396-F409 HydrophobicContact CD2-CE2 4.4Å; L396-F409 HydrophobicContact CD2-CZ 3.73Å; L396-F409 HydrophobicContact CG-CE1 4.49Å; L396-L451 HydrophobicContact CD2-CD1 3.97Å
397	V	98.4	Very high	95.9	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-58.8	-43.2	176.7	165.6	0	0	0	0	110.8	M393 I394 S400 M401 L451 T454 F458	M393-V397 WeakPolarHBondContact O-CB 3.48Å; M393-V397 WeakPolarHBondContact O-CG2 3.49Å; M393-V397 PolarHBondContact O-N 3.45Å; I394-V397 PolarHBondContact O-N 2.86Å; V397-S400 PolarHBondContact O-N 3.23Å; V397-M401 PolarHBondContact O-N 2.9Å; V397-L451 HydrophobicContact CG2-CD2 3.68Å; V397-T454 HydrophobicContact CG1-CG2 3.94Å; V397-T454 HydrophobicContact CG2-CG2 4.33Å; V397-F458 HydrophobicContact CB-CE2 4.5Å; V397-F458 HydrophobicContact CG1-CD2 3.44Å; V397-F458 VanDerWaalsContact CG1-CD2 3.44Å; V397-F458 HydrophobicContact CG1-CE2 3.59Å; V397-F458 HydrophobicContact CG1-CG 4Å; V397-F458 HydrophobicContact CG1-CZ 4.27Å
398	W	98.1	Very high	95.9	Very high	72 Å²	72	33.7 Å²	33.7	27%	0.273	18%	0.176	S	C	.	.	H	α-helix	trans	-62.7	-51.7	175.6	175.7	-104.6	0	0	0	112.7	I394 L396 S400 M401 L463 F468	I394-W398 WeakPolarHBondContact O-CB 3.49Å; I394-W398 PolarHBondContact O-N 3.09Å; L396-W398 VanDerWaalsContact C-N 3.31Å; L396-W398 PolarHBondContact O-N 3.13Å; W398-S400 PolarHBondContact O-N 2.95Å; W398-S400 VanDerWaalsContact O-N 3.08Å; W398-M401 HydrophobicContact CD2-CE 4.08Å; W398-M401 HydrophobicContact CE3-CE 3.45Å; W398-M401 VanDerWaalsContact CE3-CE 3.45Å; W398-M401 HydrophobicContact CE3-SD 3.81Å; W398-M401 HydrophobicContact CH2-CE 3.67Å; W398-M401 HydrophobicContact CZ2-CE 4.28Å; W398-M401 HydrophobicContact CZ3-CE 3.23Å; W398-M401 HydrophobicContact CZ3-SD 3.89Å; W398-M401 WeakPolarHBondContact O-CG 3.32Å; W398-M401 PolarHBondContact O-N 3.29Å; W398-L463 HydrophobicContact CE3-CD2 4.01Å; W398-L463 HydrophobicContact CE3-CG 4.48Å; W398-L463 HydrophobicContact CZ3-CB 4.28Å; W398-L463 HydrophobicContact CZ3-CD2 4.01Å; W398-L463 HydrophobicContact CZ3-CG 3.98Å; W398-L463 WeakPolarHBondContact CZ3-O 3.45Å; W398-F468 HydrophobicContact CB-CD2 3.72Å; W398-F468 HydrophobicContact CB-CE1 4.44Å; W398-F468 HydrophobicContact CB-CE2 3.41Å; W398-F468 VanDerWaalsContact CB-CE2 3.41Å; W398-F468 HydrophobicContact CB-CG 4.36Å; W398-F468 HydrophobicContact CB-CZ 3.81Å; W398-F468 AromaticContact CD1-CE1 3.72Å; W398-F468 AromaticContact CD1-CZ 3.84Å; W398-F468 HydrophobicContact CD2-CB 3.98Å; W398-F468 AromaticContact CD2-CD1 3.82Å; W398-F468 HydrophobicContact CD2-CD1 3.82Å; W398-F468 AromaticContact CD2-CD2 3.81Å; W398-F468 HydrophobicContact CD2-CD2 3.81Å; W398-F468 HydrophobicContact CD2-CE1 4.27Å; W398-F468 HydrophobicContact CD2-CE2 4.26Å; W398-F468 AromaticContact CD2-CG 3.57Å; W398-F468 HydrophobicContact CD2-CG 3.57Å; W398-F468 HydrophobicContact CD2-CZ 4.47Å; W398-F468 AromaticContact CE2-CD1 3.89Å; W398-F468 HydrophobicContact CE3-CB 3.61Å; W398-F468 HydrophobicContact CE3-CD1 4.35Å; W398-F468 AromaticContact CE3-CD2 3.89Å; W398-F468 HydrophobicContact CE3-CD2 3.89Å; W398-F468 AromaticContact CE3-CG 3.68Å; W398-F468 HydrophobicContact CE3-CG 3.68Å; W398-F468 AromaticContact CG-CD1 3.94Å; W398-F468 HydrophobicContact CG-CD1 3.94Å; W398-F468 AromaticContact CG-CD2 3.73Å; W398-F468 HydrophobicContact CG-CD2 3.73Å; W398-F468 AromaticContact CG-CE1 3.9Å; W398-F468 HydrophobicContact CG-CE1 3.9Å; W398-F468 AromaticContact CG-CE2 3.68Å; W398-F468 HydrophobicContact CG-CE2 3.68Å; W398-F468 AromaticContact CG-CG 3.86Å; W398-F468 HydrophobicContact CG-CG 3.86Å; W398-F468 AromaticContact CG-CZ 3.76Å; W398-F468 HydrophobicContact CG-CZ 3.76Å; W398-F468 HydrophobicContact CH2-CB 4.2Å; W398-F468 HydrophobicContact CZ3-CB 3.73Å; W398-F468 HydrophobicContact CZ3-CG 4.26Å; W398-F468 AromaticContact NE1-CD1 3.96Å
399	R	96.9	Very high	95.9	Very high	49 Å²	49	35.1 Å²	35.1	19%	0.185	18%	0.182	C	C	.	.	H	α-helix	trans	-55.5	-25.7	174.1	-98.3	178.1	-73.4	-167.7	-8.4	113.7	E358 G395 L396 L408 F409	E358-R399 VanDerWaalsContact CD-NH2 3.29Å; E358-R399 IonicContact OE1-CZ 3.38Å; E358-R399 IonicContact OE1-NH1 3.61Å; E358-R399 PolarHBondContact OE1-NH1 3.34Å; E358-R399 IonicContact OE1-NH2 3.1Å; E358-R399 PolarHBondContact OE1-NH2 3.45Å; E358-R399 IonicContact OE2-NH2 2.76Å; E358-R399 PolarHBondContact OE2-NH2 2.96Å; G395-R399 WeakPolarHBondContact O-CB 3.47Å; G395-R399 PolarHBondContact O-N 3.45Å; G395-R399 VanDerWaalsContact O-N 3.12Å; G395-R399 PolarHBondContact O-NE 2.88Å; L396-R399 PolarHBondContact O-N 2.98Å; R399-L408 HydrophobicContact CB-CB 4.41Å; R399-L408 HydrophobicContact CB-CD2 4.32Å; R399-L408 HydrophobicContact CG-CD2 4.42Å; R399-F409 PolarHBondContact NH1-O 3.1Å
400	S	97.8	Very high	95.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-1.2	-172.6	-53.1	0	0	0	0	114.6	L396 V397 W398 E402 H403 L407 L408 S455	L396-S400 VanDerWaalsContact O-CB 3.32Å; L396-S400 WeakPolarHBondContact O-CB 3.39Å; L396-S400 PolarHBondContact O-N 2.98Å; L396-S400 PolarHBondContact O-OG 3.46Å; V397-S400 PolarHBondContact O-N 3.23Å; W398-S400 PolarHBondContact O-N 2.95Å; W398-S400 VanDerWaalsContact O-N 3.08Å; S400-E402 VanDerWaalsContact C-N 3.28Å; S400-E402 PolarHBondContact O-N 3.03Å; S400-H403 PolarHBondContact O-N 3.35Å; S400-H403 VanDerWaalsContact O-N 3.13Å; S400-L407 WeakPolarHBondContact OG-CA 3.38Å; S400-L408 PolarHBondContact OG-N 3.34Å; S400-S455 PolarHBondContact O-OG 3.34Å
401	M	96.4	Very high	95.8	Very high	26 Å²	26	36.6 Å²	36.6	13%	0.128	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-36.7	-175.8	-69.1	-165	-51.2	0	0	113.5	V397 W398 H403 S455 F458 R459 L463	V397-M401 PolarHBondContact O-N 2.9Å; W398-M401 HydrophobicContact CD2-CE 4.08Å; W398-M401 HydrophobicContact CE3-CE 3.45Å; W398-M401 VanDerWaalsContact CE3-CE 3.45Å; W398-M401 HydrophobicContact CE3-SD 3.81Å; W398-M401 HydrophobicContact CH2-CE 3.67Å; W398-M401 HydrophobicContact CZ2-CE 4.28Å; W398-M401 HydrophobicContact CZ3-CE 3.23Å; W398-M401 HydrophobicContact CZ3-SD 3.89Å; W398-M401 WeakPolarHBondContact O-CG 3.32Å; W398-M401 PolarHBondContact O-N 3.29Å; M401-H403 VanDerWaalsContact C-N 3.3Å; M401-S455 WeakPolarHBondContact CA-OG 3.42Å; M401-S455 PolarHBondContact N-OG 3.09Å; M401-F458 HydrophobicContact CG-CB 4.01Å; M401-F458 HydrophobicContact SD-CB 3.59Å; M401-F458 VanDerWaalsContact SD-CB 3.59Å; M401-F458 HydrophobicContact SD-CD2 4.39Å; M401-R459 HydrophobicContact CB-CB 4.43Å; M401-R459 WeakPolarHBondContact O-CD 3.39Å; M401-R459 PolarHBondContact O-NH1 3.48Å; M401-L463 HydrophobicContact SD-CB 4.45Å
402	E	93.9	Very high	95.5	Very high	158 Å²	158	38.9 Å²	38.9	74%	0.738	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-80.1	-13.6	-177.5	-60	-166.1	168.2	0	0	112.8	S400 P404 R459	S400-E402 VanDerWaalsContact C-N 3.28Å; S400-E402 PolarHBondContact O-N 3.03Å; E402-P404 WeakPolarHBondContact O-CD 3.32Å; E402-R459 PolarHBondContact O-NH1 3.1Å
403	H	93.8	Very high	95.2	Very high	65 Å²	65	38 Å²	38	30%	0.301	20%	0.201	S	C	.	.	S	Bend	trans	-108.8	80.7	-173.4	-58.5	-52.7	0	0	0	112	S400 M401 G405 K406 L414	S400-H403 PolarHBondContact O-N 3.35Å; S400-H403 VanDerWaalsContact O-N 3.13Å; M401-H403 VanDerWaalsContact C-N 3.3Å; H403-G405 PolarHBondContact O-N 3.41Å; H403-K406 HydrophobicContact CB-CB 4.38Å; H403-K406 PolarHBondContact O-N 2.89Å; H403-K406 VanDerWaalsContact O-N 3.17Å; H403-L414 HydrophobicContact CB-CD1 4.18Å
404	P	91.4	Very high	94.8	Very high	97 Å²	97	41 Å²	41	63%	0.63	22%	0.217	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.9	129.8	-176.7	28.2	-35.1	0	0	0	111.2	E402 K406	E402-P404 WeakPolarHBondContact O-CD 3.32Å; P404-K406 VanDerWaalsContact C-N 3.29Å; P404-K406 PolarHBondContact O-N 3.07Å
405	G	88.6	Confident	94.4	Very high	40 Å²	40	41.2 Å²	41.2	41%	0.412	22%	0.218	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.5	-6.4	-179	0	0	0	0	0	115.6	H403	H403-G405 PolarHBondContact O-N 3.41Å
406	K	92.8	Very high	93.8	Very high	78 Å²	78	42.3 Å²	42.3	34%	0.339	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	157.5	-174.4	-48	-165.6	-166.7	-140.2	0	111.4	H403 P404 L414 L415 D416	H403-K406 HydrophobicContact CB-CB 4.38Å; H403-K406 PolarHBondContact O-N 2.89Å; H403-K406 VanDerWaalsContact O-N 3.17Å; P404-K406 VanDerWaalsContact C-N 3.29Å; P404-K406 PolarHBondContact O-N 3.07Å; K406-L414 HydrophobicContact CB-CD1 3.72Å; K406-L414 HydrophobicContact CB-CG 4.17Å; K406-L414 HydrophobicContact CD-CD2 4.09Å; K406-L414 HydrophobicContact CD-CG 4.21Å; K406-L415 CarbonylContact C-O 3.58Å; K406-L415 WeakPolarHBondContact CA-O 3.07Å; K406-L415 WeakPolarHBondContact CB-O 3.29Å; K406-D416 HydrophobicContact CD-CB 4.31Å; K406-D416 WeakPolarHBondContact CD-OD2 3.19Å; K406-D416 WeakPolarHBondContact CE-OD2 3.36Å; K406-D416 HydrophobicContact CG-CB 4.38Å; K406-D416 IonicContact NZ-OD2 3.36Å; K406-D416 PolarHBondContact NZ-OD2 3.1Å
407	L	95.6	Very high	92.9	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	123.5	175.6	-65.9	-176.9	0	0	0	110.6	L396 S400 F409 L415 F448 L451 L452	L396-L407 HydrophobicContact CD1-CB 4.32Å; L396-L407 HydrophobicContact CD2-CD1 4.35Å; S400-L407 WeakPolarHBondContact OG-CA 3.38Å; L407-F409 HydrophobicContact CB-CD2 4.05Å; L407-F409 HydrophobicContact CB-CE2 3.64Å; L407-F409 HydrophobicContact CB-CZ 4.46Å; L407-F409 HydrophobicContact CD1-CE2 4.19Å; L407-F409 HydrophobicContact CD1-CZ 4.29Å; L407-F409 PolarHBondContact O-N 3.09Å; L407-L415 PolarHBondContact N-O 3.07Å; L407-L415 PolarHBondContact O-N 3.24Å; L407-F448 HydrophobicContact CB-CE2 4.04Å; L407-F448 HydrophobicContact CB-CZ 4.07Å; L407-F448 HydrophobicContact CD1-CD1 4.36Å; L407-F448 HydrophobicContact CD1-CD2 3.59Å; L407-F448 HydrophobicContact CD1-CE1 4.37Å; L407-F448 HydrophobicContact CD1-CE2 3.62Å; L407-F448 HydrophobicContact CD1-CG 3.99Å; L407-F448 HydrophobicContact CD1-CZ 4.02Å; L407-F448 HydrophobicContact CG-CD2 4.38Å; L407-F448 HydrophobicContact CG-CE1 4.28Å; L407-F448 HydrophobicContact CG-CE2 3.96Å; L407-F448 HydrophobicContact CG-CZ 3.9Å; L407-L451 HydrophobicContact CD1-CB 3.68Å; L407-L451 HydrophobicContact CD1-CD1 3.94Å; L407-L451 HydrophobicContact CD1-CG 4.46Å; L407-L451 HydrophobicContact CD2-CB 4.2Å; L407-L452 HydrophobicContact CD2-CD2 3.78Å; L407-L452 HydrophobicContact CD2-CG 4.37Å; L407-L452 HydrophobicContact CG-CD2 3.91Å; L407-L452 HydrophobicContact CG-CG 4.37Å
408	L	96	Very high	91.5	Very high	30 Å²	30	51.8 Å²	51.8	16%	0.157	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	87.6	179	-175.2	74.6	0	0	0	109.5	L396 R399 S400 A410 L414	L396-L408 WeakPolarHBondContact CD1-O 3.49Å; R399-L408 HydrophobicContact CB-CB 4.41Å; R399-L408 HydrophobicContact CB-CD2 4.32Å; R399-L408 HydrophobicContact CG-CD2 4.42Å; S400-L408 PolarHBondContact OG-N 3.34Å; L408-A410 WeakPolarHBondContact CD1-O 3.34Å; L408-L414 HydrophobicContact CB-CD1 4.02Å; L408-L414 HydrophobicContact CD1-CB 4.1Å; L408-L414 HydrophobicContact CD1-CD1 4.04Å
409	F	95.1	Very high	90.1	Very high	31 Å²	31	51.4 Å²	51.4	14%	0.136	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	-46.5	178	-75.9	-94.4	0	0	0	111.2	L351 L354 L396 R399 L407 L413 L415 F448	L351-F409 HydrophobicContact CD2-CD1 3.46Å; L351-F409 VanDerWaalsContact CD2-CD1 3.46Å; L351-F409 HydrophobicContact CD2-CD2 4.47Å; L351-F409 HydrophobicContact CD2-CE1 3.61Å; L351-F409 HydrophobicContact CD2-CG 3.93Å; L351-F409 HydrophobicContact CD2-CZ 4.2Å; L354-F409 HydrophobicContact CD2-CB 3.88Å; L396-F409 HydrophobicContact CD1-CB 4.36Å; L396-F409 HydrophobicContact CD1-CD1 3.87Å; L396-F409 HydrophobicContact CD1-CD2 4.11Å; L396-F409 HydrophobicContact CD1-CE1 4.17Å; L396-F409 HydrophobicContact CD1-CE2 4.38Å; L396-F409 HydrophobicContact CD1-CG 3.85Å; L396-F409 HydrophobicContact CD1-CZ 4.42Å; L396-F409 HydrophobicContact CD2-CD1 3.98Å; L396-F409 HydrophobicContact CD2-CE1 3.48Å; L396-F409 VanDerWaalsContact CD2-CE1 3.48Å; L396-F409 HydrophobicContact CD2-CE2 4.4Å; L396-F409 HydrophobicContact CD2-CZ 3.73Å; L396-F409 HydrophobicContact CG-CE1 4.49Å; R399-F409 PolarHBondContact NH1-O 3.1Å; L407-F409 HydrophobicContact CB-CD2 4.05Å; L407-F409 HydrophobicContact CB-CE2 3.64Å; L407-F409 HydrophobicContact CB-CZ 4.46Å; L407-F409 HydrophobicContact CD1-CE2 4.19Å; L407-F409 HydrophobicContact CD1-CZ 4.29Å; L407-F409 PolarHBondContact O-N 3.09Å; F409-L413 HydrophobicContact CB-CB 4.4Å; F409-L413 HydrophobicContact CB-CD2 3.95Å; F409-L413 HydrophobicContact CB-CG 4.13Å; F409-L413 PolarHBondContact N-O 3.07Å; F409-L415 HydrophobicContact CD2-CB 4.2Å; F409-L415 HydrophobicContact CD2-CD1 3.82Å; F409-L415 HydrophobicContact CD2-CG 4.06Å; F409-L415 HydrophobicContact CE2-CB 4.16Å; F409-L415 HydrophobicContact CE2-CD1 3.79Å; F409-L415 HydrophobicContact CE2-CG 4.3Å; F409-F448 HydrophobicContact CE2-CE2 4.13Å
410	A	95.2	Very high	88.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	164.2	174.5	0	0	0	0	0	109.7	I332 L354 L408 N412 L413	I332-A410 WeakPolarHBondContact O-CB 3.46Å; L354-A410 HydrophobicContact CD1-CB 4.31Å; L354-A410 HydrophobicContact CD2-CB 4.1Å; L408-A410 WeakPolarHBondContact CD1-O 3.34Å; A410-N412 WeakPolarHBondContact CB-OD1 3.47Å; A410-N412 PolarHBondContact O-N 3.15Å; A410-L413 HydrophobicContact CB-CB 3.96Å; A410-L413 PolarHBondContact N-O 2.84Å; A410-L413 CarbonylContact O-C 3.51Å; A410-L413 PolarHBondContact O-N 3.27Å
411	P	93.6	Very high	86.7	Confident	56 Å²	56	50.5 Å²	50.5	36%	0.364	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-21.5	176.7	-24.7	35	0	0	0	114.1	L331 I332 Y333	L331-P411 HydrophobicContact CB-CG 4.31Å; I332-P411 WeakPolarHBondContact O-CD 3.35Å; Y333-P411 HydrophobicContact CD1-CB 4.2Å; Y333-P411 HydrophobicContact CE1-CB 3.76Å; Y333-P411 HydrophobicContact CE1-CG 4.3Å
412	N	91.4	Very high	84.6	Confident	56 Å²	56	50.7 Å²	50.7	30%	0.299	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	9.3	173.7	68.2	-30.6	0	0	0	114.3	Y333 S334 Y336 A410	Y333-N412 HydrophobicContact CD1-CB 4.17Å; S334-N412 PolarHBondContact N-OD1 3.39Å; S334-N412 PolarHBondContact O-ND2 2.98Å; S334-N412 PolarHBondContact OG-ND2 3.16Å; S334-N412 PolarHBondContact OG-OD1 3.1Å; Y336-N412 VanDerWaalsContact CD1-O 3.28Å; Y336-N412 WeakPolarHBondContact CD1-O 3.46Å; A410-N412 WeakPolarHBondContact CB-OD1 3.47Å; A410-N412 PolarHBondContact O-N 3.15Å
413	L	91.6	Very high	82.6	Confident	4 Å²	4	44 Å²	44	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	84	-177.4	-172.6	61.3	0	0	0	110.8	S334 Y336 F342 L350 L351 L354 F409 A410 L415	S334-L413 WeakPolarHBondContact OG-CB 3.42Å; Y336-L413 HydrophobicContact CD2-CD1 4.32Å; Y336-L413 HydrophobicContact CG-CD1 4.15Å; F342-L413 HydrophobicContact CZ-CD1 4.38Å; L350-L413 HydrophobicContact CD2-CD1 3.82Å; L350-L413 HydrophobicContact CD2-CD2 3.73Å; L350-L413 HydrophobicContact CD2-CG 4.44Å; L350-L413 HydrophobicContact CG-CD2 3.91Å; L351-L413 HydrophobicContact CD2-CD2 4.38Å; L354-L413 HydrophobicContact CD2-CD2 4.5Å; F409-L413 HydrophobicContact CB-CB 4.4Å; F409-L413 HydrophobicContact CB-CD2 3.95Å; F409-L413 HydrophobicContact CB-CG 4.13Å; F409-L413 PolarHBondContact N-O 3.07Å; A410-L413 HydrophobicContact CB-CB 3.96Å; A410-L413 PolarHBondContact N-O 2.84Å; A410-L413 CarbonylContact O-C 3.51Å; A410-L413 PolarHBondContact O-N 3.27Å; L413-L415 HydrophobicContact CD1-CD2 3.74Å; L413-L415 HydrophobicContact CD1-CG 4.06Å; L413-L415 HydrophobicContact CG-CD2 4.43Å; L413-L415 HydrophobicContact CG-CG 4.2Å
414	L	91.1	Very high	80.2	Confident	74 Å²	74	46.1 Å²	46.1	39%	0.387	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	107.3	170.4	-178	65.7	0	0	0	108.4	H403 K406 L408	H403-L414 HydrophobicContact CB-CD1 4.18Å; K406-L414 HydrophobicContact CB-CD1 3.72Å; K406-L414 HydrophobicContact CB-CG 4.17Å; K406-L414 HydrophobicContact CD-CD2 4.09Å; K406-L414 HydrophobicContact CD-CG 4.21Å; L408-L414 HydrophobicContact CB-CD1 4.02Å; L408-L414 HydrophobicContact CD1-CB 4.1Å; L408-L414 HydrophobicContact CD1-CD1 4.04Å
415	L	89	Confident	77.9	Confident	4 Å²	4	46.9 Å²	46.9	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	140.1	178.4	-64.5	-178.4	0	0	0	110.6	F342 L351 K406 L407 F409 L413 I419 I420 F448	F342-L415 HydrophobicContact CE2-CD2 4.44Å; F342-L415 HydrophobicContact CZ-CD2 4.15Å; L351-L415 HydrophobicContact CD2-CD1 4.43Å; K406-L415 CarbonylContact C-O 3.58Å; K406-L415 WeakPolarHBondContact CA-O 3.07Å; K406-L415 WeakPolarHBondContact CB-O 3.29Å; L407-L415 PolarHBondContact N-O 3.07Å; L407-L415 PolarHBondContact O-N 3.24Å; F409-L415 HydrophobicContact CD2-CB 4.2Å; F409-L415 HydrophobicContact CD2-CD1 3.82Å; F409-L415 HydrophobicContact CD2-CG 4.06Å; F409-L415 HydrophobicContact CE2-CB 4.16Å; F409-L415 HydrophobicContact CE2-CD1 3.79Å; F409-L415 HydrophobicContact CE2-CG 4.3Å; L413-L415 HydrophobicContact CD1-CD2 3.74Å; L413-L415 HydrophobicContact CD1-CG 4.06Å; L413-L415 HydrophobicContact CG-CD2 4.43Å; L413-L415 HydrophobicContact CG-CG 4.2Å; L415-I419 HydrophobicContact CD2-CG2 4.4Å; L415-I420 HydrophobicContact CB-CD1 4.45Å; L415-I420 HydrophobicContact CD1-CD1 4.15Å; L415-F448 HydrophobicContact CB-CE2 4.08Å; L415-F448 HydrophobicContact CB-CZ 4.29Å
416	D	85.5	Confident	75.9	Confident	35 Å²	35	51.9 Å²	51.9	19%	0.187	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	153.2	178.4	-153.7	-30.7	0	0	0	110.3	K406 D418 I419 I420	K406-D416 HydrophobicContact CD-CB 4.31Å; K406-D416 WeakPolarHBondContact CD-OD2 3.19Å; K406-D416 WeakPolarHBondContact CE-OD2 3.36Å; K406-D416 HydrophobicContact CG-CB 4.38Å; K406-D416 IonicContact NZ-OD2 3.36Å; K406-D416 PolarHBondContact NZ-OD2 3.1Å; D416-D418 PolarHBondContact O-N 3.16Å; D416-I419 HydrophobicContact CB-CD1 4.11Å; D416-I419 HydrophobicContact CB-CG1 4.05Å; D416-I419 WeakPolarHBondContact O-CB 3.32Å; D416-I419 PolarHBondContact O-N 3.26Å; D416-I420 PolarHBondContact O-N 2.94Å
417	R	79	Confident	73.7	Confident	98 Å²	98	52 Å²	52	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-56.5	-34	174.4	-168.9	-179.1	-169.7	-81.5	-6	111.5	I419 I420 S421 F448 D449 L452	R417-I419 VanDerWaalsContact C-N 3.33Å; R417-I420 PolarHBondContact O-N 3.41Å; R417-S421 WeakPolarHBondContact O-CB 3.4Å; R417-S421 PolarHBondContact O-N 3.02Å; R417-S421 PolarHBondContact O-OG 3.13Å; R417-F448 HydrophobicContact CB-CD1 4.48Å; R417-F448 HydrophobicContact CB-CE1 4.09Å; R417-D449 WeakPolarHBondContact CD-OD1 3.38Å; R417-D449 IonicContact CZ-OD1 2.74Å; R417-D449 IonicContact CZ-OD2 3.41Å; R417-D449 IonicContact NE-OD1 2.67Å; R417-D449 PolarHBondContact NE-OD1 3.31Å; R417-D449 IonicContact NE-OD2 3.29Å; R417-D449 PolarHBondContact NE-OD2 2.96Å; R417-D449 IonicContact NH2-OD1 3.48Å; R417-D449 IonicContact NH2-OD2 3.21Å; R417-D449 PolarHBondContact NH2-OD2 3.34Å; R417-L452 HydrophobicContact CB-CD1 4.46Å
418	D	69.1	Low	71.4	Confident	115 Å²	115	57.6 Å²	57.6	62%	0.615	31%	0.308	S	S	*	.	H	α-helix	trans	-77.4	-16.8	179.1	-67	-7.6	0	0	0	113	D416 G422	D416-D418 PolarHBondContact O-N 3.16Å; D418-G422 VanDerWaalsContact O-CA 3.24Å; D418-G422 WeakPolarHBondContact O-CA 3.38Å; D418-G422 PolarHBondContact O-N 3.36Å
419	I	69.2	Low	69	Low	64 Å²	64	60.6 Å²	60.6	33%	0.328	33%	0.332	S	S	.	.	H	α-helix	trans	-78.4	-46.3	169.2	-63.1	173.8	0	0	0	109.3	F342 M347 L415 D416 R417 G422 L423	F342-I419 HydrophobicContact CD2-CG2 4.06Å; F342-I419 HydrophobicContact CE2-CG2 4.22Å; M347-I419 HydrophobicContact CE-CG2 3.95Å; L415-I419 HydrophobicContact CD2-CG2 4.4Å; D416-I419 HydrophobicContact CB-CD1 4.11Å; D416-I419 HydrophobicContact CB-CG1 4.05Å; D416-I419 WeakPolarHBondContact O-CB 3.32Å; D416-I419 PolarHBondContact O-N 3.26Å; R417-I419 VanDerWaalsContact C-N 3.33Å; I419-G422 PolarHBondContact O-N 3Å; I419-L423 PolarHBondContact O-N 2.94Å
420	I	65.6	Low	66.5	Low	7 Å²	7	65.8 Å²	65.8	4%	0.036	36%	0.36	C	S	.	.	H	α-helix	trans	-65.2	-40.2	177.5	-49.4	-55.6	0	0	0	111.1	M347 L415 D416 R417 C440 V445 F448	M347-I420 HydrophobicContact CE-CD1 3.93Å; M347-I420 HydrophobicContact SD-CD1 3.64Å; L415-I420 HydrophobicContact CB-CD1 4.45Å; L415-I420 HydrophobicContact CD1-CD1 4.15Å; D416-I420 PolarHBondContact O-N 2.94Å; R417-I420 PolarHBondContact O-N 3.41Å; I420-C440 PolarHBondContact O-SG 3.19Å; I420-V445 HydrophobicContact CG2-CG2 3.92Å; I420-F448 HydrophobicContact CD1-CD2 4.25Å; I420-F448 HydrophobicContact CD1-CE2 4.04Å; I420-F448 HydrophobicContact CG1-CD1 4.49Å; I420-F448 HydrophobicContact CG1-CD2 3.65Å; I420-F448 HydrophobicContact CG1-CE1 4.42Å; I420-F448 HydrophobicContact CG1-CE2 3.54Å; I420-F448 HydrophobicContact CG1-CG 4.13Å; I420-F448 HydrophobicContact CG1-CZ 3.96Å
421	S	58.1	Low	63.9	Low	22 Å²	22	73.1 Å²	73.1	15%	0.154	40%	0.399	C	S	.	.	H	α-helix	trans	-88.6	-15.8	177.4	64.9	0	0	0	0	114.6	R417 L423 Q424 I425	R417-S421 WeakPolarHBondContact O-CB 3.4Å; R417-S421 PolarHBondContact O-N 3.02Å; R417-S421 PolarHBondContact O-OG 3.13Å; S421-L423 VanDerWaalsContact C-N 3.3Å; S421-L423 PolarHBondContact O-N 3.44Å; S421-Q424 WeakPolarHBondContact O-CA 3.31Å; S421-Q424 WeakPolarHBondContact O-CB 3.5Å; S421-Q424 PolarHBondContact O-N 3.46Å; S421-I425 PolarHBondContact O-N 3.06Å
422	G	51.6	Low	61.6	Low	31 Å²	31	80 Å²	80	32%	0.32	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-37.5	169.1	0	0	0	0	0	112.4	D418 I419 Q424 I425 L426	D418-G422 VanDerWaalsContact O-CA 3.24Å; D418-G422 WeakPolarHBondContact O-CA 3.38Å; D418-G422 PolarHBondContact O-N 3.36Å; I419-G422 PolarHBondContact O-N 3Å; G422-Q424 PolarHBondContact O-N 3.33Å; G422-I425 PolarHBondContact O-N 2.71Å; G422-L426 PolarHBondContact O-N 3.47Å
423	L	52.5	Low	59.1	Low	18 Å²	18	82.5 Å²	82.5	9%	0.094	45%	0.446	C	S	.	.	H	α-helix	trans	-60	-18.9	167.9	-91.3	146.3	0	0	0	113.7	F342 M347 I419 S421 C440	F342-L423 HydrophobicContact CB-CD1 4.29Å; M347-L423 HydrophobicContact CE-CD1 3.48Å; M347-L423 VanDerWaalsContact CE-CD1 3.48Å; M347-L423 HydrophobicContact SD-CD1 4.08Å; I419-L423 PolarHBondContact O-N 2.94Å; S421-L423 VanDerWaalsContact C-N 3.3Å; S421-L423 PolarHBondContact O-N 3.44Å; L423-C440 HydrophobicContact CB-CB 3.88Å
424	Q	42.4	Very low	56.7	Low	109 Å²	109	90.3 Å²	90.3	51%	0.509	48%	0.482	S	S	.	.	H	α-helix	trans	-81.9	-30	172.9	-163.3	73.8	42.7	0	0	111.9	S421 G422 C440	S421-Q424 WeakPolarHBondContact O-CA 3.31Å; S421-Q424 WeakPolarHBondContact O-CB 3.5Å; S421-Q424 PolarHBondContact O-N 3.46Å; G422-Q424 PolarHBondContact O-N 3.33Å; Q424-C440 HydrophobicContact CB-CB 4.37Å
425	I	43.8	Very low	54.4	Low	112 Å²	112	97.1 Å²	97.1	57%	0.574	50%	0.503	S	S	*	.	H	α-helix	trans	-96.8	-37.3	-168.5	-63.5	174.5	0	0	0	112.1	S421 G422 L427 V428	S421-I425 PolarHBondContact O-N 3.06Å; G422-I425 PolarHBondContact O-N 2.71Å; I425-L427 PolarHBondContact O-N 3.29Å; I425-V428 PolarHBondContact O-N 3.06Å
426	L	45.6	Very low	52.1	Low	146 Å²	146	104.9 Å²	104.9	76%	0.764	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-18.2	-177.7	-152.5	78.3	0	0	0	113.4	G422	G422-L426 PolarHBondContact O-N 3.47Å
427	L	46	Very low	50.1	Low	80 Å²	80	110.8 Å²	110.8	42%	0.419	57%	0.571	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.9	-21.3	172.2	-93.8	-174	0	0	0	115.4	I425 Q437 G438 K439	I425-L427 PolarHBondContact O-N 3.29Å; L427-Q437 WeakPolarHBondContact CD2-O 3.13Å; L427-G438 WeakPolarHBondContact CD1-O 3.35Å; L427-G438 VanDerWaalsContact CG-O 3.31Å; L427-G438 WeakPolarHBondContact CG-O 3.11Å; L427-K439 HydrophobicContact CD1-CB 4.32Å; L427-K439 HydrophobicContact CD1-CG 3.85Å
428	V	47.8	Very low	48.3	Very low	118 Å²	118	107.3 Å²	107.3	72%	0.715	57%	0.565	S	S	*	*	S	Bend	trans	-94	-14.6	-163.4	-175	0	0	0	0	112.2	I425	I425-V428 PolarHBondContact O-N 3.06Å
429	S	45.4	Very low	46.9	Very low	93 Å²	93	109.2 Å²	109.2	65%	0.65	57%	0.568	S	S	*	*	S	Bend	trans	-126.3	4.8	-161.8	-56.8	0	0	0	0	116.4
430	L	43.8	Very low	46	Very low	139 Å²	139	106.6 Å²	106.6	73%	0.728	56%	0.555	S	S	*	*	S	Bend	trans	-135.7	101.1	174.1	-71.8	175.7	0	0	0	112.3
431	D	40.2	Very low	45.5	Very low	155 Å²	155	106.3 Å²	106.3	83%	0.829	55%	0.554	S	S	*	*			trans	52.4	139.1	157.5	-63.7	-37.9	0	0	0	123	S433	D431-S433 VanDerWaalsContact C-N 3.26Å; D431-S433 PolarHBondContact O-N 3.41Å
432	F	44.1	Very low	45.7	Very low	200 Å²	200	112 Å²	112	88%	0.877	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	23.2	-162.4	-170.7	-107.5	0	0	0	115.1
433	S	39.4	Very low	46.6	Very low	109 Å²	109	112 Å²	112	76%	0.762	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.1	-33.6	-163	-153.9	0	0	0	0	117.2	D431	D431-S433 VanDerWaalsContact C-N 3.26Å; D431-S433 PolarHBondContact O-N 3.41Å
434	E	41.2	Very low	48.1	Very low	167 Å²	167	112.7 Å²	112.7	78%	0.78	58%	0.582	S	S	*	*			trans	-113.2	80.6	-175.5	-68.5	-153.1	138.4	0	0	114.3	N436	E434-N436 PolarHBondContact O-N 2.89Å
435	R	43.1	Very low	50	Low	218 Å²	218	109.3 Å²	109.3	82%	0.823	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	86	168.1	-62.9	-175.5	-168.2	176.1	4.8	111.2
436	N	41.1	Very low	52.2	Low	167 Å²	167	108.9 Å²	108.9	89%	0.893	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-174.2	-3.2	144.2	-101.2	-7.3	0	0	0	117.3	E434	E434-N436 PolarHBondContact O-N 2.89Å
437	Q	43.2	Very low	54.4	Low	159 Å²	159	102.4 Å²	102.4	74%	0.743	53%	0.53	S	S	*	.	S	Bend	trans	-116.8	136.7	-179.7	-63.5	-171.3	57.8	0	0	112.1	L427	L427-Q437 WeakPolarHBondContact CD2-O 3.13Å
438	G	41.2	Very low	56.6	Low	25 Å²	25	99 Å²	99	26%	0.258	51%	0.512	S	S	.	.			trans	113.6	0.7	166.4	0	0	0	0	0	117.8	L427 C440	L427-G438 WeakPolarHBondContact CD1-O 3.35Å; L427-G438 VanDerWaalsContact CG-O 3.31Å; L427-G438 WeakPolarHBondContact CG-O 3.11Å; G438-C440 PolarHBondContact O-N 2.86Å
439	K	40.7	Very low	58.7	Low	155 Å²	155	96 Å²	96	67%	0.674	49%	0.492	S	S	*	.			trans	-60.6	122.5	172.7	-76.2	-174.4	175.7	-177	0	109.8	E344 L427	E344-K439 VanDerWaalsContact CB-O 3.32Å; E344-K439 WeakPolarHBondContact CB-O 3.37Å; E344-K439 VanDerWaalsContact CG-O 3.29Å; E344-K439 WeakPolarHBondContact CG-O 3.32Å; L427-K439 HydrophobicContact CD1-CB 4.32Å; L427-K439 HydrophobicContact CD1-CG 3.85Å
440	C	50	Low	61.1	Low	8 Å²	8	93.8 Å²	93.8	5%	0.054	47%	0.472	C	S	.	.			trans	-57.7	145.4	169.7	-173.5	0	0	0	0	109.9	I420 L423 Q424 G438 E442	I420-C440 PolarHBondContact O-SG 3.19Å; L423-C440 HydrophobicContact CB-CB 3.88Å; Q424-C440 HydrophobicContact CB-CB 4.37Å; G438-C440 PolarHBondContact O-N 2.86Å; C440-E442 PolarHBondContact O-N 2.79Å
441	V	55.4	Low	63.6	Low	2 Å²	2	87.5 Å²	87.5	1%	0.012	44%	0.439	C	S	.	.			trans	-60.4	106.5	-177	-136.2	0	0	0	0	110	E344 M348 G443 M444 H547 M551	E344-V441 HydrophobicContact CG-CB 4.19Å; E344-V441 HydrophobicContact CG-CG1 3.95Å; E344-V441 HydrophobicContact CG-CG2 4.01Å; M348-V441 HydrophobicContact CG-CB 4.38Å; M348-V441 HydrophobicContact CG-CG1 3.57Å; M348-V441 HydrophobicContact CG-CG2 3.94Å; M348-V441 HydrophobicContact SD-CB 4.33Å; M348-V441 HydrophobicContact SD-CG1 3.79Å; M348-V441 HydrophobicContact SD-CG2 4Å; V441-G443 PolarHBondContact O-N 2.89Å; V441-M444 HydrophobicContact CB-CB 4.2Å; V441-M444 HydrophobicContact CB-CG 3.73Å; V441-M444 HydrophobicContact CG1-CG 4.34Å; V441-M444 HydrophobicContact CG2-CG 4.14Å; V441-M444 WeakPolarHBondContact O-CB 3.37Å; V441-M444 PolarHBondContact O-N 2.94Å; V441-H547 WeakPolarHBondContact CG1-NE2 3.32Å; V441-M551 HydrophobicContact CG1-CE 3.88Å; V441-M551 HydrophobicContact CG1-CG 4.11Å; V441-M551 HydrophobicContact CG1-SD 3.42Å; V441-M551 WeakPolarHBondContact CG1-SD 3.49Å
442	E	60.9	Low	66.3	Low	140 Å²	140	81.2 Å²	81.2	65%	0.654	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	110.6	-168.2	-171.3	174.5	-152.2	0	0	111.4	C440 H547 K554	C440-E442 PolarHBondContact O-N 2.79Å; E442-H547 PolarHBondContact O-CE1 3.4Å; E442-H547 PolarHBondContact O-ND1 3Å; E442-K554 IonicContact OE2-NZ 3.72Å; E442-K554 PolarHBondContact OE2-NZ 2.95Å
443	G	71.9	Confident	68.8	Low	33 Å²	33	74.7 Å²	74.7	34%	0.34	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-11.1	-177.4	0	0	0	0	0	116.2	V441 V445 E446	V441-G443 PolarHBondContact O-N 2.89Å; G443-V445 VanDerWaalsContact C-N 3.29Å; G443-V445 PolarHBondContact O-N 3.04Å; G443-E446 PolarHBondContact O-N 3.17Å
444	M	82.1	Confident	71.6	Confident	31 Å²	31	69.7 Å²	69.7	15%	0.153	35%	0.353	C	S	.	.	H	α-helix	trans	-64.2	-32	179	-81.9	-67.6	-93.2	0	0	113.2	M348 L351 V441 E446 I447 F448 H547	M348-M444 HydrophobicContact SD-CE 4Å; M348-M444 HydrophobicContact SD-CG 4.43Å; L351-M444 HydrophobicContact CD1-CE 3.72Å; V441-M444 HydrophobicContact CB-CB 4.2Å; V441-M444 HydrophobicContact CB-CG 3.73Å; V441-M444 HydrophobicContact CG1-CG 4.34Å; V441-M444 HydrophobicContact CG2-CG 4.14Å; V441-M444 WeakPolarHBondContact O-CB 3.37Å; V441-M444 PolarHBondContact O-N 2.94Å; M444-E446 VanDerWaalsContact C-N 3.32Å; M444-E446 PolarHBondContact O-N 2.86Å; M444-I447 PolarHBondContact O-N 2.92Å; M444-I447 HydrophobicContact SD-CD1 4.19Å; M444-F448 WeakPolarHBondContact O-CB 3.31Å; M444-F448 PolarHBondContact O-N 3.23Å; M444-H547 WeakPolarHBondContact CG-NE2 3.45Å
445	V	83.8	Confident	74.2	Confident	39 Å²	39	62 Å²	62	24%	0.236	32%	0.318	C	S	.	.	H	α-helix	trans	-60.1	-40.4	176.9	-179.5	0	0	0	0	111.6	I420 G443 I447 F448 D449	I420-V445 HydrophobicContact CG2-CG2 3.92Å; G443-V445 VanDerWaalsContact C-N 3.29Å; G443-V445 PolarHBondContact O-N 3.04Å; V445-I447 PolarHBondContact O-N 2.95Å; V445-F448 PolarHBondContact O-N 3.16Å; V445-D449 WeakPolarHBondContact O-CB 3.42Å; V445-D449 PolarHBondContact O-N 2.89Å
446	E	89.1	Confident	76.8	Confident	103 Å²	103	54.6 Å²	54.6	48%	0.481	30%	0.299	S	S	.	.	H	α-helix	trans	-61.9	-45.4	176.5	-62.5	-174.1	174.5	0	0	111.4	G443 M444 D449 M450 K543	G443-E446 PolarHBondContact O-N 3.17Å; M444-E446 VanDerWaalsContact C-N 3.32Å; M444-E446 PolarHBondContact O-N 2.86Å; E446-D449 PolarHBondContact O-N 2.89Å; E446-M450 WeakPolarHBondContact O-CG 3.34Å; E446-M450 PolarHBondContact O-N 3.33Å; E446-K543 IonicContact OE2-NZ 2.73Å; E446-K543 PolarHBondContact OE2-NZ 3.31Å
447	I	92	Very high	79.4	Confident	10 Å²	10	50.9 Å²	50.9	5%	0.051	27%	0.273	C	S	.	.	H	α-helix	trans	-66.1	-42	-179.2	-61	161.8	0	0	0	110	M393 M444 V445 M450 L451 K543 H547	M393-I447 HydrophobicContact CE-CG2 4.09Å; M444-I447 PolarHBondContact O-N 2.92Å; M444-I447 HydrophobicContact SD-CD1 4.19Å; V445-I447 PolarHBondContact O-N 2.95Å; I447-M450 HydrophobicContact CG1-CE 4.35Å; I447-M450 PolarHBondContact O-N 2.95Å; I447-L451 HydrophobicContact CG2-CD1 3.92Å; I447-L451 WeakPolarHBondContact O-CB 3.35Å; I447-L451 VanDerWaalsContact O-CG 3.26Å; I447-L451 WeakPolarHBondContact O-CG 3.49Å; I447-L451 PolarHBondContact O-N 3.25Å; I447-K543 HydrophobicContact CG1-CB 4.2Å; I447-H547 HydrophobicContact CD1-CB 3.75Å
448	F	92.3	Very high	82	Confident	9 Å²	9	43.3 Å²	43.3	4%	0.039	24%	0.237	C	C	.	.	H	α-helix	trans	-63	-46.7	177.7	-160.1	-87.3	0	0	0	111.9	L407 F409 L415 R417 I420 M444 V445 M450 L451 L452	L407-F448 HydrophobicContact CB-CE2 4.04Å; L407-F448 HydrophobicContact CB-CZ 4.07Å; L407-F448 HydrophobicContact CD1-CD1 4.36Å; L407-F448 HydrophobicContact CD1-CD2 3.59Å; L407-F448 HydrophobicContact CD1-CE1 4.37Å; L407-F448 HydrophobicContact CD1-CE2 3.62Å; L407-F448 HydrophobicContact CD1-CG 3.99Å; L407-F448 HydrophobicContact CD1-CZ 4.02Å; L407-F448 HydrophobicContact CG-CD2 4.38Å; L407-F448 HydrophobicContact CG-CE1 4.28Å; L407-F448 HydrophobicContact CG-CE2 3.96Å; L407-F448 HydrophobicContact CG-CZ 3.9Å; F409-F448 HydrophobicContact CE2-CE2 4.13Å; L415-F448 HydrophobicContact CB-CE2 4.08Å; L415-F448 HydrophobicContact CB-CZ 4.29Å; R417-F448 HydrophobicContact CB-CD1 4.48Å; R417-F448 HydrophobicContact CB-CE1 4.09Å; I420-F448 HydrophobicContact CD1-CD2 4.25Å; I420-F448 HydrophobicContact CD1-CE2 4.04Å; I420-F448 HydrophobicContact CG1-CD1 4.49Å; I420-F448 HydrophobicContact CG1-CD2 3.65Å; I420-F448 HydrophobicContact CG1-CE1 4.42Å; I420-F448 HydrophobicContact CG1-CE2 3.54Å; I420-F448 HydrophobicContact CG1-CG 4.13Å; I420-F448 HydrophobicContact CG1-CZ 3.96Å; M444-F448 WeakPolarHBondContact O-CB 3.31Å; M444-F448 PolarHBondContact O-N 3.23Å; V445-F448 PolarHBondContact O-N 3.16Å; F448-M450 PolarHBondContact O-N 3.41Å; F448-L451 PolarHBondContact O-N 3.18Å; F448-L452 HydrophobicContact CD1-CD1 3.73Å; F448-L452 HydrophobicContact CD1-CG 3.99Å; F448-L452 HydrophobicContact CE1-CD1 3.72Å; F448-L452 HydrophobicContact CE1-CD2 4.31Å; F448-L452 HydrophobicContact CE1-CG 4.01Å; F448-L452 WeakPolarHBondContact O-CG 3.22Å; F448-L452 PolarHBondContact O-N 3.39Å
449	D	92.3	Very high	84.7	Confident	54 Å²	54	48.3 Å²	48.3	29%	0.289	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-36.5	177.8	-79.2	-17.1	0	0	0	112.1	R417 V445 E446 A453	R417-D449 WeakPolarHBondContact CD-OD1 3.38Å; R417-D449 IonicContact CZ-OD1 2.74Å; R417-D449 IonicContact CZ-OD2 3.41Å; R417-D449 IonicContact NE-OD1 2.67Å; R417-D449 PolarHBondContact NE-OD1 3.31Å; R417-D449 IonicContact NE-OD2 3.29Å; R417-D449 PolarHBondContact NE-OD2 2.96Å; R417-D449 IonicContact NH2-OD1 3.48Å; R417-D449 IonicContact NH2-OD2 3.21Å; R417-D449 PolarHBondContact NH2-OD2 3.34Å; V445-D449 WeakPolarHBondContact O-CB 3.42Å; V445-D449 PolarHBondContact O-N 2.89Å; E446-D449 PolarHBondContact O-N 2.89Å; D449-A453 WeakPolarHBondContact O-CB 3.34Å; D449-A453 PolarHBondContact O-N 3.32Å
450	M	95.4	Very high	87.3	Confident	46 Å²	46	48.5 Å²	48.5	23%	0.227	25%	0.254	C	S	.	.	H	α-helix	trans	-66.5	-39.9	172.5	-70.4	-172.4	-68.2	0	0	112.8	E446 I447 F448 A453 T454 M540 K543	E446-M450 WeakPolarHBondContact O-CG 3.34Å; E446-M450 PolarHBondContact O-N 3.33Å; I447-M450 HydrophobicContact CG1-CE 4.35Å; I447-M450 PolarHBondContact O-N 2.95Å; F448-M450 PolarHBondContact O-N 3.41Å; M450-A453 PolarHBondContact O-N 3.43Å; M450-T454 WeakPolarHBondContact O-CB 3.45Å; M450-T454 PolarHBondContact O-N 3.44Å; M450-T454 PolarHBondContact O-OG1 3.46Å; M450-M540 HydrophobicContact CB-CG 3.68Å; M450-M540 HydrophobicContact CB-SD 3.62Å; M450-M540 HydrophobicContact CE-CG 4.2Å; M450-M540 HydrophobicContact SD-CG 4.12Å; M450-K543 HydrophobicContact CE-CB 4.18Å; M450-K543 HydrophobicContact CE-CG 4.19Å
451	L	96.8	Very high	89.5	Confident	7 Å²	7	49.6 Å²	49.6	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-65.7	-43.8	176.6	-74.1	165.1	0	0	0	111.1	M393 L396 V397 L407 I447 F448 T454 S455 M540	M393-L451 HydrophobicContact CB-CD2 4.09Å; M393-L451 HydrophobicContact CG-CD2 4.04Å; M393-L451 HydrophobicContact SD-CD2 4.36Å; L396-L451 HydrophobicContact CD2-CD1 3.97Å; V397-L451 HydrophobicContact CG2-CD2 3.68Å; L407-L451 HydrophobicContact CD1-CB 3.68Å; L407-L451 HydrophobicContact CD1-CD1 3.94Å; L407-L451 HydrophobicContact CD1-CG 4.46Å; L407-L451 HydrophobicContact CD2-CB 4.2Å; I447-L451 HydrophobicContact CG2-CD1 3.92Å; I447-L451 WeakPolarHBondContact O-CB 3.35Å; I447-L451 VanDerWaalsContact O-CG 3.26Å; I447-L451 WeakPolarHBondContact O-CG 3.49Å; I447-L451 PolarHBondContact O-N 3.25Å; F448-L451 PolarHBondContact O-N 3.18Å; L451-T454 PolarHBondContact O-N 3.05Å; L451-S455 WeakPolarHBondContact O-CB 3.44Å; L451-S455 PolarHBondContact O-N 2.88Å; L451-M540 HydrophobicContact CB-SD 4.43Å; L451-M540 HydrophobicContact CD2-CE 4.05Å; L451-M540 HydrophobicContact CD2-SD 3.78Å; L451-M540 HydrophobicContact CG-SD 3.91Å
452	L	95.9	Very high	91.4	Very high	23 Å²	23	54.9 Å²	54.9	12%	0.12	29%	0.286	C	S	.	.	H	α-helix	trans	-59.4	-46.7	172.9	-74.3	-179.5	0	0	0	112	L407 R417 F448 T454 S455 S456	L407-L452 HydrophobicContact CD2-CD2 3.78Å; L407-L452 HydrophobicContact CD2-CG 4.37Å; L407-L452 HydrophobicContact CG-CD2 3.91Å; L407-L452 HydrophobicContact CG-CG 4.37Å; R417-L452 HydrophobicContact CB-CD1 4.46Å; F448-L452 HydrophobicContact CD1-CD1 3.73Å; F448-L452 HydrophobicContact CD1-CG 3.99Å; F448-L452 HydrophobicContact CE1-CD1 3.72Å; F448-L452 HydrophobicContact CE1-CD2 4.31Å; F448-L452 HydrophobicContact CE1-CG 4.01Å; F448-L452 WeakPolarHBondContact O-CG 3.22Å; F448-L452 PolarHBondContact O-N 3.39Å; L452-T454 VanDerWaalsContact C-N 3.26Å; L452-T454 PolarHBondContact O-N 2.96Å; L452-S455 PolarHBondContact O-N 2.89Å; L452-S456 WeakPolarHBondContact O-CB 3.39Å; L452-S456 PolarHBondContact O-N 2.98Å
453	A	96.6	Very high	93.1	Very high	63 Å²	63	48.4 Å²	48.4	52%	0.521	26%	0.256	S	S	.	.	H	α-helix	trans	-61.5	-35.6	177.3	0	0	0	0	0	112	D449 M450 R457	D449-A453 WeakPolarHBondContact O-CB 3.34Å; D449-A453 PolarHBondContact O-N 3.32Å; M450-A453 PolarHBondContact O-N 3.43Å; A453-R457 WeakPolarHBondContact O-CB 3.5Å; A453-R457 PolarHBondContact O-N 2.96Å; A453-R457 VanDerWaalsContact O-N 3.08Å
454	T	97.7	Very high	94.4	Very high	5 Å²	5	50.6 Å²	50.6	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-74.6	-40.2	177.6	-52.9	0	0	0	0	111.9	V397 M450 L451 L452 R457 F458 I533 I537 M540	V397-T454 HydrophobicContact CG1-CG2 3.94Å; V397-T454 HydrophobicContact CG2-CG2 4.33Å; M450-T454 WeakPolarHBondContact O-CB 3.45Å; M450-T454 PolarHBondContact O-N 3.44Å; M450-T454 PolarHBondContact O-OG1 3.46Å; L451-T454 PolarHBondContact O-N 3.05Å; L452-T454 VanDerWaalsContact C-N 3.26Å; L452-T454 PolarHBondContact O-N 2.96Å; T454-R457 PolarHBondContact O-N 2.81Å; T454-F458 PolarHBondContact O-N 3.41Å; T454-I533 HydrophobicContact CG2-CG2 3.7Å; T454-I537 HydrophobicContact CG2-CG1 4.49Å; T454-M540 HydrophobicContact CG2-CE 4.02Å; T454-M540 WeakPolarHBondContact OG1-CE 3.47Å
455	S	97.7	Very high	95.1	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.042	26%	0.261	C	S	.	.	H	α-helix	trans	-59.6	-49.7	172.9	170	0	0	0	0	111.4	S400 M401 L451 L452 R457 F458 R459	S400-S455 PolarHBondContact O-OG 3.34Å; M401-S455 WeakPolarHBondContact CA-OG 3.42Å; M401-S455 PolarHBondContact N-OG 3.09Å; L451-S455 WeakPolarHBondContact O-CB 3.44Å; L451-S455 PolarHBondContact O-N 2.88Å; L452-S455 PolarHBondContact O-N 2.89Å; S455-R457 VanDerWaalsContact C-N 3.26Å; S455-R457 PolarHBondContact O-N 3.33Å; S455-F458 PolarHBondContact O-N 2.83Å; S455-F458 VanDerWaalsContact O-N 3.14Å; S455-R459 PolarHBondContact O-N 2.97Å
456	S	96.8	Very high	95.8	Very high	61 Å²	61	51.9 Å²	51.9	43%	0.427	27%	0.266	S	S	.	.	H	α-helix	trans	-55.1	-42.4	173.9	-175	0	0	0	0	111.5	L452 R459 M460	L452-S456 WeakPolarHBondContact O-CB 3.39Å; L452-S456 PolarHBondContact O-N 2.98Å; S456-R459 PolarHBondContact O-N 2.87Å; S456-M460 WeakPolarHBondContact O-CB 3.46Å; S456-M460 VanDerWaalsContact O-CG 3.25Å; S456-M460 WeakPolarHBondContact O-CG 3.45Å; S456-M460 PolarHBondContact O-N 2.86Å
457	R	96.8	Very high	96.2	Very high	89 Å²	89	47.4 Å²	47.4	34%	0.336	25%	0.245	S	C	.	.	H	α-helix	trans	-68.2	-37	177.7	-174.4	165.8	169.9	165.3	-13.9	113.6	A453 T454 S455 M461 I533	A453-R457 WeakPolarHBondContact O-CB 3.5Å; A453-R457 PolarHBondContact O-N 2.96Å; A453-R457 VanDerWaalsContact O-N 3.08Å; T454-R457 PolarHBondContact O-N 2.81Å; S455-R457 VanDerWaalsContact C-N 3.26Å; S455-R457 PolarHBondContact O-N 3.33Å; R457-M461 VanDerWaalsContact O-CG 3.29Å; R457-M461 WeakPolarHBondContact O-CG 3.45Å; R457-M461 PolarHBondContact O-N 3.33Å; R457-M461 VanDerWaalsContact O-N 3.16Å; R457-I533 HydrophobicContact CG-CD1 3.96Å
458	F	97.6	Very high	96.5	Very high	1 Å²	1	47.2 Å²	47.2	0%	0.004	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-47.2	171.6	-82.4	8.4	0	0	0	111.3	I394 V397 M401 T454 S455 M460 M461 N462 L463 I533 I537	I394-F458 HydrophobicContact CD1-CE2 4.35Å; I394-F458 HydrophobicContact CD1-CZ 4.07Å; I394-F458 HydrophobicContact CG1-CE2 3.86Å; I394-F458 HydrophobicContact CG1-CZ 3.92Å; V397-F458 HydrophobicContact CB-CE2 4.5Å; V397-F458 HydrophobicContact CG1-CD2 3.44Å; V397-F458 VanDerWaalsContact CG1-CD2 3.44Å; V397-F458 HydrophobicContact CG1-CE2 3.59Å; V397-F458 HydrophobicContact CG1-CG 4Å; V397-F458 HydrophobicContact CG1-CZ 4.27Å; M401-F458 HydrophobicContact CG-CB 4.01Å; M401-F458 HydrophobicContact SD-CB 3.59Å; M401-F458 VanDerWaalsContact SD-CB 3.59Å; M401-F458 HydrophobicContact SD-CD2 4.39Å; T454-F458 PolarHBondContact O-N 3.41Å; S455-F458 PolarHBondContact O-N 2.83Å; S455-F458 VanDerWaalsContact O-N 3.14Å; F458-M460 PolarHBondContact O-N 3.37Å; F458-M461 HydrophobicContact CD1-CE 3.96Å; F458-M461 PolarHBondContact O-N 2.83Å; F458-N462 PolarHBondContact O-N 3.02Å; F458-L463 HydrophobicContact CB-CB 4.38Å; F458-L463 HydrophobicContact CB-CD2 4.29Å; F458-L463 HydrophobicContact CD1-CD2 4.07Å; F458-L463 HydrophobicContact CD2-CD2 3.41Å; F458-L463 VanDerWaalsContact CD2-CD2 3.41Å; F458-L463 HydrophobicContact CE1-CD2 4.16Å; F458-L463 HydrophobicContact CE2-CD2 3.56Å; F458-L463 HydrophobicContact CG-CD2 3.69Å; F458-L463 HydrophobicContact CZ-CD2 3.93Å; F458-L463 PolarHBondContact O-N 2.71Å; F458-I533 HydrophobicContact CD1-CD1 4.34Å; F458-I533 HydrophobicContact CD1-CG2 4.39Å; F458-I533 HydrophobicContact CE1-CB 4.37Å; F458-I533 HydrophobicContact CE1-CD1 4.26Å; F458-I533 HydrophobicContact CE1-CG2 3.66Å; F458-I533 HydrophobicContact CZ-CG2 4.46Å; F458-I537 HydrophobicContact CZ-CD1 4.28Å
459	R	96.7	Very high	96.8	Very high	130 Å²	130	46.9 Å²	46.9	49%	0.491	24%	0.243	S	C	.	.	H	α-helix	trans	-57.6	-48.1	174.7	-174	-165	-178.5	123.4	-6	112	M401 E402 S455 S456 M461 N462	M401-R459 HydrophobicContact CB-CB 4.43Å; M401-R459 WeakPolarHBondContact O-CD 3.39Å; M401-R459 PolarHBondContact O-NH1 3.48Å; E402-R459 PolarHBondContact O-NH1 3.1Å; S455-R459 PolarHBondContact O-N 2.97Å; S456-R459 PolarHBondContact O-N 2.87Å; R459-M461 VanDerWaalsContact C-N 3.25Å; R459-M461 PolarHBondContact O-N 2.93Å; R459-N462 PolarHBondContact O-N 2.83Å
460	M	95.9	Very high	97.1	Very high	159 Å²	159	44.3 Å²	44.3	78%	0.783	23%	0.229	S	C	*	.	H	α-helix	trans	-63.2	-26.9	179.5	-75.8	179.7	74.2	0	0	113.9	S456 F458	S456-M460 WeakPolarHBondContact O-CB 3.46Å; S456-M460 VanDerWaalsContact O-CG 3.25Å; S456-M460 WeakPolarHBondContact O-CG 3.45Å; S456-M460 PolarHBondContact O-N 2.86Å; F458-M460 PolarHBondContact O-N 3.37Å
461	M	95	Very high	97.3	Very high	31 Å²	31	42.1 Å²	42.1	15%	0.153	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-7.6	174.4	-68	-175.4	-45.1	0	0	113.3	R457 F458 R459 R526 Q529 L530 I533	R457-M461 VanDerWaalsContact O-CG 3.29Å; R457-M461 WeakPolarHBondContact O-CG 3.45Å; R457-M461 PolarHBondContact O-N 3.33Å; R457-M461 VanDerWaalsContact O-N 3.16Å; F458-M461 HydrophobicContact CD1-CE 3.96Å; F458-M461 PolarHBondContact O-N 2.83Å; R459-M461 VanDerWaalsContact C-N 3.25Å; R459-M461 PolarHBondContact O-N 2.93Å; M461-R526 PolarHBondContact O-NH1 3.48Å; M461-R526 PolarHBondContact O-NH2 3.49Å; M461-Q529 HydrophobicContact SD-CB 4.28Å; M461-L530 HydrophobicContact CE-CD2 3.53Å; M461-L530 HydrophobicContact SD-CD2 4.14Å; M461-I533 HydrophobicContact CE-CD1 3.27Å; M461-I533 HydrophobicContact SD-CD1 3.65Å
462	N	96.2	Very high	97.3	Very high	112 Å²	112	42.2 Å²	42.2	60%	0.599	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.2	62.1	-166.9	-166.2	28.9	0	0	0	111.2	F458 R459 Q464 R526	F458-N462 PolarHBondContact O-N 3.02Å; R459-N462 PolarHBondContact O-N 2.83Å; N462-Q464 VanDerWaalsContact CG-NE2 3.28Å; N462-Q464 PolarHBondContact ND2-NE2 3.12Å; N462-Q464 PolarHBondContact O-N 3.36Å; N462-Q464 PolarHBondContact O-NE2 3.38Å; N462-Q464 PolarHBondContact OD1-NE2 3.29Å; N462-Q464 VanDerWaalsContact OD1-NE2 3.1Å; N462-R526 PolarHBondContact O-NH2 3.27Å
463	L	97.3	Very high	97.4	Very high	4 Å²	4	41.1 Å²	41.1	2%	0.021	21%	0.213	C	C	.	.			trans	-65.3	128.3	176.2	-177.6	68	0	0	0	110.2	W398 M401 F458 E467 F468 L471 L530	W398-L463 HydrophobicContact CE3-CD2 4.01Å; W398-L463 HydrophobicContact CE3-CG 4.48Å; W398-L463 HydrophobicContact CZ3-CB 4.28Å; W398-L463 HydrophobicContact CZ3-CD2 4.01Å; W398-L463 HydrophobicContact CZ3-CG 3.98Å; W398-L463 WeakPolarHBondContact CZ3-O 3.45Å; M401-L463 HydrophobicContact SD-CB 4.45Å; F458-L463 HydrophobicContact CB-CB 4.38Å; F458-L463 HydrophobicContact CB-CD2 4.29Å; F458-L463 HydrophobicContact CD1-CD2 4.07Å; F458-L463 HydrophobicContact CD2-CD2 3.41Å; F458-L463 VanDerWaalsContact CD2-CD2 3.41Å; F458-L463 HydrophobicContact CE1-CD2 4.16Å; F458-L463 HydrophobicContact CE2-CD2 3.56Å; F458-L463 HydrophobicContact CG-CD2 3.69Å; F458-L463 HydrophobicContact CZ-CD2 3.93Å; F458-L463 PolarHBondContact O-N 2.71Å; L463-E467 HydrophobicContact CD1-CB 3.59Å; L463-F468 HydrophobicContact CD2-CB 4.17Å; L463-F468 HydrophobicContact CG-CB 4.49Å; L463-L471 HydrophobicContact CD1-CD1 3.92Å; L463-L471 HydrophobicContact CD2-CD1 4.39Å; L463-L530 HydrophobicContact CD1-CD1 4.3Å; L463-L530 HydrophobicContact CD1-CD2 3.78Å
464	Q	97.6	Very high	97.5	Very high	80 Å²	80	38.4 Å²	38.4	37%	0.374	19%	0.189	S	C	.	.			trans	-91	160	178.3	-54.5	-54	-79.2	0	0	111.8	N462 E466 E467 F468	N462-Q464 VanDerWaalsContact CG-NE2 3.28Å; N462-Q464 PolarHBondContact ND2-NE2 3.12Å; N462-Q464 PolarHBondContact O-N 3.36Å; N462-Q464 PolarHBondContact O-NE2 3.38Å; N462-Q464 PolarHBondContact OD1-NE2 3.29Å; N462-Q464 VanDerWaalsContact OD1-NE2 3.1Å; Q464-E466 VanDerWaalsContact C-N 3.32Å; Q464-E466 WeakPolarHBondContact CB-OE2 3.24Å; Q464-E466 PolarHBondContact O-N 3.24Å; Q464-E467 HydrophobicContact CB-CG 4.37Å; Q464-E467 PolarHBondContact N-OE2 3.08Å; Q464-E467 WeakPolarHBondContact O-CB 3.41Å; Q464-E467 PolarHBondContact O-N 3.06Å; Q464-E467 VanDerWaalsContact O-N 3.14Å; Q464-F468 PolarHBondContact O-N 3.29Å
465	G	97.6	Very high	97.4	Very high	21 Å²	21	38.3 Å²	38.3	22%	0.216	19%	0.189	C	C	.	.	H	α-helix	trans	-63.1	-38	-175.8	0	0	0	0	0	113	E467 F468 V469	G465-E467 VanDerWaalsContact C-N 3.31Å; G465-E467 PolarHBondContact O-N 3.24Å; G465-F468 PolarHBondContact O-N 3.48Å; G465-V469 PolarHBondContact O-N 3.24Å
466	E	98.2	Very high	97.3	Very high	75 Å²	75	38 Å²	38	35%	0.35	19%	0.187	S	C	.	.	H	α-helix	trans	-63.3	-36.5	175.8	-54.6	95.2	135.8	0	0	111.8	V321 L325 Q464 V469 C470 L512	V321-E466 HydrophobicContact CG1-CB 3.73Å; V321-E466 HydrophobicContact CG1-CG 3.59Å; L325-E466 HydrophobicContact CD1-CG 4.37Å; Q464-E466 VanDerWaalsContact C-N 3.32Å; Q464-E466 WeakPolarHBondContact CB-OE2 3.24Å; Q464-E466 PolarHBondContact O-N 3.24Å; E466-V469 WeakPolarHBondContact O-CG2 3.36Å; E466-C470 PolarHBondContact O-N 2.78Å; E466-C470 PolarHBondContact O-SG 3.44Å; E466-L512 HydrophobicContact CB-CD1 3.65Å; E466-L512 HydrophobicContact CB-CD2 3.75Å; E466-L512 HydrophobicContact CB-CG 4.37Å; E466-L512 HydrophobicContact CG-CD2 4.24Å
467	E	98.3	Very high	97.2	Very high	9 Å²	9	35.2 Å²	35.2	4%	0.042	17%	0.167	C	C	.	.	H	α-helix	trans	-74.4	-39.7	175	-61.6	177	119	0	0	111.3	L463 Q464 G465 C470 L471 L509 L512 R526 L530	L463-E467 HydrophobicContact CD1-CB 3.59Å; Q464-E467 HydrophobicContact CB-CG 4.37Å; Q464-E467 PolarHBondContact N-OE2 3.08Å; Q464-E467 WeakPolarHBondContact O-CB 3.41Å; Q464-E467 PolarHBondContact O-N 3.06Å; Q464-E467 VanDerWaalsContact O-N 3.14Å; G465-E467 VanDerWaalsContact C-N 3.31Å; G465-E467 PolarHBondContact O-N 3.24Å; E467-C470 PolarHBondContact O-N 3.11Å; E467-L471 WeakPolarHBondContact O-CG 3.44Å; E467-L471 PolarHBondContact O-N 2.78Å; E467-L509 HydrophobicContact CB-CD2 4.05Å; E467-L509 HydrophobicContact CG-CD2 4.17Å; E467-L512 HydrophobicContact CG-CD1 4.39Å; E467-R526 IonicContact OE1-CZ 2.94Å; E467-R526 IonicContact OE1-NE 2.72Å; E467-R526 PolarHBondContact OE1-NE 3.44Å; E467-R526 IonicContact OE1-NH2 3.23Å; E467-R526 PolarHBondContact OE1-NH2 2.89Å; E467-R526 IonicContact OE2-CZ 2.67Å; E467-R526 IonicContact OE2-NE 2.76Å; E467-R526 IonicContact OE2-NH2 2.93Å; E467-R526 PolarHBondContact OE2-NH2 3.14Å; E467-L530 HydrophobicContact CB-CD1 4.45Å
468	F	98.6	Very high	96.7	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.026	16%	0.164	C	C	.	.	H	α-helix	trans	-59	-50	176.7	161.3	-104.9	0	0	0	112	I394 W398 L463 Q464 G465 C470 L471 K472	I394-F468 HydrophobicContact CD1-CD2 4.39Å; I394-F468 HydrophobicContact CD1-CE2 4.44Å; I394-F468 HydrophobicContact CG1-CD2 4.31Å; I394-F468 HydrophobicContact CG1-CE2 4.05Å; I394-F468 HydrophobicContact CG2-CE2 4.3Å; W398-F468 HydrophobicContact CB-CD2 3.72Å; W398-F468 HydrophobicContact CB-CE1 4.44Å; W398-F468 HydrophobicContact CB-CE2 3.41Å; W398-F468 VanDerWaalsContact CB-CE2 3.41Å; W398-F468 HydrophobicContact CB-CG 4.36Å; W398-F468 HydrophobicContact CB-CZ 3.81Å; W398-F468 AromaticContact CD1-CE1 3.72Å; W398-F468 AromaticContact CD1-CZ 3.84Å; W398-F468 HydrophobicContact CD2-CB 3.98Å; W398-F468 AromaticContact CD2-CD1 3.82Å; W398-F468 HydrophobicContact CD2-CD1 3.82Å; W398-F468 AromaticContact CD2-CD2 3.81Å; W398-F468 HydrophobicContact CD2-CD2 3.81Å; W398-F468 HydrophobicContact CD2-CE1 4.27Å; W398-F468 HydrophobicContact CD2-CE2 4.26Å; W398-F468 AromaticContact CD2-CG 3.57Å; W398-F468 HydrophobicContact CD2-CG 3.57Å; W398-F468 HydrophobicContact CD2-CZ 4.47Å; W398-F468 AromaticContact CE2-CD1 3.89Å; W398-F468 HydrophobicContact CE3-CB 3.61Å; W398-F468 HydrophobicContact CE3-CD1 4.35Å; W398-F468 AromaticContact CE3-CD2 3.89Å; W398-F468 HydrophobicContact CE3-CD2 3.89Å; W398-F468 AromaticContact CE3-CG 3.68Å; W398-F468 HydrophobicContact CE3-CG 3.68Å; W398-F468 AromaticContact CG-CD1 3.94Å; W398-F468 HydrophobicContact CG-CD1 3.94Å; W398-F468 AromaticContact CG-CD2 3.73Å; W398-F468 HydrophobicContact CG-CD2 3.73Å; W398-F468 AromaticContact CG-CE1 3.9Å; W398-F468 HydrophobicContact CG-CE1 3.9Å; W398-F468 AromaticContact CG-CE2 3.68Å; W398-F468 HydrophobicContact CG-CE2 3.68Å; W398-F468 AromaticContact CG-CG 3.86Å; W398-F468 HydrophobicContact CG-CG 3.86Å; W398-F468 AromaticContact CG-CZ 3.76Å; W398-F468 HydrophobicContact CG-CZ 3.76Å; W398-F468 HydrophobicContact CH2-CB 4.2Å; W398-F468 HydrophobicContact CZ3-CB 3.73Å; W398-F468 HydrophobicContact CZ3-CG 4.26Å; W398-F468 AromaticContact NE1-CD1 3.96Å; L463-F468 HydrophobicContact CD2-CB 4.17Å; L463-F468 HydrophobicContact CG-CB 4.49Å; Q464-F468 PolarHBondContact O-N 3.29Å; G465-F468 PolarHBondContact O-N 3.48Å; F468-C470 VanDerWaalsContact C-N 3.28Å; F468-C470 PolarHBondContact O-N 3.18Å; F468-L471 PolarHBondContact O-N 3Å; F468-L471 VanDerWaalsContact O-N 3.15Å; F468-K472 HydrophobicContact CE1-CD 4.3Å; F468-K472 HydrophobicContact CZ-CD 3.97Å; F468-K472 WeakPolarHBondContact O-CB 3.33Å; F468-K472 PolarHBondContact O-N 3.32Å
469	V	98.6	Very high	95.7	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.012	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-31.4	179.7	-61.3	0	0	0	0	112.3	L324 L325 E328 G465 E466 S473	L324-V469 HydrophobicContact CB-CB 4.02Å; L324-V469 HydrophobicContact CB-CG2 3.65Å; L325-V469 HydrophobicContact CD2-CG1 4.08Å; L325-V469 HydrophobicContact CD2-CG2 4.1Å; L325-V469 HydrophobicContact CG-CG2 4.32Å; E328-V469 HydrophobicContact CG-CG1 3.77Å; G465-V469 PolarHBondContact O-N 3.24Å; E466-V469 WeakPolarHBondContact O-CG2 3.36Å; V469-S473 WeakPolarHBondContact O-CB 3.31Å; V469-S473 PolarHBondContact O-N 3.49Å; V469-S473 PolarHBondContact O-OG 2.96Å
470	C	98.5	Very high	94	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65.5	-46.4	170.6	-69.5	0	0	0	0	112	E466 E467 F468 S473 I474 I505 L509	E466-C470 PolarHBondContact O-N 2.78Å; E466-C470 PolarHBondContact O-SG 3.44Å; E467-C470 PolarHBondContact O-N 3.11Å; F468-C470 VanDerWaalsContact C-N 3.28Å; F468-C470 PolarHBondContact O-N 3.18Å; C470-S473 PolarHBondContact O-N 2.96Å; C470-I474 WeakPolarHBondContact O-CG1 3.29Å; C470-I474 PolarHBondContact O-N 3.14Å; C470-I505 HydrophobicContact CB-CG2 3.79Å; C470-L509 HydrophobicContact CB-CD1 4.22Å; C470-L509 HydrophobicContact CB-CD2 3.63Å; C470-L509 HydrophobicContact CB-CG 3.73Å
471	L	98.3	Very high	92.1	Very high	1 Å²	1	22.4 Å²	22.4	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-64.1	-41.3	178.1	-70.2	171.5	0	0	0	112.5	I394 L463 E467 F468 S473 I474 I475 L509 L530 L534	I394-L471 HydrophobicContact CD1-CB 4.03Å; L463-L471 HydrophobicContact CD1-CD1 3.92Å; L463-L471 HydrophobicContact CD2-CD1 4.39Å; E467-L471 WeakPolarHBondContact O-CG 3.44Å; E467-L471 PolarHBondContact O-N 2.78Å; F468-L471 PolarHBondContact O-N 3Å; F468-L471 VanDerWaalsContact O-N 3.15Å; L471-S473 VanDerWaalsContact C-N 3.3Å; L471-S473 PolarHBondContact O-N 3.41Å; L471-I474 PolarHBondContact O-N 2.92Å; L471-I475 WeakPolarHBondContact O-CG1 3.33Å; L471-I475 PolarHBondContact O-N 3.47Å; L471-L509 HydrophobicContact CD2-CD1 4.34Å; L471-L530 HydrophobicContact CD1-CB 4.15Å; L471-L530 HydrophobicContact CD1-CD1 4.27Å; L471-L530 HydrophobicContact CD1-CD2 4.32Å; L471-L530 HydrophobicContact CD1-CG 4.47Å; L471-L530 HydrophobicContact CD2-CB 3.96Å; L471-L534 HydrophobicContact CB-CD2 4.32Å; L471-L534 HydrophobicContact CD2-CD1 4.38Å; L471-L534 HydrophobicContact CD2-CD2 4.12Å; L471-L534 HydrophobicContact CD2-CG 4.48Å
472	K	98.1	Very high	90	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.035	14%	0.143	C	C	.	.	H	α-helix	trans	-59.2	-40.9	173.7	-167.9	-171.5	178.2	-170.9	0	111.3	E328 W365 I391 I394 F468 I475 L476	E328-K472 IonicContact OE1-NZ 3.65Å; E328-K472 PolarHBondContact OE1-NZ 2.9Å; E328-K472 IonicContact OE2-NZ 3.53Å; E328-K472 PolarHBondContact OE2-NZ 3.42Å; W365-K472 HydrophobicContact CH2-CD 4.33Å; W365-K472 HydrophobicContact CH2-CG 3.86Å; W365-K472 HydrophobicContact CZ2-CB 4.24Å; W365-K472 HydrophobicContact CZ2-CD 3.63Å; W365-K472 HydrophobicContact CZ2-CG 3.56Å; I391-K472 HydrophobicContact CD1-CG 4.01Å; I391-K472 WeakPolarHBondContact CD1-O 3.23Å; I391-K472 HydrophobicContact CG2-CG 4.34Å; I394-K472 HydrophobicContact CG2-CB 4.36Å; I394-K472 HydrophobicContact CG2-CG 4.03Å; F468-K472 HydrophobicContact CE1-CD 4.3Å; F468-K472 HydrophobicContact CZ-CD 3.97Å; F468-K472 WeakPolarHBondContact O-CB 3.33Å; F468-K472 PolarHBondContact O-N 3.32Å; K472-I475 PolarHBondContact O-N 2.92Å; K472-L476 PolarHBondContact O-N 3.35Å
473	S	98	Very high	87.7	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-70.5	-35.5	175.6	-56.4	0	0	0	0	113.1	L324 V469 C470 L471 I475 L476 L477	L324-S473 WeakPolarHBondContact CD2-OG 3.35Å; V469-S473 WeakPolarHBondContact O-CB 3.31Å; V469-S473 PolarHBondContact O-N 3.49Å; V469-S473 PolarHBondContact O-OG 2.96Å; C470-S473 PolarHBondContact O-N 2.96Å; L471-S473 VanDerWaalsContact C-N 3.3Å; L471-S473 PolarHBondContact O-N 3.41Å; S473-I475 VanDerWaalsContact C-N 3.35Å; S473-L476 PolarHBondContact O-N 3.05Å; S473-L477 WeakPolarHBondContact O-CG 3.16Å; S473-L477 PolarHBondContact O-N 3.35Å; S473-L477 VanDerWaalsContact O-N 3.12Å
474	I	97.3	Very high	85	Confident	6 Å²	6	34.5 Å²	34.5	3%	0.031	17%	0.169	C	C	.	.	H	α-helix	trans	-63.9	-40	172.6	-70.4	166.1	0	0	0	110.7	C470 L471 L477 N478 L502 I505 L509 L531 L534	C470-I474 WeakPolarHBondContact O-CG1 3.29Å; C470-I474 PolarHBondContact O-N 3.14Å; L471-I474 PolarHBondContact O-N 2.92Å; I474-L477 PolarHBondContact O-N 3.3Å; I474-N478 HydrophobicContact CG2-CB 4.47Å; I474-N478 WeakPolarHBondContact O-CB 3.44Å; I474-N478 PolarHBondContact O-N 2.89Å; I474-L502 HydrophobicContact CB-CD2 4.25Å; I474-L502 HydrophobicContact CG1-CD2 4.13Å; I474-L502 HydrophobicContact CG2-CD2 4.1Å; I474-I505 HydrophobicContact CD1-CG2 3.97Å; I474-I505 HydrophobicContact CG1-CB 4.38Å; I474-I505 HydrophobicContact CG1-CG2 3.79Å; I474-L509 HydrophobicContact CD1-CD1 3.66Å; I474-L531 HydrophobicContact CD1-CD2 4.13Å; I474-L534 HydrophobicContact CB-CD1 4.38Å; I474-L534 HydrophobicContact CG2-CD1 3.6Å
475	I	96.6	Very high	82.3	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.182	C	C	.	.	H	α-helix	trans	-58.2	-50.8	174.7	-71.9	170	0	0	0	110.7	A387 E390 I391 I394 L471 K472 S473 L477 N478 S479 L534 I537	A387-I475 HydrophobicContact CB-CG2 4.39Å; E390-I475 HydrophobicContact CB-CG2 3.44Å; E390-I475 VanDerWaalsContact CB-CG2 3.44Å; E390-I475 HydrophobicContact CG-CG2 4.38Å; I391-I475 HydrophobicContact CD1-CB 3.81Å; I391-I475 HydrophobicContact CD1-CG2 3.51Å; I391-I475 HydrophobicContact CG1-CG2 4.06Å; I394-I475 HydrophobicContact CB-CD1 4.04Å; I394-I475 HydrophobicContact CD1-CD1 3.72Å; I394-I475 HydrophobicContact CG1-CD1 4.4Å; I394-I475 HydrophobicContact CG2-CD1 4.01Å; L471-I475 WeakPolarHBondContact O-CG1 3.33Å; L471-I475 PolarHBondContact O-N 3.47Å; K472-I475 PolarHBondContact O-N 2.92Å; S473-I475 VanDerWaalsContact C-N 3.35Å; I475-L477 PolarHBondContact O-N 2.96Å; I475-N478 PolarHBondContact O-N 3.45Å; I475-S479 WeakPolarHBondContact O-CB 3.41Å; I475-S479 PolarHBondContact O-N 2.94Å; I475-L534 HydrophobicContact CD1-CD2 3.95Å; I475-L534 HydrophobicContact CG1-CD2 3.88Å; I475-I537 HydrophobicContact CD1-CD1 4.21Å; I475-I537 HydrophobicContact CD1-CG2 4.1Å
476	L	95.8	Very high	79.8	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56.7	-46.9	-180	176.2	65.8	0	0	0	112.1	W365 A366 V369 F372 L383 L384 A387 I391 K472 S473 S479	W365-L476 HydrophobicContact CH2-CB 3.88Å; W365-L476 HydrophobicContact CH2-CD2 3.9Å; W365-L476 HydrophobicContact CH2-CG 4.44Å; W365-L476 HydrophobicContact CZ3-CB 4.11Å; W365-L476 HydrophobicContact CZ3-CD1 4.39Å; W365-L476 HydrophobicContact CZ3-CD2 3.73Å; W365-L476 HydrophobicContact CZ3-CG 4.29Å; A366-L476 HydrophobicContact CB-CD1 4.46Å; A366-L476 HydrophobicContact CB-CD2 3.86Å; V369-L476 HydrophobicContact CB-CD2 4.3Å; V369-L476 HydrophobicContact CG1-CD2 4.41Å; V369-L476 HydrophobicContact CG2-CD2 4.06Å; F372-L476 HydrophobicContact CD2-CD1 4.42Å; F372-L476 HydrophobicContact CD2-CD2 3.72Å; F372-L476 HydrophobicContact CD2-CG 4.12Å; F372-L476 HydrophobicContact CE2-CD1 3.98Å; F372-L476 HydrophobicContact CE2-CD2 4.06Å; F372-L476 HydrophobicContact CE2-CG 4.19Å; F372-L476 HydrophobicContact CG-CD2 4.28Å; L383-L476 HydrophobicContact CB-CD1 4.44Å; L384-L476 HydrophobicContact CD2-CD1 4.05Å; L384-L476 HydrophobicContact CG-CD1 4.32Å; A387-L476 HydrophobicContact CB-CD1 4.31Å; I391-L476 HydrophobicContact CD1-CB 4.3Å; K472-L476 PolarHBondContact O-N 3.35Å; S473-L476 PolarHBondContact O-N 3.05Å; L476-S479 PolarHBondContact O-OG 3.41Å
477	L	93.3	Very high	76.9	Confident	1 Å²	1	37.5 Å²	37.5	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-83.9	-21.7	-173.1	-65.4	171.6	0	0	0	113.7	F372 L383 S473 I474 I475 I498 V501 L502 I505	F372-L477 HydrophobicContact CD2-CD2 4.43Å; L383-L477 HydrophobicContact CD1-CD2 4.2Å; S473-L477 WeakPolarHBondContact O-CG 3.16Å; S473-L477 PolarHBondContact O-N 3.35Å; S473-L477 VanDerWaalsContact O-N 3.12Å; I474-L477 PolarHBondContact O-N 3.3Å; I475-L477 PolarHBondContact O-N 2.96Å; L477-I498 HydrophobicContact CB-CG2 4.23Å; L477-I498 WeakPolarHBondContact O-CG2 3.33Å; L477-V501 HydrophobicContact CD1-CB 4.23Å; L477-V501 HydrophobicContact CD1-CG1 3.56Å; L477-L502 HydrophobicContact CB-CD1 4.31Å; L477-L502 HydrophobicContact CB-CD2 3.69Å; L477-L502 HydrophobicContact CB-CG 3.83Å; L477-I505 HydrophobicContact CD1-CD1 3.66Å
478	N	87.3	Confident	74.1	Confident	53 Å²	53	41.9 Å²	41.9	28%	0.283	22%	0.221	S	C	.	.	H	α-helix	trans	-94.2	-4.6	179.3	-168.2	38.1	0	0	0	113.3	I474 I475 G480 V481 L502	I474-N478 HydrophobicContact CG2-CB 4.47Å; I474-N478 WeakPolarHBondContact O-CB 3.44Å; I474-N478 PolarHBondContact O-N 2.89Å; I475-N478 PolarHBondContact O-N 3.45Å; N478-G480 PolarHBondContact O-N 3.01Å; N478-V481 PolarHBondContact O-N 2.86Å; N478-L502 HydrophobicContact CB-CD1 4.32Å; N478-L502 HydrophobicContact CB-CD2 4.38Å
479	S	76.3	Confident	71.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.232	C	C	.	.	G	3₁₀ helix	trans	-60.1	-49.1	-170.7	65.9	0	0	0	0	113.6	L383 I475 L476 V481 R538	L383-S479 WeakPolarHBondContact CA-OG 3.3Å; L383-S479 WeakPolarHBondContact CD2-OG 3.3Å; L383-S479 PolarHBondContact O-OG 3.37Å; I475-S479 WeakPolarHBondContact O-CB 3.41Å; I475-S479 PolarHBondContact O-N 2.94Å; L476-S479 PolarHBondContact O-OG 3.41Å; S479-V481 VanDerWaalsContact C-N 3.35Å; S479-V481 PolarHBondContact O-N 2.93Å; S479-R538 PolarHBondContact O-NH1 3.29Å
480	G	61.6	Low	69.4	Low	6 Å²	6	49.8 Å²	49.8	6%	0.062	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-81.4	5.5	-176.5	0	0	0	0	0	116.5	N478	N478-G480 PolarHBondContact O-N 3.01Å
481	V	55.8	Low	67.7	Low	52 Å²	52	53.6 Å²	53.6	32%	0.315	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-80.2	-27.2	-179.7	-177.7	0	0	0	0	112.3	N478 S479	N478-V481 PolarHBondContact O-N 2.86Å; S479-V481 VanDerWaalsContact C-N 3.35Å; S479-V481 PolarHBondContact O-N 2.93Å
482	Y	50.3	Low	66.5	Low	153 Å²	153	53.7 Å²	53.7	60%	0.6	29%	0.285	S	S	*	.			trans	-122.6	29.7	-169.3	-72.6	-78.8	0	0	0	114.3	F484	Y482-F484 HydrophobicContact CD1-CE2 4.34Å; Y482-F484 PolarHBondContact O-N 3.36Å
483	T	48.1	Very low	65.5	Low	52 Å²	52	58.7 Å²	58.7	32%	0.319	31%	0.308	S	S	.	.			trans	-74.4	64.6	179.1	44.1	0	0	0	0	112.9	L485 S486	T483-L485 PolarHBondContact O-N 2.76Å; T483-S486 PolarHBondContact O-N 3.21Å
484	F	41	Very low	64.8	Low	195 Å²	195	62.2 Å²	62.2	86%	0.855	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58	-8.7	172.1	-87.3	-85.9	0	0	0	114.7	Y482	Y482-F484 HydrophobicContact CD1-CE2 4.34Å; Y482-F484 PolarHBondContact O-N 3.36Å
485	L	41.2	Very low	64.2	Low	123 Å²	123	65.4 Å²	65.4	64%	0.644	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.9	-2.3	174.7	-60.1	176.5	0	0	0	113.5	T483 S487 H573	T483-L485 PolarHBondContact O-N 2.76Å; L485-S487 PolarHBondContact O-N 3.1Å; L485-H573 CarbonylContact O-C 3.57Å
486	S	44.8	Very low	63.8	Low	31 Å²	31	71.2 Å²	71.2	22%	0.217	37%	0.369	C	S	.	.			trans	-94.3	86.5	176.8	-166.2	0	0	0	0	110.8	T483	T483-S486 PolarHBondContact O-N 3.21Å
487	S	37.8	Very low	63.5	Low	86 Å²	86	72 Å²	72	60%	0.601	37%	0.373	S	S	*	.	S	Bend	trans	-84.7	-4.7	-178	65.6	0	0	0	0	114.6	L485 H573	L485-S487 PolarHBondContact O-N 3.1Å; S487-H573 PolarHBondContact OG-O 3.2Å
488	T	38.7	Very low	63.4	Low	100 Å²	100	72.1 Å²	72.1	61%	0.613	37%	0.373	S	S	*	.	S	Bend	trans	-142.4	-13.1	-166.1	5.7	0	0	0	0	116.3	H573	T488-H573 VanDerWaalsContact CB-ND1 3.32Å; T488-H573 WeakPolarHBondContact CB-ND1 3.31Å; T488-H573 PolarHBondContact OG1-ND1 3.39Å
489	L	45.6	Very low	63.6	Low	48 Å²	48	73.2 Å²	73.2	25%	0.251	38%	0.377	S	S	.	.	S	Bend	trans	-80.2	148.1	161.8	-83	162.1	0	0	0	109.8	H573	L489-H573 WeakPolarHBondContact CD1-NE2 3.4Å
490	K	53.8	Low	64.4	Low	127 Å²	127	78.2 Å²	78.2	55%	0.552	40%	0.396	S	S	*	.	P	Polyproline II helix	trans	-59.8	146.5	172.7	-68.2	175.4	173.1	178.7	0	109.4	L492 E493	K490-L492 PolarHBondContact O-N 3.26Å; K490-E493 WeakPolarHBondContact CD-OE1 3.47Å; K490-E493 WeakPolarHBondContact CE-OE1 3.45Å; K490-E493 IonicContact NZ-OE1 2.73Å; K490-E493 PolarHBondContact NZ-OE1 3.02Å
491	S	62.9	Low	66	Low	79 Å²	79	78 Å²	78	55%	0.552	39%	0.393	S	S	*	.	P	Polyproline II helix	trans	-66.4	130.6	168.1	101.6	0	0	0	0	109	E493 K495	S491-E493 PolarHBondContact O-N 2.95Å; S491-K495 PolarHBondContact OG-NZ 3.45Å
492	L	71.8	Confident	67.9	Low	4 Å²	4	76.2 Å²	76.2	2%	0.021	38%	0.382	C	S	.	.			trans	-28.7	124.6	179.9	-70.4	163.3	0	0	0	113	D379 H382 L383 K490 K495 I498	D379-L492 HydrophobicContact CB-CD2 3.82Å; D379-L492 VanDerWaalsContact OD1-CA 3.27Å; D379-L492 WeakPolarHBondContact OD1-CA 3.35Å; D379-L492 WeakPolarHBondContact OD1-CD2 3.29Å; H382-L492 HydrophobicContact CB-CD2 4.46Å; L383-L492 HydrophobicContact CD2-CD1 4.07Å; L383-L492 HydrophobicContact CD2-CD2 4.09Å; L383-L492 HydrophobicContact CG-CD2 4.13Å; K490-L492 PolarHBondContact O-N 3.26Å; L492-K495 HydrophobicContact CB-CD 4.35Å; L492-K495 HydrophobicContact CB-CG 3.73Å; L492-K495 WeakPolarHBondContact O-CD 3.37Å; L492-K495 VanDerWaalsContact O-CE 3.29Å; L492-K495 WeakPolarHBondContact O-CE 3.48Å; L492-K495 WeakPolarHBondContact O-CG 3.35Å; L492-I498 HydrophobicContact CB-CD1 4.31Å; L492-I498 HydrophobicContact CD1-CD1 3.9Å; L492-I498 HydrophobicContact CD2-CD1 4.07Å; L492-I498 HydrophobicContact CG-CD1 4.33Å
493	E	77.5	Confident	70	Confident	112 Å²	112	73.6 Å²	73.6	52%	0.523	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-34.7	-172.3	-63.6	-163.2	169.9	0	0	111.7	D379 K490 S491	D379-E493 PolarHBondContact OD1-N 3.23Å; D379-E493 PolarHBondContact OD2-N 2.91Å; D379-E493 VanDerWaalsContact OD2-N 3.1Å; K490-E493 WeakPolarHBondContact CD-OE1 3.47Å; K490-E493 WeakPolarHBondContact CE-OE1 3.45Å; K490-E493 IonicContact NZ-OE1 2.73Å; K490-E493 PolarHBondContact NZ-OE1 3.02Å; S491-E493 PolarHBondContact O-N 2.95Å
494	E	83.8	Confident	72.3	Confident	74 Å²	74	73.4 Å²	73.4	35%	0.346	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.9	34	-174.3	-66.4	-173.1	100	0	0	114.5	L375 N376 D379 D496 H497 I498	L375-E494 HydrophobicContact CD2-CB 3.84Å; N376-E494 PolarHBondContact N-OE2 3.34Å; N376-E494 PolarHBondContact ND2-OE2 3.12Å; D379-E494 PolarHBondContact OD2-N 3.26Å; E494-D496 VanDerWaalsContact C-N 3.25Å; E494-D496 PolarHBondContact O-N 2.65Å; E494-D496 VanDerWaalsContact O-N 3.1Å; E494-H497 HydrophobicContact CB-CB 4.41Å; E494-H497 WeakPolarHBondContact O-CA 3.32Å; E494-H497 WeakPolarHBondContact O-CB 3.17Å; E494-H497 PolarHBondContact O-N 3.03Å; E494-I498 PolarHBondContact O-N 3.39Å; E494-I498 VanDerWaalsContact O-N 3.13Å
495	K	84.8	Confident	75	Confident	73 Å²	73	64.1 Å²	64.1	32%	0.317	33%	0.332	S	S	.	.	H	α-helix	trans	-44.9	-43.1	177	-75.1	166.1	178.2	-178.1	0	114.8	S491 L492 H497 I498 H499	S491-K495 PolarHBondContact OG-NZ 3.45Å; L492-K495 HydrophobicContact CB-CD 4.35Å; L492-K495 HydrophobicContact CB-CG 3.73Å; L492-K495 WeakPolarHBondContact O-CD 3.37Å; L492-K495 VanDerWaalsContact O-CE 3.29Å; L492-K495 WeakPolarHBondContact O-CE 3.48Å; L492-K495 WeakPolarHBondContact O-CG 3.35Å; K495-H497 PolarHBondContact O-N 3.25Å; K495-I498 PolarHBondContact O-N 2.63Å; K495-H499 VanDerWaalsContact O-CG 3.31Å; K495-H499 PolarHBondContact O-N 2.68Å; K495-H499 PolarHBondContact O-ND1 2.9Å; K495-H499 VanDerWaalsContact O-ND1 3.08Å
496	D	87.8	Confident	77.6	Confident	127 Å²	127	60 Å²	60	68%	0.679	31%	0.311	S	S	*	.	H	α-helix	trans	-66.9	-20.8	179.9	-83.5	6.7	0	0	0	112.9	E494 R500	E494-D496 VanDerWaalsContact C-N 3.25Å; E494-D496 PolarHBondContact O-N 2.65Å; E494-D496 VanDerWaalsContact O-N 3.1Å; D496-R500 VanDerWaalsContact O-CZ 3.29Å; D496-R500 PolarHBondContact O-NE 2.83Å; D496-R500 PolarHBondContact O-NH2 3.35Å
497	H	89	Confident	80.1	Confident	16 Å²	16	63.5 Å²	63.5	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-82	-49.8	169	177.7	50.8	0	0	0	110.7	S310 G371 E494 K495 H499 R500 V501	S310-H497 VanDerWaalsContact CB-CE1 3.43Å; S310-H497 WeakPolarHBondContact CB-CE1 3.43Å; S310-H497 PolarHBondContact OG-CE1 3.05Å; G371-H497 PolarHBondContact O-NE2 3.06Å; E494-H497 HydrophobicContact CB-CB 4.41Å; E494-H497 WeakPolarHBondContact O-CA 3.32Å; E494-H497 WeakPolarHBondContact O-CB 3.17Å; E494-H497 PolarHBondContact O-N 3.03Å; K495-H497 PolarHBondContact O-N 3.25Å; H497-H499 VanDerWaalsContact C-N 3.33Å; H497-H499 PolarHBondContact O-N 3.49Å; H497-R500 VanDerWaalsContact CA-NH2 3.33Å; H497-R500 PolarHBondContact O-N 3.22Å; H497-V501 VanDerWaalsContact CE1-CG2 3.47Å; H497-V501 WeakPolarHBondContact CE1-CG2 3.45Å; H497-V501 PolarHBondContact O-N 3.49Å
498	I	91.1	Very high	83	Confident	3 Å²	3	59.5 Å²	59.5	2%	0.015	30%	0.299	C	S	.	.	H	α-helix	trans	-52.5	-48.8	178.3	-60.6	171.7	0	0	0	111.4	L375 L383 L477 L492 E494 K495 R500 V501 L502	L375-I498 HydrophobicContact CD1-CG1 4.27Å; L375-I498 HydrophobicContact CD2-CD1 4.07Å; L375-I498 HydrophobicContact CD2-CG1 3.67Å; L383-I498 HydrophobicContact CD1-CD1 4.2Å; L477-I498 HydrophobicContact CB-CG2 4.23Å; L477-I498 WeakPolarHBondContact O-CG2 3.33Å; L492-I498 HydrophobicContact CB-CD1 4.31Å; L492-I498 HydrophobicContact CD1-CD1 3.9Å; L492-I498 HydrophobicContact CD2-CD1 4.07Å; L492-I498 HydrophobicContact CG-CD1 4.33Å; E494-I498 PolarHBondContact O-N 3.39Å; E494-I498 VanDerWaalsContact O-N 3.13Å; K495-I498 PolarHBondContact O-N 2.63Å; I498-R500 PolarHBondContact O-N 3.46Å; I498-V501 PolarHBondContact O-N 3.43Å; I498-L502 HydrophobicContact CG2-CD1 4.12Å; I498-L502 PolarHBondContact O-N 3.08Å
499	H	91.6	Very high	85.8	Confident	77 Å²	77	54.7 Å²	54.7	36%	0.356	27%	0.27	S	S	.	.	H	α-helix	trans	-61.2	-40.2	177.2	-65.4	136.8	0	0	0	112.8	K495 H497 V501 L502 D503	K495-H499 VanDerWaalsContact O-CG 3.31Å; K495-H499 PolarHBondContact O-N 2.68Å; K495-H499 PolarHBondContact O-ND1 2.9Å; K495-H499 VanDerWaalsContact O-ND1 3.08Å; H497-H499 VanDerWaalsContact C-N 3.33Å; H497-H499 PolarHBondContact O-N 3.49Å; H499-V501 VanDerWaalsContact C-N 3.33Å; H499-V501 PolarHBondContact O-N 3.04Å; H499-L502 WeakPolarHBondContact O-CB 3.06Å; H499-L502 PolarHBondContact O-N 2.77Å; H499-D503 WeakPolarHBondContact O-CB 3.45Å; H499-D503 VanDerWaalsContact O-CG 3.24Å; H499-D503 PolarHBondContact O-N 3.28Å
500	R	93.9	Very high	88.3	Confident	105 Å²	105	54.6 Å²	54.6	40%	0.396	27%	0.269	S	S	.	.	H	α-helix	trans	-68.1	-30.7	178	-80.4	-179.6	-73	132.1	9.1	112.9	L313 D496 H497 I498 K504	L313-R500 HydrophobicContact CD1-CB 4.35Å; L313-R500 HydrophobicContact CD2-CB 3.96Å; L313-R500 WeakPolarHBondContact CD2-O 3.41Å; D496-R500 VanDerWaalsContact O-CZ 3.29Å; D496-R500 PolarHBondContact O-NE 2.83Å; D496-R500 PolarHBondContact O-NH2 3.35Å; H497-R500 VanDerWaalsContact CA-NH2 3.33Å; H497-R500 PolarHBondContact O-N 3.22Å; I498-R500 PolarHBondContact O-N 3.46Å; R500-K504 WeakPolarHBondContact O-CB 3.49Å; R500-K504 PolarHBondContact O-N 3.05Å
501	V	94.6	Very high	90.4	Very high	1 Å²	1	52.1 Å²	52.1	1%	0.006	26%	0.259	C	S	.	.	H	α-helix	trans	-74.2	-40.5	172.8	-178.5	0	0	0	0	110.4	L313 P370 L477 H497 I498 H499 K504 I505	L313-V501 HydrophobicContact CD2-CG2 4.08Å; P370-V501 WeakPolarHBondContact O-CG1 3.18Å; L477-V501 HydrophobicContact CD1-CB 4.23Å; L477-V501 HydrophobicContact CD1-CG1 3.56Å; H497-V501 VanDerWaalsContact CE1-CG2 3.47Å; H497-V501 WeakPolarHBondContact CE1-CG2 3.45Å; H497-V501 PolarHBondContact O-N 3.49Å; I498-V501 PolarHBondContact O-N 3.43Å; H499-V501 VanDerWaalsContact C-N 3.33Å; H499-V501 PolarHBondContact O-N 3.04Å; V501-K504 WeakPolarHBondContact O-CB 3.31Å; V501-K504 PolarHBondContact O-N 3.37Å; V501-I505 HydrophobicContact CG1-CD1 4.04Å; V501-I505 WeakPolarHBondContact O-CG1 3.28Å; V501-I505 PolarHBondContact O-N 3.46Å
502	L	95.4	Very high	92.1	Very high	15 Å²	15	49.3 Å²	49.3	8%	0.079	24%	0.238	C	C	.	.	H	α-helix	trans	-60	-46.3	172.3	-79.3	169.8	0	0	0	112.4	I474 L477 N478 I498 H499 K504 I505 N506	I474-L502 HydrophobicContact CB-CD2 4.25Å; I474-L502 HydrophobicContact CG1-CD2 4.13Å; I474-L502 HydrophobicContact CG2-CD2 4.1Å; L477-L502 HydrophobicContact CB-CD1 4.31Å; L477-L502 HydrophobicContact CB-CD2 3.69Å; L477-L502 HydrophobicContact CB-CG 3.83Å; N478-L502 HydrophobicContact CB-CD1 4.32Å; N478-L502 HydrophobicContact CB-CD2 4.38Å; I498-L502 HydrophobicContact CG2-CD1 4.12Å; I498-L502 PolarHBondContact O-N 3.08Å; H499-L502 WeakPolarHBondContact O-CB 3.06Å; H499-L502 PolarHBondContact O-N 2.77Å; L502-K504 VanDerWaalsContact C-N 3.3Å; L502-K504 PolarHBondContact O-N 2.8Å; L502-I505 PolarHBondContact O-N 3.49Å; L502-N506 PolarHBondContact O-N 2.72Å; L502-N506 PolarHBondContact O-ND2 2.65Å
503	D	95.4	Very high	93.3	Very high	98 Å²	98	49.2 Å²	49.2	52%	0.524	24%	0.237	S	C	.	.	H	α-helix	trans	-56.3	-46.4	174.4	-71.1	-26.9	0	0	0	110.2	H499 I505 N506 D507	H499-D503 WeakPolarHBondContact O-CB 3.45Å; H499-D503 VanDerWaalsContact O-CG 3.24Å; H499-D503 PolarHBondContact O-N 3.28Å; D503-I505 VanDerWaalsContact C-N 3.33Å; D503-I505 PolarHBondContact O-N 3.39Å; D503-N506 PolarHBondContact O-N 2.76Å; D503-N506 VanDerWaalsContact O-N 3.12Å; D503-D507 PolarHBondContact O-N 2.61Å
504	K	96.6	Very high	94.2	Very high	47 Å²	47	46.1 Å²	46.1	20%	0.204	23%	0.231	C	C	.	.	H	α-helix	trans	-60.4	-37.2	177.9	-171.5	71.8	177.4	-159	0	113.3	L313 L315 M320 R500 V501 L502 T508	L313-K504 PolarHBondContact O-NZ 3.06Å; L315-K504 WeakPolarHBondContact O-CE 3.25Å; L315-K504 PolarHBondContact O-NZ 3.5Å; M320-K504 HydrophobicContact CE-CB 4.49Å; M320-K504 HydrophobicContact CE-CG 3.64Å; R500-K504 WeakPolarHBondContact O-CB 3.49Å; R500-K504 PolarHBondContact O-N 3.05Å; V501-K504 WeakPolarHBondContact O-CB 3.31Å; V501-K504 PolarHBondContact O-N 3.37Å; L502-K504 VanDerWaalsContact C-N 3.3Å; L502-K504 PolarHBondContact O-N 2.8Å; K504-T508 WeakPolarHBondContact O-CB 3.08Å; K504-T508 PolarHBondContact O-N 3.33Å; K504-T508 PolarHBondContact O-OG1 2.73Å
505	I	97.3	Very high	94.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-74.4	-33.9	176.2	-62.1	161	0	0	0	110.8	M320 C470 I474 L477 V501 L502 D503 T508 L509	M320-I505 HydrophobicContact SD-CG1 4.47Å; C470-I505 HydrophobicContact CB-CG2 3.79Å; I474-I505 HydrophobicContact CD1-CG2 3.97Å; I474-I505 HydrophobicContact CG1-CB 4.38Å; I474-I505 HydrophobicContact CG1-CG2 3.79Å; L477-I505 HydrophobicContact CD1-CD1 3.66Å; V501-I505 HydrophobicContact CG1-CD1 4.04Å; V501-I505 WeakPolarHBondContact O-CG1 3.28Å; V501-I505 PolarHBondContact O-N 3.46Å; L502-I505 PolarHBondContact O-N 3.49Å; D503-I505 VanDerWaalsContact C-N 3.33Å; D503-I505 PolarHBondContact O-N 3.39Å; I505-T508 WeakPolarHBondContact O-CB 3.36Å; I505-T508 PolarHBondContact O-N 2.96Å; I505-L509 PolarHBondContact O-N 3.39Å
506	N	96.8	Very high	95.4	Very high	35 Å²	35	49.1 Å²	49.1	19%	0.187	26%	0.256	C	S	.	.	H	α-helix	trans	-67.1	-42.7	172.5	-78.8	-85.2	0	0	0	112	L502 D503 T508 L509 I510	L502-N506 PolarHBondContact O-N 2.72Å; L502-N506 PolarHBondContact O-ND2 2.65Å; D503-N506 PolarHBondContact O-N 2.76Å; D503-N506 VanDerWaalsContact O-N 3.12Å; N506-T508 PolarHBondContact O-N 3.27Å; N506-L509 PolarHBondContact O-N 2.94Å; N506-I510 WeakPolarHBondContact O-CG1 3.21Å; N506-I510 PolarHBondContact O-N 2.95Å
507	D	97.1	Very high	95.8	Very high	105 Å²	105	46 Å²	46	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-58	-38.2	170.6	-78.2	-18.5	0	0	0	111.4	D503 I510 H511	D503-D507 PolarHBondContact O-N 2.61Å; D507-I510 PolarHBondContact O-N 3.13Å; D507-H511 WeakPolarHBondContact O-CB 3.44Å; D507-H511 PolarHBondContact O-N 2.97Å
508	T	98.2	Very high	96.2	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.012	26%	0.263	C	S	.	.	H	α-helix	trans	-67.3	-41.7	177.1	-59.3	0	0	0	0	111.8	A317 M320 V321 K504 I505 N506 H511 L512	A317-T508 HydrophobicContact CB-CG2 4.25Å; M320-T508 HydrophobicContact CB-CG2 4.19Å; M320-T508 HydrophobicContact CG-CG2 4.16Å; V321-T508 HydrophobicContact CG2-CG2 3.49Å; V321-T508 VanDerWaalsContact CG2-CG2 3.49Å; K504-T508 WeakPolarHBondContact O-CB 3.08Å; K504-T508 PolarHBondContact O-N 3.33Å; K504-T508 PolarHBondContact O-OG1 2.73Å; I505-T508 WeakPolarHBondContact O-CB 3.36Å; I505-T508 PolarHBondContact O-N 2.96Å; N506-T508 PolarHBondContact O-N 3.27Å; T508-H511 WeakPolarHBondContact O-CB 3.42Å; T508-H511 PolarHBondContact O-N 3.43Å; T508-L512 WeakPolarHBondContact O-CG 3.25Å; T508-L512 PolarHBondContact O-N 3.42Å
509	L	97.9	Very high	96.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.3	-43.6	171.3	-81.1	173.1	0	0	0	112.2	E467 C470 L471 I474 I505 N506 H511 L512 M513 L527	E467-L509 HydrophobicContact CB-CD2 4.05Å; E467-L509 HydrophobicContact CG-CD2 4.17Å; C470-L509 HydrophobicContact CB-CD1 4.22Å; C470-L509 HydrophobicContact CB-CD2 3.63Å; C470-L509 HydrophobicContact CB-CG 3.73Å; L471-L509 HydrophobicContact CD2-CD1 4.34Å; I474-L509 HydrophobicContact CD1-CD1 3.66Å; I505-L509 PolarHBondContact O-N 3.39Å; N506-L509 PolarHBondContact O-N 2.94Å; L509-H511 VanDerWaalsContact C-N 3.31Å; L509-H511 PolarHBondContact O-N 2.91Å; L509-L512 PolarHBondContact O-N 3.14Å; L509-M513 HydrophobicContact CB-CE 4.37Å; L509-M513 VanDerWaalsContact O-CG 3.31Å; L509-M513 WeakPolarHBondContact O-CG 3.32Å; L509-M513 PolarHBondContact O-N 3.36Å; L509-L527 HydrophobicContact CB-CD1 4.11Å; L509-L527 HydrophobicContact CD1-CD1 4.04Å
510	I	97.6	Very high	96.7	Very high	46 Å²	46	52.8 Å²	52.8	24%	0.236	30%	0.297	C	S	.	.	H	α-helix	trans	-62.8	-41.4	176.4	-66.7	166.3	0	0	0	110.3	N506 D507 M513 A514 L527	N506-I510 WeakPolarHBondContact O-CG1 3.21Å; N506-I510 PolarHBondContact O-N 2.95Å; D507-I510 PolarHBondContact O-N 3.13Å; I510-M513 PolarHBondContact O-N 2.99Å; I510-A514 WeakPolarHBondContact O-CB 3.33Å; I510-A514 PolarHBondContact O-N 2.84Å; I510-L527 HydrophobicContact CD1-CD2 3.98Å; I510-L527 HydrophobicContact CG1-CD2 3.9Å
511	H	97.6	Very high	96.8	Very high	75 Å²	75	55.6 Å²	55.6	35%	0.347	31%	0.314	S	S	.	.	H	α-helix	trans	-61.4	-45	175.3	-178.5	87.2	0	0	0	112.3	A317 D318 D507 T508 L509 M513 A514 K515	A317-H511 HydrophobicContact CB-CB 3.76Å; A317-H511 VanDerWaalsContact CB-CD2 3.46Å; A317-H511 WeakPolarHBondContact CB-CD2 3.4Å; A317-H511 VanDerWaalsContact CB-CG 3.48Å; D318-H511 IonicContact OD2-NE2 2.78Å; D507-H511 WeakPolarHBondContact O-CB 3.44Å; D507-H511 PolarHBondContact O-N 2.97Å; T508-H511 WeakPolarHBondContact O-CB 3.42Å; T508-H511 PolarHBondContact O-N 3.43Å; L509-H511 VanDerWaalsContact C-N 3.31Å; L509-H511 PolarHBondContact O-N 2.91Å; H511-M513 VanDerWaalsContact C-N 3.33Å; H511-M513 PolarHBondContact O-N 2.7Å; H511-A514 PolarHBondContact O-N 3.01Å; H511-K515 VanDerWaalsContact O-CB 3.3Å; H511-K515 WeakPolarHBondContact O-CB 3.31Å; H511-K515 PolarHBondContact O-N 3.16Å
512	L	97.9	Very high	96.8	Very high	20 Å²	20	60.3 Å²	60.3	11%	0.105	34%	0.336	C	S	.	.	H	α-helix	trans	-57.6	-44.2	174.8	-75.7	169.2	0	0	0	111.8	V321 E466 E467 T508 L509 A514 K515 A516	V321-L512 HydrophobicContact CG2-CD1 3.97Å; V321-L512 HydrophobicContact CG2-CD2 4.13Å; V321-L512 HydrophobicContact CG2-CG 4.21Å; E466-L512 HydrophobicContact CB-CD1 3.65Å; E466-L512 HydrophobicContact CB-CD2 3.75Å; E466-L512 HydrophobicContact CB-CG 4.37Å; E466-L512 HydrophobicContact CG-CD2 4.24Å; E467-L512 HydrophobicContact CG-CD1 4.39Å; T508-L512 WeakPolarHBondContact O-CG 3.25Å; T508-L512 PolarHBondContact O-N 3.42Å; L509-L512 PolarHBondContact O-N 3.14Å; L512-A514 PolarHBondContact O-N 3.29Å; L512-K515 PolarHBondContact O-N 3.06Å; L512-A516 WeakPolarHBondContact O-CB 3.21Å; L512-A516 PolarHBondContact O-N 3.42Å
513	M	97.6	Very high	96.9	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-67.2	-35.8	178.2	-63.7	175.1	-162.5	0	0	112.5	L509 I510 H511 A516 G517 L518 Q523 R526 L527 L530	L509-M513 HydrophobicContact CB-CE 4.37Å; L509-M513 VanDerWaalsContact O-CG 3.31Å; L509-M513 WeakPolarHBondContact O-CG 3.32Å; L509-M513 PolarHBondContact O-N 3.36Å; I510-M513 PolarHBondContact O-N 2.99Å; H511-M513 VanDerWaalsContact C-N 3.33Å; H511-M513 PolarHBondContact O-N 2.7Å; M513-A516 PolarHBondContact O-N 3.02Å; M513-G517 PolarHBondContact O-N 2.86Å; M513-L518 HydrophobicContact CB-CD2 4.3Å; M513-L518 WeakPolarHBondContact O-CB 3.4Å; M513-L518 PolarHBondContact O-N 3.42Å; M513-L518 VanDerWaalsContact O-N 3.12Å; M513-Q523 HydrophobicContact CB-CB 4.25Å; M513-Q523 HydrophobicContact CB-CG 3.86Å; M513-R526 HydrophobicContact CE-CB 4.29Å; M513-R526 HydrophobicContact CE-CG 3.89Å; M513-R526 HydrophobicContact SD-CB 3.78Å; M513-R526 HydrophobicContact SD-CG 3.93Å; M513-L527 HydrophobicContact CE-CB 4.29Å; M513-L527 HydrophobicContact CE-CD1 4.5Å; M513-L527 HydrophobicContact SD-CB 4.28Å; M513-L530 HydrophobicContact CE-CD1 3.61Å
514	A	97.3	Very high	96.9	Very high	47 Å²	47	60.8 Å²	60.8	39%	0.388	33%	0.334	S	S	.	.	H	α-helix	trans	-67.9	-41.2	173	0	0	0	0	0	112.1	I510 H511 L512 A516 G517	I510-A514 WeakPolarHBondContact O-CB 3.33Å; I510-A514 PolarHBondContact O-N 2.84Å; H511-A514 PolarHBondContact O-N 3.01Å; L512-A514 PolarHBondContact O-N 3.29Å; A514-A516 VanDerWaalsContact C-N 3.29Å; A514-A516 PolarHBondContact O-N 3.29Å; A514-G517 PolarHBondContact O-N 3.37Å
515	K	96.4	Very high	96.8	Very high	136 Å²	136	66.7 Å²	66.7	59%	0.591	36%	0.356	S	S	*	.	H	α-helix	trans	-63.6	-33.6	175.3	-170.3	177.9	-178.8	-176.9	0	112	D318 H511 L512 G517	D318-K515 IonicContact OD1-NZ 3.04Å; D318-K515 PolarHBondContact OD1-NZ 3.23Å; H511-K515 VanDerWaalsContact O-CB 3.3Å; H511-K515 WeakPolarHBondContact O-CB 3.31Å; H511-K515 PolarHBondContact O-N 3.16Å; L512-K515 PolarHBondContact O-N 3.06Å; K515-G517 PolarHBondContact O-N 3.27Å
516	A	95.7	Very high	96.8	Very high	74 Å²	74	68.9 Å²	68.9	61%	0.612	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	5.9	170.5	0	0	0	0	0	114.4	L512 M513 A514 L518	L512-A516 WeakPolarHBondContact O-CB 3.21Å; L512-A516 PolarHBondContact O-N 3.42Å; M513-A516 PolarHBondContact O-N 3.02Å; A514-A516 VanDerWaalsContact C-N 3.29Å; A514-A516 PolarHBondContact O-N 3.29Å; A516-L518 HydrophobicContact CB-CD1 4.01Å; A516-L518 PolarHBondContact O-N 2.91Å
517	G	96.4	Very high	96.8	Very high	63 Å²	63	68.2 Å²	68.2	65%	0.649	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.4	11.7	172.4	0	0	0	0	0	116.1	M513 A514 K515	M513-G517 PolarHBondContact O-N 2.86Å; A514-G517 PolarHBondContact O-N 3.37Å; K515-G517 PolarHBondContact O-N 3.27Å
518	L	97.1	Very high	96.8	Very high	45 Å²	45	65.5 Å²	65.5	24%	0.236	35%	0.352	C	S	.	.			trans	-70	139.6	177.4	-80.6	64	0	0	0	110.8	M513 A516 Q522 Q523 R526	M513-L518 HydrophobicContact CB-CD2 4.3Å; M513-L518 WeakPolarHBondContact O-CB 3.4Å; M513-L518 PolarHBondContact O-N 3.42Å; M513-L518 VanDerWaalsContact O-N 3.12Å; A516-L518 HydrophobicContact CB-CD1 4.01Å; A516-L518 PolarHBondContact O-N 2.91Å; L518-Q522 HydrophobicContact CB-CB 3.94Å; L518-Q522 HydrophobicContact CD2-CB 4.13Å; L518-Q522 HydrophobicContact CG-CB 4.08Å; L518-Q523 HydrophobicContact CB-CG 3.88Å; L518-Q523 PolarHBondContact O-NE2 3.32Å; L518-R526 HydrophobicContact CD2-CB 4.21Å
519	T	97.4	Very high	96.7	Very high	81 Å²	81	68.9 Å²	68.9	50%	0.497	37%	0.368	S	S	.	.			trans	-65.3	156	169.1	63.4	0	0	0	0	111.1	Q521 Q522 Q523	T519-Q521 PolarHBondContact O-N 2.93Å; T519-Q521 VanDerWaalsContact O-N 3.09Å; T519-Q522 CarbonylContact O-C 3.47Å; T519-Q522 WeakPolarHBondContact O-CA 3.39Å; T519-Q522 WeakPolarHBondContact O-CB 3.38Å; T519-Q522 PolarHBondContact O-N 3.2Å; T519-Q522 VanDerWaalsContact OG1-CD 3.28Å; T519-Q522 WeakPolarHBondContact OG1-CG 3.26Å; T519-Q522 PolarHBondContact OG1-OE1 2.98Å; T519-Q523 WeakPolarHBondContact O-CG 3.48Å; T519-Q523 PolarHBondContact O-N 3.08Å
520	L	95.8	Very high	96.6	Very high	112 Å²	112	68.9 Å²	68.9	59%	0.586	37%	0.368	S	S	*	.	H	α-helix	trans	-51.2	-38.8	-178.5	-172.2	67.2	0	0	0	113.7	Q523 H524	L520-Q523 PolarHBondContact O-N 3.26Å; L520-H524 PolarHBondContact O-CD2 2.87Å; L520-H524 PolarHBondContact O-N 2.86Å; L520-H524 VanDerWaalsContact O-N 3.1Å
521	Q	96.2	Very high	96.5	Very high	163 Å²	163	69.5 Å²	69.5	76%	0.762	37%	0.371	S	S	*	.	H	α-helix	trans	-68.1	-37.6	176.1	-172.9	179.6	0.3	0	0	112.5	T519 R525	T519-Q521 PolarHBondContact O-N 2.93Å; T519-Q521 VanDerWaalsContact O-N 3.09Å; Q521-R525 WeakPolarHBondContact O-CB 3.48Å; Q521-R525 PolarHBondContact O-N 2.83Å; Q521-R525 VanDerWaalsContact O-N 3.09Å
522	Q	96.1	Very high	96.5	Very high	100 Å²	100	70.9 Å²	70.9	47%	0.467	38%	0.381	S	S	.	.	H	α-helix	trans	-70.4	-38.6	174.4	-70.6	163.8	-45.9	0	0	111.7	L518 T519 R525 R526	L518-Q522 HydrophobicContact CB-CB 3.94Å; L518-Q522 HydrophobicContact CD2-CB 4.13Å; L518-Q522 HydrophobicContact CG-CB 4.08Å; T519-Q522 CarbonylContact O-C 3.47Å; T519-Q522 WeakPolarHBondContact O-CA 3.39Å; T519-Q522 WeakPolarHBondContact O-CB 3.38Å; T519-Q522 PolarHBondContact O-N 3.2Å; T519-Q522 VanDerWaalsContact OG1-CD 3.28Å; T519-Q522 WeakPolarHBondContact OG1-CG 3.26Å; T519-Q522 PolarHBondContact OG1-OE1 2.98Å; Q522-R525 PolarHBondContact O-N 3.24Å; Q522-R526 WeakPolarHBondContact O-CB 3.47Å; Q522-R526 PolarHBondContact O-N 3.36Å
523	Q	96.5	Very high	96.3	Very high	22 Å²	22	70 Å²	70	10%	0.103	38%	0.376	C	S	.	.	H	α-helix	trans	-57.6	-55.3	174.6	-64.5	169.3	16.8	0	0	110.6	M513 L518 T519 L520 R525 R526 L527	M513-Q523 HydrophobicContact CB-CB 4.25Å; M513-Q523 HydrophobicContact CB-CG 3.86Å; L518-Q523 HydrophobicContact CB-CG 3.88Å; L518-Q523 PolarHBondContact O-NE2 3.32Å; T519-Q523 WeakPolarHBondContact O-CG 3.48Å; T519-Q523 PolarHBondContact O-N 3.08Å; L520-Q523 PolarHBondContact O-N 3.26Å; Q523-R525 VanDerWaalsContact C-N 3.31Å; Q523-R525 PolarHBondContact O-N 3.11Å; Q523-R526 PolarHBondContact O-N 3.42Å; Q523-L527 WeakPolarHBondContact O-CB 3.47Å; Q523-L527 PolarHBondContact O-N 3.09Å
524	H	94.7	Very high	96.2	Very high	101 Å²	101	70.8 Å²	70.8	47%	0.468	38%	0.38	S	S	.	.	H	α-helix	trans	-61.4	-37	178	-67.8	-50	0	0	0	112.9	L520 A528	L520-H524 PolarHBondContact O-CD2 2.87Å; L520-H524 PolarHBondContact O-N 2.86Å; L520-H524 VanDerWaalsContact O-N 3.1Å; H524-A528 WeakPolarHBondContact O-CB 3.43Å; H524-A528 PolarHBondContact O-N 3.29Å
525	R	96.2	Very high	96	Very high	172 Å²	172	71.8 Å²	71.8	65%	0.649	39%	0.385	S	S	*	.	H	α-helix	trans	-64.9	-46.7	175.3	-176.6	-179.5	174.7	171.7	0.7	111.7	Q521 Q522 Q523 A528 Q529	Q521-R525 WeakPolarHBondContact O-CB 3.48Å; Q521-R525 PolarHBondContact O-N 2.83Å; Q521-R525 VanDerWaalsContact O-N 3.09Å; Q522-R525 PolarHBondContact O-N 3.24Å; Q523-R525 VanDerWaalsContact C-N 3.31Å; Q523-R525 PolarHBondContact O-N 3.11Å; R525-A528 PolarHBondContact O-N 2.95Å; R525-Q529 VanDerWaalsContact O-CG 3.3Å; R525-Q529 WeakPolarHBondContact O-CG 3.36Å; R525-Q529 PolarHBondContact O-N 3.48Å; R525-Q529 PolarHBondContact O-OE1 3.49Å
526	R	96.6	Very high	95.8	Very high	46 Å²	46	69 Å²	69	17%	0.174	37%	0.373	C	S	.	.	H	α-helix	trans	-65.7	-46.6	179.6	-175.4	175	179.9	93.3	-5.2	110.8	M461 N462 E467 M513 L518 Q522 Q523 A528 Q529 L530	M461-R526 PolarHBondContact O-NH1 3.48Å; M461-R526 PolarHBondContact O-NH2 3.49Å; N462-R526 PolarHBondContact O-NH2 3.27Å; E467-R526 IonicContact OE1-CZ 2.94Å; E467-R526 IonicContact OE1-NE 2.72Å; E467-R526 PolarHBondContact OE1-NE 3.44Å; E467-R526 IonicContact OE1-NH2 3.23Å; E467-R526 PolarHBondContact OE1-NH2 2.89Å; E467-R526 IonicContact OE2-CZ 2.67Å; E467-R526 IonicContact OE2-NE 2.76Å; E467-R526 IonicContact OE2-NH2 2.93Å; E467-R526 PolarHBondContact OE2-NH2 3.14Å; M513-R526 HydrophobicContact CE-CB 4.29Å; M513-R526 HydrophobicContact CE-CG 3.89Å; M513-R526 HydrophobicContact SD-CB 3.78Å; M513-R526 HydrophobicContact SD-CG 3.93Å; L518-R526 HydrophobicContact CD2-CB 4.21Å; Q522-R526 WeakPolarHBondContact O-CB 3.47Å; Q522-R526 PolarHBondContact O-N 3.36Å; Q523-R526 PolarHBondContact O-N 3.42Å; R526-A528 VanDerWaalsContact C-N 3.32Å; R526-A528 PolarHBondContact O-N 2.87Å; R526-Q529 WeakPolarHBondContact O-CB 3.33Å; R526-Q529 PolarHBondContact O-N 3.16Å; R526-L530 HydrophobicContact CG-CD1 4.45Å; R526-L530 HydrophobicContact CG-CG 4.35Å; R526-L530 WeakPolarHBondContact O-CG 3.05Å; R526-L530 PolarHBondContact O-N 2.82Å
527	L	97.2	Very high	95.8	Very high	21 Å²	21	65.5 Å²	65.5	11%	0.11	34%	0.344	C	S	.	.	H	α-helix	trans	-53.4	-48.4	174.2	-177.3	66.6	0	0	0	111.6	L509 I510 M513 Q523 Q529 L530 L531	L509-L527 HydrophobicContact CB-CD1 4.11Å; L509-L527 HydrophobicContact CD1-CD1 4.04Å; I510-L527 HydrophobicContact CD1-CD2 3.98Å; I510-L527 HydrophobicContact CG1-CD2 3.9Å; M513-L527 HydrophobicContact CE-CB 4.29Å; M513-L527 HydrophobicContact CE-CD1 4.5Å; M513-L527 HydrophobicContact SD-CB 4.28Å; Q523-L527 WeakPolarHBondContact O-CB 3.47Å; Q523-L527 PolarHBondContact O-N 3.09Å; L527-Q529 PolarHBondContact O-N 2.95Å; L527-L530 PolarHBondContact O-N 3.32Å; L527-L531 HydrophobicContact CD1-CD1 3.98Å; L527-L531 HydrophobicContact CD1-CG 4.19Å; L527-L531 HydrophobicContact CG-CD1 3.92Å; L527-L531 HydrophobicContact CG-CG 4.43Å; L527-L531 WeakPolarHBondContact O-CB 3.38Å; L527-L531 VanDerWaalsContact O-CG 3.32Å; L527-L531 WeakPolarHBondContact O-CG 3.49Å; L527-L531 PolarHBondContact O-N 3.43Å
528	A	96.7	Very high	95.7	Very high	48 Å²	48	65.6 Å²	65.6	40%	0.397	33%	0.325	S	S	.	.	H	α-helix	trans	-62	-41	175.6	0	0	0	0	0	112.6	H524 R525 R526 L532	H524-A528 WeakPolarHBondContact O-CB 3.43Å; H524-A528 PolarHBondContact O-N 3.29Å; R525-A528 PolarHBondContact O-N 2.95Å; R526-A528 VanDerWaalsContact C-N 3.32Å; R526-A528 PolarHBondContact O-N 2.87Å; A528-L532 VanDerWaalsContact O-CB 3.3Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 WeakPolarHBondContact O-CD1 3.39Å; A528-L532 WeakPolarHBondContact O-CG 3.3Å; A528-L532 PolarHBondContact O-N 3.41Å
529	Q	96.3	Very high	95.5	Very high	73 Å²	73	68.3 Å²	68.3	34%	0.341	34%	0.336	S	S	.	.	H	α-helix	trans	-63.8	-38.9	177.2	-73.9	173.7	-71.5	0	0	113	M461 R525 R526 L527 I533	M461-Q529 HydrophobicContact SD-CB 4.28Å; R525-Q529 VanDerWaalsContact O-CG 3.3Å; R525-Q529 WeakPolarHBondContact O-CG 3.36Å; R525-Q529 PolarHBondContact O-N 3.48Å; R525-Q529 PolarHBondContact O-OE1 3.49Å; R526-Q529 WeakPolarHBondContact O-CB 3.33Å; R526-Q529 PolarHBondContact O-N 3.16Å; L527-Q529 PolarHBondContact O-N 2.95Å; Q529-I533 WeakPolarHBondContact O-CD1 3.38Å; Q529-I533 WeakPolarHBondContact O-CG1 3.34Å
530	L	96.4	Very high	95.4	Very high	1 Å²	1	64.5 Å²	64.5	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-69.4	-52.2	176.4	-63.6	-173.1	0	0	0	111.3	M461 L463 E467 L471 M513 R526 L527 L532 I533	M461-L530 HydrophobicContact CE-CD2 3.53Å; M461-L530 HydrophobicContact SD-CD2 4.14Å; L463-L530 HydrophobicContact CD1-CD1 4.3Å; L463-L530 HydrophobicContact CD1-CD2 3.78Å; E467-L530 HydrophobicContact CB-CD1 4.45Å; L471-L530 HydrophobicContact CD1-CB 4.15Å; L471-L530 HydrophobicContact CD1-CD1 4.27Å; L471-L530 HydrophobicContact CD1-CD2 4.32Å; L471-L530 HydrophobicContact CD1-CG 4.47Å; L471-L530 HydrophobicContact CD2-CB 3.96Å; M513-L530 HydrophobicContact CE-CD1 3.61Å; R526-L530 HydrophobicContact CG-CD1 4.45Å; R526-L530 HydrophobicContact CG-CG 4.35Å; R526-L530 WeakPolarHBondContact O-CG 3.05Å; R526-L530 PolarHBondContact O-N 2.82Å; L527-L530 PolarHBondContact O-N 3.32Å; L530-L532 VanDerWaalsContact C-N 3.28Å; L530-L532 PolarHBondContact O-N 3.07Å; L530-I533 PolarHBondContact O-N 3.34Å
531	L	95.6	Very high	95.3	Very high	58 Å²	58	59.4 Å²	59.4	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-61.8	-33.7	-178.9	-67.5	177.5	0	0	0	112.6	I474 L527 I533 L534	I474-L531 HydrophobicContact CD1-CD2 4.13Å; L527-L531 HydrophobicContact CD1-CD1 3.98Å; L527-L531 HydrophobicContact CD1-CG 4.19Å; L527-L531 HydrophobicContact CG-CD1 3.92Å; L527-L531 HydrophobicContact CG-CG 4.43Å; L527-L531 WeakPolarHBondContact O-CB 3.38Å; L527-L531 VanDerWaalsContact O-CG 3.32Å; L527-L531 WeakPolarHBondContact O-CG 3.49Å; L527-L531 PolarHBondContact O-N 3.43Å; L531-I533 VanDerWaalsContact C-N 3.27Å; L531-I533 PolarHBondContact O-N 3.11Å; L531-L534 HydrophobicContact CD2-CD1 3.9Å; L531-L534 WeakPolarHBondContact O-CB 3.45Å; L531-L534 PolarHBondContact O-N 3.35Å
532	L	95.6	Very high	95	Very high	105 Å²	105	56.2 Å²	56.2	55%	0.55	28%	0.275	S	S	.	.	H	α-helix	trans	-63	-30.2	174.8	-79.1	168.7	0	0	0	113.2	A528 L530 L534 S535	A528-L532 VanDerWaalsContact O-CB 3.3Å; A528-L532 WeakPolarHBondContact O-CB 3.46Å; A528-L532 WeakPolarHBondContact O-CD1 3.39Å; A528-L532 WeakPolarHBondContact O-CG 3.3Å; A528-L532 PolarHBondContact O-N 3.41Å; L530-L532 VanDerWaalsContact C-N 3.28Å; L530-L532 PolarHBondContact O-N 3.07Å; L532-L534 VanDerWaalsContact C-N 3.28Å; L532-L534 PolarHBondContact O-N 3.33Å; L532-S535 WeakPolarHBondContact O-CB 3.4Å; L532-S535 PolarHBondContact O-N 3.31Å; L532-S535 PolarHBondContact O-OG 2.82Å
533	I	95.2	Very high	94.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-74.8	-21.9	-179.5	-63.5	157.8	0	0	0	111.5	T454 R457 F458 M461 Q529 L530 L531 S535 H536 I537	T454-I533 HydrophobicContact CG2-CG2 3.7Å; R457-I533 HydrophobicContact CG-CD1 3.96Å; F458-I533 HydrophobicContact CD1-CD1 4.34Å; F458-I533 HydrophobicContact CD1-CG2 4.39Å; F458-I533 HydrophobicContact CE1-CB 4.37Å; F458-I533 HydrophobicContact CE1-CD1 4.26Å; F458-I533 HydrophobicContact CE1-CG2 3.66Å; F458-I533 HydrophobicContact CZ-CG2 4.46Å; M461-I533 HydrophobicContact CE-CD1 3.27Å; M461-I533 HydrophobicContact SD-CD1 3.65Å; Q529-I533 WeakPolarHBondContact O-CD1 3.38Å; Q529-I533 WeakPolarHBondContact O-CG1 3.34Å; L530-I533 PolarHBondContact O-N 3.34Å; L531-I533 VanDerWaalsContact C-N 3.27Å; L531-I533 PolarHBondContact O-N 3.11Å; I533-S535 PolarHBondContact O-N 3.44Å; I533-H536 WeakPolarHBondContact O-CA 3.48Å; I533-H536 WeakPolarHBondContact O-CB 3.39Å; I533-H536 PolarHBondContact O-N 3.38Å; I533-I537 HydrophobicContact CG2-CD1 4.27Å; I533-I537 HydrophobicContact CG2-CG1 4.47Å; I533-I537 PolarHBondContact O-N 3Å
534	L	94.3	Very high	94.5	Very high	19 Å²	19	53.9 Å²	53.9	10%	0.099	27%	0.265	C	S	.	.	H	α-helix	trans	-58.2	-31.5	170.2	-51.6	-175.2	0	0	0	111.5	L471 I474 I475 L531 L532 I537 R538	L471-L534 HydrophobicContact CB-CD2 4.32Å; L471-L534 HydrophobicContact CD2-CD1 4.38Å; L471-L534 HydrophobicContact CD2-CD2 4.12Å; L471-L534 HydrophobicContact CD2-CG 4.48Å; I474-L534 HydrophobicContact CB-CD1 4.38Å; I474-L534 HydrophobicContact CG2-CD1 3.6Å; I475-L534 HydrophobicContact CD1-CD2 3.95Å; I475-L534 HydrophobicContact CG1-CD2 3.88Å; L531-L534 HydrophobicContact CD2-CD1 3.9Å; L531-L534 WeakPolarHBondContact O-CB 3.45Å; L531-L534 PolarHBondContact O-N 3.35Å; L532-L534 VanDerWaalsContact C-N 3.28Å; L532-L534 PolarHBondContact O-N 3.33Å; L534-I537 HydrophobicContact CD2-CD1 4.28Å; L534-I537 PolarHBondContact O-N 3.25Å; L534-R538 PolarHBondContact O-N 3.33Å
535	S	93.3	Very high	94.4	Very high	68 Å²	68	50.1 Å²	50.1	48%	0.476	25%	0.248	S	C	.	.	H	α-helix	trans	-68.5	-31.6	173.4	76.1	0	0	0	0	113.5	L532 I533 H539	L532-S535 WeakPolarHBondContact O-CB 3.4Å; L532-S535 PolarHBondContact O-N 3.31Å; L532-S535 PolarHBondContact O-OG 2.82Å; I533-S535 PolarHBondContact O-N 3.44Å; S535-H539 PolarHBondContact O-N 3.06Å; S535-H539 VanDerWaalsContact O-N 3.09Å
536	H	93.6	Very high	94	Very high	77 Å²	77	47.3 Å²	47.3	36%	0.356	24%	0.242	S	C	.	.	H	α-helix	trans	-70.9	-41.3	173.4	-64	-162.2	0	0	0	110.4	I533 H539 M540	I533-H536 WeakPolarHBondContact O-CA 3.48Å; I533-H536 WeakPolarHBondContact O-CB 3.39Å; I533-H536 PolarHBondContact O-N 3.38Å; H536-H539 WeakPolarHBondContact O-CB 3.35Å; H536-H539 PolarHBondContact O-N 3.23Å; H536-H539 VanDerWaalsContact O-N 3.14Å; H536-M540 WeakPolarHBondContact O-CG 3.29Å; H536-M540 PolarHBondContact O-N 3.15Å
537	I	95.9	Very high	93.6	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-63.3	-42.8	177	-63.5	163.5	0	0	0	110.6	E390 I394 T454 F458 I475 I533 L534 H539 M540 S541	E390-I537 HydrophobicContact CB-CG2 3.84Å; E390-I537 HydrophobicContact CG-CG2 4.19Å; I394-I537 HydrophobicContact CB-CD1 4.1Å; I394-I537 HydrophobicContact CD1-CD1 3.9Å; I394-I537 HydrophobicContact CG1-CD1 3.81Å; T454-I537 HydrophobicContact CG2-CG1 4.49Å; F458-I537 HydrophobicContact CZ-CD1 4.28Å; I475-I537 HydrophobicContact CD1-CD1 4.21Å; I475-I537 HydrophobicContact CD1-CG2 4.1Å; I533-I537 HydrophobicContact CG2-CD1 4.27Å; I533-I537 HydrophobicContact CG2-CG1 4.47Å; I533-I537 PolarHBondContact O-N 3Å; L534-I537 HydrophobicContact CD2-CD1 4.28Å; L534-I537 PolarHBondContact O-N 3.25Å; I537-H539 VanDerWaalsContact C-N 3.33Å; I537-H539 PolarHBondContact O-N 2.8Å; I537-M540 HydrophobicContact CB-CE 4.36Å; I537-M540 HydrophobicContact CG1-CE 3.91Å; I537-M540 PolarHBondContact O-N 3.43Å; I537-S541 VanDerWaalsContact O-CB 3.29Å; I537-S541 WeakPolarHBondContact O-CB 3.46Å; I537-S541 PolarHBondContact O-N 3.23Å
538	R	93.7	Very high	93.2	Very high	65 Å²	65	45.6 Å²	45.6	25%	0.245	24%	0.236	C	C	.	.	H	α-helix	trans	-57	-43	170.3	-178.3	60.6	54.4	115.2	1	112.4	E390 S479 L534 S541 N542	E390-R538 VanDerWaalsContact CD-NH2 3.31Å; E390-R538 IonicContact OE1-CZ 2.68Å; E390-R538 IonicContact OE1-NE 2.63Å; E390-R538 PolarHBondContact OE1-NE 2.71Å; E390-R538 IonicContact OE1-NH2 2.65Å; E390-R538 PolarHBondContact OE1-NH2 3.33Å; E390-R538 WeakPolarHBondContact OE2-CA 3.41Å; E390-R538 IonicContact OE2-CZ 3.16Å; E390-R538 IonicContact OE2-NE 2.72Å; E390-R538 PolarHBondContact OE2-NE 3.41Å; E390-R538 IonicContact OE2-NH2 2.76Å; E390-R538 PolarHBondContact OE2-NH2 2.78Å; E390-R538 VanDerWaalsContact OE2-NH2 3.1Å; S479-R538 PolarHBondContact O-NH1 3.29Å; L534-R538 PolarHBondContact O-N 3.33Å; R538-S541 PolarHBondContact O-N 2.87Å; R538-N542 PolarHBondContact O-N 3.21Å; R538-N542 PolarHBondContact O-OD1 2.75Å
539	H	93.2	Very high	92.7	Very high	102 Å²	102	46.2 Å²	46.2	47%	0.472	23%	0.229	S	C	.	.	H	α-helix	trans	-66.5	-46	178.7	-176.7	68.1	0	0	0	112.3	S535 H536 I537 S541 N542 K543	S535-H539 PolarHBondContact O-N 3.06Å; S535-H539 VanDerWaalsContact O-N 3.09Å; H536-H539 WeakPolarHBondContact O-CB 3.35Å; H536-H539 PolarHBondContact O-N 3.23Å; H536-H539 VanDerWaalsContact O-N 3.14Å; I537-H539 VanDerWaalsContact C-N 3.33Å; I537-H539 PolarHBondContact O-N 2.8Å; H539-S541 VanDerWaalsContact C-N 3.34Å; H539-S541 PolarHBondContact O-N 3.17Å; H539-N542 PolarHBondContact O-N 2.83Å; H539-K543 PolarHBondContact O-N 3.49Å; H539-K543 VanDerWaalsContact O-N 3.11Å
540	M	94	Very high	92.2	Very high	2 Å²	2	45.9 Å²	45.9	1%	0.01	23%	0.229	C	C	.	.	H	α-helix	trans	-60.4	-43.2	174.6	-67.5	-174.2	-64.2	0	0	111.5	M393 M450 L451 T454 H536 I537 K543 G544	M393-M540 HydrophobicContact CE-CB 4.48Å; M393-M540 WeakPolarHBondContact CE-O 3.5Å; M393-M540 VanDerWaalsContact SD-C 3.52Å; M393-M540 HydrophobicContact SD-CB 3.61Å; M450-M540 HydrophobicContact CB-CG 3.68Å; M450-M540 HydrophobicContact CB-SD 3.62Å; M450-M540 HydrophobicContact CE-CG 4.2Å; M450-M540 HydrophobicContact SD-CG 4.12Å; L451-M540 HydrophobicContact CB-SD 4.43Å; L451-M540 HydrophobicContact CD2-CE 4.05Å; L451-M540 HydrophobicContact CD2-SD 3.78Å; L451-M540 HydrophobicContact CG-SD 3.91Å; T454-M540 HydrophobicContact CG2-CE 4.02Å; T454-M540 WeakPolarHBondContact OG1-CE 3.47Å; H536-M540 WeakPolarHBondContact O-CG 3.29Å; H536-M540 PolarHBondContact O-N 3.15Å; I537-M540 HydrophobicContact CB-CE 4.36Å; I537-M540 HydrophobicContact CG1-CE 3.91Å; I537-M540 PolarHBondContact O-N 3.43Å; M540-K543 PolarHBondContact O-N 3.08Å; M540-G544 PolarHBondContact O-N 3.45Å
541	S	93.9	Very high	91.5	Very high	4 Å²	4	45.9 Å²	45.9	3%	0.028	23%	0.229	C	C	.	.	H	α-helix	trans	-60.2	-47.9	177.1	178.8	0	0	0	0	111.6	L389 E390 M393 I537 R538 H539 K543 G544 M545	L389-S541 WeakPolarHBondContact CD2-O 3.39Å; E390-S541 VanDerWaalsContact CG-CB 3.45Å; M393-S541 PolarHBondContact SD-N 3.46Å; M393-S541 VanDerWaalsContact SD-N 3.44Å; I537-S541 VanDerWaalsContact O-CB 3.29Å; I537-S541 WeakPolarHBondContact O-CB 3.46Å; I537-S541 PolarHBondContact O-N 3.23Å; R538-S541 PolarHBondContact O-N 2.87Å; H539-S541 VanDerWaalsContact C-N 3.34Å; H539-S541 PolarHBondContact O-N 3.17Å; S541-K543 VanDerWaalsContact C-N 3.32Å; S541-K543 PolarHBondContact O-N 3.32Å; S541-G544 PolarHBondContact O-N 2.94Å; S541-G544 VanDerWaalsContact O-N 3.16Å; S541-M545 WeakPolarHBondContact O-CB 3.48Å; S541-M545 PolarHBondContact O-N 3.22Å
542	N	91	Very high	91	Very high	97 Å²	97	45.4 Å²	45.4	52%	0.519	23%	0.225	S	C	.	.	H	α-helix	trans	-57.4	-43.6	175.9	-69.2	-9.7	0	0	0	112.3	R538 H539 M545 E546	R538-N542 PolarHBondContact O-N 3.21Å; R538-N542 PolarHBondContact O-OD1 2.75Å; H539-N542 PolarHBondContact O-N 2.83Å; N542-M545 PolarHBondContact O-N 3.45Å; N542-E546 PolarHBondContact O-N 3.43Å
543	K	90.6	Very high	90.5	Very high	64 Å²	64	43.4 Å²	43.4	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-65.1	-40.8	175.6	-90.1	-82.3	-169.5	164.4	0	112.7	E446 I447 M450 H539 M540 S541 H547	E446-K543 IonicContact OE2-NZ 2.73Å; E446-K543 PolarHBondContact OE2-NZ 3.31Å; I447-K543 HydrophobicContact CG1-CB 4.2Å; M450-K543 HydrophobicContact CE-CB 4.18Å; M450-K543 HydrophobicContact CE-CG 4.19Å; H539-K543 PolarHBondContact O-N 3.49Å; H539-K543 VanDerWaalsContact O-N 3.11Å; M540-K543 PolarHBondContact O-N 3.08Å; S541-K543 VanDerWaalsContact C-N 3.32Å; S541-K543 PolarHBondContact O-N 3.32Å; K543-H547 WeakPolarHBondContact O-CB 3.49Å; K543-H547 PolarHBondContact O-N 2.97Å
544	G	91.6	Very high	89.9	Confident	9 Å²	9	48.5 Å²	48.5	9%	0.093	24%	0.241	C	C	.	.	H	α-helix	trans	-66.3	-36.9	175.2	0	0	0	0	0	113	M540 S541 H547 L548	M540-G544 PolarHBondContact O-N 3.45Å; S541-G544 PolarHBondContact O-N 2.94Å; S541-G544 VanDerWaalsContact O-N 3.16Å; G544-H547 PolarHBondContact O-N 3.46Å; G544-L548 WeakPolarHBondContact O-CB 3.33Å; G544-L548 PolarHBondContact O-N 2.9Å
545	M	90.8	Very high	89.2	Confident	21 Å²	21	54.2 Å²	54.2	10%	0.103	27%	0.271	C	S	.	.	H	α-helix	trans	-64.7	-47.1	175.5	-164.2	66.8	60.2	0	0	111.3	W388 L389 S541 N542 L548 Y549 L567 H570	W388-M545 HydrophobicContact CH2-CE 4.46Å; W388-M545 HydrophobicContact CZ2-CE 3.55Å; W388-M545 HydrophobicContact CZ2-SD 3.84Å; L389-M545 HydrophobicContact CB-CE 3.98Å; L389-M545 HydrophobicContact CD2-CB 4.33Å; L389-M545 HydrophobicContact CD2-CE 3.86Å; S541-M545 WeakPolarHBondContact O-CB 3.48Å; S541-M545 PolarHBondContact O-N 3.22Å; N542-M545 PolarHBondContact O-N 3.45Å; M545-L548 PolarHBondContact O-N 2.86Å; M545-Y549 VanDerWaalsContact O-CB 3.3Å; M545-Y549 WeakPolarHBondContact O-CB 3.37Å; M545-Y549 PolarHBondContact O-N 2.97Å; M545-L567 HydrophobicContact CG-CD1 4.39Å; M545-L567 HydrophobicContact SD-CD1 3.53Å; M545-L567 VanDerWaalsContact SD-CD1 3.53Å; M545-H570 WeakPolarHBondContact CE-CD2 3.45Å; M545-H570 WeakPolarHBondContact CE-NE2 3.36Å; M545-H570 HydrophobicContact CG-CB 4.31Å; M545-H570 HydrophobicContact SD-CB 4.32Å; M545-H570 PolarHBondContact SD-CD2 2.92Å
546	E	88.5	Confident	88.4	Confident	113 Å²	113	52.5 Å²	52.5	53%	0.528	26%	0.258	S	S	.	.	H	α-helix	trans	-58.6	-46.9	173.8	178.1	176	-144.6	0	0	111.2	N542 Y549 N550	N542-E546 PolarHBondContact O-N 3.43Å; E546-Y549 PolarHBondContact O-N 3.4Å; E546-N550 WeakPolarHBondContact O-CB 3.48Å; E546-N550 PolarHBondContact O-N 3.44Å; E546-N550 PolarHBondContact O-ND2 3.18Å; E546-N550 VanDerWaalsContact O-ND2 3.16Å
547	H	87.8	Confident	87.5	Confident	14 Å²	14	49.4 Å²	49.4	7%	0.065	25%	0.245	C	C	.	.	H	α-helix	trans	-62.7	-49.3	178	-178.9	82.9	0	0	0	112.6	V441 E442 M444 I447 K543 G544 Y549 N550 M551	V441-H547 WeakPolarHBondContact CG1-NE2 3.32Å; E442-H547 PolarHBondContact O-CE1 3.4Å; E442-H547 PolarHBondContact O-ND1 3Å; M444-H547 WeakPolarHBondContact CG-NE2 3.45Å; I447-H547 HydrophobicContact CD1-CB 3.75Å; K543-H547 WeakPolarHBondContact O-CB 3.49Å; K543-H547 PolarHBondContact O-N 2.97Å; G544-H547 PolarHBondContact O-N 3.46Å; H547-Y549 VanDerWaalsContact C-N 3.32Å; H547-Y549 PolarHBondContact O-N 3.06Å; H547-N550 WeakPolarHBondContact O-CB 3.4Å; H547-N550 PolarHBondContact O-N 3.3Å; H547-N550 VanDerWaalsContact O-N 3.13Å; H547-M551 WeakPolarHBondContact O-CG 3.45Å; H547-M551 PolarHBondContact O-N 3.17Å
548	L	88.7	Confident	86.6	Confident	18 Å²	18	54.8 Å²	54.8	9%	0.094	28%	0.28	C	S	.	.	H	α-helix	trans	-63.1	-38.9	179.6	-176.5	63.8	0	0	0	111.7	T352 W388 G544 M545 M551 K552 L559 L563 L567	T352-L548 HydrophobicContact CG2-CD1 3.85Å; W388-L548 HydrophobicContact CH2-CD2 3.87Å; G544-L548 WeakPolarHBondContact O-CB 3.33Å; G544-L548 PolarHBondContact O-N 2.9Å; M545-L548 PolarHBondContact O-N 2.86Å; L548-M551 PolarHBondContact O-N 3.22Å; L548-K552 PolarHBondContact O-N 3.02Å; L548-L559 HydrophobicContact CD1-CD2 4.1Å; L548-L563 HydrophobicContact CD2-CD1 4.26Å; L548-L567 HydrophobicContact CD2-CD1 4.26Å; L548-L567 HydrophobicContact CD2-CD2 4.23Å; L548-L567 HydrophobicContact CG-CD1 4.39Å; L548-L567 HydrophobicContact CG-CD2 4.03Å
549	Y	87.1	Confident	86	Confident	60 Å²	60	52.9 Å²	52.9	24%	0.235	27%	0.274	C	S	.	.	H	α-helix	trans	-63.5	-40.4	173	177.3	-103.2	0	0	0	112.4	M545 E546 H547 M551 K552 C553 R571	M545-Y549 VanDerWaalsContact O-CB 3.3Å; M545-Y549 WeakPolarHBondContact O-CB 3.37Å; M545-Y549 PolarHBondContact O-N 2.97Å; E546-Y549 PolarHBondContact O-N 3.4Å; H547-Y549 VanDerWaalsContact C-N 3.32Å; H547-Y549 PolarHBondContact O-N 3.06Å; Y549-M551 VanDerWaalsContact C-N 3.33Å; Y549-M551 PolarHBondContact O-N 2.94Å; Y549-K552 WeakPolarHBondContact O-CB 3.44Å; Y549-K552 PolarHBondContact O-N 3.34Å; Y549-C553 WeakPolarHBondContact CE1-SG 3.42Å; Y549-C553 PolarHBondContact O-N 3.44Å; Y549-C553 PolarHBondContact O-SG 3.5Å; Y549-C553 PolarHBondContact OH-SG 2.94Å; Y549-C553 VanDerWaalsContact OH-SG 3.35Å; Y549-R571 VanDerWaalsContact CZ-NE 3.31Å; Y549-R571 PolarHBondContact OH-NH1 3.4Å; Y549-R571 PolarHBondContact OH-NH2 3.49Å
550	N	85.1	Confident	85.6	Confident	67 Å²	67	53 Å²	53	36%	0.358	27%	0.271	S	S	.	.	H	α-helix	trans	-65.5	-35.8	175.2	-72.8	-29.2	0	0	0	111.9	E546 H547 C553 K554	E546-N550 WeakPolarHBondContact O-CB 3.48Å; E546-N550 PolarHBondContact O-N 3.44Å; E546-N550 PolarHBondContact O-ND2 3.18Å; E546-N550 VanDerWaalsContact O-ND2 3.16Å; H547-N550 WeakPolarHBondContact O-CB 3.4Å; H547-N550 PolarHBondContact O-N 3.3Å; H547-N550 VanDerWaalsContact O-N 3.13Å; N550-C553 PolarHBondContact O-N 3.4Å; N550-K554 WeakPolarHBondContact O-CB 3.41Å; N550-K554 WeakPolarHBondContact O-CG 3.38Å; N550-K554 PolarHBondContact O-N 2.97Å
551	M	82.9	Confident	85.2	Confident	1 Å²	1	57.1 Å²	57.1	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-67.3	-39.7	173.3	-69.3	-57.6	117.6	0	0	112.9	M348 V441 H547 L548 Y549 K554 N555 V556	M348-M551 HydrophobicContact CE-CG 4.26Å; V441-M551 HydrophobicContact CG1-CE 3.88Å; V441-M551 HydrophobicContact CG1-CG 4.11Å; V441-M551 HydrophobicContact CG1-SD 3.42Å; V441-M551 WeakPolarHBondContact CG1-SD 3.49Å; H547-M551 WeakPolarHBondContact O-CG 3.45Å; H547-M551 PolarHBondContact O-N 3.17Å; L548-M551 PolarHBondContact O-N 3.22Å; Y549-M551 VanDerWaalsContact C-N 3.33Å; Y549-M551 PolarHBondContact O-N 2.94Å; M551-K554 HydrophobicContact CE-CD 3.86Å; M551-K554 PolarHBondContact O-N 3.37Å; M551-N555 PolarHBondContact O-N 3.48Å; M551-N555 VanDerWaalsContact O-N 3.09Å; M551-V556 PolarHBondContact O-N 3.13Å; M551-V556 HydrophobicContact SD-CB 4.06Å; M551-V556 HydrophobicContact SD-CG1 4.32Å; M551-V556 HydrophobicContact SD-CG2 3.77Å
552	K	84.8	Confident	84.9	Confident	48 Å²	48	57.7 Å²	57.7	21%	0.209	30%	0.296	C	S	.	.	H	α-helix	trans	-58.2	-47.9	169.7	175.3	178.5	174.8	174	0	111.2	L548 Y549 K554 N555 L559 L564 L567 D568	L548-K552 PolarHBondContact O-N 3.02Å; Y549-K552 WeakPolarHBondContact O-CB 3.44Å; Y549-K552 PolarHBondContact O-N 3.34Å; K552-K554 VanDerWaalsContact C-N 3.35Å; K552-K554 PolarHBondContact O-N 3.09Å; K552-N555 PolarHBondContact O-N 2.93Å; K552-L559 HydrophobicContact CB-CD1 4.15Å; K552-L559 HydrophobicContact CD-CD1 4.19Å; K552-L559 HydrophobicContact CG-CD1 4.38Å; K552-L564 HydrophobicContact CD-CD1 3.99Å; K552-L567 HydrophobicContact CB-CD2 4.32Å; K552-L567 HydrophobicContact CD-CD2 3.81Å; K552-D568 IonicContact NZ-OD1 3.43Å; K552-D568 PolarHBondContact NZ-OD1 2.95Å; K552-D568 IonicContact NZ-OD2 3.51Å; K552-D568 PolarHBondContact NZ-OD2 3.07Å
553	C	84.6	Confident	84.8	Confident	62 Å²	62	53.1 Å²	53.1	42%	0.419	27%	0.271	S	S	.	.	H	α-helix	trans	-62	-40.5	178.7	-66	0	0	0	0	113.1	Y549 N550 N555	Y549-C553 WeakPolarHBondContact CE1-SG 3.42Å; Y549-C553 PolarHBondContact O-N 3.44Å; Y549-C553 PolarHBondContact O-SG 3.5Å; Y549-C553 PolarHBondContact OH-SG 2.94Å; Y549-C553 VanDerWaalsContact OH-SG 3.35Å; N550-C553 PolarHBondContact O-N 3.4Å; C553-N555 PolarHBondContact O-N 3.17Å; C553-N555 PolarHBondContact O-ND2 3.16Å
554	K	81.9	Confident	84.7	Confident	108 Å²	108	52.7 Å²	52.7	47%	0.47	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-7	175.1	-71.9	175.8	177.9	-179.2	0	113	E442 N550 M551 K552 V556	E442-K554 IonicContact OE2-NZ 3.72Å; E442-K554 PolarHBondContact OE2-NZ 2.95Å; N550-K554 WeakPolarHBondContact O-CB 3.41Å; N550-K554 WeakPolarHBondContact O-CG 3.38Å; N550-K554 PolarHBondContact O-N 2.97Å; M551-K554 HydrophobicContact CE-CD 3.86Å; M551-K554 PolarHBondContact O-N 3.37Å; K552-K554 VanDerWaalsContact C-N 3.35Å; K552-K554 PolarHBondContact O-N 3.09Å; K554-V556 HydrophobicContact CB-CG2 3.61Å; K554-V556 HydrophobicContact CD-CG2 4.48Å; K554-V556 PolarHBondContact O-N 2.97Å
555	N	81.2	Confident	84.5	Confident	138 Å²	138	53.4 Å²	53.4	74%	0.738	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	34.2	-174.2	-65.6	-90.9	0	0	0	113.7	M551 K552 C553 V557	M551-N555 PolarHBondContact O-N 3.48Å; M551-N555 VanDerWaalsContact O-N 3.09Å; K552-N555 PolarHBondContact O-N 2.93Å; C553-N555 PolarHBondContact O-N 3.17Å; C553-N555 PolarHBondContact O-ND2 3.16Å; N555-V557 VanDerWaalsContact C-N 3.31Å; N555-V557 PolarHBondContact O-N 2.98Å
556	V	75.2	Confident	84.4	Confident	32 Å²	32	52.5 Å²	52.5	19%	0.194	27%	0.269	C	S	.	.			trans	-68.2	-32.9	-176.8	-179.8	0	0	0	0	111.7	E344 A345 M551 K554	E344-V556 HydrophobicContact CG-CG1 4.27Å; A345-V556 HydrophobicContact CB-CG1 4.1Å; A345-V556 WeakPolarHBondContact CB-O 3.35Å; M551-V556 PolarHBondContact O-N 3.13Å; M551-V556 HydrophobicContact SD-CB 4.06Å; M551-V556 HydrophobicContact SD-CG1 4.32Å; M551-V556 HydrophobicContact SD-CG2 3.77Å; K554-V556 HydrophobicContact CB-CG2 3.61Å; K554-V556 HydrophobicContact CD-CG2 4.48Å; K554-V556 PolarHBondContact O-N 2.97Å
557	V	74.9	Confident	84.4	Confident	12 Å²	12	47.2 Å²	47.2	7%	0.073	24%	0.244	C	C	.	.	S	Bend	trans	-142.7	145.4	177.7	-68.1	0	0	0	0	111	A345 M348 T352 N555 L559	A345-V557 VanDerWaalsContact O-CG1 3.29Å; A345-V557 WeakPolarHBondContact O-CG1 3.43Å; M348-V557 HydrophobicContact CB-CG1 3.66Å; M348-V557 HydrophobicContact CB-CG2 4.26Å; T352-V557 HydrophobicContact CG2-CG2 4.24Å; N555-V557 VanDerWaalsContact C-N 3.31Å; N555-V557 PolarHBondContact O-N 2.98Å; V557-L559 HydrophobicContact CG2-CD2 4.21Å
558	P	77.1	Confident	84.1	Confident	113 Å²	113	48.8 Å²	48.8	73%	0.734	25%	0.253	S	S	*	.			trans	-66.2	146.4	163.1	30.8	-33.8	0	0	0	109.8
559	L	82.2	Confident	83.7	Confident	26 Å²	26	48.4 Å²	48.4	14%	0.136	25%	0.252	C	S	.	.			trans	-110.5	141.3	169.8	-57.5	-179.9	0	0	0	108.8	T352 L548 K552 V557 L563 L564 L567	T352-L559 HydrophobicContact CG2-CD2 3.6Å; L548-L559 HydrophobicContact CD1-CD2 4.1Å; K552-L559 HydrophobicContact CB-CD1 4.15Å; K552-L559 HydrophobicContact CD-CD1 4.19Å; K552-L559 HydrophobicContact CG-CD1 4.38Å; V557-L559 HydrophobicContact CG2-CD2 4.21Å; L559-L563 HydrophobicContact CD2-CD2 3.99Å; L559-L564 HydrophobicContact CB-CB 4.28Å; L559-L564 HydrophobicContact CB-CD1 4.2Å; L559-L564 HydrophobicContact CD1-CD1 4.15Å; L559-L567 HydrophobicContact CD1-CD2 3.47Å; L559-L567 VanDerWaalsContact CD1-CD2 3.47Å
560	Y	83.9	Confident	82.8	Confident	103 Å²	103	48.7 Å²	48.7	40%	0.404	26%	0.256	S	S	.	.			trans	-70.3	152	175.4	-61.7	-91.6	0	0	0	110.9	N353 D356 L562 L563 L564	N353-Y560 HydrophobicContact CB-CE2 4.08Å; N353-Y560 PolarHBondContact ND2-OH 3.02Å; N353-Y560 VanDerWaalsContact ND2-OH 3.11Å; D356-Y560 HydrophobicContact CB-CD2 3.9Å; D356-Y560 HydrophobicContact CB-CG 4.14Å; D356-Y560 VanDerWaalsContact CG-CB 3.4Å; D356-Y560 WeakPolarHBondContact OD1-CB 3.48Å; Y560-L562 VanDerWaalsContact C-N 3.27Å; Y560-L562 PolarHBondContact O-N 3.2Å; Y560-L562 VanDerWaalsContact O-N 3.15Å; Y560-L563 PolarHBondContact O-N 2.86Å; Y560-L564 WeakPolarHBondContact O-CB 3.38Å; Y560-L564 PolarHBondContact O-N 2.62Å
561	D	85.1	Confident	81.7	Confident	90 Å²	90	51.3 Å²	51.3	48%	0.481	26%	0.26	S	S	.	.	H	α-helix	trans	-50.8	-41.3	-173.9	-91.3	39	0	0	0	113.6	K8 E565	K8-D561 IonicContact NZ-OD2 2.73Å; K8-D561 PolarHBondContact NZ-OD2 3.2Å; D561-E565 PolarHBondContact O-N 3.29Å
562	L	88.6	Confident	80	Confident	15 Å²	15	56.2 Å²	56.2	8%	0.079	29%	0.286	C	S	.	.	H	α-helix	trans	-70.3	-57.2	179.6	177.5	63	0	0	0	111.2	L14 L359 V360 I363 Y560 L564 E565 M566	L14-L562 HydrophobicContact CB-CD1 4.28Å; L359-L562 HydrophobicContact CB-CD2 3.91Å; L359-L562 HydrophobicContact CB-CG 4.47Å; V360-L562 HydrophobicContact CG2-CD2 3.89Å; I363-L562 HydrophobicContact CD1-CD1 4.23Å; I363-L562 HydrophobicContact CD1-CD2 4Å; Y560-L562 VanDerWaalsContact C-N 3.27Å; Y560-L562 PolarHBondContact O-N 3.2Å; Y560-L562 VanDerWaalsContact O-N 3.15Å; L562-L564 PolarHBondContact O-N 3.19Å; L562-L564 VanDerWaalsContact O-N 3.13Å; L562-E565 PolarHBondContact O-N 3.07Å; L562-E565 VanDerWaalsContact O-N 3.1Å; L562-M566 HydrophobicContact CD1-CG 4.22Å; L562-M566 HydrophobicContact CD1-SD 4.36Å; L562-M566 HydrophobicContact CG-CG 4.46Å; L562-M566 VanDerWaalsContact O-CG 3.29Å; L562-M566 WeakPolarHBondContact O-CG 3.44Å; L562-M566 PolarHBondContact O-N 3.32Å
563	L	88.9	Confident	78.2	Confident	1 Å²	1	55.4 Å²	55.4	1%	0.005	28%	0.283	C	S	.	.	H	α-helix	trans	-54.3	-31.9	175.2	-179.3	61.8	0	0	0	112.9	T352 A355 D356 L359 W388 L548 L559 Y560 L567	T352-L563 HydrophobicContact CG2-CD2 4.05Å; A355-L563 HydrophobicContact CB-CD1 4.5Å; A355-L563 HydrophobicContact CB-CD2 4.48Å; D356-L563 HydrophobicContact CB-CB 4.18Å; D356-L563 WeakPolarHBondContact OD1-CB 3.36Å; D356-L563 PolarHBondContact OD1-N 2.96Å; L359-L563 HydrophobicContact CD1-CB 4.09Å; L359-L563 HydrophobicContact CD1-CD1 3.75Å; W388-L563 HydrophobicContact CH2-CD1 3.58Å; W388-L563 HydrophobicContact CZ2-CD1 4.44Å; W388-L563 HydrophobicContact CZ3-CD1 3.65Å; L548-L563 HydrophobicContact CD2-CD1 4.26Å; L559-L563 HydrophobicContact CD2-CD2 3.99Å; Y560-L563 PolarHBondContact O-N 2.86Å; L563-L567 VanDerWaalsContact O-CB 3.32Å; L563-L567 WeakPolarHBondContact O-CB 3.29Å; L563-L567 PolarHBondContact O-N 3.2Å; L563-L567 VanDerWaalsContact O-N 3.12Å
564	L	87.7	Confident	75.8	Confident	55 Å²	55	54.5 Å²	54.5	29%	0.288	28%	0.28	S	S	.	.	H	α-helix	trans	-69.9	-46.1	176.1	-173.6	68.7	0	0	0	112.3	K552 L559 Y560 L562 L567 D568	K552-L564 HydrophobicContact CD-CD1 3.99Å; L559-L564 HydrophobicContact CB-CB 4.28Å; L559-L564 HydrophobicContact CB-CD1 4.2Å; L559-L564 HydrophobicContact CD1-CD1 4.15Å; Y560-L564 WeakPolarHBondContact O-CB 3.38Å; Y560-L564 PolarHBondContact O-N 2.62Å; L562-L564 PolarHBondContact O-N 3.19Å; L562-L564 VanDerWaalsContact O-N 3.13Å; L564-L567 PolarHBondContact O-N 3.31Å; L564-D568 PolarHBondContact O-N 3.08Å
565	E	87.6	Confident	73.4	Confident	25 Å²	25	54.3 Å²	54.3	12%	0.117	29%	0.29	C	S	.	.	H	α-helix	trans	-60.3	-46.8	172.8	-78.2	-174.1	-175.1	0	0	111.2	G11 M12 A13 L14 D561 L562 L567 D568 A569	G11-E565 WeakPolarHBondContact CA-OE2 3.46Å; M12-E565 PolarHBondContact N-OE1 3.48Å; M12-E565 PolarHBondContact N-OE2 2.76Å; M12-E565 VanDerWaalsContact N-OE2 3.14Å; A13-E565 WeakPolarHBondContact CA-OE2 3.24Å; A13-E565 WeakPolarHBondContact CB-OE1 3.32Å; A13-E565 WeakPolarHBondContact CB-OE2 3.11Å; A13-E565 VanDerWaalsContact N-CD 3.3Å; A13-E565 PolarHBondContact N-OE1 3.47Å; A13-E565 PolarHBondContact N-OE2 2.84Å; L14-E565 PolarHBondContact N-OE2 2.74Å; D561-E565 PolarHBondContact O-N 3.29Å; L562-E565 PolarHBondContact O-N 3.07Å; L562-E565 VanDerWaalsContact O-N 3.1Å; E565-L567 PolarHBondContact O-N 3.26Å; E565-D568 PolarHBondContact O-N 3.44Å; E565-A569 PolarHBondContact O-N 2.67Å
566	M	89.1	Confident	71.2	Confident	2 Å²	2	52.1 Å²	52.1	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-30.6	179	-61.4	-56.3	-69.4	0	0	112.7	L14 L359 L384 W388 L562 H570	L14-M566 HydrophobicContact CB-SD 4.44Å; L14-M566 HydrophobicContact CD1-SD 4Å; L14-M566 HydrophobicContact CD2-CE 4.45Å; L14-M566 HydrophobicContact CD2-SD 3.76Å; L14-M566 HydrophobicContact CG-SD 4.28Å; L359-M566 HydrophobicContact CD1-CB 4.49Å; L359-M566 HydrophobicContact CD1-CG 4.02Å; L359-M566 HydrophobicContact CD2-CE 4.24Å; L359-M566 HydrophobicContact CD2-CG 4.13Å; L384-M566 HydrophobicContact CB-CE 4.45Å; L384-M566 WeakPolarHBondContact O-CE 3.42Å; W388-M566 HydrophobicContact CB-CE 3.67Å; W388-M566 HydrophobicContact CD2-CB 4.21Å; W388-M566 HydrophobicContact CG-CB 4.35Å; W388-M566 HydrophobicContact CG-CE 3.66Å; W388-M566 HydrophobicContact CZ2-CB 4.32Å; W388-M566 PolarHBondContact NE1-O 3.36Å; W388-M566 VanDerWaalsContact NE1-O 3.16Å; L562-M566 HydrophobicContact CD1-CG 4.22Å; L562-M566 HydrophobicContact CD1-SD 4.36Å; L562-M566 HydrophobicContact CG-CG 4.46Å; L562-M566 VanDerWaalsContact O-CG 3.29Å; L562-M566 WeakPolarHBondContact O-CG 3.44Å; L562-M566 PolarHBondContact O-N 3.32Å; M566-H570 PolarHBondContact O-CD2 3.33Å
567	L	87.4	Confident	69.1	Low	1 Å²	1	56 Å²	56	1%	0.005	32%	0.32	C	S	.	.	H	α-helix	trans	-79.9	-41.9	177.2	177.8	60.8	0	0	0	112.7	M545 L548 K552 L559 L563 L564 E565 H570	M545-L567 HydrophobicContact CG-CD1 4.39Å; M545-L567 HydrophobicContact SD-CD1 3.53Å; M545-L567 VanDerWaalsContact SD-CD1 3.53Å; L548-L567 HydrophobicContact CD2-CD1 4.26Å; L548-L567 HydrophobicContact CD2-CD2 4.23Å; L548-L567 HydrophobicContact CG-CD1 4.39Å; L548-L567 HydrophobicContact CG-CD2 4.03Å; K552-L567 HydrophobicContact CB-CD2 4.32Å; K552-L567 HydrophobicContact CD-CD2 3.81Å; L559-L567 HydrophobicContact CD1-CD2 3.47Å; L559-L567 VanDerWaalsContact CD1-CD2 3.47Å; L563-L567 VanDerWaalsContact O-CB 3.32Å; L563-L567 WeakPolarHBondContact O-CB 3.29Å; L563-L567 PolarHBondContact O-N 3.2Å; L563-L567 VanDerWaalsContact O-N 3.12Å; L564-L567 PolarHBondContact O-N 3.31Å; E565-L567 PolarHBondContact O-N 3.26Å; L567-H570 PolarHBondContact O-N 2.81Å
568	D	82.8	Confident	67.2	Low	48 Å²	48	67.1 Å²	67.1	26%	0.257	36%	0.36	S	S	.	.	H	α-helix	trans	-74.7	-26	-178.4	-79.9	-25.2	0	0	0	113.2	K552 L564 E565 H570 R571 L572	K552-D568 IonicContact NZ-OD1 3.43Å; K552-D568 PolarHBondContact NZ-OD1 2.95Å; K552-D568 IonicContact NZ-OD2 3.51Å; K552-D568 PolarHBondContact NZ-OD2 3.07Å; L564-D568 PolarHBondContact O-N 3.08Å; E565-D568 PolarHBondContact O-N 3.44Å; D568-H570 PolarHBondContact O-N 3.2Å; D568-R571 PolarHBondContact O-N 3.45Å; D568-L572 PolarHBondContact O-N 2.93Å
569	A	80.1	Confident	65.2	Low	10 Å²	10	70.5 Å²	70.5	8%	0.083	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-37.4	171.3	0	0	0	0	0	112.7	E385 E565 R571	E385-A569 HydrophobicContact CB-CB 4.22Å; E385-A569 HydrophobicContact CG-CB 3.94Å; E565-A569 PolarHBondContact O-N 2.67Å; A569-R571 VanDerWaalsContact C-N 3.27Å; A569-R571 PolarHBondContact O-N 2.74Å
570	H	69	Low	62.7	Low	66 Å²	66	72.9 Å²	72.9	31%	0.306	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-18.7	176	-74.9	-82.4	0	0	0	114.4	E385 W388 M545 M566 L567 D568	E385-H570 PolarHBondContact O-CE1 2.88Å; E385-H570 PolarHBondContact O-NE2 2.98Å; W388-H570 AromaticContact CD1-NE2 3.88Å; W388-H570 AromaticContact NE1-CD2 3.75Å; W388-H570 AromaticContact NE1-NE2 3.36Å; W388-H570 PolarHBondContact NE1-NE2 3.45Å; M545-H570 WeakPolarHBondContact CE-CD2 3.45Å; M545-H570 WeakPolarHBondContact CE-NE2 3.36Å; M545-H570 HydrophobicContact CG-CB 4.31Å; M545-H570 HydrophobicContact SD-CB 4.32Å; M545-H570 PolarHBondContact SD-CD2 2.92Å; M566-H570 PolarHBondContact O-CD2 3.33Å; L567-H570 PolarHBondContact O-N 2.81Å; D568-H570 PolarHBondContact O-N 3.2Å
571	R	61.2	Low	60.2	Low	121 Å²	121	74.4 Å²	74.4	46%	0.457	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	-22.7	-175.3	-75.6	-165.3	67.4	-107.5	2.9	115.2	Y549 D568 A569 H573 A574	Y549-R571 VanDerWaalsContact CZ-NE 3.31Å; Y549-R571 PolarHBondContact OH-NH1 3.4Å; Y549-R571 PolarHBondContact OH-NH2 3.49Å; D568-R571 PolarHBondContact O-N 3.45Å; A569-R571 VanDerWaalsContact C-N 3.27Å; A569-R571 PolarHBondContact O-N 2.74Å; R571-H573 PolarHBondContact O-N 3.02Å; R571-A574 PolarHBondContact O-N 3.01Å
572	L	46.3	Very low	57.7	Low	104 Å²	104	75.4 Å²	75.4	55%	0.545	43%	0.431	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-11.9	177.9	-74.7	171.2	0	0	0	114.3	S10 D568	S10-L572 WeakPolarHBondContact OG-CD1 3.47Å; D568-L572 PolarHBondContact O-N 2.93Å
573	H	48.1	Very low	55.1	Low	31 Å²	31	80.6 Å²	80.6	14%	0.144	47%	0.465	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	-9.2	-176.1	-55.9	-57	0	0	0	115.4	L485 S487 T488 L489 R571	L485-H573 CarbonylContact O-C 3.57Å; S487-H573 PolarHBondContact OG-O 3.2Å; T488-H573 VanDerWaalsContact CB-ND1 3.32Å; T488-H573 WeakPolarHBondContact CB-ND1 3.31Å; T488-H573 PolarHBondContact OG1-ND1 3.39Å; L489-H573 WeakPolarHBondContact CD1-NE2 3.4Å; R571-H573 PolarHBondContact O-N 3.02Å
574	A	33.8	Very low	52.4	Low	44 Å²	44	89.8 Å²	89.8	36%	0.364	51%	0.508	S	S	.	.	S	Bend	trans	-70.2	124.8	176.1	0	0	0	0	0	109.9	R571 A576	R571-A574 PolarHBondContact O-N 3.01Å; A574-A576 PolarHBondContact O-N 2.73Å; A574-A576 VanDerWaalsContact O-N 3.08Å
575	P	31.9	Very low	49.5	Very low	103 Å²	103	96 Å²	96	67%	0.669	54%	0.536	S	S	*	.			trans	-68.7	111.8	-175.2	26.8	-33.9	0	0	0	110.8	S577	P575-S577 PolarHBondContact O-N 3.03Å
576	A	33.6	Very low	46.8	Very low	93 Å²	93	100.8 Å²	100.8	77%	0.769	57%	0.569	S	S	*	*			trans	-57.8	127.3	178.9	0	0	0	0	0	111.4	A574 R578	A574-A576 PolarHBondContact O-N 2.73Å; A574-A576 VanDerWaalsContact O-N 3.08Å; A576-R578 PolarHBondContact O-N 3.17Å
577	S	31.8	Very low	44	Very low	114 Å²	114	106.2 Å²	106.2	80%	0.797	61%	0.607	S	S	*	*			trans	-61	132	168	41.6	0	0	0	0	109.4	P575 M579	P575-S577 PolarHBondContact O-N 3.03Å; S577-M579 PolarHBondContact O-N 2.96Å
578	R	35.7	Very low	41.3	Very low	244 Å²	244	115.6 Å²	115.6	92%	0.921	65%	0.651	S	S	*	*	S	Bend	trans	-69.3	89.7	-170.1	-72.7	-178.2	172.6	-174.1	-3.8	112.8	A576	A576-R578 PolarHBondContact O-N 3.17Å
579	M	35.3	Very low	38.8	Very low	185 Å²	185	118.8 Å²	118.8	91%	0.911	68%	0.677	S	S	*	*			trans	-131.9	93.2	158.7	-73.6	-88.5	71.5	0	0	108.6	S577	S577-M579 PolarHBondContact O-N 2.96Å
580	G	28.4	Very low	36.4	Very low	75 Å²	75	127.3 Å²	127.3	77%	0.773	72%	0.715	S	S	*	*			trans	178	128.4	-178.9	0	0	0	0	0	111.3
581	V	32.8	Very low	34.5	Very low	136 Å²	136	131.7 Å²	131.7	82%	0.824	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-79.1	140.7	178.5	179.4	0	0	0	0	109
582	P	32.1	Very low	32.9	Very low	111 Å²	111	131.5 Å²	131.5	72%	0.721	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-68.3	140	175.5	28.7	-35.3	0	0	0	111.4
583	P	34.5	Very low	32	Very low	124 Å²	124	132.1 Å²	132.1	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-76.3	153.2	170.1	33.1	-34.5	0	0	0	111.3
584	E	30.6	Very low	31.1	Very low	194 Å²	194	136.4 Å²	136.4	91%	0.907	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-79.8	142.4	171.4	-61.6	-174.7	126.3	0	0	111.2
585	E	27.3	Very low	30.7	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-88.7	133	170.3	-72.9	-164.8	139.5	0	0	111.4	S587	E585-S587 PolarHBondContact O-N 2.96Å
586	P	32	Very low	30.4	Very low	126 Å²	126	139.3 Å²	139.3	82%	0.818	81%	0.809	S	S	*	*			trans	-78.6	105.5	170.3	31.3	-31.9	0	0	0	110.3	Q588	P586-Q588 PolarHBondContact O-N 3Å
587	S	28.7	Very low	30.2	Very low	116 Å²	116	140.9 Å²	140.9	81%	0.811	81%	0.809	S	S	*	*			trans	-71.7	121.1	179.9	44.7	0	0	0	0	112.3	E585	E585-S587 PolarHBondContact O-N 2.96Å
588	Q	31.4	Very low	29.9	Very low	197 Å²	197	140.6 Å²	140.6	92%	0.921	81%	0.807	S	S	*	*			trans	-73.3	138.4	174.8	-68.3	-176.2	-7.6	0	0	111.2	P586	P586-Q588 PolarHBondContact O-N 3Å
589	S	30.1	Very low	29.6	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	80%	0.795	S	S	*	*			trans	-104.7	132.2	179.9	50.7	0	0	0	0	112.2
590	Q	30.2	Very low	29.2	Very low	190 Å²	190	132.5 Å²	132.5	89%	0.888	79%	0.791	S	S	*	*			trans	-136.3	157.1	162.2	-72.1	-162.2	-6.9	0	0	110.5
591	L	29	Very low	29.3	Very low	158 Å²	158	133.4 Å²	133.4	83%	0.827	79%	0.786	S	S	*	*			trans	-74.5	164.1	-170.2	-63.1	67.4	0	0	0	110.3
592	T	27.2	Very low	29	Very low	116 Å²	116	134.9 Å²	134.9	71%	0.712	79%	0.788	S	S	*	*				-167.2	166.6	51.5	48.6	0	0	0	0	115.2
593	T	27.6	Very low	28.8	Very low	117 Å²	117	137.7 Å²	137.7	72%	0.718	79%	0.791	S	S	*	*			trans	79.1	124.1	142.3	39.7	0	0	0	0	124.2
594	T	28.1	Very low	28.4	Very low	121 Å²	121	137.3 Å²	137.3	74%	0.742	79%	0.787	S	S	*	*			trans	76.2	97	137	52.5	0	0	0	0	123.9
595	S	26.1	Very low	28.3	Very low	101 Å²	101	138.1 Å²	138.1	71%	0.706	78%	0.783	S	S	*	*				60.8	119.3	121.8	63.5	0	0	0	0	124.1
596	S	26.7	Very low	28.2	Very low	108 Å²	108	139.7 Å²	139.7	76%	0.755	78%	0.783	S	S	*	*			trans	58.2	134.6	139	65.8	0	0	0	0	119.7
597	T	27.8	Very low	28.1	Very low	126 Å²	126	140.5 Å²	140.5	77%	0.773	78%	0.778	S	S	*	*			cis	-158.2	152.2	44	44	0	0	0	0	115.2
598	S	27.2	Very low	28.5	Very low	108 Å²	108	140.4 Å²	140.4	76%	0.755	78%	0.775	S	S	*	*			trans	19.2	115.3	150.9	61.7	0	0	0	0	124
599	A	28.1	Very low	29	Very low	79 Å²	79	136.7 Å²	136.7	65%	0.653	77%	0.768	S	S	*	*				98	140.7	111.8	0	0	0	0	0	123.3
600	H	28.1	Very low	29	Very low	179 Å²	179	140.7 Å²	140.7	83%	0.829	77%	0.774	S	S	*	*			trans	66.4	142.2	165.8	-54.5	-59.3	0	0	0	119.5
601	S	28.8	Very low	29.2	Very low	95 Å²	95	135.5 Å²	135.5	66%	0.664	76%	0.764	S	S	*	*			cis	-168.7	136.2	-24.3	-94.4	0	0	0	0	108.6
602	L	28.1	Very low	29.3	Very low	166 Å²	166	137.6 Å²	137.6	87%	0.869	77%	0.769	S	S	*	*				168	163.2	116.2	-88.6	175.5	0	0	0	111.1
603	Q	27.4	Very low	29.4	Very low	171 Å²	171	135.9 Å²	135.9	80%	0.799	77%	0.774	S	S	*	*			trans	-101.4	145.6	-158	-69.5	158.4	-82.1	0	0	115.5
604	T	26.5	Very low	30	Very low	115 Å²	115	139.9 Å²	139.9	71%	0.706	78%	0.782	S	S	*	*			trans	-19	143.4	142.1	-35.1	0	0	0	0	116.3
605	Y	27.1	Very low	31	Very low	211 Å²	211	139.7 Å²	139.7	83%	0.827	78%	0.783	S	S	*	*			trans	-145.9	145.8	132.8	-104.1	-73	0	0	0	111.2
606	Y	25.8	Very low	31.6	Very low	219 Å²	219	141.5 Å²	141.5	86%	0.859	79%	0.785	S	S	*	*			trans	-146.5	124.4	-177.1	-147.7	-75.1	0	0	0	106.2
607	I	31.3	Very low	32.1	Very low	142 Å²	142	142.9 Å²	142.9	73%	0.728	79%	0.789	S	S	*	*			trans	-139.5	142	-180	-64.2	-175	0	0	0	109.6
608	P	35.9	Very low	32.7	Very low	115 Å²	115	148.2 Å²	148.2	75%	0.747	81%	0.81	S	S	*	*			trans	-98	178.7	-170.3	3.8	20.1	0	0	0	113.9
609	P	42.4	Very low	33	Very low	119 Å²	119	150.3 Å²	150.3	77%	0.773	81%	0.813	S	S	*	*			trans	-102.9	149.5	-177.7	38.5	-32.5	0	0	0	115
610	E	30.5	Very low	33.2	Very low	198 Å²	198	154 Å²	154	93%	0.925	82%	0.822	S	S	*	*			trans	-179.8	168.1	160.4	-103.2	163.5	-153.1	0	0	106.5
611	A	32.8	Very low	33.5	Very low	81 Å²	81	152.6 Å²	152.6	67%	0.669	82%	0.821	S	S	*	*			cis	-171.5	165.8	-40.7	0	0	0	0	0	108.1
612	E	32.2	Very low	33.8	Very low	203 Å²	203	156 Å²	156	95%	0.949	83%	0.83	S	S	*	*			trans	66.3	161.8	169.1	-50.2	-157.6	142.2	0	0	120.4
613	G	30	Very low	34.1	Very low	79 Å²	79	155.4 Å²	155.4	81%	0.814	83%	0.828	S	S	*	*			trans	112.9	77	155.6	0	0	0	0	0	120
614	F	38.9	Very low	34.6	Very low	201 Å²	201	154.3 Å²	154.3	88%	0.882	83%	0.83	S	S	*	*			trans	-86.4	147.8	157.4	-97.6	-78	0	0	0	110
615	P	48.6	Very low	35.2	Very low	118 Å²	118	157.1 Å²	157.1	77%	0.766	84%	0.839	S	S	*	*				-153.2	156.2	86.1	39.3	-20.2	0	0	0	119.1
616	N	40	Very low	35.8	Very low	139 Å²	139	153 Å²	153	74%	0.743	84%	0.84	S	S	*	*			trans	13.5	153.5	151.1	-65.1	-3.9	0	0	0	125.2
617	T	37.8	Very low	36.6	Very low	137 Å²	137	147.5 Å²	147.5	84%	0.84	84%	0.838	S	S	*	*			trans	68.5	144.9	162.9	42.4	0	0	0	0	116.8
618	I	39	Very low	37.1	Very low	238 Å²	238	148 Å²	148	100%	1.221	85%	0.848	S	S	*	*			cis	-100.6	0	11.6	-63.9	169.2	0	0	0	112

Retrieved 618 of 618 residues in 688.3 ms (Link to these results)

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