A0A2K6B494_MACNE Loading...

Centromere/kinetochore protein zw10 homolog

AlphaFold DB , UniProt , Accession A0A2K6B494, Species MACNE (Macaca nemestrina, Pig-tailed macaque), Gene ZW10, Length 778 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.3	Very low	39.4	Very low	245 Å²	245	141.5 Å²	141.5	100%	1.207	79%	0.793	S	S	*	*				0	134	0	-84.8	-165.9	-94.4	0	0	107.9
2	A	36.7	Very low	38.4	Very low	101 Å²	101	139.3 Å²	139.3	84%	0.835	79%	0.794	S	S	*	*			trans	68.4	87.2	-169.2	0	0	0	0	0	115.4
3	S	39.6	Very low	37.7	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	78%	0.781	S	S	*	*				83.4	94.7	84	-162.3	0	0	0	0	111.3
4	F	49.8	Very low	37.6	Very low	198 Å²	198	140.6 Å²	140.6	87%	0.868	79%	0.789	S	S	*	*	S	Bend		18.2	126.1	81.7	-147.2	-106.2	0	0	0	113.4
5	V	43.2	Very low	37.4	Very low	106 Å²	106	141.4 Å²	141.4	64%	0.642	79%	0.79	S	S	*	*	S	Bend	trans	114.7	-31.3	164.4	-173.6	0	0	0	0	118.3
6	T	42.3	Very low	37.5	Very low	116 Å²	116	143.4 Å²	143.4	71%	0.712	79%	0.791	S	S	*	*	S	Bend	trans	-108.8	-5.1	-165.8	32.8	0	0	0	0	120.6
7	E	36.8	Very low	38.5	Very low	183 Å²	183	147.1 Å²	147.1	86%	0.855	80%	0.797	S	S	*	*	S	Bend	trans	-117.1	24.1	169.1	-112.7	176.8	-170.2	0	0	114.8	L9	E7-L9 PolarHBondContact O-N 2.81Å
8	V	44.1	Very low	38.7	Very low	124 Å²	124	145.9 Å²	145.9	75%	0.752	79%	0.786	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.4	0.6	154	165.9	0	0	0	0	112.7
9	L	36.2	Very low	39.3	Very low	134 Å²	134	145.1 Å²	145.1	70%	0.702	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.3	40.2	-167.4	-73	172.8	0	0	0	116	E7	E7-L9 PolarHBondContact O-N 2.81Å
10	A	33.8	Very low	40.1	Very low	81 Å²	81	144 Å²	144	67%	0.669	77%	0.774	S	S	*	*	S	Bend	trans	-132.3	69.5	154.9	0	0	0	0	0	109.4
11	H	31.6	Very low	40.8	Very low	169 Å²	169	139 Å²	139	78%	0.782	76%	0.757	S	S	*	*				26.1	119.9	129.7	-73.7	-62.8	0	0	0	115.2
12	S	27.1	Very low	41.7	Very low	115 Å²	115	130.1 Å²	130.1	80%	0.804	72%	0.716	S	S	*	*			cis	177.1	124.1	36.6	177.5	0	0	0	0	103.5
13	G	30.2	Very low	42.7	Very low	61 Å²	61	132.8 Å²	132.8	63%	0.629	71%	0.705	S	S	*	*				119.7	115.2	78	0	0	0	0	0	109.3
14	R	36.3	Very low	43.5	Very low	236 Å²	236	133.1 Å²	133.1	89%	0.891	70%	0.698	S	S	*	*			trans	69	116.3	151.2	-58.4	-178.7	179.9	-172	-1.1	117
15	L	33.9	Very low	43.9	Very low	152 Å²	152	127.5 Å²	127.5	80%	0.796	68%	0.683	S	S	*	*				49.5	116.9	78.2	-73.7	156.3	0	0	0	109.6
16	E	39.7	Very low	44.9	Very low	174 Å²	174	127.7 Å²	127.7	81%	0.813	67%	0.672	S	S	*	*				-171.8	168.3	53.6	-117.4	158.7	-154.2	0	0	111.5
17	K	53.8	Low	45.7	Very low	206 Å²	206	127.5 Å²	127.5	90%	0.896	67%	0.666	S	S	*	*			trans	-53.8	134	177.1	-70.1	168.8	171.1	175.3	0	113.1
18	E	42.7	Very low	47.1	Very low	126 Å²	126	122.1 Å²	122.1	59%	0.589	65%	0.646	S	S	*	*			trans	-134.2	131.5	163	-83.6	-172.8	148.5	0	0	111.9	R26	E18-R26 IonicContact OE2-CZ 3.06Å; E18-R26 IonicContact OE2-NH1 2.72Å; E18-R26 PolarHBondContact OE2-NH1 3.38Å; E18-R26 IonicContact OE2-NH2 2.67Å; E18-R26 PolarHBondContact OE2-NH2 3.38Å
19	D	49.4	Very low	48	Very low	130 Å²	130	123.7 Å²	123.7	70%	0.695	64%	0.638	S	S	*	*			trans	-72.7	143.9	-174.9	-168.2	10.2	0	0	0	112.5	G21 T22	D19-G21 PolarHBondContact O-N 3.16Å; D19-T22 WeakPolarHBondContact O-CB 3.26Å; D19-T22 PolarHBondContact O-N 3.45Å; D19-T22 PolarHBondContact O-OG1 3.24Å
20	L	55.6	Low	49.3	Very low	123 Å²	123	125.2 Å²	125.2	64%	0.644	64%	0.635	S	S	*	*	H	α-helix	trans	-57.9	-25.3	-172.3	-113.5	110.9	0	0	0	113.5	R23 I24	L20-R23 WeakPolarHBondContact O-CB 2.84Å; L20-R23 PolarHBondContact O-N 3.42Å; L20-R23 VanDerWaalsContact O-N 3.09Å; L20-I24 PolarHBondContact O-N 3.14Å; L20-I24 VanDerWaalsContact O-N 3.07Å
21	G	55	Low	50.6	Low	40 Å²	40	125.9 Å²	125.9	41%	0.412	63%	0.63	S	S	.	*	H	α-helix	trans	-62.7	-38.8	171.5	0	0	0	0	0	112.9	D19 R23 I24 S25	D19-G21 PolarHBondContact O-N 3.16Å; G21-R23 VanDerWaalsContact C-N 3.26Å; G21-R23 PolarHBondContact O-N 3.24Å; G21-I24 PolarHBondContact O-N 3.23Å; G21-S25 PolarHBondContact O-N 3.39Å; G21-S25 PolarHBondContact O-OG 3.49Å
22	T	57.7	Low	52.1	Low	58 Å²	58	123.7 Å²	123.7	36%	0.356	62%	0.62	S	S	.	*	H	α-helix	trans	-71.2	-19.2	172.2	67.9	0	0	0	0	112.7	D19 R26	D19-T22 WeakPolarHBondContact O-CB 3.26Å; D19-T22 PolarHBondContact O-N 3.45Å; D19-T22 PolarHBondContact O-OG1 3.24Å; T22-R26 WeakPolarHBondContact O-CB 2.96Å; T22-R26 PolarHBondContact O-N 3.28Å; T22-R26 PolarHBondContact O-NE 3.41Å; T22-R26 VanDerWaalsContact O-NE 3.17Å; T22-R26 PolarHBondContact OG1-NH2 3.47Å; T22-R26 VanDerWaalsContact OG1-NH2 3.15Å
23	R	57.8	Low	53.7	Low	157 Å²	157	122.3 Å²	122.3	59%	0.592	60%	0.601	S	S	*	*	H	α-helix	trans	-75.2	-40.7	170.1	-79.9	-177.3	171.5	-175.4	-2.3	111.2	L20 G21 R26 L27	L20-R23 WeakPolarHBondContact O-CB 2.84Å; L20-R23 PolarHBondContact O-N 3.42Å; L20-R23 VanDerWaalsContact O-N 3.09Å; G21-R23 VanDerWaalsContact C-N 3.26Å; G21-R23 PolarHBondContact O-N 3.24Å; R23-R26 PolarHBondContact O-N 3.47Å; R23-L27 WeakPolarHBondContact O-CB 3.46Å; R23-L27 WeakPolarHBondContact O-CD1 3.31Å; R23-L27 PolarHBondContact O-N 3.48Å
24	I	57.3	Low	55.3	Low	107 Å²	107	123.8 Å²	123.8	55%	0.549	59%	0.594	S	S	.	*	H	α-helix	trans	-68.6	-46.4	177.5	-65.6	170.9	0	0	0	110.4	L20 G21 R26 L27 T28	L20-I24 PolarHBondContact O-N 3.14Å; L20-I24 VanDerWaalsContact O-N 3.07Å; G21-I24 PolarHBondContact O-N 3.23Å; I24-R26 VanDerWaalsContact C-N 3.28Å; I24-R26 PolarHBondContact O-N 3.49Å; I24-L27 WeakPolarHBondContact O-CB 3Å; I24-L27 PolarHBondContact O-N 3.14Å; I24-L27 VanDerWaalsContact O-N 3.11Å; I24-T28 PolarHBondContact O-N 3.34Å; I24-T28 PolarHBondContact O-OG1 3.45Å
25	S	58.2	Low	56.5	Low	80 Å²	80	119.6 Å²	119.6	56%	0.559	58%	0.582	S	S	*	*	H	α-helix	trans	-64.4	-30.7	175.9	-48.2	0	0	0	0	113.2	G21 R29	G21-S25 PolarHBondContact O-N 3.39Å; G21-S25 PolarHBondContact O-OG 3.49Å; S25-R29 VanDerWaalsContact O-CB 3.31Å; S25-R29 WeakPolarHBondContact O-CB 3.16Å; S25-R29 PolarHBondContact O-N 2.55Å
26	R	62.8	Low	57.9	Low	109 Å²	109	114.1 Å²	114.1	41%	0.411	56%	0.562	S	S	.	*	H	α-helix	trans	-78.2	-27.6	175	-164.6	-173.9	-16.9	-170.9	2.7	112.4	E18 T22 R23 I24 R30	E18-R26 IonicContact OE2-CZ 3.06Å; E18-R26 IonicContact OE2-NH1 2.72Å; E18-R26 PolarHBondContact OE2-NH1 3.38Å; E18-R26 IonicContact OE2-NH2 2.67Å; E18-R26 PolarHBondContact OE2-NH2 3.38Å; T22-R26 WeakPolarHBondContact O-CB 2.96Å; T22-R26 PolarHBondContact O-N 3.28Å; T22-R26 PolarHBondContact O-NE 3.41Å; T22-R26 VanDerWaalsContact O-NE 3.17Å; T22-R26 PolarHBondContact OG1-NH2 3.47Å; T22-R26 VanDerWaalsContact OG1-NH2 3.15Å; R23-R26 PolarHBondContact O-N 3.47Å; I24-R26 VanDerWaalsContact C-N 3.28Å; I24-R26 PolarHBondContact O-N 3.49Å; R26-R30 VanDerWaalsContact O-CB 3.3Å; R26-R30 WeakPolarHBondContact O-CB 3.31Å; R26-R30 PolarHBondContact O-N 2.98Å
27	L	60.8	Low	58.6	Low	113 Å²	113	112.3 Å²	112.3	59%	0.592	55%	0.553	S	S	*	*	H	α-helix	trans	-72.7	-41.7	169	-103.9	124.3	0	0	0	111.3	R23 I24 R30 V31	R23-L27 WeakPolarHBondContact O-CB 3.46Å; R23-L27 WeakPolarHBondContact O-CD1 3.31Å; R23-L27 PolarHBondContact O-N 3.48Å; I24-L27 WeakPolarHBondContact O-CB 3Å; I24-L27 PolarHBondContact O-N 3.14Å; I24-L27 VanDerWaalsContact O-N 3.11Å; L27-R30 WeakPolarHBondContact O-CB 3.44Å; L27-R30 PolarHBondContact O-N 3.36Å; L27-V31 VanDerWaalsContact O-CG2 3.32Å; L27-V31 WeakPolarHBondContact O-CG2 3.19Å; L27-V31 PolarHBondContact O-N 2.82Å
28	T	65.3	Low	58.7	Low	69 Å²	69	105.5 Å²	105.5	42%	0.423	53%	0.529	S	S	.	.	H	α-helix	trans	-65.8	-45	175.1	-48.5	0	0	0	0	111.4	I24 R30 V31 E32	I24-T28 PolarHBondContact O-N 3.34Å; I24-T28 PolarHBondContact O-OG1 3.45Å; T28-R30 VanDerWaalsContact C-N 3.29Å; T28-R30 PolarHBondContact O-N 3.42Å; T28-V31 WeakPolarHBondContact O-CB 3.43Å; T28-V31 PolarHBondContact O-N 2.89Å; T28-E32 PolarHBondContact O-N 3.02Å
29	R	63.4	Low	59.1	Low	158 Å²	158	103.1 Å²	103.1	60%	0.596	53%	0.525	S	S	*	.	H	α-helix	trans	-62	-34.7	173	-156.6	-175.4	94.4	160.9	8.9	112.4	S25 E32 E33	S25-R29 VanDerWaalsContact O-CB 3.31Å; S25-R29 WeakPolarHBondContact O-CB 3.16Å; S25-R29 PolarHBondContact O-N 2.55Å; R29-E32 PolarHBondContact O-N 3.14Å; R29-E33 IonicContact CZ-OE1 2.61Å; R29-E33 IonicContact NE-OE1 3.87Å; R29-E33 PolarHBondContact NE-OE1 3.17Å; R29-E33 IonicContact NH2-OE1 3.85Å; R29-E33 PolarHBondContact NH2-OE1 3.17Å; R29-E33 WeakPolarHBondContact O-CB 3.22Å; R29-E33 VanDerWaalsContact O-CG 3.3Å; R29-E33 WeakPolarHBondContact O-CG 3.49Å; R29-E33 PolarHBondContact O-N 2.88Å
30	R	62.1	Low	59.4	Low	166 Å²	166	102.8 Å²	102.8	63%	0.626	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-38.4	171.2	-108.1	178.1	170.6	173.6	-3.3	112.6	R26 L27 T28 E32 I34	R26-R30 VanDerWaalsContact O-CB 3.3Å; R26-R30 WeakPolarHBondContact O-CB 3.31Å; R26-R30 PolarHBondContact O-N 2.98Å; L27-R30 WeakPolarHBondContact O-CB 3.44Å; L27-R30 PolarHBondContact O-N 3.36Å; T28-R30 VanDerWaalsContact C-N 3.29Å; T28-R30 PolarHBondContact O-N 3.42Å; R30-E32 VanDerWaalsContact C-N 3.32Å; R30-I34 VanDerWaalsContact O-CB 3.23Å; R30-I34 WeakPolarHBondContact O-CB 2.9Å; R30-I34 WeakPolarHBondContact O-CD1 3.32Å; R30-I34 WeakPolarHBondContact O-CG1 3.35Å; R30-I34 PolarHBondContact O-N 3.45Å
31	V	62.4	Low	59.2	Low	95 Å²	95	103.3 Å²	103.3	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-66.3	-36.7	176.1	168.6	0	0	0	0	110.8	L27 T28 K35	L27-V31 VanDerWaalsContact O-CG2 3.32Å; L27-V31 WeakPolarHBondContact O-CG2 3.19Å; L27-V31 PolarHBondContact O-N 2.82Å; T28-V31 WeakPolarHBondContact O-CB 3.43Å; T28-V31 PolarHBondContact O-N 2.89Å; V31-K35 VanDerWaalsContact O-CB 3.24Å; V31-K35 WeakPolarHBondContact O-CB 3.42Å; V31-K35 PolarHBondContact O-N 3.3Å
32	E	63.7	Low	59.2	Low	123 Å²	123	106.6 Å²	106.6	58%	0.575	53%	0.531	S	S	*	.	H	α-helix	trans	-77.3	-36.2	175.9	-78.5	147.6	165.3	0	0	113.7	T28 R29 R30 K35 G36	T28-E32 PolarHBondContact O-N 3.02Å; R29-E32 PolarHBondContact O-N 3.14Å; R30-E32 VanDerWaalsContact C-N 3.32Å; E32-K35 PolarHBondContact O-N 3.44Å; E32-G36 PolarHBondContact O-N 2.74Å
33	E	60.6	Low	58.9	Low	85 Å²	85	108.4 Å²	108.4	40%	0.397	55%	0.546	S	S	.	.	H	α-helix	trans	-63.6	-44	169.8	-77.5	168.1	178.5	0	0	110.9	R29 K35 G36 E37	R29-E33 IonicContact CZ-OE1 2.61Å; R29-E33 IonicContact NE-OE1 3.87Å; R29-E33 PolarHBondContact NE-OE1 3.17Å; R29-E33 IonicContact NH2-OE1 3.85Å; R29-E33 PolarHBondContact NH2-OE1 3.17Å; R29-E33 WeakPolarHBondContact O-CB 3.22Å; R29-E33 VanDerWaalsContact O-CG 3.3Å; R29-E33 WeakPolarHBondContact O-CG 3.49Å; R29-E33 PolarHBondContact O-N 2.88Å; E33-K35 PolarHBondContact O-N 3.45Å; E33-G36 PolarHBondContact O-N 3.29Å; E33-E37 WeakPolarHBondContact O-CG 2.93Å; E33-E37 PolarHBondContact O-N 2.69Å
34	I	62.4	Low	58.4	Low	93 Å²	93	109.9 Å²	109.9	48%	0.477	56%	0.557	S	S	.	*	H	α-helix	trans	-68.1	-35.1	176.5	-68.9	167	0	0	0	111.3	R30 E37 V38	R30-I34 VanDerWaalsContact O-CB 3.23Å; R30-I34 WeakPolarHBondContact O-CB 2.9Å; R30-I34 WeakPolarHBondContact O-CD1 3.32Å; R30-I34 WeakPolarHBondContact O-CG1 3.35Å; R30-I34 PolarHBondContact O-N 3.45Å; I34-E37 PolarHBondContact O-N 3.44Å; I34-V38 HydrophobicContact CG2-CG2 4.3Å; I34-V38 WeakPolarHBondContact O-CB 3.41Å; I34-V38 WeakPolarHBondContact O-CG2 3.49Å; I34-V38 PolarHBondContact O-N 2.98Å
35	K	61.8	Low	58.1	Low	148 Å²	148	113.1 Å²	113.1	64%	0.643	57%	0.567	S	S	*	*	H	α-helix	trans	-65.3	-39.5	172.8	-174.3	-178.9	176.7	-176	0	111.8	V31 E32 E33 C39	V31-K35 VanDerWaalsContact O-CB 3.24Å; V31-K35 WeakPolarHBondContact O-CB 3.42Å; V31-K35 PolarHBondContact O-N 3.3Å; E32-K35 PolarHBondContact O-N 3.44Å; E33-K35 PolarHBondContact O-N 3.45Å; K35-C39 WeakPolarHBondContact O-CB 3.46Å; K35-C39 PolarHBondContact O-N 3.47Å; K35-C39 VanDerWaalsContact O-N 3.08Å; K35-C39 PolarHBondContact O-SG 2.77Å
36	G	62.7	Low	57.3	Low	36 Å²	36	119.2 Å²	119.2	37%	0.371	58%	0.579	S	S	.	*	H	α-helix	trans	-66.3	-39.1	173.1	0	0	0	0	0	113.2	E32 E33 N40	E32-G36 PolarHBondContact O-N 2.74Å; E33-G36 PolarHBondContact O-N 3.29Å; G36-N40 WeakPolarHBondContact O-CB 3.07Å; G36-N40 PolarHBondContact O-N 3.11Å
37	E	55.3	Low	56	Low	136 Å²	136	119.5 Å²	119.5	64%	0.636	60%	0.598	S	S	*	*	H	α-helix	trans	-70.3	-37.6	176.4	-74.6	179.6	176	0	0	112.5	E33 I34 N40 M41	E33-E37 WeakPolarHBondContact O-CG 2.93Å; E33-E37 PolarHBondContact O-N 2.69Å; I34-E37 PolarHBondContact O-N 3.44Å; E37-N40 PolarHBondContact O-N 2.76Å; E37-M41 WeakPolarHBondContact O-CB 3.18Å; E37-M41 PolarHBondContact O-N 3.26Å
38	V	55.4	Low	55	Low	64 Å²	64	123 Å²	123	39%	0.388	61%	0.611	S	S	.	*	H	α-helix	trans	-69	-38.1	174.8	171.5	0	0	0	0	111.5	I34 M41 I42	I34-V38 HydrophobicContact CG2-CG2 4.3Å; I34-V38 WeakPolarHBondContact O-CB 3.41Å; I34-V38 WeakPolarHBondContact O-CG2 3.49Å; I34-V38 PolarHBondContact O-N 2.98Å; V38-M41 PolarHBondContact O-N 3.31Å; V38-I42 HydrophobicContact CG1-CD1 4.04Å; V38-I42 VanDerWaalsContact O-CG1 3.31Å; V38-I42 WeakPolarHBondContact O-CG1 3.16Å; V38-I42 PolarHBondContact O-N 2.83Å; V38-I42 VanDerWaalsContact O-N 3.16Å
39	C	51.7	Low	53.6	Low	75 Å²	75	128.9 Å²	128.9	51%	0.507	63%	0.631	S	S	.	*	H	α-helix	trans	-70.1	-32.2	174.4	-78.2	0	0	0	0	113.5	K35 S43	K35-C39 WeakPolarHBondContact O-CB 3.46Å; K35-C39 PolarHBondContact O-N 3.47Å; K35-C39 VanDerWaalsContact O-N 3.08Å; K35-C39 PolarHBondContact O-SG 2.77Å; C39-S43 PolarHBondContact O-N 2.74Å; C39-S43 PolarHBondContact O-OG 3.31Å
40	N	54.8	Low	52.8	Low	123 Å²	123	127.8 Å²	127.8	66%	0.658	64%	0.637	S	S	*	*	H	α-helix	trans	-76.9	-32.6	172.3	-90.8	-22.7	0	0	0	113.1	G36 E37 S43	G36-N40 WeakPolarHBondContact O-CB 3.07Å; G36-N40 PolarHBondContact O-N 3.11Å; E37-N40 PolarHBondContact O-N 2.76Å; N40-S43 PolarHBondContact O-N 3.39Å
41	M	52.8	Low	52.3	Low	135 Å²	135	126 Å²	126	67%	0.665	65%	0.646	S	S	*	*	H	α-helix	trans	-68.6	-32.8	176.8	-171.9	-173.7	67.8	0	0	112.3	E37 V38	E37-M41 WeakPolarHBondContact O-CB 3.18Å; E37-M41 PolarHBondContact O-N 3.26Å; V38-M41 PolarHBondContact O-N 3.31Å
42	I	54.8	Low	51.7	Low	108 Å²	108	126.3 Å²	126.3	55%	0.554	65%	0.653	S	S	*	*	H	α-helix	trans	-76.9	-33.9	176.2	-67.1	168	0	0	0	111.5	V38 K44 K45	V38-I42 HydrophobicContact CG1-CD1 4.04Å; V38-I42 VanDerWaalsContact O-CG1 3.31Å; V38-I42 WeakPolarHBondContact O-CG1 3.16Å; V38-I42 PolarHBondContact O-N 2.83Å; V38-I42 VanDerWaalsContact O-N 3.16Å; I42-K44 VanDerWaalsContact C-N 3.25Å; I42-K44 PolarHBondContact O-N 3.25Å; I42-K45 PolarHBondContact O-N 2.71Å
43	S	51.2	Low	50.9	Low	96 Å²	96	128.3 Å²	128.3	67%	0.671	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.6	-5.5	-177.4	-59.8	0	0	0	0	114.9	C39 N40	C39-S43 PolarHBondContact O-N 2.74Å; C39-S43 PolarHBondContact O-OG 3.31Å; N40-S43 PolarHBondContact O-N 3.39Å
44	K	46.9	Very low	50.7	Low	189 Å²	189	133.4 Å²	133.4	82%	0.822	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123	34.1	172.7	-92	-177.3	173.1	-178.6	0	112.6	I42 Y46	I42-K44 VanDerWaalsContact C-N 3.25Å; I42-K44 PolarHBondContact O-N 3.25Å; K44-Y46 PolarHBondContact O-N 2.71Å
45	K	51.2	Low	50.3	Low	175 Å²	175	133.3 Å²	133.3	76%	0.761	70%	0.696	S	S	*	*			trans	-58.7	90.8	145.8	-95.5	-163.3	174.6	-176	0	107.9	I42	I42-K45 PolarHBondContact O-N 2.71Å
46	Y	41	Very low	50	Low	208 Å²	208	129 Å²	129	82%	0.816	69%	0.688	S	S	*	*	S	Bend		169.3	111.8	123.4	-96.8	-78.4	0	0	0	107.6	K44	K44-Y46 PolarHBondContact O-N 2.71Å
47	S	36.2	Very low	49.7	Very low	115 Å²	115	133.7 Å²	133.7	80%	0.804	70%	0.7	S	S	*	*	S	Bend	trans	56.9	103.8	174.2	48.3	0	0	0	0	115.5
48	E	38.5	Very low	49.9	Very low	187 Å²	187	129.3 Å²	129.3	87%	0.874	69%	0.692	S	S	*	*				-150.8	125.7	57.9	-69.2	172.1	158.6	0	0	109.7
49	F	37.3	Very low	50	Low	191 Å²	191	132.4 Å²	132.4	84%	0.838	71%	0.705	S	S	*	*				81.6	103.9	87	-133.5	-104.3	0	0	0	115.7
50	L	45.8	Very low	50.4	Low	136 Å²	136	132.8 Å²	132.8	71%	0.712	70%	0.702	S	S	*	*			trans	44.4	113	153.4	-83.8	136.3	0	0	0	118.5
51	P	51.6	Low	50.8	Low	127 Å²	127	131.6 Å²	131.6	83%	0.825	70%	0.699	S	S	*	*	S	Bend		-158.2	96	59.7	35.3	-9.9	0	0	0	116.1
52	S	50.2	Low	51.2	Low	103 Å²	103	132.4 Å²	132.4	72%	0.72	70%	0.701	S	S	*	*			trans	-147.7	25.4	176.4	65.8	0	0	0	0	116.7
53	M	46.9	Very low	51.4	Low	165 Å²	165	132 Å²	132	81%	0.813	70%	0.703	S	S	*	*			trans	-91.6	-4.4	-179.4	-105.8	-166.6	78	0	0	116.1
54	Q	55.5	Low	51.9	Low	191 Å²	191	132 Å²	132	89%	0.893	70%	0.696	S	S	*	*	S	Bend	trans	-93.2	-3.4	-174.2	-77.3	179.4	-19.3	0	0	115.6
55	S	55.4	Low	52.8	Low	92 Å²	92	130.3 Å²	130.3	64%	0.643	69%	0.688	S	S	*	*	S	Bend	trans	-90.7	-14	172.3	50.9	0	0	0	0	113.6	Q57	S55-Q57 VanDerWaalsContact C-N 3.33Å; S55-Q57 PolarHBondContact O-N 3.47Å
56	A	54.9	Low	53.3	Low	58 Å²	58	127.8 Å²	127.8	48%	0.479	68%	0.683	S	S	.	*	H	α-helix	trans	-72.8	-22.5	179	0	0	0	0	0	113.3
57	Q	55.8	Low	54.2	Low	133 Å²	133	120.6 Å²	120.6	62%	0.621	66%	0.663	S	S	*	*	H	α-helix	trans	-81.7	-25.9	-175.1	-143.9	80.3	21.9	0	0	113.8	S55 I60	S55-Q57 VanDerWaalsContact C-N 3.33Å; S55-Q57 PolarHBondContact O-N 3.47Å; Q57-I60 PolarHBondContact O-N 3.47Å
58	G	61.1	Low	55.7	Low	45 Å²	45	121.9 Å²	121.9	46%	0.464	66%	0.656	S	S	.	*	H	α-helix	trans	-76.4	-25.7	-178.6	0	0	0	0	0	114.4	I60 T61	G58-I60 VanDerWaalsContact C-N 3.33Å; G58-T61 PolarHBondContact O-OG1 2.76Å
59	L	56.8	Low	56.8	Low	128 Å²	128	118.5 Å²	118.5	67%	0.67	64%	0.644	S	S	*	*	H	α-helix	trans	-72.8	-27.3	173.7	-101.2	96.3	0	0	0	112.4	Q62	L59-Q62 PolarHBondContact O-N 3.46Å
60	I	59.7	Low	57.7	Low	84 Å²	84	114.6 Å²	114.6	43%	0.431	63%	0.631	S	S	.	*	H	α-helix	trans	-66.8	-39.3	-178.6	-63.2	172.3	0	0	0	110.5	Q57 G58 Q62 V63 D64	Q57-I60 PolarHBondContact O-N 3.47Å; G58-I60 VanDerWaalsContact C-N 3.33Å; I60-Q62 VanDerWaalsContact C-N 3.29Å; I60-Q62 PolarHBondContact O-N 3.07Å; I60-V63 WeakPolarHBondContact O-CB 3.44Å; I60-V63 PolarHBondContact O-N 3.09Å; I60-V63 VanDerWaalsContact O-N 3.11Å; I60-D64 PolarHBondContact O-N 3.06Å
61	T	62.7	Low	58.3	Low	98 Å²	98	112 Å²	112	60%	0.601	62%	0.618	S	S	*	*	H	α-helix	trans	-70.5	-15.9	179.7	44.5	0	0	0	0	115.5	G58	G58-T61 PolarHBondContact O-OG1 2.76Å
62	Q	61.2	Low	59	Low	152 Å²	152	112 Å²	112	71%	0.71	61%	0.61	S	S	*	*	H	α-helix	trans	-86.1	-24.4	171.7	-74.9	-175.3	-11.5	0	0	112.3	L59 I60	L59-Q62 PolarHBondContact O-N 3.46Å; I60-Q62 VanDerWaalsContact C-N 3.29Å; I60-Q62 PolarHBondContact O-N 3.07Å
63	V	59.1	Low	59.3	Low	99 Å²	99	113 Å²	113	60%	0.6	61%	0.607	S	S	*	*	H	α-helix	trans	-72.8	-36.3	175.4	172.9	0	0	0	0	110.9	I60 K65 L66 S67	I60-V63 WeakPolarHBondContact O-CB 3.44Å; I60-V63 PolarHBondContact O-N 3.09Å; I60-V63 VanDerWaalsContact O-N 3.11Å; V63-K65 PolarHBondContact O-N 3.46Å; V63-L66 PolarHBondContact O-N 2.83Å; V63-S67 PolarHBondContact O-N 2.76Å
64	D	62.1	Low	59.6	Low	97 Å²	97	111.1 Å²	111.1	52%	0.519	59%	0.594	S	S	.	*	H	α-helix	trans	-67.3	-36	179.5	-69	-27.2	0	0	0	113.3	I60 L66 S67 E68	I60-D64 PolarHBondContact O-N 3.06Å; D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 PolarHBondContact O-N 2.66Å; D64-S67 VanDerWaalsContact O-CB 3.31Å; D64-S67 WeakPolarHBondContact O-CB 3.15Å; D64-S67 PolarHBondContact O-N 2.87Å; D64-S67 VanDerWaalsContact O-N 3.14Å; D64-E68 PolarHBondContact O-N 3.48Å
65	K	64.9	Low	59.6	Low	152 Å²	152	105.1 Å²	105.1	66%	0.661	57%	0.573	S	S	*	*	H	α-helix	trans	-70.4	-30.7	-179.5	-146.6	177.4	-171.4	179.1	0	113.1	V63 S67	V63-K65 PolarHBondContact O-N 3.46Å; K65-S67 VanDerWaalsContact C-N 3.29Å
66	L	62.7	Low	59.6	Low	122 Å²	122	110.2 Å²	110.2	64%	0.639	58%	0.578	S	S	*	*	H	α-helix	trans	-74.9	-23.3	174	-148.4	84.1	0	0	0	111.7	V63 D64 I70	V63-L66 PolarHBondContact O-N 2.83Å; D64-L66 VanDerWaalsContact C-N 3.34Å; D64-L66 PolarHBondContact O-N 2.66Å; L66-I70 WeakPolarHBondContact O-CG1 3.45Å
67	S	60.9	Low	59.4	Low	57 Å²	57	112.2 Å²	112.2	40%	0.399	58%	0.58	S	S	.	*	H	α-helix	trans	-74	-37.4	175.9	-165.6	0	0	0	0	112.4	V63 D64 K65 D69 I70 D71	V63-S67 PolarHBondContact O-N 2.76Å; D64-S67 VanDerWaalsContact O-CB 3.31Å; D64-S67 WeakPolarHBondContact O-CB 3.15Å; D64-S67 PolarHBondContact O-N 2.87Å; D64-S67 VanDerWaalsContact O-N 3.14Å; K65-S67 VanDerWaalsContact C-N 3.29Å; S67-D69 VanDerWaalsContact C-N 3.35Å; S67-D69 PolarHBondContact O-N 3.36Å; S67-I70 WeakPolarHBondContact O-CB 3.39Å; S67-I70 PolarHBondContact O-N 2.73Å; S67-D71 PolarHBondContact O-N 3.48Å; S67-D71 VanDerWaalsContact O-N 3.17Å
68	E	66.8	Low	59.2	Low	142 Å²	142	112.8 Å²	112.8	66%	0.664	58%	0.582	S	S	*	*	H	α-helix	trans	-64.6	-35.5	177.6	-78.7	-175.5	151.5	0	0	112.9	D64 I70 D71 L72	D64-E68 PolarHBondContact O-N 3.48Å; E68-I70 VanDerWaalsContact C-N 3.29Å; E68-I70 PolarHBondContact O-N 3.24Å; E68-D71 PolarHBondContact O-N 2.73Å; E68-L72 PolarHBondContact O-N 2.67Å
69	D	60.7	Low	58.8	Low	117 Å²	117	115.3 Å²	115.3	63%	0.626	59%	0.593	S	S	*	*	H	α-helix	trans	-68.9	-28.1	175.2	-73.2	-24.1	0	0	0	112.3	S67	S67-D69 VanDerWaalsContact C-N 3.35Å; S67-D69 PolarHBondContact O-N 3.36Å
70	I	57.8	Low	58.5	Low	109 Å²	109	116.9 Å²	116.9	56%	0.559	60%	0.597	S	S	*	*	H	α-helix	trans	-73.6	-35.1	174.9	-72.1	171.6	0	0	0	111.3	L66 S67 E68 L73 K74	L66-I70 WeakPolarHBondContact O-CG1 3.45Å; S67-I70 WeakPolarHBondContact O-CB 3.39Å; S67-I70 PolarHBondContact O-N 2.73Å; E68-I70 VanDerWaalsContact C-N 3.29Å; E68-I70 PolarHBondContact O-N 3.24Å; I70-L73 PolarHBondContact O-N 3.15Å; I70-K74 PolarHBondContact O-N 3.17Å
71	D	58.3	Low	58.1	Low	81 Å²	81	115.2 Å²	115.2	43%	0.433	59%	0.59	S	S	.	*	H	α-helix	trans	-75.2	-28.3	178.1	-76.9	-40	0	0	0	113.1	S67 E68 L73 K74 S75	S67-D71 PolarHBondContact O-N 3.48Å; S67-D71 VanDerWaalsContact O-N 3.17Å; E68-D71 PolarHBondContact O-N 2.73Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 2.88Å; D71-K74 VanDerWaalsContact O-CB 3.26Å; D71-K74 WeakPolarHBondContact O-CB 3.38Å; D71-K74 PolarHBondContact O-N 3.11Å; D71-K74 IonicContact OD1-NZ 3.83Å; D71-S75 PolarHBondContact O-N 3.45Å
72	L	65.7	Low	57.4	Low	126 Å²	126	116.3 Å²	116.3	66%	0.66	60%	0.6	S	S	*	*	H	α-helix	trans	-66.5	-35	173.8	-158.8	77.9	0	0	0	111.8	E68 K74 S75	E68-L72 PolarHBondContact O-N 2.67Å; L72-K74 VanDerWaalsContact C-N 3.33Å; L72-S75 PolarHBondContact O-N 2.97Å; L72-S75 PolarHBondContact O-OG 3.01Å
73	L	57.1	Low	56.9	Low	125 Å²	125	119.4 Å²	119.4	65%	0.654	61%	0.606	S	S	*	*	H	α-helix	trans	-66.7	-35.7	174.3	-151.5	87.3	0	0	0	111.9	I70 D71 S75 R76 I77	I70-L73 PolarHBondContact O-N 3.15Å; D71-L73 VanDerWaalsContact C-N 3.32Å; D71-L73 PolarHBondContact O-N 2.88Å; L73-S75 PolarHBondContact O-N 2.93Å; L73-R76 PolarHBondContact O-N 2.86Å; L73-I77 PolarHBondContact O-N 2.72Å
74	K	53.4	Low	56.3	Low	126 Å²	126	119.4 Å²	119.4	55%	0.548	60%	0.602	S	S	.	*	H	α-helix	trans	-64.7	-35.6	178.6	-158.1	178.7	-178.8	-179	0	112.6	I70 D71 L72 I77 E78	I70-K74 PolarHBondContact O-N 3.17Å; D71-K74 VanDerWaalsContact O-CB 3.26Å; D71-K74 WeakPolarHBondContact O-CB 3.38Å; D71-K74 PolarHBondContact O-N 3.11Å; D71-K74 IonicContact OD1-NZ 3.83Å; L72-K74 VanDerWaalsContact C-N 3.33Å; K74-I77 PolarHBondContact O-N 3.18Å; K74-E78 PolarHBondContact O-N 3.31Å
75	S	55.6	Low	55.6	Low	64 Å²	64	119.3 Å²	119.3	45%	0.448	60%	0.601	S	S	.	*	H	α-helix	trans	-70.7	-27.7	178.5	75.1	0	0	0	0	114.4	D71 L72 L73	D71-S75 PolarHBondContact O-N 3.45Å; L72-S75 PolarHBondContact O-N 2.97Å; L72-S75 PolarHBondContact O-OG 3.01Å; L73-S75 PolarHBondContact O-N 2.93Å
76	R	53.8	Low	54.7	Low	200 Å²	200	120.4 Å²	120.4	76%	0.755	61%	0.608	S	S	*	*	H	α-helix	trans	-75.1	-35	174.6	-95.1	-176.3	174.9	-174.1	-1.2	112.4	L73 S79	L73-R76 PolarHBondContact O-N 2.86Å; R76-S79 PolarHBondContact O-OG 3.38Å
77	I	51.5	Low	54.2	Low	100 Å²	100	119.1 Å²	119.1	51%	0.513	61%	0.606	S	S	.	*	H	α-helix	trans	-60	-48.7	174.6	-66.5	171.5	0	0	0	109.2	L73 K74 S79 V81	L73-I77 PolarHBondContact O-N 2.72Å; K74-I77 PolarHBondContact O-N 3.18Å; I77-S79 VanDerWaalsContact C-N 3.3Å; I77-S79 PolarHBondContact O-N 3.27Å; I77-S79 VanDerWaalsContact O-N 3.14Å; I77-V81 HydrophobicContact CG2-CG2 3.8Å; I77-V81 WeakPolarHBondContact O-CB 3.49Å; I77-V81 WeakPolarHBondContact O-CG2 3.12Å; I77-V81 PolarHBondContact O-N 3.29Å
78	E	51.6	Low	53.6	Low	144 Å²	144	119.3 Å²	119.3	67%	0.673	61%	0.607	S	S	*	*	H	α-helix	trans	-60.2	-27.9	-176.8	-80.9	178.2	153.4	0	0	116.2	K74	K74-E78 PolarHBondContact O-N 3.31Å
79	S	52.9	Low	52.8	Low	98 Å²	98	115.9 Å²	115.9	69%	0.685	60%	0.596	S	S	*	*	H	α-helix	trans	-90.6	-29.6	-172.7	68.7	0	0	0	0	115.4	R76 I77	R76-S79 PolarHBondContact O-OG 3.38Å; I77-S79 VanDerWaalsContact C-N 3.3Å; I77-S79 PolarHBondContact O-N 3.27Å; I77-S79 VanDerWaalsContact O-N 3.14Å
80	E	50.8	Low	52.7	Low	162 Å²	162	111.7 Å²	111.7	76%	0.757	58%	0.58	S	S	*	*	H	α-helix	trans	-86.8	-21.4	171.5	-77.3	-170.8	152.7	0	0	112.4	C82	E80-C82 PolarHBondContact O-N 2.91Å
81	V	50	Low	52.7	Low	49 Å²	49	111.8 Å²	111.8	30%	0.297	58%	0.578	S	S	.	*	H	α-helix	trans	-78	-17	-168.6	161.7	0	0	0	0	115.4	I77 R83 L85	I77-V81 HydrophobicContact CG2-CG2 3.8Å; I77-V81 WeakPolarHBondContact O-CB 3.49Å; I77-V81 WeakPolarHBondContact O-CG2 3.12Å; I77-V81 PolarHBondContact O-N 3.29Å; V81-R83 VanDerWaalsContact C-N 3.25Å; V81-R83 PolarHBondContact O-N 3.49Å; V81-R83 VanDerWaalsContact O-N 3.16Å; V81-L85 HydrophobicContact CG1-CD1 3.2Å; V81-L85 HydrophobicContact CG1-CG 4.45Å; V81-L85 VanDerWaalsContact O-CB 3.31Å; V81-L85 WeakPolarHBondContact O-CB 3.18Å; V81-L85 PolarHBondContact O-N 2.76Å
82	C	48	Very low	52.4	Low	120 Å²	120	114.7 Å²	114.7	81%	0.811	59%	0.587	S	S	*	*	H	α-helix	trans	-71.6	-10.3	-176.5	-86.2	0	0	0	0	115.8	E80	E80-C82 PolarHBondContact O-N 2.91Å
83	R	50.2	Low	52.2	Low	217 Å²	217	111.6 Å²	111.6	82%	0.819	57%	0.573	S	S	*	*	H	α-helix	trans	-107.3	-29.3	175.2	-158.4	176.5	60.2	168	-1.7	113.2	V81	V81-R83 VanDerWaalsContact C-N 3.25Å; V81-R83 PolarHBondContact O-N 3.49Å; V81-R83 VanDerWaalsContact O-N 3.16Å
84	D	47.8	Very low	52.6	Low	100 Å²	100	110 Å²	110	54%	0.535	57%	0.566	S	S	.	*	H	α-helix	trans	-85.1	-14.5	174.9	-70	-16.5	0	0	0	113	H86 V87 S88	D84-H86 PolarHBondContact O-N 2.77Å; D84-H86 VanDerWaalsContact O-N 3.14Å; D84-V87 PolarHBondContact O-N 2.96Å; D84-S88 WeakPolarHBondContact O-CB 3.12Å; D84-S88 PolarHBondContact O-N 2.91Å
85	L	46	Very low	53.2	Low	95 Å²	95	109.7 Å²	109.7	50%	0.497	57%	0.569	S	S	.	*	H	α-helix	trans	-57.5	-31.1	178.6	-145.3	90.4	0	0	0	112.7	V81 T89	V81-L85 HydrophobicContact CG1-CD1 3.2Å; V81-L85 HydrophobicContact CG1-CG 4.45Å; V81-L85 VanDerWaalsContact O-CB 3.31Å; V81-L85 WeakPolarHBondContact O-CB 3.18Å; V81-L85 PolarHBondContact O-N 2.76Å; L85-T89 WeakPolarHBondContact O-CA 3.31Å; L85-T89 WeakPolarHBondContact O-CB 3.26Å; L85-T89 PolarHBondContact O-N 3.49Å; L85-T89 PolarHBondContact O-OG1 2.83Å
86	H	46.3	Very low	53.8	Low	174 Å²	174	112 Å²	112	81%	0.806	57%	0.571	S	S	*	*	H	α-helix	trans	-83.1	-34.7	-176.2	-133	53.6	0	0	0	113.4	D84 G90	D84-H86 PolarHBondContact O-N 2.77Å; D84-H86 VanDerWaalsContact O-N 3.14Å; H86-G90 PolarHBondContact O-N 3.43Å
87	V	52.7	Low	54.4	Low	96 Å²	96	106.5 Å²	106.5	58%	0.582	55%	0.554	S	S	*	*	H	α-helix	trans	-80.4	-40.3	175.6	179.3	0	0	0	0	110.4	D84 G90 E91	D84-V87 PolarHBondContact O-N 2.96Å; V87-G90 PolarHBondContact O-N 3.4Å; V87-E91 PolarHBondContact O-N 2.99Å
88	S	47.9	Very low	55.3	Low	61 Å²	61	105.9 Å²	105.9	43%	0.427	55%	0.549	S	S	.	.	H	α-helix	trans	-78.5	-23.5	177.2	-142.7	0	0	0	0	113	D84 G90 F92	D84-S88 WeakPolarHBondContact O-CB 3.12Å; D84-S88 PolarHBondContact O-N 2.91Å; S88-G90 VanDerWaalsContact C-N 3.35Å; S88-F92 WeakPolarHBondContact O-CA 3.49Å; S88-F92 WeakPolarHBondContact O-CB 3.25Å; S88-F92 PolarHBondContact O-N 3.04Å
89	T	50.2	Low	56.1	Low	70 Å²	70	104.9 Å²	104.9	43%	0.429	55%	0.548	S	S	.	.	H	α-helix	trans	-69.1	-36.5	166.2	-61	0	0	0	0	110.4	L85 T93	L85-T89 WeakPolarHBondContact O-CA 3.31Å; L85-T89 WeakPolarHBondContact O-CB 3.26Å; L85-T89 PolarHBondContact O-N 3.49Å; L85-T89 PolarHBondContact O-OG1 2.83Å; T89-T93 HydrophobicContact CG2-CG2 4.14Å; T89-T93 WeakPolarHBondContact O-CA 3.49Å; T89-T93 VanDerWaalsContact O-CB 3.22Å; T89-T93 WeakPolarHBondContact O-CB 3.39Å; T89-T93 WeakPolarHBondContact O-CG2 2.95Å; T89-T93 PolarHBondContact O-N 3.04Å; T89-T93 PolarHBondContact O-OG1 3.28Å
90	G	59	Low	56.8	Low	28 Å²	28	105.3 Å²	105.3	29%	0.289	54%	0.539	S	S	.	.	H	α-helix	trans	-61.1	-55	170.5	0	0	0	0	0	111.9	H86 V87 S88 F92 T93 D94	H86-G90 PolarHBondContact O-N 3.43Å; V87-G90 PolarHBondContact O-N 3.4Å; S88-G90 VanDerWaalsContact C-N 3.35Å; G90-F92 PolarHBondContact O-N 2.84Å; G90-T93 WeakPolarHBondContact CA-OG1 3.23Å; G90-T93 CarbonylContact O-C 3.58Å; G90-T93 PolarHBondContact O-N 3.28Å; G90-T93 PolarHBondContact O-OG1 2.79Å; G90-D94 VanDerWaalsContact O-CB 3.32Å; G90-D94 WeakPolarHBondContact O-CB 3.24Å; G90-D94 VanDerWaalsContact O-CG 3.28Å; G90-D94 PolarHBondContact O-N 3.35Å
91	E	57.5	Low	57.6	Low	112 Å²	112	103.6 Å²	103.6	52%	0.523	53%	0.525	S	S	.	.	H	α-helix	trans	-65.3	-33.8	177.6	-69.9	178.8	170.5	0	0	113.1	V87 D94 L95	V87-E91 PolarHBondContact O-N 2.99Å; E91-D94 PolarHBondContact O-N 2.73Å; E91-L95 WeakPolarHBondContact O-CA 3.09Å; E91-L95 WeakPolarHBondContact O-CB 3.45Å; E91-L95 WeakPolarHBondContact O-CD1 3.04Å; E91-L95 PolarHBondContact O-N 2.91Å
92	F	52.4	Low	58.8	Low	141 Å²	141	104.7 Å²	104.7	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-76.8	-33	174.6	-169.8	-90.8	0	0	0	111.3	S88 G90 K96	S88-F92 WeakPolarHBondContact O-CA 3.49Å; S88-F92 WeakPolarHBondContact O-CB 3.25Å; S88-F92 PolarHBondContact O-N 3.04Å; G90-F92 PolarHBondContact O-N 2.84Å; F92-K96 WeakPolarHBondContact O-CA 3.48Å; F92-K96 WeakPolarHBondContact O-CB 3.26Å; F92-K96 PolarHBondContact O-N 2.94Å
93	T	62	Low	60	Low	61 Å²	61	102.3 Å²	102.3	37%	0.374	52%	0.515	S	S	.	.	H	α-helix	trans	-69.9	-34.6	168.4	52.1	0	0	0	0	111.4	T89 G90 Q97	T89-T93 HydrophobicContact CG2-CG2 4.14Å; T89-T93 WeakPolarHBondContact O-CA 3.49Å; T89-T93 VanDerWaalsContact O-CB 3.22Å; T89-T93 WeakPolarHBondContact O-CB 3.39Å; T89-T93 WeakPolarHBondContact O-CG2 2.95Å; T89-T93 PolarHBondContact O-N 3.04Å; T89-T93 PolarHBondContact O-OG1 3.28Å; G90-T93 WeakPolarHBondContact CA-OG1 3.23Å; G90-T93 CarbonylContact O-C 3.58Å; G90-T93 PolarHBondContact O-N 3.28Å; G90-T93 PolarHBondContact O-OG1 2.79Å; T93-Q97 WeakPolarHBondContact O-CB 3.48Å; T93-Q97 WeakPolarHBondContact O-CG 3.27Å; T93-Q97 PolarHBondContact O-N 3.43Å
94	D	65.4	Low	60.9	Low	93 Å²	93	95.3 Å²	95.3	50%	0.497	50%	0.496	S	S	.	.	H	α-helix	trans	-73.7	-41.6	175.6	-75.3	-19.8	0	0	0	110.9	G90 E91 Q97 Q98	G90-D94 VanDerWaalsContact O-CB 3.32Å; G90-D94 WeakPolarHBondContact O-CB 3.24Å; G90-D94 VanDerWaalsContact O-CG 3.28Å; G90-D94 PolarHBondContact O-N 3.35Å; E91-D94 PolarHBondContact O-N 2.73Å; D94-Q97 PolarHBondContact O-N 2.89Å; D94-Q98 WeakPolarHBondContact O-CA 3.28Å; D94-Q98 WeakPolarHBondContact O-CB 3.35Å; D94-Q98 PolarHBondContact O-N 3.43Å
95	L	65.6	Low	62	Low	119 Å²	119	94 Å²	94	62%	0.623	49%	0.491	S	S	*	.	H	α-helix	trans	-67.6	-36.4	171.7	-94.8	144.9	0	0	0	111.8	E91 Q98 L99	E91-L95 WeakPolarHBondContact O-CA 3.09Å; E91-L95 WeakPolarHBondContact O-CB 3.45Å; E91-L95 WeakPolarHBondContact O-CD1 3.04Å; E91-L95 PolarHBondContact O-N 2.91Å; L95-Q98 PolarHBondContact O-N 2.89Å; L95-L99 WeakPolarHBondContact O-CB 3.31Å; L95-L99 PolarHBondContact O-N 3.17Å
96	K	67.8	Low	63.4	Low	112 Å²	112	95 Å²	95	49%	0.487	50%	0.496	S	S	.	.	H	α-helix	trans	-70.4	-43.7	173.7	-180	-178.1	174	-175.2	0	110.7	F92 Q98 L99 E100	F92-K96 WeakPolarHBondContact O-CA 3.48Å; F92-K96 WeakPolarHBondContact O-CB 3.26Å; F92-K96 PolarHBondContact O-N 2.94Å; K96-Q98 VanDerWaalsContact C-N 3.29Å; K96-Q98 PolarHBondContact O-N 3.37Å; K96-L99 PolarHBondContact O-N 3.2Å; K96-E100 WeakPolarHBondContact CE-OE1 3.32Å; K96-E100 VanDerWaalsContact O-CB 3.26Å; K96-E100 WeakPolarHBondContact O-CB 3.23Å; K96-E100 VanDerWaalsContact O-CG 3.23Å; K96-E100 WeakPolarHBondContact O-CG 3.39Å; K96-E100 PolarHBondContact O-N 3.44Å
97	Q	65.9	Low	64.8	Low	84 Å²	84	88.6 Å²	88.6	39%	0.393	47%	0.471	S	S	.	.	H	α-helix	trans	-64.4	-36.1	172.3	-80.1	-177.2	20.6	0	0	111.2	T93 D94 R101	T93-Q97 WeakPolarHBondContact O-CB 3.48Å; T93-Q97 WeakPolarHBondContact O-CG 3.27Å; T93-Q97 PolarHBondContact O-N 3.43Å; D94-Q97 PolarHBondContact O-N 2.89Å; Q97-R101 VanDerWaalsContact O-CB 3.31Å; Q97-R101 WeakPolarHBondContact O-CB 3.24Å; Q97-R101 WeakPolarHBondContact O-CG 3.43Å; Q97-R101 PolarHBondContact O-N 3.47Å
98	Q	70.3	Confident	65.7	Low	87 Å²	87	85 Å²	85	41%	0.407	45%	0.448	S	S	.	.	H	α-helix	trans	-69.8	-41.9	175.7	-169.7	62.7	24.7	0	0	110.7	D94 L95 K96 R101 D102	D94-Q98 WeakPolarHBondContact O-CA 3.28Å; D94-Q98 WeakPolarHBondContact O-CB 3.35Å; D94-Q98 PolarHBondContact O-N 3.43Å; L95-Q98 PolarHBondContact O-N 2.89Å; K96-Q98 VanDerWaalsContact C-N 3.29Å; K96-Q98 PolarHBondContact O-N 3.37Å; Q98-R101 CarbonylContact O-C 3.59Å; Q98-R101 WeakPolarHBondContact O-CB 3.41Å; Q98-R101 PolarHBondContact O-N 2.9Å; Q98-D102 PolarHBondContact NE2-OD1 2.82Å; Q98-D102 VanDerWaalsContact O-CB 3.25Å; Q98-D102 WeakPolarHBondContact O-CB 3.3Å; Q98-D102 PolarHBondContact O-N 3.43Å
99	L	69.3	Low	67	Low	123 Å²	123	86.8 Å²	86.8	64%	0.644	45%	0.453	S	S	*	.	H	α-helix	trans	-67.9	-36.1	175	-173.7	68.5	0	0	0	111.7	L95 K96 S103	L95-L99 WeakPolarHBondContact O-CB 3.31Å; L95-L99 PolarHBondContact O-N 3.17Å; K96-L99 PolarHBondContact O-N 3.2Å; L99-S103 WeakPolarHBondContact O-CA 3.4Å; L99-S103 WeakPolarHBondContact O-CB 3.41Å; L99-S103 PolarHBondContact O-N 2.8Å
100	E	68.2	Low	68.4	Low	107 Å²	107	89.4 Å²	89.4	50%	0.5	46%	0.458	S	S	.	.	H	α-helix	trans	-67.5	-41.9	172	-77.4	173.4	-175.6	0	0	110.8	K96 S103 V104	K96-E100 WeakPolarHBondContact CE-OE1 3.32Å; K96-E100 VanDerWaalsContact O-CB 3.26Å; K96-E100 WeakPolarHBondContact O-CB 3.23Å; K96-E100 VanDerWaalsContact O-CG 3.23Å; K96-E100 WeakPolarHBondContact O-CG 3.39Å; K96-E100 PolarHBondContact O-N 3.44Å; E100-S103 PolarHBondContact O-N 2.89Å; E100-V104 WeakPolarHBondContact O-CB 3.42Å; E100-V104 VanDerWaalsContact O-CG2 3.24Å; E100-V104 WeakPolarHBondContact O-CG2 3.25Å; E100-V104 PolarHBondContact O-N 3.39Å
101	R	68.1	Low	69.2	Low	126 Å²	126	89.1 Å²	89.1	48%	0.475	45%	0.449	S	S	.	.	H	α-helix	trans	-62	-48.1	172.1	-77.5	175.4	-165.4	115.2	9.6	111.2	Q97 Q98 S103 V104 V105	Q97-R101 VanDerWaalsContact O-CB 3.31Å; Q97-R101 WeakPolarHBondContact O-CB 3.24Å; Q97-R101 WeakPolarHBondContact O-CG 3.43Å; Q97-R101 PolarHBondContact O-N 3.47Å; Q98-R101 CarbonylContact O-C 3.59Å; Q98-R101 WeakPolarHBondContact O-CB 3.41Å; Q98-R101 PolarHBondContact O-N 2.9Å; R101-S103 VanDerWaalsContact C-N 3.34Å; R101-S103 PolarHBondContact O-N 2.86Å; R101-V104 PolarHBondContact O-N 3.43Å; R101-V105 WeakPolarHBondContact O-CB 3.32Å; R101-V105 VanDerWaalsContact O-CG2 3.26Å; R101-V105 WeakPolarHBondContact O-CG2 3.46Å; R101-V105 PolarHBondContact O-N 2.88Å
102	D	73.4	Confident	70.2	Confident	72 Å²	72	86.1 Å²	86.1	39%	0.385	44%	0.437	S	S	.	.	H	α-helix	trans	-68.5	-34.2	-179.1	-68.1	-14.6	0	0	0	111.1	Q98 V105 L106	Q98-D102 PolarHBondContact NE2-OD1 2.82Å; Q98-D102 VanDerWaalsContact O-CB 3.25Å; Q98-D102 WeakPolarHBondContact O-CB 3.3Å; Q98-D102 PolarHBondContact O-N 3.43Å; D102-V105 PolarHBondContact O-N 3.25Å; D102-L106 VanDerWaalsContact O-CB 3.27Å; D102-L106 WeakPolarHBondContact O-CB 3.43Å; D102-L106 VanDerWaalsContact O-CG 3.28Å; D102-L106 WeakPolarHBondContact O-CG 3.21Å; D102-L106 PolarHBondContact O-N 3.49Å
103	S	73.1	Confident	71.5	Confident	71 Å²	71	85.5 Å²	85.5	50%	0.497	44%	0.436	S	S	.	.	H	α-helix	trans	-67.3	-42.5	172.4	-178.8	0	0	0	0	112	L99 E100 R101 L106 S107	L99-S103 WeakPolarHBondContact O-CA 3.4Å; L99-S103 WeakPolarHBondContact O-CB 3.41Å; L99-S103 PolarHBondContact O-N 2.8Å; E100-S103 PolarHBondContact O-N 2.89Å; R101-S103 VanDerWaalsContact C-N 3.34Å; R101-S103 PolarHBondContact O-N 2.86Å; S103-L106 PolarHBondContact O-N 2.96Å; S103-S107 WeakPolarHBondContact O-CB 3.3Å; S103-S107 PolarHBondContact O-N 3.5Å; S103-S107 PolarHBondContact O-OG 2.85Å
104	V	70.6	Confident	72.4	Confident	69 Å²	69	86.7 Å²	86.7	42%	0.418	44%	0.437	S	S	.	.	H	α-helix	trans	-61.6	-48.8	172.2	170.5	0	0	0	0	109.5	E100 R101 L106 S107 L108	E100-V104 WeakPolarHBondContact O-CB 3.42Å; E100-V104 VanDerWaalsContact O-CG2 3.24Å; E100-V104 WeakPolarHBondContact O-CG2 3.25Å; E100-V104 PolarHBondContact O-N 3.39Å; R101-V104 PolarHBondContact O-N 3.43Å; V104-L106 PolarHBondContact O-N 2.88Å; V104-S107 PolarHBondContact O-N 3.44Å; V104-S107 PolarHBondContact O-OG 3.05Å; V104-L108 HydrophobicContact CG1-CD1 4.1Å; V104-L108 HydrophobicContact CG1-CG 4.35Å; V104-L108 VanDerWaalsContact O-CG 3.25Å; V104-L108 WeakPolarHBondContact O-CG 3.32Å; V104-L108 PolarHBondContact O-N 3.45Å
105	V	71.3	Confident	73.3	Confident	73 Å²	73	82.6 Å²	82.6	44%	0.442	42%	0.415	S	S	.	.	H	α-helix	trans	-59.2	-44.5	177	171.2	0	0	0	0	111.6	R101 D102 S107 L108 L109	R101-V105 WeakPolarHBondContact O-CB 3.32Å; R101-V105 VanDerWaalsContact O-CG2 3.26Å; R101-V105 WeakPolarHBondContact O-CG2 3.46Å; R101-V105 PolarHBondContact O-N 2.88Å; D102-V105 PolarHBondContact O-N 3.25Å; V105-S107 PolarHBondContact O-N 3.34Å; V105-L108 WeakPolarHBondContact O-CB 3.32Å; V105-L108 PolarHBondContact O-N 3.08Å; V105-L108 VanDerWaalsContact O-N 3.17Å; V105-L109 HydrophobicContact CG1-CD1 3.97Å; V105-L109 HydrophobicContact CG1-CG 4.31Å; V105-L109 WeakPolarHBondContact O-CG 3.33Å; V105-L109 PolarHBondContact O-N 3.3Å
106	L	74.6	Confident	73.9	Confident	116 Å²	116	79.6 Å²	79.6	61%	0.607	40%	0.404	S	S	*	.	H	α-helix	trans	-62.1	-42.4	175.9	-82.4	165.8	0	0	0	112	D102 S103 V104 L108 L109 K110	D102-L106 VanDerWaalsContact O-CB 3.27Å; D102-L106 WeakPolarHBondContact O-CB 3.43Å; D102-L106 VanDerWaalsContact O-CG 3.28Å; D102-L106 WeakPolarHBondContact O-CG 3.21Å; D102-L106 PolarHBondContact O-N 3.49Å; S103-L106 PolarHBondContact O-N 2.96Å; V104-L106 PolarHBondContact O-N 2.88Å; L106-L108 VanDerWaalsContact C-N 3.28Å; L106-L108 PolarHBondContact O-N 3.49Å; L106-L109 PolarHBondContact O-N 3.23Å; L106-K110 WeakPolarHBondContact O-CB 3.49Å; L106-K110 PolarHBondContact O-N 2.91Å
107	S	75.6	Confident	74.7	Confident	39 Å²	39	76.7 Å²	76.7	27%	0.273	40%	0.396	S	S	.	.	H	α-helix	trans	-65.8	-32.7	175.6	76.2	0	0	0	0	112.4	S103 V104 V105 Q111 R151	S103-S107 WeakPolarHBondContact O-CB 3.3Å; S103-S107 PolarHBondContact O-N 3.5Å; S103-S107 PolarHBondContact O-OG 2.85Å; V104-S107 PolarHBondContact O-N 3.44Å; V104-S107 PolarHBondContact O-OG 3.05Å; V105-S107 PolarHBondContact O-N 3.34Å; S107-Q111 WeakPolarHBondContact O-CG 3.38Å; S107-Q111 PolarHBondContact O-N 3.43Å; S107-Q111 VanDerWaalsContact O-N 3.08Å; S107-R151 PolarHBondContact OG-NH1 3.44Å
108	L	72	Confident	75.5	Confident	20 Å²	20	73 Å²	73	11%	0.105	38%	0.379	C	S	.	.	H	α-helix	trans	-71.3	-42.6	174.6	-69.5	-180	0	0	0	111.9	V104 V105 L106 K110 Q111 L112 L148 F154	V104-L108 HydrophobicContact CG1-CD1 4.1Å; V104-L108 HydrophobicContact CG1-CG 4.35Å; V104-L108 VanDerWaalsContact O-CG 3.25Å; V104-L108 WeakPolarHBondContact O-CG 3.32Å; V104-L108 PolarHBondContact O-N 3.45Å; V105-L108 WeakPolarHBondContact O-CB 3.32Å; V105-L108 PolarHBondContact O-N 3.08Å; V105-L108 VanDerWaalsContact O-N 3.17Å; L106-L108 VanDerWaalsContact C-N 3.28Å; L106-L108 PolarHBondContact O-N 3.49Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.32Å; L108-Q111 PolarHBondContact O-N 3.43Å; L108-L112 WeakPolarHBondContact O-CB 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.45Å; L108-L112 PolarHBondContact O-N 2.87Å; L108-L148 HydrophobicContact CD2-CD2 4.17Å; L108-F154 HydrophobicContact CD1-CE2 4.24Å; L108-F154 HydrophobicContact CD2-CD2 4.46Å; L108-F154 HydrophobicContact CD2-CE2 3.71Å; L108-F154 HydrophobicContact CG-CE2 4.37Å
109	L	75.3	Confident	76.1	Confident	100 Å²	100	69.7 Å²	69.7	52%	0.524	36%	0.364	S	S	.	.	H	α-helix	trans	-62.9	-39.5	174.8	-71.8	172.5	0	0	0	111	V105 L106 L112 Q113	V105-L109 HydrophobicContact CG1-CD1 3.97Å; V105-L109 HydrophobicContact CG1-CG 4.31Å; V105-L109 WeakPolarHBondContact O-CG 3.33Å; V105-L109 PolarHBondContact O-N 3.3Å; L106-L109 PolarHBondContact O-N 3.23Å; L109-L112 PolarHBondContact O-N 3.08Å; L109-Q113 WeakPolarHBondContact O-CB 3.46Å; L109-Q113 PolarHBondContact O-N 2.98Å
110	K	78.6	Confident	76.6	Confident	125 Å²	125	69.2 Å²	69.2	54%	0.543	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-43.7	174.3	-169.1	179.4	178	-175.3	0	112.1	L106 L108 L112 Q113 E114	L106-K110 WeakPolarHBondContact O-CB 3.49Å; L106-K110 PolarHBondContact O-N 2.91Å; L108-K110 VanDerWaalsContact C-N 3.31Å; L108-K110 PolarHBondContact O-N 3.32Å; K110-L112 PolarHBondContact O-N 3.16Å; K110-Q113 WeakPolarHBondContact O-CB 3.19Å; K110-Q113 PolarHBondContact O-N 3.46Å; K110-E114 WeakPolarHBondContact CE-OE1 3.46Å; K110-E114 WeakPolarHBondContact O-CG 3.49Å; K110-E114 PolarHBondContact O-N 2.86Å
111	Q	77.1	Confident	77.4	Confident	22 Å²	22	68.4 Å²	68.4	10%	0.103	36%	0.355	C	S	.	.	H	α-helix	trans	-67	-33.7	175.9	-74.4	-178.9	-23.2	0	0	113.2	S107 L108 F115 L148	S107-Q111 WeakPolarHBondContact O-CG 3.38Å; S107-Q111 PolarHBondContact O-N 3.43Å; S107-Q111 VanDerWaalsContact O-N 3.08Å; L108-Q111 PolarHBondContact O-N 3.43Å; Q111-F115 WeakPolarHBondContact O-CB 3.33Å; Q111-F115 PolarHBondContact O-N 3.37Å; Q111-L148 HydrophobicContact CB-CD2 3.74Å; Q111-L148 HydrophobicContact CB-CG 4.25Å
112	L	77.6	Confident	78.4	Confident	49 Å²	49	62.4 Å²	62.4	26%	0.257	33%	0.332	S	S	.	.	H	α-helix	trans	-68.8	-38.1	172	-79.7	164.9	0	0	0	111.8	L108 L109 K110 F115 S116 F154 L162	L108-L112 WeakPolarHBondContact O-CB 3.31Å; L108-L112 WeakPolarHBondContact O-CG 3.45Å; L108-L112 PolarHBondContact O-N 2.87Å; L109-L112 PolarHBondContact O-N 3.08Å; K110-L112 PolarHBondContact O-N 3.16Å; L112-F115 PolarHBondContact O-N 2.98Å; L112-S116 PolarHBondContact O-N 3.01Å; L112-F154 HydrophobicContact CD1-CE1 4.27Å; L112-F154 HydrophobicContact CD1-CZ 3.93Å; L112-F154 HydrophobicContact CD2-CZ 4.42Å; L112-F154 HydrophobicContact CG-CZ 4.23Å; L112-L162 HydrophobicContact CD2-CD1 3.58Å
113	Q	79.3	Confident	78.8	Confident	128 Å²	128	61.8 Å²	61.8	60%	0.598	33%	0.329	S	S	*	.	H	α-helix	trans	-63.6	-49.1	173.4	-175.7	-177.7	9.2	0	0	110.6	L109 K110 F115 S116 T117	L109-Q113 WeakPolarHBondContact O-CB 3.46Å; L109-Q113 PolarHBondContact O-N 2.98Å; K110-Q113 WeakPolarHBondContact O-CB 3.19Å; K110-Q113 PolarHBondContact O-N 3.46Å; Q113-F115 VanDerWaalsContact C-N 3.28Å; Q113-F115 PolarHBondContact O-N 2.96Å; Q113-S116 PolarHBondContact O-N 3.36Å; Q113-S116 VanDerWaalsContact O-N 3.1Å; Q113-T117 WeakPolarHBondContact O-CB 3.34Å; Q113-T117 PolarHBondContact O-N 2.95Å; Q113-T117 PolarHBondContact O-OG1 3.21Å; Q113-T117 VanDerWaalsContact O-OG1 3.05Å
114	E	82.4	Confident	79.3	Confident	86 Å²	86	62 Å²	62	40%	0.402	33%	0.329	S	S	.	.	H	α-helix	trans	-56.7	-40.8	175.6	-73.5	166.3	-174.3	0	0	111.6	K110 A118	K110-E114 WeakPolarHBondContact CE-OE1 3.46Å; K110-E114 WeakPolarHBondContact O-CG 3.49Å; K110-E114 PolarHBondContact O-N 2.86Å; E114-A118 VanDerWaalsContact O-CB 3.31Å; E114-A118 WeakPolarHBondContact O-CB 3.47Å; E114-A118 PolarHBondContact O-N 3.25Å
115	F	84.2	Confident	80	Confident	7 Å²	7	59 Å²	59	3%	0.031	31%	0.312	C	S	.	.	H	α-helix	trans	-64.4	-44.7	173.7	-178.8	-87.6	0	0	0	112.9	Q111 L112 Q113 A118 I119 A141 C144 L145 L162 L166	Q111-F115 WeakPolarHBondContact O-CB 3.33Å; Q111-F115 PolarHBondContact O-N 3.37Å; L112-F115 PolarHBondContact O-N 2.98Å; Q113-F115 VanDerWaalsContact C-N 3.28Å; Q113-F115 PolarHBondContact O-N 2.96Å; F115-A118 PolarHBondContact O-N 3.49Å; F115-I119 HydrophobicContact CD1-CD1 4.08Å; F115-I119 HydrophobicContact CE1-CD1 3.3Å; F115-I119 HydrophobicContact CE1-CG1 4.15Å; F115-I119 HydrophobicContact CE2-CD1 4.39Å; F115-I119 HydrophobicContact CZ-CD1 3.5Å; F115-I119 VanDerWaalsContact CZ-CD1 3.5Å; F115-I119 HydrophobicContact CZ-CG1 4.37Å; F115-I119 PolarHBondContact O-N 3.03Å; F115-I119 VanDerWaalsContact O-N 3.08Å; F115-A141 HydrophobicContact CD2-CB 4Å; F115-A141 WeakPolarHBondContact CD2-O 3.37Å; F115-A141 HydrophobicContact CE2-CB 4.03Å; F115-C144 HydrophobicContact CB-CB 4.4Å; F115-C144 HydrophobicContact CD2-CB 4.49Å; F115-L145 HydrophobicContact CD2-CB 4.46Å; F115-L145 HydrophobicContact CE2-CB 4.2Å; F115-L162 HydrophobicContact CD1-CD2 3.85Å; F115-L162 HydrophobicContact CE1-CB 4.31Å; F115-L162 HydrophobicContact CE1-CD2 3.49Å; F115-L162 VanDerWaalsContact CE1-CD2 3.49Å; F115-L162 HydrophobicContact CE1-CG 4.44Å; F115-L162 HydrophobicContact CZ-CB 4.19Å; F115-L162 HydrophobicContact CZ-CD2 4.22Å; F115-L166 HydrophobicContact CE2-CD1 3.82Å; F115-L166 HydrophobicContact CZ-CB 4.35Å; F115-L166 HydrophobicContact CZ-CD1 4.39Å
116	S	78	Confident	80.5	Confident	55 Å²	55	56.7 Å²	56.7	39%	0.385	30%	0.297	S	S	.	.	H	α-helix	trans	-64.2	-45.3	178.3	-164.6	0	0	0	0	111.3	L112 Q113 A118 I119 E120	L112-S116 PolarHBondContact O-N 3.01Å; Q113-S116 PolarHBondContact O-N 3.36Å; Q113-S116 VanDerWaalsContact O-N 3.1Å; S116-A118 PolarHBondContact O-N 3.44Å; S116-I119 PolarHBondContact O-N 3.33Å; S116-E120 WeakPolarHBondContact O-CG 3.43Å; S116-E120 PolarHBondContact O-N 2.83Å; S116-E120 PolarHBondContact OG-OE1 3.19Å
117	T	83.2	Confident	80.8	Confident	52 Å²	52	56.8 Å²	56.8	32%	0.319	30%	0.302	S	S	.	.	H	α-helix	trans	-61.1	-44.5	177.1	-58.4	0	0	0	0	111	Q113 I119 E120 E121	Q113-T117 WeakPolarHBondContact O-CB 3.34Å; Q113-T117 PolarHBondContact O-N 2.95Å; Q113-T117 PolarHBondContact O-OG1 3.21Å; Q113-T117 VanDerWaalsContact O-OG1 3.05Å; T117-I119 VanDerWaalsContact C-N 3.31Å; T117-I119 PolarHBondContact O-N 2.95Å; T117-E120 PolarHBondContact O-N 3.41Å; T117-E121 HydrophobicContact CG2-CG 4.32Å; T117-E121 WeakPolarHBondContact O-CB 3.45Å; T117-E121 WeakPolarHBondContact O-CG 3.12Å; T117-E121 PolarHBondContact O-N 2.86Å
118	A	83.8	Confident	81.1	Confident	5 Å²	5	60.2 Å²	60.2	4%	0.041	31%	0.314	C	S	.	.	H	α-helix	trans	-62	-35.9	175.9	0	0	0	0	0	112.9	E114 F115 S116 Y122 A141	E114-A118 VanDerWaalsContact O-CB 3.31Å; E114-A118 WeakPolarHBondContact O-CB 3.47Å; E114-A118 PolarHBondContact O-N 3.25Å; F115-A118 PolarHBondContact O-N 3.49Å; S116-A118 PolarHBondContact O-N 3.44Å; A118-Y122 VanDerWaalsContact O-CB 3.24Å; A118-Y122 WeakPolarHBondContact O-CB 3.43Å; A118-Y122 PolarHBondContact O-N 3.37Å; A118-A141 HydrophobicContact CB-CB 3.99Å
119	I	81.7	Confident	81.3	Confident	18 Å²	18	62.7 Å²	62.7	9%	0.092	32%	0.324	C	S	.	.	H	α-helix	trans	-72	-38.6	174.5	-71.1	-166.9	0	0	0	112	F115 S116 T117 Y122 N123 A141 E165	F115-I119 HydrophobicContact CD1-CD1 4.08Å; F115-I119 HydrophobicContact CE1-CD1 3.3Å; F115-I119 HydrophobicContact CE1-CG1 4.15Å; F115-I119 HydrophobicContact CE2-CD1 4.39Å; F115-I119 HydrophobicContact CZ-CD1 3.5Å; F115-I119 VanDerWaalsContact CZ-CD1 3.5Å; F115-I119 HydrophobicContact CZ-CG1 4.37Å; F115-I119 PolarHBondContact O-N 3.03Å; F115-I119 VanDerWaalsContact O-N 3.08Å; S116-I119 PolarHBondContact O-N 3.33Å; T117-I119 VanDerWaalsContact C-N 3.31Å; T117-I119 PolarHBondContact O-N 2.95Å; I119-Y122 WeakPolarHBondContact O-CB 3.29Å; I119-Y122 PolarHBondContact O-N 3.11Å; I119-N123 VanDerWaalsContact O-CG 3.32Å; I119-N123 PolarHBondContact O-N 2.97Å; I119-N123 PolarHBondContact O-ND2 3.1Å; I119-A141 HydrophobicContact CG1-CB 4.39Å; I119-E165 HydrophobicContact CD1-CG 4.01Å
120	E	81.4	Confident	81.7	Confident	113 Å²	113	63.3 Å²	63.3	53%	0.528	32%	0.322	S	S	.	.	H	α-helix	trans	-64	-46.7	175.1	-75	169.6	-156.9	0	0	111.5	S116 T117 Y122 N123 C124	S116-E120 WeakPolarHBondContact O-CG 3.43Å; S116-E120 PolarHBondContact O-N 2.83Å; S116-E120 PolarHBondContact OG-OE1 3.19Å; T117-E120 PolarHBondContact O-N 3.41Å; E120-Y122 VanDerWaalsContact C-N 3.33Å; E120-Y122 PolarHBondContact O-N 2.95Å; E120-N123 PolarHBondContact O-N 3.22Å; E120-C124 PolarHBondContact O-N 3.37Å; E120-C124 PolarHBondContact O-SG 3.05Å; E120-C124 VanDerWaalsContact O-SG 3.4Å
121	E	84.1	Confident	81.9	Confident	90 Å²	90	57.9 Å²	57.9	42%	0.421	30%	0.299	S	S	.	.	H	α-helix	trans	-62.8	-39.3	175.5	-71.7	177.3	174.8	0	0	111.8	T117 C124 A125 H137	T117-E121 HydrophobicContact CG2-CG 4.32Å; T117-E121 WeakPolarHBondContact O-CB 3.45Å; T117-E121 WeakPolarHBondContact O-CG 3.12Å; T117-E121 PolarHBondContact O-N 2.86Å; E121-C124 PolarHBondContact O-N 3.1Å; E121-A125 WeakPolarHBondContact O-CB 3.25Å; E121-A125 PolarHBondContact O-N 3.37Å; E121-H137 IonicContact OE2-CE1 2.93Å; E121-H137 PolarHBondContact OE2-CE1 3.44Å; E121-H137 IonicContact OE2-ND1 2.86Å; E121-H137 PolarHBondContact OE2-ND1 3.3Å; E121-H137 IonicContact OE2-NE2 3.7Å
122	Y	88.8	Confident	82.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-58.2	-48.8	170.1	158.7	-99.4	0	0	0	112.2	A118 I119 E120 C124 A125 L126 G134 L138 Q169 I173	A118-Y122 VanDerWaalsContact O-CB 3.24Å; A118-Y122 WeakPolarHBondContact O-CB 3.43Å; A118-Y122 PolarHBondContact O-N 3.37Å; I119-Y122 WeakPolarHBondContact O-CB 3.29Å; I119-Y122 PolarHBondContact O-N 3.11Å; E120-Y122 VanDerWaalsContact C-N 3.33Å; E120-Y122 PolarHBondContact O-N 2.95Å; Y122-C124 VanDerWaalsContact C-N 3.32Å; Y122-C124 PolarHBondContact O-N 3.28Å; Y122-A125 PolarHBondContact O-N 2.89Å; Y122-L126 HydrophobicContact CE1-CD2 4.43Å; Y122-L126 HydrophobicContact CE2-CB 4.43Å; Y122-L126 WeakPolarHBondContact O-CB 3.39Å; Y122-L126 PolarHBondContact O-N 3.18Å; Y122-G134 WeakPolarHBondContact CD2-O 3.31Å; Y122-L138 HydrophobicContact CD1-CD2 4.34Å; Y122-L138 HydrophobicContact CD2-CD1 3.56Å; Y122-L138 HydrophobicContact CD2-CD2 4.19Å; Y122-L138 HydrophobicContact CD2-CG 3.5Å; Y122-L138 VanDerWaalsContact CD2-CG 3.5Å; Y122-L138 HydrophobicContact CE2-CD1 3.31Å; Y122-L138 HydrophobicContact CE2-CD2 4.43Å; Y122-L138 HydrophobicContact CE2-CG 3.81Å; Y122-L138 HydrophobicContact CG-CD1 4.3Å; Y122-L138 HydrophobicContact CG-CD2 4.11Å; Y122-L138 HydrophobicContact CG-CG 3.86Å; Y122-Q169 HydrophobicContact CD1-CB 4.34Å; Y122-Q169 HydrophobicContact CD1-CG 4.48Å; Y122-Q169 HydrophobicContact CE1-CB 3.76Å; Y122-Q169 HydrophobicContact CE1-CG 4.05Å; Y122-Q169 VanDerWaalsContact CE1-OE1 3.29Å; Y122-Q169 PolarHBondContact OH-O 3.08Å; Y122-Q169 VanDerWaalsContact OH-O 3.08Å; Y122-I173 HydrophobicContact CE2-CB 3.92Å; Y122-I173 HydrophobicContact CE2-CD1 4.02Å; Y122-I173 HydrophobicContact CE2-CG1 4.31Å; Y122-I173 PolarHBondContact OH-N 3.36Å
123	N	83	Confident	82.3	Confident	60 Å²	60	58.5 Å²	58.5	32%	0.321	31%	0.306	S	S	.	.	H	α-helix	trans	-62.6	-41.2	-178.8	-75.7	-42.9	0	0	0	111	I119 E120 L126 T127	I119-N123 VanDerWaalsContact O-CG 3.32Å; I119-N123 PolarHBondContact O-N 2.97Å; I119-N123 PolarHBondContact O-ND2 3.1Å; E120-N123 PolarHBondContact O-N 3.22Å; N123-L126 PolarHBondContact O-N 2.94Å; N123-T127 WeakPolarHBondContact O-CG2 3.42Å; N123-T127 PolarHBondContact O-N 2.89Å; N123-T127 VanDerWaalsContact O-N 3.08Å
124	C	83.9	Confident	82.5	Confident	74 Å²	74	52.5 Å²	52.5	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-60.1	-51	172.5	-69.8	0	0	0	0	111.3	E120 E121 Y122 L126 T127 E128	E120-C124 PolarHBondContact O-N 3.37Å; E120-C124 PolarHBondContact O-SG 3.05Å; E120-C124 VanDerWaalsContact O-SG 3.4Å; E121-C124 PolarHBondContact O-N 3.1Å; Y122-C124 VanDerWaalsContact C-N 3.32Å; Y122-C124 PolarHBondContact O-N 3.28Å; C124-L126 VanDerWaalsContact C-N 3.27Å; C124-L126 PolarHBondContact O-N 3.45Å; C124-T127 PolarHBondContact O-N 3.38Å; C124-T127 VanDerWaalsContact O-N 3.15Å; C124-T127 PolarHBondContact O-OG1 3.1Å; C124-E128 WeakPolarHBondContact O-CG 3.35Å; C124-E128 PolarHBondContact O-N 3.21Å; C124-E128 VanDerWaalsContact O-N 3.08Å
125	A	83.5	Confident	82.6	Confident	7 Å²	7	48.4 Å²	48.4	6%	0.058	26%	0.259	C	S	.	.	H	α-helix	trans	-60.1	-36.2	178.8	0	0	0	0	0	112.9	E121 Y122 E128 K129 K130	E121-A125 WeakPolarHBondContact O-CB 3.25Å; E121-A125 PolarHBondContact O-N 3.37Å; Y122-A125 PolarHBondContact O-N 2.89Å; A125-E128 CarbonylContact O-C 3.6Å; A125-E128 PolarHBondContact O-N 3Å; A125-K129 PolarHBondContact O-N 3.45Å; A125-K130 PolarHBondContact O-N 3.42Å
126	L	82.9	Confident	82.6	Confident	24 Å²	24	51.2 Å²	51.2	13%	0.126	27%	0.272	C	S	.	.	H	α-helix	trans	-65.9	-44.1	176.1	-172	71.2	0	0	0	111.4	Y122 N123 C124 E128 K129 Y131 I173 H176	Y122-L126 HydrophobicContact CE1-CD2 4.43Å; Y122-L126 HydrophobicContact CE2-CB 4.43Å; Y122-L126 WeakPolarHBondContact O-CB 3.39Å; Y122-L126 PolarHBondContact O-N 3.18Å; N123-L126 PolarHBondContact O-N 2.94Å; C124-L126 VanDerWaalsContact C-N 3.27Å; C124-L126 PolarHBondContact O-N 3.45Å; L126-E128 PolarHBondContact O-N 2.9Å; L126-K129 PolarHBondContact O-N 3.21Å; L126-Y131 HydrophobicContact CD1-CD1 4.42Å; L126-Y131 HydrophobicContact CD1-CE1 4.14Å; L126-I173 HydrophobicContact CD1-CG1 4.38Å; L126-H176 HydrophobicContact CD1-CB 4.49Å
127	T	80.7	Confident	82.9	Confident	118 Å²	118	50.5 Å²	50.5	72%	0.724	26%	0.263	S	S	*	.	H	α-helix	trans	-63.9	-30.7	176.3	59.9	0	0	0	0	112.8	N123 C124 K129	N123-T127 WeakPolarHBondContact O-CG2 3.42Å; N123-T127 PolarHBondContact O-N 2.89Å; N123-T127 VanDerWaalsContact O-N 3.08Å; C124-T127 PolarHBondContact O-N 3.38Å; C124-T127 VanDerWaalsContact O-N 3.15Å; C124-T127 PolarHBondContact O-OG1 3.1Å; T127-K129 VanDerWaalsContact C-N 3.28Å; T127-K129 PolarHBondContact O-N 3.33Å
128	E	80.8	Confident	83	Confident	111 Å²	111	48.3 Å²	48.3	52%	0.519	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.5	1.8	175.4	-65.8	-176.2	179.1	0	0	113.6	C124 A125 L126 K130	C124-E128 WeakPolarHBondContact O-CG 3.35Å; C124-E128 PolarHBondContact O-N 3.21Å; C124-E128 VanDerWaalsContact O-N 3.08Å; A125-E128 CarbonylContact O-C 3.6Å; A125-E128 PolarHBondContact O-N 3Å; L126-E128 PolarHBondContact O-N 2.9Å; E128-K130 HydrophobicContact CB-CD 4.24Å; E128-K130 HydrophobicContact CB-CG 4.13Å; E128-K130 PolarHBondContact O-N 3.08Å; E128-K130 WeakPolarHBondContact OE2-CD 3.36Å; E128-K130 WeakPolarHBondContact OE2-CE 3.49Å; E128-K130 IonicContact OE2-NZ 3.27Å; E128-K130 PolarHBondContact OE2-NZ 3.19Å
129	K	78	Confident	83	Confident	72 Å²	72	51.5 Å²	51.5	31%	0.313	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.5	24.1	-174.9	-58.5	-176.9	174.2	-173.4	0	114	A125 L126 T127 Y131 T219	A125-K129 PolarHBondContact O-N 3.45Å; L126-K129 PolarHBondContact O-N 3.21Å; T127-K129 VanDerWaalsContact C-N 3.28Å; T127-K129 PolarHBondContact O-N 3.33Å; K129-Y131 HydrophobicContact CB-CE2 4.05Å; K129-Y131 VanDerWaalsContact O-CD2 3.25Å; K129-Y131 WeakPolarHBondContact O-CD2 3.43Å; K129-Y131 PolarHBondContact O-N 3.36Å; K129-Y131 VanDerWaalsContact O-N 3.14Å; K129-T219 PolarHBondContact NZ-OG1 3.16Å
130	K	82.9	Confident	83	Confident	113 Å²	113	55 Å²	55	49%	0.491	28%	0.279	S	S	.	.			trans	-86.7	77.7	175	-65.3	177.4	179.4	161.4	0	109.6	A125 E128 V132 T133 G134	A125-K130 PolarHBondContact O-N 3.42Å; E128-K130 HydrophobicContact CB-CD 4.24Å; E128-K130 HydrophobicContact CB-CG 4.13Å; E128-K130 PolarHBondContact O-N 3.08Å; E128-K130 WeakPolarHBondContact OE2-CD 3.36Å; E128-K130 WeakPolarHBondContact OE2-CE 3.49Å; E128-K130 IonicContact OE2-NZ 3.27Å; E128-K130 PolarHBondContact OE2-NZ 3.19Å; K130-V132 PolarHBondContact O-N 3.46Å; K130-T133 WeakPolarHBondContact CB-OG1 3.47Å; K130-T133 PolarHBondContact O-OG1 2.85Å; K130-G134 PolarHBondContact O-N 3.2Å
131	Y	82.6	Confident	83.2	Confident	11 Å²	11	49.6 Å²	49.6	4%	0.043	25%	0.254	C	S	.	.	H	α-helix	trans	-66.8	-33	-170.8	-63.1	-69.6	0	0	0	114.6	L126 K129 A135 I173 H176 L177 E180 P222	L126-Y131 HydrophobicContact CD1-CD1 4.42Å; L126-Y131 HydrophobicContact CD1-CE1 4.14Å; K129-Y131 HydrophobicContact CB-CE2 4.05Å; K129-Y131 VanDerWaalsContact O-CD2 3.25Å; K129-Y131 WeakPolarHBondContact O-CD2 3.43Å; K129-Y131 PolarHBondContact O-N 3.36Å; K129-Y131 VanDerWaalsContact O-N 3.14Å; Y131-A135 WeakPolarHBondContact O-CB 3.34Å; Y131-A135 PolarHBondContact O-N 2.76Å; Y131-I173 HydrophobicContact CD1-CG1 4.46Å; Y131-H176 HydrophobicContact CE1-CB 3.9Å; Y131-L177 HydrophobicContact CD1-CD2 3.98Å; Y131-L177 HydrophobicContact CD1-CG 4.27Å; Y131-L177 HydrophobicContact CD2-CD2 4.47Å; Y131-L177 HydrophobicContact CG-CD2 3.83Å; Y131-E180 HydrophobicContact CE2-CG 3.98Å; Y131-P222 HydrophobicContact CD2-CB 4.27Å; Y131-P222 HydrophobicContact CD2-CG 4.14Å; Y131-P222 HydrophobicContact CE2-CB 4.38Å; Y131-P222 HydrophobicContact CE2-CG 3.86Å
132	V	81.7	Confident	83.2	Confident	36 Å²	36	48.9 Å²	48.9	22%	0.218	25%	0.251	C	S	.	.	H	α-helix	trans	-66.9	-49.6	179.3	179.9	0	0	0	0	110.8	K130 G134 A135 Q136 S226 L229	K130-V132 PolarHBondContact O-N 3.46Å; V132-G134 VanDerWaalsContact C-N 3.35Å; V132-G134 PolarHBondContact O-N 2.96Å; V132-A135 PolarHBondContact O-N 3.49Å; V132-Q136 WeakPolarHBondContact O-CG 3.46Å; V132-Q136 PolarHBondContact O-N 3.5Å; V132-S226 VanDerWaalsContact CG2-O 3.3Å; V132-S226 WeakPolarHBondContact CG2-O 3.37Å; V132-L229 HydrophobicContact CG2-CB 3.99Å
133	T	81.6	Confident	83	Confident	49 Å²	49	53.6 Å²	53.6	30%	0.301	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-39.1	177.7	56.2	0	0	0	0	111.1	K130 A135 Q136 H137	K130-T133 WeakPolarHBondContact CB-OG1 3.47Å; K130-T133 PolarHBondContact O-OG1 2.85Å; T133-A135 PolarHBondContact O-N 2.96Å; T133-Q136 PolarHBondContact O-N 3.23Å; T133-H137 PolarHBondContact O-CD2 3.45Å; T133-H137 PolarHBondContact O-N 2.7Å
134	G	84.6	Confident	82.9	Confident	1 Å²	1	51.7 Å²	51.7	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-60.2	-41.5	172.9	0	0	0	0	0	113.1	Y122 K130 V132 L138	Y122-G134 WeakPolarHBondContact CD2-O 3.31Å; K130-G134 PolarHBondContact O-N 3.2Å; V132-G134 VanDerWaalsContact C-N 3.35Å; V132-G134 PolarHBondContact O-N 2.96Å; G134-L138 PolarHBondContact O-N 2.89Å; G134-L138 VanDerWaalsContact O-N 3.12Å
135	A	84.4	Confident	82.7	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-38.4	175.7	0	0	0	0	0	112.4	Y131 V132 T133 L138 E139 I173 A230 V233 L234	Y131-A135 WeakPolarHBondContact O-CB 3.34Å; Y131-A135 PolarHBondContact O-N 2.76Å; V132-A135 PolarHBondContact O-N 3.49Å; T133-A135 PolarHBondContact O-N 2.96Å; A135-L138 PolarHBondContact O-N 2.91Å; A135-E139 PolarHBondContact O-N 2.75Å; A135-I173 HydrophobicContact CB-CD1 4.14Å; A135-A230 HydrophobicContact CB-CB 4.24Å; A135-V233 HydrophobicContact CB-CB 4.05Å; A135-V233 HydrophobicContact CB-CG1 3.89Å; A135-L234 HydrophobicContact CB-CD1 4.41Å; A135-L234 HydrophobicContact CB-CD2 4.21Å; A135-L234 HydrophobicContact CB-CG 4Å
136	Q	83.9	Confident	82.6	Confident	66 Å²	66	54.5 Å²	54.5	31%	0.308	27%	0.265	S	S	.	.	H	α-helix	trans	-63.5	-48	175.7	-72	169.1	-20.3	0	0	111.9	V132 T133 L138 E139 E140	V132-Q136 WeakPolarHBondContact O-CG 3.46Å; V132-Q136 PolarHBondContact O-N 3.5Å; T133-Q136 PolarHBondContact O-N 3.23Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 2.86Å; Q136-E139 WeakPolarHBondContact O-CA 3.42Å; Q136-E139 WeakPolarHBondContact O-CB 3.41Å; Q136-E139 PolarHBondContact O-N 3.04Å; Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 2.95Å
137	H	84.5	Confident	82.4	Confident	41 Å²	41	57.8 Å²	57.8	19%	0.19	28%	0.282	C	S	.	.	H	α-helix	trans	-62.4	-34.4	177	-68.3	-55.4	0	0	0	112.6	E121 T133 E140 A141	E121-H137 IonicContact OE2-CE1 2.93Å; E121-H137 PolarHBondContact OE2-CE1 3.44Å; E121-H137 IonicContact OE2-ND1 2.86Å; E121-H137 PolarHBondContact OE2-ND1 3.3Å; E121-H137 IonicContact OE2-NE2 3.7Å; T133-H137 PolarHBondContact O-CD2 3.45Å; T133-H137 PolarHBondContact O-N 2.7Å; H137-E140 IonicContact ND1-OE2 3.14Å; H137-E140 PolarHBondContact ND1-OE2 2.9Å; H137-E140 PolarHBondContact O-N 2.85Å; H137-A141 WeakPolarHBondContact O-CB 3.12Å; H137-A141 PolarHBondContact O-N 3.41Å
138	L	84.9	Confident	82.1	Confident	6 Å²	6	52.2 Å²	52.2	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-67.3	-36.5	171.2	-81.9	173.5	0	0	0	112.9	Y122 G134 A135 Q136 A141 Q142 Q169 I173 L234	Y122-L138 HydrophobicContact CD1-CD2 4.34Å; Y122-L138 HydrophobicContact CD2-CD1 3.56Å; Y122-L138 HydrophobicContact CD2-CD2 4.19Å; Y122-L138 HydrophobicContact CD2-CG 3.5Å; Y122-L138 VanDerWaalsContact CD2-CG 3.5Å; Y122-L138 HydrophobicContact CE2-CD1 3.31Å; Y122-L138 HydrophobicContact CE2-CD2 4.43Å; Y122-L138 HydrophobicContact CE2-CG 3.81Å; Y122-L138 HydrophobicContact CG-CD1 4.3Å; Y122-L138 HydrophobicContact CG-CD2 4.11Å; Y122-L138 HydrophobicContact CG-CG 3.86Å; G134-L138 PolarHBondContact O-N 2.89Å; G134-L138 VanDerWaalsContact O-N 3.12Å; A135-L138 PolarHBondContact O-N 2.91Å; Q136-L138 VanDerWaalsContact C-N 3.29Å; Q136-L138 PolarHBondContact O-N 2.86Å; L138-A141 PolarHBondContact O-N 3.21Å; L138-Q142 WeakPolarHBondContact O-CB 3.42Å; L138-Q142 PolarHBondContact O-N 3.02Å; L138-Q169 HydrophobicContact CD2-CB 3.82Å; L138-I173 HydrophobicContact CD1-CB 4.11Å; L138-I173 HydrophobicContact CD1-CD1 4.25Å; L138-I173 HydrophobicContact CD1-CG2 3.55Å; L138-L234 HydrophobicContact CD1-CD2 4.43Å
139	E	83.4	Confident	81.7	Confident	71 Å²	71	52.8 Å²	52.8	33%	0.332	25%	0.249	S	C	.	.	H	α-helix	trans	-66.2	-39.9	174.2	-157.7	-152	167.9	0	0	111.2	A135 Q136 Q142 K143 V233	A135-E139 PolarHBondContact O-N 2.75Å; Q136-E139 WeakPolarHBondContact O-CA 3.42Å; Q136-E139 WeakPolarHBondContact O-CB 3.41Å; Q136-E139 PolarHBondContact O-N 3.04Å; E139-Q142 CarbonylContact O-C 3.59Å; E139-Q142 WeakPolarHBondContact O-CB 3.39Å; E139-Q142 PolarHBondContact O-N 2.93Å; E139-K143 WeakPolarHBondContact O-CG 3.46Å; E139-K143 PolarHBondContact O-N 3.34Å; E139-K143 WeakPolarHBondContact OE1-CE 3.35Å; E139-K143 IonicContact OE1-NZ 3.16Å; E139-K143 PolarHBondContact OE1-NZ 3.27Å; E139-K143 IonicContact OE2-NZ 2.8Å; E139-K143 PolarHBondContact OE2-NZ 3.36Å; E139-V233 HydrophobicContact CB-CG1 4.27Å
140	E	82.8	Confident	81.5	Confident	91 Å²	91	53.5 Å²	53.5	43%	0.425	26%	0.263	S	S	.	.	H	α-helix	trans	-62.2	-46.4	173.1	-71.3	174	170.4	0	0	111.8	Q136 H137 Q142 K143 C144	Q136-E140 WeakPolarHBondContact O-CG 3.41Å; Q136-E140 PolarHBondContact O-N 2.95Å; H137-E140 IonicContact ND1-OE2 3.14Å; H137-E140 PolarHBondContact ND1-OE2 2.9Å; H137-E140 PolarHBondContact O-N 2.85Å; E140-Q142 PolarHBondContact O-N 3.48Å; E140-K143 WeakPolarHBondContact O-CB 3.4Å; E140-K143 PolarHBondContact O-N 2.92Å; E140-K143 VanDerWaalsContact O-N 3.16Å; E140-C144 PolarHBondContact O-N 3.16Å; E140-C144 PolarHBondContact O-SG 3.12Å
141	A	83.9	Confident	80.7	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-59	-37.8	172.6	0	0	0	0	0	111.5	F115 A118 I119 H137 L138 C144 L145 L166	F115-A141 HydrophobicContact CD2-CB 4Å; F115-A141 WeakPolarHBondContact CD2-O 3.37Å; F115-A141 HydrophobicContact CE2-CB 4.03Å; A118-A141 HydrophobicContact CB-CB 3.99Å; I119-A141 HydrophobicContact CG1-CB 4.39Å; H137-A141 WeakPolarHBondContact O-CB 3.12Å; H137-A141 PolarHBondContact O-N 3.41Å; L138-A141 PolarHBondContact O-N 3.21Å; A141-C144 PolarHBondContact O-N 2.93Å; A141-L145 WeakPolarHBondContact O-CB 3.47Å; A141-L145 PolarHBondContact O-N 2.96Å; A141-L166 HydrophobicContact CB-CD1 4.01Å
142	Q	84.4	Confident	79.5	Confident	76 Å²	76	62.5 Å²	62.5	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-68.5	-39.2	176.1	-167.5	-178.8	0.8	0	0	112.3	L138 E139 E140 L145 K146 L166	L138-Q142 WeakPolarHBondContact O-CB 3.42Å; L138-Q142 PolarHBondContact O-N 3.02Å; E139-Q142 CarbonylContact O-C 3.59Å; E139-Q142 WeakPolarHBondContact O-CB 3.39Å; E139-Q142 PolarHBondContact O-N 2.93Å; E140-Q142 PolarHBondContact O-N 3.48Å; Q142-L145 PolarHBondContact O-N 3.45Å; Q142-K146 WeakPolarHBondContact O-CG 3.24Å; Q142-K146 PolarHBondContact O-N 3.05Å; Q142-L166 HydrophobicContact CB-CD1 4.01Å; Q142-L166 HydrophobicContact CB-CD2 4.48Å; Q142-L166 HydrophobicContact CG-CD2 4.36Å
143	K	84	Confident	78.2	Confident	99 Å²	99	65.9 Å²	65.9	43%	0.43	32%	0.324	S	S	.	.	H	α-helix	trans	-62.3	-45.8	173.2	-73.6	166.2	-175.8	158	0	110.5	E139 E140 L145 K146 L147	E139-K143 WeakPolarHBondContact O-CG 3.46Å; E139-K143 PolarHBondContact O-N 3.34Å; E139-K143 WeakPolarHBondContact OE1-CE 3.35Å; E139-K143 IonicContact OE1-NZ 3.16Å; E139-K143 PolarHBondContact OE1-NZ 3.27Å; E139-K143 IonicContact OE2-NZ 2.8Å; E139-K143 PolarHBondContact OE2-NZ 3.36Å; E140-K143 WeakPolarHBondContact O-CB 3.4Å; E140-K143 PolarHBondContact O-N 2.92Å; E140-K143 VanDerWaalsContact O-N 3.16Å; K143-L145 PolarHBondContact O-N 3.47Å; K143-K146 PolarHBondContact O-N 2.88Å; K143-L147 WeakPolarHBondContact O-CG 3.4Å; K143-L147 PolarHBondContact O-N 3.43Å; K143-L147 VanDerWaalsContact O-N 3.1Å
144	C	81.6	Confident	77.2	Confident	19 Å²	19	65.4 Å²	65.4	13%	0.128	32%	0.318	C	S	.	.	H	α-helix	trans	-58.9	-45.4	175	-65	0	0	0	0	111.7	F115 E140 A141 K146 L147 L148	F115-C144 HydrophobicContact CB-CB 4.4Å; F115-C144 HydrophobicContact CD2-CB 4.49Å; E140-C144 PolarHBondContact O-N 3.16Å; E140-C144 PolarHBondContact O-SG 3.12Å; A141-C144 PolarHBondContact O-N 2.93Å; C144-K146 PolarHBondContact O-N 3.01Å; C144-L147 WeakPolarHBondContact O-CB 3.34Å; C144-L147 PolarHBondContact O-N 3.41Å; C144-L148 WeakPolarHBondContact O-CG 3.24Å; C144-L148 PolarHBondContact O-N 3.28Å
145	L	80.8	Confident	76.1	Confident	7 Å²	7	70.3 Å²	70.3	4%	0.037	34%	0.344	C	S	.	.	H	α-helix	trans	-64.3	-35.8	177.4	-172.2	66.8	0	0	0	113	F115 A141 Q142 K143 L148 K149 L159 L162 L166	F115-L145 HydrophobicContact CD2-CB 4.46Å; F115-L145 HydrophobicContact CE2-CB 4.2Å; A141-L145 WeakPolarHBondContact O-CB 3.47Å; A141-L145 PolarHBondContact O-N 2.96Å; Q142-L145 PolarHBondContact O-N 3.45Å; K143-L145 PolarHBondContact O-N 3.47Å; L145-L148 PolarHBondContact O-N 3.13Å; L145-K149 WeakPolarHBondContact O-CG 3.4Å; L145-K149 PolarHBondContact O-N 2.92Å; L145-L159 HydrophobicContact CD1-CD2 4.28Å; L145-L162 HydrophobicContact CD1-CB 3.99Å; L145-L166 HydrophobicContact CD2-CB 4.47Å; L145-L166 HydrophobicContact CD2-CD1 4.29Å
146	K	80.8	Confident	75	Confident	133 Å²	133	76.3 Å²	76.3	58%	0.578	38%	0.375	S	S	*	.	H	α-helix	trans	-64.2	-40.3	173.9	-75.3	175.3	-177.1	174.5	0	111.6	Q142 K143 C144 L148 K149 S150	Q142-K146 WeakPolarHBondContact O-CG 3.24Å; Q142-K146 PolarHBondContact O-N 3.05Å; K143-K146 PolarHBondContact O-N 2.88Å; C144-K146 PolarHBondContact O-N 3.01Å; K146-L148 VanDerWaalsContact C-N 3.35Å; K146-K149 PolarHBondContact O-N 2.94Å; K146-S150 PolarHBondContact O-N 3.17Å
147	L	79.3	Confident	74.3	Confident	94 Å²	94	80.6 Å²	80.6	49%	0.492	39%	0.393	S	S	.	.	H	α-helix	trans	-67.3	-34	175.2	-66.8	171.4	0	0	0	112.5	K143 C144 S150	K143-L147 WeakPolarHBondContact O-CG 3.4Å; K143-L147 PolarHBondContact O-N 3.43Å; K143-L147 VanDerWaalsContact O-N 3.1Å; C144-L147 WeakPolarHBondContact O-CB 3.34Å; C144-L147 PolarHBondContact O-N 3.41Å; L147-S150 PolarHBondContact O-OG 3.04Å
148	L	73.9	Confident	73.6	Confident	0 Å²	0	82.5 Å²	82.5	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-70.2	-37	174.2	-69.6	166.3	0	0	0	111.9	L108 Q111 C144 L145 K146 R151 F154 L159	L108-L148 HydrophobicContact CD2-CD2 4.17Å; Q111-L148 HydrophobicContact CB-CD2 3.74Å; Q111-L148 HydrophobicContact CB-CG 4.25Å; C144-L148 WeakPolarHBondContact O-CG 3.24Å; C144-L148 PolarHBondContact O-N 3.28Å; L145-L148 PolarHBondContact O-N 3.13Å; K146-L148 VanDerWaalsContact C-N 3.35Å; L148-R151 PolarHBondContact O-N 2.98Å; L148-F154 HydrophobicContact CB-CE2 4.44Å; L148-F154 HydrophobicContact CD2-CE2 3.51Å; L148-F154 HydrophobicContact CD2-CZ 3.89Å; L148-L159 HydrophobicContact CB-CD2 4.18Å
149	K	72.6	Confident	73.1	Confident	123 Å²	123	83.5 Å²	83.5	54%	0.535	41%	0.409	S	S	.	.	H	α-helix	trans	-69.6	-29.3	177.5	-77.7	178.4	179.3	-178.8	0	114.1	L145 K146 R151 L159	L145-K149 WeakPolarHBondContact O-CG 3.4Å; L145-K149 PolarHBondContact O-N 2.92Å; K146-K149 PolarHBondContact O-N 2.94Å; K149-R151 PolarHBondContact O-N 3.43Å; K149-L159 HydrophobicContact CG-CD2 4.22Å
150	S	72.8	Confident	72.6	Confident	88 Å²	88	86.9 Å²	86.9	62%	0.615	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-16.2	179.2	65	0	0	0	0	113.1	K146 L147	K146-S150 PolarHBondContact O-N 3.17Å; L147-S150 PolarHBondContact O-OG 3.04Å
151	R	67.4	Low	72.4	Confident	87 Å²	87	86 Å²	86	33%	0.328	43%	0.427	S	S	.	.	S	Bend	trans	-89.9	117.5	177.6	-63.2	179.7	178.6	-155.2	2.2	110.1	S107 L148 K149 C153	S107-R151 PolarHBondContact OG-NH1 3.44Å; L148-R151 PolarHBondContact O-N 2.98Å; K149-R151 PolarHBondContact O-N 3.43Å; R151-C153 PolarHBondContact O-N 3.4Å
152	K	56.7	Low	72.2	Confident	225 Å²	225	87.5 Å²	87.5	98%	0.978	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	10.5	-175.4	-67.6	-176.5	176.9	178.9	0	116.1
153	C	54.8	Low	71.9	Confident	107 Å²	107	85.5 Å²	85.5	72%	0.723	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.1	14.1	-165.1	-106.4	0	0	0	0	115.7	R151	R151-C153 PolarHBondContact O-N 3.4Å
154	F	58.9	Low	71.8	Confident	39 Å²	39	86.7 Å²	86.7	17%	0.171	44%	0.437	C	S	.	.	S	Bend	trans	-98.7	144.2	-178.7	-105.2	-82.9	0	0	0	114.2	L108 L112 L148 L156 I158 L159	L108-F154 HydrophobicContact CD1-CE2 4.24Å; L108-F154 HydrophobicContact CD2-CD2 4.46Å; L108-F154 HydrophobicContact CD2-CE2 3.71Å; L108-F154 HydrophobicContact CG-CE2 4.37Å; L112-F154 HydrophobicContact CD1-CE1 4.27Å; L112-F154 HydrophobicContact CD1-CZ 3.93Å; L112-F154 HydrophobicContact CD2-CZ 4.42Å; L112-F154 HydrophobicContact CG-CZ 4.23Å; L148-F154 HydrophobicContact CB-CE2 4.44Å; L148-F154 HydrophobicContact CD2-CE2 3.51Å; L148-F154 HydrophobicContact CD2-CZ 3.89Å; F154-L156 PolarHBondContact O-N 3.1Å; F154-I158 HydrophobicContact CD1-CB 4.45Å; F154-I158 HydrophobicContact CD1-CG2 4.4Å; F154-I158 HydrophobicContact CE1-CG2 4.14Å; F154-L159 HydrophobicContact CB-CD1 3.39Å; F154-L159 HydrophobicContact CB-CD2 4.47Å; F154-L159 HydrophobicContact CB-CG 3.68Å; F154-L159 HydrophobicContact CD1-CG 4.2Å; F154-L159 HydrophobicContact CG-CD1 4.12Å; F154-L159 HydrophobicContact CG-CD2 4.34Å; F154-L159 HydrophobicContact CG-CG 3.95Å
155	D	62.5	Low	71.8	Confident	105 Å²	105	89.2 Å²	89.2	56%	0.561	45%	0.447	S	S	*	.			trans	-62	118.2	164	-162.3	-15.2	0	0	0	109.3	K157 I158 L159	D155-K157 PolarHBondContact O-N 2.86Å; D155-K157 PolarHBondContact OD1-N 3.31Å; D155-I158 HydrophobicContact CB-CD1 4.38Å; D155-I158 HydrophobicContact CB-CG1 4.47Å; D155-I158 PolarHBondContact O-N 3Å; D155-L159 PolarHBondContact O-N 2.84Å
156	L	61.8	Low	71.9	Confident	125 Å²	125	89.7 Å²	89.7	65%	0.654	45%	0.45	S	S	*	.	H	α-helix	trans	-52.9	-25.6	-179.1	-85.1	147	0	0	0	112.1	F154 K160	F154-L156 PolarHBondContact O-N 3.1Å; L156-K160 VanDerWaalsContact O-CB 3.29Å; L156-K160 WeakPolarHBondContact O-CB 3.46Å; L156-K160 WeakPolarHBondContact O-CD 3.49Å; L156-K160 WeakPolarHBondContact O-CG 3.29Å; L156-K160 PolarHBondContact O-N 3.44Å; L156-K160 VanDerWaalsContact O-N 3.1Å
157	K	68.4	Low	72.1	Confident	156 Å²	156	86.9 Å²	86.9	68%	0.678	44%	0.444	S	S	*	.	H	α-helix	trans	-70.9	-43.5	178.8	-161.7	175.1	-178.2	-177.4	0	112.8	D155 K160 S161	D155-K157 PolarHBondContact O-N 2.86Å; D155-K157 PolarHBondContact OD1-N 3.31Å; K157-K160 PolarHBondContact O-N 2.9Å; K157-S161 PolarHBondContact O-N 3.01Å; K157-S161 PolarHBondContact O-OG 2.76Å
158	I	70.9	Confident	72.3	Confident	82 Å²	82	86.4 Å²	86.4	42%	0.421	44%	0.441	S	S	.	.	H	α-helix	trans	-70.2	-43.7	179.9	-63.3	173.9	0	0	0	110.3	F154 D155 K160 S161 L162	F154-I158 HydrophobicContact CD1-CB 4.45Å; F154-I158 HydrophobicContact CD1-CG2 4.4Å; F154-I158 HydrophobicContact CE1-CG2 4.14Å; D155-I158 HydrophobicContact CB-CD1 4.38Å; D155-I158 HydrophobicContact CB-CG1 4.47Å; D155-I158 PolarHBondContact O-N 3Å; I158-K160 VanDerWaalsContact C-N 3.28Å; I158-K160 PolarHBondContact O-N 3.01Å; I158-S161 PolarHBondContact O-N 3.02Å; I158-L162 HydrophobicContact CG2-CD1 3.89Å; I158-L162 HydrophobicContact CG2-CG 4.3Å; I158-L162 WeakPolarHBondContact O-CG 3.21Å; I158-L162 PolarHBondContact O-N 2.68Å
159	L	72.7	Confident	72.8	Confident	27 Å²	27	87.3 Å²	87.3	14%	0.141	45%	0.445	C	S	.	.	H	α-helix	trans	-60.5	-38.6	174.4	-80.1	174.5	0	0	0	112.2	L145 L148 K149 F154 D155 S163	L145-L159 HydrophobicContact CD1-CD2 4.28Å; L148-L159 HydrophobicContact CB-CD2 4.18Å; K149-L159 HydrophobicContact CG-CD2 4.22Å; F154-L159 HydrophobicContact CB-CD1 3.39Å; F154-L159 HydrophobicContact CB-CD2 4.47Å; F154-L159 HydrophobicContact CB-CG 3.68Å; F154-L159 HydrophobicContact CD1-CG 4.2Å; F154-L159 HydrophobicContact CG-CD1 4.12Å; F154-L159 HydrophobicContact CG-CD2 4.34Å; F154-L159 HydrophobicContact CG-CG 3.95Å; D155-L159 PolarHBondContact O-N 2.84Å; L159-S163 VanDerWaalsContact O-CB 3.25Å; L159-S163 WeakPolarHBondContact O-CB 3.41Å; L159-S163 PolarHBondContact O-N 3.25Å; L159-S163 PolarHBondContact O-OG 3.21Å; L159-S163 VanDerWaalsContact O-OG 3.11Å
160	K	73.9	Confident	73.4	Confident	141 Å²	141	84 Å²	84	61%	0.613	43%	0.431	S	S	*	.	H	α-helix	trans	-62.8	-47.9	173.6	-80.6	173.8	-176.9	-175.1	0	111.2	L156 K157 I158 S163 M164	L156-K160 VanDerWaalsContact O-CB 3.29Å; L156-K160 WeakPolarHBondContact O-CB 3.46Å; L156-K160 WeakPolarHBondContact O-CD 3.49Å; L156-K160 WeakPolarHBondContact O-CG 3.29Å; L156-K160 PolarHBondContact O-N 3.44Å; L156-K160 VanDerWaalsContact O-N 3.1Å; K157-K160 PolarHBondContact O-N 2.9Å; I158-K160 VanDerWaalsContact C-N 3.28Å; I158-K160 PolarHBondContact O-N 3.01Å; K160-S163 WeakPolarHBondContact CA-OG 3.38Å; K160-S163 PolarHBondContact O-N 3.47Å; K160-S163 PolarHBondContact O-OG 3.48Å; K160-M164 WeakPolarHBondContact O-CB 3.4Å; K160-M164 PolarHBondContact O-N 3.08Å
161	S	77.6	Confident	74	Confident	74 Å²	74	85.4 Å²	85.4	52%	0.517	43%	0.428	S	S	.	.	H	α-helix	trans	-60.4	-46.5	177.6	-66.9	0	0	0	0	112.8	K157 I158 S163 M164 E165	K157-S161 PolarHBondContact O-N 3.01Å; K157-S161 PolarHBondContact O-OG 2.76Å; I158-S161 PolarHBondContact O-N 3.02Å; S161-S163 VanDerWaalsContact C-N 3.34Å; S161-S163 PolarHBondContact O-N 3.45Å; S161-M164 WeakPolarHBondContact O-CB 3.5Å; S161-M164 PolarHBondContact O-N 3.33Å; S161-E165 PolarHBondContact O-N 2.83Å
162	L	80	Confident	74.8	Confident	30 Å²	30	83.8 Å²	83.8	16%	0.157	43%	0.426	C	S	.	.	H	α-helix	trans	-65.1	-37.7	177.3	-64.8	169.4	0	0	0	112.1	L112 F115 L145 I158 E165 L166	L112-L162 HydrophobicContact CD2-CD1 3.58Å; F115-L162 HydrophobicContact CD1-CD2 3.85Å; F115-L162 HydrophobicContact CE1-CB 4.31Å; F115-L162 HydrophobicContact CE1-CD2 3.49Å; F115-L162 VanDerWaalsContact CE1-CD2 3.49Å; F115-L162 HydrophobicContact CE1-CG 4.44Å; F115-L162 HydrophobicContact CZ-CB 4.19Å; F115-L162 HydrophobicContact CZ-CD2 4.22Å; L145-L162 HydrophobicContact CD1-CB 3.99Å; I158-L162 HydrophobicContact CG2-CD1 3.89Å; I158-L162 HydrophobicContact CG2-CG 4.3Å; I158-L162 WeakPolarHBondContact O-CG 3.21Å; I158-L162 PolarHBondContact O-N 2.68Å; L162-E165 PolarHBondContact O-N 3.1Å; L162-L166 WeakPolarHBondContact O-CB 3.21Å; L162-L166 PolarHBondContact O-N 3.41Å
163	S	79.3	Confident	76.2	Confident	35 Å²	35	73.1 Å²	73.1	25%	0.245	38%	0.379	C	S	.	.	H	α-helix	trans	-68.5	-34.9	175.1	70.8	0	0	0	0	112.9	L159 K160 S161 T167	L159-S163 VanDerWaalsContact O-CB 3.25Å; L159-S163 WeakPolarHBondContact O-CB 3.41Å; L159-S163 PolarHBondContact O-N 3.25Å; L159-S163 PolarHBondContact O-OG 3.21Å; L159-S163 VanDerWaalsContact O-OG 3.11Å; K160-S163 WeakPolarHBondContact CA-OG 3.38Å; K160-S163 PolarHBondContact O-N 3.47Å; K160-S163 PolarHBondContact O-OG 3.48Å; S161-S163 VanDerWaalsContact C-N 3.34Å; S161-S163 PolarHBondContact O-N 3.45Å; S163-T167 WeakPolarHBondContact O-CB 3.44Å; S163-T167 PolarHBondContact O-N 2.99Å; S163-T167 PolarHBondContact O-OG1 3.23Å
164	M	80.8	Confident	77.6	Confident	124 Å²	124	69.2 Å²	69.2	61%	0.611	35%	0.351	S	S	*	.	H	α-helix	trans	-65.2	-47.3	173.9	-168	84.8	166.2	0	0	109.7	K160 S161 L166 T167 I168	K160-M164 WeakPolarHBondContact O-CB 3.4Å; K160-M164 PolarHBondContact O-N 3.08Å; S161-M164 WeakPolarHBondContact O-CB 3.5Å; S161-M164 PolarHBondContact O-N 3.33Å; M164-L166 PolarHBondContact O-N 2.9Å; M164-T167 WeakPolarHBondContact O-CB 3.25Å; M164-T167 PolarHBondContact O-N 3.35Å; M164-T167 VanDerWaalsContact O-N 3.13Å; M164-I168 HydrophobicContact CG-CD1 4.03Å; M164-I168 VanDerWaalsContact O-CG1 3.29Å; M164-I168 WeakPolarHBondContact O-CG1 3.4Å; M164-I168 PolarHBondContact O-N 2.72Å
165	E	81.2	Confident	78.9	Confident	71 Å²	71	74 Å²	74	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-60.1	-48	178.3	-171.1	58.5	-149.2	0	0	111.7	I119 S161 L162 T167 I168 Q169	I119-E165 HydrophobicContact CD1-CG 4.01Å; S161-E165 PolarHBondContact O-N 2.83Å; L162-E165 PolarHBondContact O-N 3.1Å; E165-T167 PolarHBondContact O-N 3.15Å; E165-I168 WeakPolarHBondContact O-CB 3.44Å; E165-I168 PolarHBondContact O-N 3.08Å; E165-I168 VanDerWaalsContact O-N 3.1Å; E165-Q169 WeakPolarHBondContact O-CG 3.16Å; E165-Q169 PolarHBondContact O-N 3.22Å; E165-Q169 PolarHBondContact OE1-NE2 3.29Å
166	L	84	Confident	79.8	Confident	17 Å²	17	71.6 Å²	71.6	9%	0.089	35%	0.354	C	S	.	.	H	α-helix	trans	-61.9	-34.2	176.2	-171.3	137.6	0	0	0	112.3	F115 A141 Q142 L145 L162 M164 K170	F115-L166 HydrophobicContact CE2-CD1 3.82Å; F115-L166 HydrophobicContact CZ-CB 4.35Å; F115-L166 HydrophobicContact CZ-CD1 4.39Å; A141-L166 HydrophobicContact CB-CD1 4.01Å; Q142-L166 HydrophobicContact CB-CD1 4.01Å; Q142-L166 HydrophobicContact CB-CD2 4.48Å; Q142-L166 HydrophobicContact CG-CD2 4.36Å; L145-L166 HydrophobicContact CD2-CB 4.47Å; L145-L166 HydrophobicContact CD2-CD1 4.29Å; L162-L166 WeakPolarHBondContact O-CB 3.21Å; L162-L166 PolarHBondContact O-N 3.41Å; M164-L166 PolarHBondContact O-N 2.9Å; L166-K170 VanDerWaalsContact O-CB 3.24Å; L166-K170 WeakPolarHBondContact O-CB 3.38Å; L166-K170 PolarHBondContact O-N 3.19Å
167	T	83.7	Confident	80.8	Confident	75 Å²	75	65.7 Å²	65.7	46%	0.46	32%	0.323	S	S	.	.	H	α-helix	trans	-68.5	-42.8	174.6	-55.9	0	0	0	0	111	S163 M164 E165 K170 Q171	S163-T167 WeakPolarHBondContact O-CB 3.44Å; S163-T167 PolarHBondContact O-N 2.99Å; S163-T167 PolarHBondContact O-OG1 3.23Å; M164-T167 WeakPolarHBondContact O-CB 3.25Å; M164-T167 PolarHBondContact O-N 3.35Å; M164-T167 VanDerWaalsContact O-N 3.13Å; E165-T167 PolarHBondContact O-N 3.15Å; T167-K170 PolarHBondContact O-N 2.83Å; T167-Q171 VanDerWaalsContact O-CG 3.32Å; T167-Q171 WeakPolarHBondContact O-CG 3.3Å; T167-Q171 PolarHBondContact O-N 3.45Å
168	I	84.9	Confident	81.4	Confident	83 Å²	83	58.8 Å²	58.8	43%	0.426	30%	0.296	S	S	.	.	H	α-helix	trans	-61	-49.8	176.6	-69.4	163.8	0	0	0	109.9	M164 E165 K170 Q171 N172	M164-I168 HydrophobicContact CG-CD1 4.03Å; M164-I168 VanDerWaalsContact O-CG1 3.29Å; M164-I168 WeakPolarHBondContact O-CG1 3.4Å; M164-I168 PolarHBondContact O-N 2.72Å; E165-I168 WeakPolarHBondContact O-CB 3.44Å; E165-I168 PolarHBondContact O-N 3.08Å; E165-I168 VanDerWaalsContact O-N 3.1Å; I168-K170 PolarHBondContact O-N 3.42Å; I168-Q171 CarbonylContact O-C 3.58Å; I168-Q171 PolarHBondContact O-N 3.06Å; I168-Q171 VanDerWaalsContact O-N 3.14Å; I168-N172 WeakPolarHBondContact O-CB 3.5Å; I168-N172 PolarHBondContact O-N 3.34Å
169	Q	84	Confident	81.9	Confident	20 Å²	20	57.8 Å²	57.8	9%	0.093	29%	0.29	C	S	.	.	H	α-helix	trans	-68	-35.6	-179.4	-60	-54	-13.1	0	0	112.6	Y122 L138 E165 Q171 N172 I173	Y122-Q169 HydrophobicContact CD1-CB 4.34Å; Y122-Q169 HydrophobicContact CD1-CG 4.48Å; Y122-Q169 HydrophobicContact CE1-CB 3.76Å; Y122-Q169 HydrophobicContact CE1-CG 4.05Å; Y122-Q169 VanDerWaalsContact CE1-OE1 3.29Å; Y122-Q169 PolarHBondContact OH-O 3.08Å; Y122-Q169 VanDerWaalsContact OH-O 3.08Å; L138-Q169 HydrophobicContact CD2-CB 3.82Å; E165-Q169 WeakPolarHBondContact O-CG 3.16Å; E165-Q169 PolarHBondContact O-N 3.22Å; E165-Q169 PolarHBondContact OE1-NE2 3.29Å; Q169-Q171 VanDerWaalsContact C-N 3.34Å; Q169-Q171 PolarHBondContact O-N 3.34Å; Q169-N172 WeakPolarHBondContact O-CB 3.48Å; Q169-N172 PolarHBondContact O-N 2.94Å; Q169-N172 PolarHBondContact OE1-ND2 3.45Å; Q169-I173 PolarHBondContact O-N 3.14Å
170	K	84.6	Confident	82.3	Confident	53 Å²	53	56.8 Å²	56.8	23%	0.23	29%	0.285	C	S	.	.	H	α-helix	trans	-60.5	-43.8	169.8	-175.4	175.4	177.8	178.4	0	111.3	L166 T167 I168 N172 I173 L174 L234 E236	L166-K170 VanDerWaalsContact O-CB 3.24Å; L166-K170 WeakPolarHBondContact O-CB 3.38Å; L166-K170 PolarHBondContact O-N 3.19Å; T167-K170 PolarHBondContact O-N 2.83Å; I168-K170 PolarHBondContact O-N 3.42Å; K170-N172 VanDerWaalsContact C-N 3.32Å; K170-I173 VanDerWaalsContact O-CG2 3.25Å; K170-I173 WeakPolarHBondContact O-CG2 3.41Å; K170-L174 HydrophobicContact CG-CD1 4.06Å; K170-L174 WeakPolarHBondContact O-CB 3.32Å; K170-L174 WeakPolarHBondContact O-CD1 3.41Å; K170-L174 WeakPolarHBondContact O-CG 3.4Å; K170-L174 PolarHBondContact O-N 2.74Å; K170-L174 VanDerWaalsContact O-N 3.1Å; K170-L234 PolarHBondContact NZ-O 3.48Å; K170-E236 IonicContact NZ-OE1 2.95Å
171	Q	85.3	Confident	82.7	Confident	118 Å²	118	51.2 Å²	51.2	55%	0.551	26%	0.26	S	S	*	.	H	α-helix	trans	-67.3	-34.5	176.2	-69.8	-63.2	-14.2	0	0	112.2	T167 I168 Q169 L174 Y175	T167-Q171 VanDerWaalsContact O-CG 3.32Å; T167-Q171 WeakPolarHBondContact O-CG 3.3Å; T167-Q171 PolarHBondContact O-N 3.45Å; I168-Q171 CarbonylContact O-C 3.58Å; I168-Q171 PolarHBondContact O-N 3.06Å; I168-Q171 VanDerWaalsContact O-N 3.14Å; Q169-Q171 VanDerWaalsContact C-N 3.34Å; Q169-Q171 PolarHBondContact O-N 3.34Å; Q171-L174 PolarHBondContact O-N 3.5Å; Q171-Y175 WeakPolarHBondContact O-CB 3.37Å; Q171-Y175 PolarHBondContact O-N 3.15Å
172	N	85.8	Confident	82.8	Confident	53 Å²	53	54.3 Å²	54.3	28%	0.283	27%	0.266	S	S	.	.	H	α-helix	trans	-64.1	-50	178.1	-168.4	22.2	0	0	0	111.9	I168 Q169 K170 L174 Y175 H176	I168-N172 WeakPolarHBondContact O-CB 3.5Å; I168-N172 PolarHBondContact O-N 3.34Å; Q169-N172 WeakPolarHBondContact O-CB 3.48Å; Q169-N172 PolarHBondContact O-N 2.94Å; Q169-N172 PolarHBondContact OE1-ND2 3.45Å; K170-N172 VanDerWaalsContact C-N 3.32Å; N172-L174 VanDerWaalsContact C-N 3.31Å; N172-L174 PolarHBondContact O-N 2.99Å; N172-Y175 WeakPolarHBondContact O-CB 3.24Å; N172-Y175 PolarHBondContact O-N 3.14Å; N172-H176 PolarHBondContact O-CD2 3.05Å; N172-H176 VanDerWaalsContact O-CD2 3.23Å; N172-H176 PolarHBondContact O-N 3.14Å; N172-H176 VanDerWaalsContact O-N 3.15Å; N172-H176 PolarHBondContact OD1-NE2 2.81Å
173	I	84.9	Confident	82.7	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-64.1	-37.3	174.8	-164.9	172.1	0	0	0	111.6	Y122 L126 Y131 A135 L138 Q169 K170 Y175 H176 L177 L234	Y122-I173 HydrophobicContact CE2-CB 3.92Å; Y122-I173 HydrophobicContact CE2-CD1 4.02Å; Y122-I173 HydrophobicContact CE2-CG1 4.31Å; Y122-I173 PolarHBondContact OH-N 3.36Å; L126-I173 HydrophobicContact CD1-CG1 4.38Å; Y131-I173 HydrophobicContact CD1-CG1 4.46Å; A135-I173 HydrophobicContact CB-CD1 4.14Å; L138-I173 HydrophobicContact CD1-CB 4.11Å; L138-I173 HydrophobicContact CD1-CD1 4.25Å; L138-I173 HydrophobicContact CD1-CG2 3.55Å; Q169-I173 PolarHBondContact O-N 3.14Å; K170-I173 VanDerWaalsContact O-CG2 3.25Å; K170-I173 WeakPolarHBondContact O-CG2 3.41Å; I173-Y175 VanDerWaalsContact C-N 3.33Å; I173-Y175 PolarHBondContact O-N 3.16Å; I173-H176 PolarHBondContact O-N 3.46Å; I173-L177 HydrophobicContact CD1-CD1 4.38Å; I173-L177 HydrophobicContact CG1-CD1 3.89Å; I173-L177 HydrophobicContact CG1-CG 4.15Å; I173-L177 VanDerWaalsContact O-CB 3.27Å; I173-L177 WeakPolarHBondContact O-CB 3.27Å; I173-L177 VanDerWaalsContact O-CG 3.24Å; I173-L177 WeakPolarHBondContact O-CG 3.46Å; I173-L177 PolarHBondContact O-N 3.25Å; I173-L234 HydrophobicContact CD1-CD1 4.29Å; I173-L234 HydrophobicContact CG1-CD1 4.42Å; I173-L234 HydrophobicContact CG2-CD1 3.61Å; I173-L234 HydrophobicContact CG2-CD2 4.26Å
174	L	84.3	Confident	82.5	Confident	24 Å²	24	56 Å²	56	13%	0.126	27%	0.268	C	S	.	.	H	α-helix	trans	-67.1	-33.3	177.5	-73.3	173.8	0	0	0	112.7	K170 Q171 N172 G178 F231 L234 E236	K170-L174 HydrophobicContact CG-CD1 4.06Å; K170-L174 WeakPolarHBondContact O-CB 3.32Å; K170-L174 WeakPolarHBondContact O-CD1 3.41Å; K170-L174 WeakPolarHBondContact O-CG 3.4Å; K170-L174 PolarHBondContact O-N 2.74Å; K170-L174 VanDerWaalsContact O-N 3.1Å; Q171-L174 PolarHBondContact O-N 3.5Å; N172-L174 VanDerWaalsContact C-N 3.31Å; N172-L174 PolarHBondContact O-N 2.99Å; L174-G178 WeakPolarHBondContact O-CA 3.33Å; L174-G178 PolarHBondContact O-N 3.22Å; L174-F231 HydrophobicContact CD2-CD1 4.07Å; L174-F231 HydrophobicContact CD2-CE1 3.87Å; L174-L234 HydrophobicContact CD2-CD1 3.95Å; L174-L234 HydrophobicContact CG-CD1 4.44Å; L174-E236 HydrophobicContact CD1-CG 4.08Å; L174-E236 HydrophobicContact CD2-CB 4.04Å; L174-E236 HydrophobicContact CD2-CG 3.78Å
175	Y	86	Confident	82.4	Confident	139 Å²	139	50.5 Å²	50.5	55%	0.545	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-52.9	172.8	176.6	-92.2	0	0	0	110.2	Q171 N172 I173 G178 E179	Q171-Y175 WeakPolarHBondContact O-CB 3.37Å; Q171-Y175 PolarHBondContact O-N 3.15Å; N172-Y175 WeakPolarHBondContact O-CB 3.24Å; N172-Y175 PolarHBondContact O-N 3.14Å; I173-Y175 VanDerWaalsContact C-N 3.33Å; I173-Y175 PolarHBondContact O-N 3.16Å; Y175-G178 CarbonylContact O-C 3.56Å; Y175-G178 WeakPolarHBondContact O-CA 3.39Å; Y175-G178 PolarHBondContact O-N 3.41Å; Y175-G178 VanDerWaalsContact O-N 3.1Å; Y175-E179 HydrophobicContact CD1-CG 4.48Å; Y175-E179 HydrophobicContact CE1-CG 3.99Å; Y175-E179 WeakPolarHBondContact CE1-OE1 3.27Å; Y175-E179 PolarHBondContact O-N 2.83Å; Y175-E179 PolarHBondContact OH-OE1 3.4Å
176	H	81.8	Confident	82.4	Confident	56 Å²	56	49.2 Å²	49.2	26%	0.259	24%	0.238	S	C	.	.	H	α-helix	trans	-64.3	-43.2	178.9	-71.4	-59.8	0	0	0	113.1	L126 Y131 N172 I173 G178 E179 E180	L126-H176 HydrophobicContact CD1-CB 4.49Å; Y131-H176 HydrophobicContact CE1-CB 3.9Å; N172-H176 PolarHBondContact O-CD2 3.05Å; N172-H176 VanDerWaalsContact O-CD2 3.23Å; N172-H176 PolarHBondContact O-N 3.14Å; N172-H176 VanDerWaalsContact O-N 3.15Å; N172-H176 PolarHBondContact OD1-NE2 2.81Å; I173-H176 PolarHBondContact O-N 3.46Å; H176-G178 PolarHBondContact O-N 3.35Å; H176-E179 IonicContact ND1-OE2 3.36Å; H176-E179 PolarHBondContact O-N 3.38Å; H176-E180 WeakPolarHBondContact O-CG 3.18Å; H176-E180 PolarHBondContact O-N 3.47Å
177	L	83.2	Confident	82.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-61.5	-34.9	172.8	-75	171.5	0	0	0	111.8	Y131 I173 W181 V227 A230 F231 L234	Y131-L177 HydrophobicContact CD1-CD2 3.98Å; Y131-L177 HydrophobicContact CD1-CG 4.27Å; Y131-L177 HydrophobicContact CD2-CD2 4.47Å; Y131-L177 HydrophobicContact CG-CD2 3.83Å; I173-L177 HydrophobicContact CD1-CD1 4.38Å; I173-L177 HydrophobicContact CG1-CD1 3.89Å; I173-L177 HydrophobicContact CG1-CG 4.15Å; I173-L177 VanDerWaalsContact O-CB 3.27Å; I173-L177 WeakPolarHBondContact O-CB 3.27Å; I173-L177 VanDerWaalsContact O-CG 3.24Å; I173-L177 WeakPolarHBondContact O-CG 3.46Å; I173-L177 PolarHBondContact O-N 3.25Å; L177-W181 VanDerWaalsContact O-CB 3.22Å; L177-W181 WeakPolarHBondContact O-CB 3.25Å; L177-W181 PolarHBondContact O-N 3.07Å; L177-V227 HydrophobicContact CD2-CB 4.49Å; L177-V227 HydrophobicContact CD2-CG1 4.05Å; L177-A230 HydrophobicContact CD1-CB 3.89Å; L177-A230 HydrophobicContact CD2-CB 3.71Å; L177-A230 HydrophobicContact CG-CB 4.45Å; L177-F231 HydrophobicContact CB-CE1 3.79Å; L177-F231 HydrophobicContact CB-CE2 4.06Å; L177-F231 HydrophobicContact CB-CZ 3.51Å; L177-F231 HydrophobicContact CD1-CD1 4.26Å; L177-F231 HydrophobicContact CD1-CE1 4.22Å; L177-L234 HydrophobicContact CD1-CD1 3.57Å
178	G	81.1	Confident	82	Confident	11 Å²	11	51.8 Å²	51.8	11%	0.113	24%	0.24	C	C	.	.	H	α-helix	trans	-65.6	-43.1	174.1	0	0	0	0	0	112.8	L174 Y175 H176 W181 Q182	L174-G178 WeakPolarHBondContact O-CA 3.33Å; L174-G178 PolarHBondContact O-N 3.22Å; Y175-G178 CarbonylContact O-C 3.56Å; Y175-G178 WeakPolarHBondContact O-CA 3.39Å; Y175-G178 PolarHBondContact O-N 3.41Å; Y175-G178 VanDerWaalsContact O-N 3.1Å; H176-G178 PolarHBondContact O-N 3.35Å; G178-W181 PolarHBondContact O-N 3.15Å; G178-Q182 WeakPolarHBondContact O-CG 3.31Å; G178-Q182 PolarHBondContact O-N 3.21Å
179	E	82.1	Confident	81.5	Confident	61 Å²	61	52 Å²	52	29%	0.285	24%	0.239	S	C	.	.	H	α-helix	trans	-62.8	-45.9	174	-71.6	-173.2	146.9	0	0	111.3	Y175 H176 W181 Q182 K183	Y175-E179 HydrophobicContact CD1-CG 4.48Å; Y175-E179 HydrophobicContact CE1-CG 3.99Å; Y175-E179 WeakPolarHBondContact CE1-OE1 3.27Å; Y175-E179 PolarHBondContact O-N 2.83Å; Y175-E179 PolarHBondContact OH-OE1 3.4Å; H176-E179 IonicContact ND1-OE2 3.36Å; H176-E179 PolarHBondContact O-N 3.38Å; E179-W181 PolarHBondContact O-N 3.27Å; E179-Q182 PolarHBondContact O-N 2.91Å; E179-K183 WeakPolarHBondContact O-CG 3.21Å; E179-K183 PolarHBondContact O-N 3.16Å
180	E	79.9	Confident	80.5	Confident	7 Å²	7	52.1 Å²	52.1	3%	0.033	24%	0.241	C	C	.	.	H	α-helix	trans	-65.4	-39	177.4	-66	-56.2	129.9	0	0	111.7	Y131 H176 Q182 K183 L184 P222 V227	Y131-E180 HydrophobicContact CE2-CG 3.98Å; H176-E180 WeakPolarHBondContact O-CG 3.18Å; H176-E180 PolarHBondContact O-N 3.47Å; E180-Q182 PolarHBondContact O-N 3.19Å; E180-K183 PolarHBondContact O-N 3.04Å; E180-K183 IonicContact OE1-NZ 3.16Å; E180-K183 PolarHBondContact OE1-NZ 2.98Å; E180-L184 WeakPolarHBondContact O-CB 3.5Å; E180-L184 VanDerWaalsContact O-CG 3.25Å; E180-L184 WeakPolarHBondContact O-CG 3.47Å; E180-L184 PolarHBondContact O-N 3.48Å; E180-P222 HydrophobicContact CG-CG 4.34Å; E180-P222 WeakPolarHBondContact OE2-CD 3.49Å; E180-V227 HydrophobicContact CB-CG2 4.29Å
181	W	81.6	Confident	79.2	Confident	24 Å²	24	55.8 Å²	55.8	9%	0.091	27%	0.27	C	S	.	.	H	α-helix	trans	-59.8	-43	172.7	179.5	-99.1	0	0	0	112.8	L177 G178 E179 K183 L184 I185 V227 L228 F231 F244	L177-W181 VanDerWaalsContact O-CB 3.22Å; L177-W181 WeakPolarHBondContact O-CB 3.25Å; L177-W181 PolarHBondContact O-N 3.07Å; G178-W181 PolarHBondContact O-N 3.15Å; E179-W181 PolarHBondContact O-N 3.27Å; W181-K183 VanDerWaalsContact C-N 3.29Å; W181-K183 PolarHBondContact O-N 2.85Å; W181-L184 PolarHBondContact O-N 2.86Å; W181-I185 HydrophobicContact CD2-CD1 4.14Å; W181-I185 HydrophobicContact CE3-CD1 4.09Å; W181-I185 HydrophobicContact CH2-CD1 3.28Å; W181-I185 HydrophobicContact CZ2-CD1 3.32Å; W181-I185 HydrophobicContact CZ3-CD1 3.66Å; W181-I185 PolarHBondContact O-N 3.23Å; W181-V227 HydrophobicContact CE3-CG1 4.44Å; W181-L228 HydrophobicContact CH2-CD2 4.02Å; W181-L228 HydrophobicContact CZ3-CD2 3.57Å; W181-L228 HydrophobicContact CZ3-CG 4.18Å; W181-F231 HydrophobicContact CB-CE2 4.22Å; W181-F231 HydrophobicContact CE3-CE2 4.45Å; W181-F244 HydrophobicContact CZ2-CB 4.25Å; W181-F244 HydrophobicContact CZ2-CD2 4.43Å; W181-F244 HydrophobicContact CZ2-CG 4.45Å
182	Q	80	Confident	77.8	Confident	139 Å²	139	53.1 Å²	53.1	65%	0.65	26%	0.264	S	S	*	.	H	α-helix	trans	-67.7	-28.7	177.3	-75.4	177.6	-7.7	0	0	112.9	G178 E179 E180 V186	G178-Q182 WeakPolarHBondContact O-CG 3.31Å; G178-Q182 PolarHBondContact O-N 3.21Å; E179-Q182 PolarHBondContact O-N 2.91Å; E180-Q182 PolarHBondContact O-N 3.19Å; Q182-V186 VanDerWaalsContact O-CG2 3.3Å; Q182-V186 WeakPolarHBondContact O-CG2 3.22Å
183	K	78.9	Confident	76.3	Confident	95 Å²	95	60.1 Å²	60.1	41%	0.413	29%	0.292	S	S	.	.	H	α-helix	trans	-76	-35	173.1	-66.6	170.7	-167.2	170.3	0	112.1	E179 E180 W181 Y209 M221	E179-K183 WeakPolarHBondContact O-CG 3.21Å; E179-K183 PolarHBondContact O-N 3.16Å; E180-K183 PolarHBondContact O-N 3.04Å; E180-K183 IonicContact OE1-NZ 3.16Å; E180-K183 PolarHBondContact OE1-NZ 2.98Å; W181-K183 VanDerWaalsContact C-N 3.29Å; W181-K183 PolarHBondContact O-N 2.85Å; K183-Y209 WeakPolarHBondContact O-CD2 3.35Å; K183-M221 HydrophobicContact CB-CE 3.37Å; K183-M221 HydrophobicContact CD-CE 4.34Å; K183-M221 HydrophobicContact CG-CE 4.5Å
184	L	74	Confident	74.5	Confident	6 Å²	6	65.7 Å²	65.7	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-77.2	-32.8	-179.3	-70.9	167.8	0	0	0	113.2	E180 W181 Y209 M221 I224 V227	E180-L184 WeakPolarHBondContact O-CB 3.5Å; E180-L184 VanDerWaalsContact O-CG 3.25Å; E180-L184 WeakPolarHBondContact O-CG 3.47Å; E180-L184 PolarHBondContact O-N 3.48Å; W181-L184 PolarHBondContact O-N 2.86Å; L184-Y209 WeakPolarHBondContact CD2-O 3.47Å; L184-Y209 PolarHBondContact O-N 2.95Å; L184-M221 HydrophobicContact CD2-CE 3.59Å; L184-M221 HydrophobicContact CG-CE 3.73Å; L184-I224 HydrophobicContact CB-CD1 4.31Å; L184-I224 HydrophobicContact CD1-CB 4.12Å; L184-I224 HydrophobicContact CD1-CG1 4.08Å; L184-V227 HydrophobicContact CD1-CB 4.27Å; L184-V227 HydrophobicContact CD1-CG2 3.84Å
185	I	80.3	Confident	73	Confident	7 Å²	7	68.2 Å²	68.2	4%	0.036	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	99.5	-179.7	-57.3	-179.4	0	0	0	108.9	W181 L206 L208 I224 F244 L306	W181-I185 HydrophobicContact CD2-CD1 4.14Å; W181-I185 HydrophobicContact CE3-CD1 4.09Å; W181-I185 HydrophobicContact CH2-CD1 3.28Å; W181-I185 HydrophobicContact CZ2-CD1 3.32Å; W181-I185 HydrophobicContact CZ3-CD1 3.66Å; W181-I185 PolarHBondContact O-N 3.23Å; I185-L206 HydrophobicContact CG2-CD1 3.79Å; I185-L208 HydrophobicContact CD1-CD2 4.45Å; I185-L208 HydrophobicContact CG1-CD2 3.97Å; I185-L208 HydrophobicContact CG2-CD2 4.24Å; I185-I224 HydrophobicContact CD1-CD1 4.41Å; I185-I224 HydrophobicContact CG1-CD1 4.34Å; I185-F244 HydrophobicContact CD1-CD2 4.17Å; I185-F244 HydrophobicContact CD1-CE2 4.08Å; I185-F244 HydrophobicContact CG2-CD2 4.13Å; I185-F244 HydrophobicContact CG2-CE2 3.85Å; I185-L306 HydrophobicContact CD1-CD1 3.85Å
186	V	80.7	Confident	71.5	Confident	45 Å²	45	66.3 Å²	66.3	27%	0.273	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	127.1	-178.8	-179.9	0	0	0	0	109.8	Q182 H207 Y209	Q182-V186 VanDerWaalsContact O-CG2 3.3Å; Q182-V186 WeakPolarHBondContact O-CG2 3.22Å; V186-H207 HydrophobicContact CB-CB 4.2Å; V186-H207 PolarHBondContact N-O 3.22Å; V186-H207 PolarHBondContact O-N 2.91Å; V186-Y209 HydrophobicContact CB-CE2 4.22Å; V186-Y209 HydrophobicContact CG2-CD2 4.49Å; V186-Y209 HydrophobicContact CG2-CE2 3.83Å
187	W	81.3	Confident	70.5	Confident	48 Å²	48	65.9 Å²	65.9	18%	0.182	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.5	172	-63	87.4	0	0	0	110	F189 L206 F244 M247 L248 I252	W187-F189 HydrophobicContact CB-CD2 4.37Å; W187-F189 HydrophobicContact CB-CE1 4.1Å; W187-F189 HydrophobicContact CB-CE2 3.5Å; W187-F189 VanDerWaalsContact CB-CE2 3.5Å; W187-F189 HydrophobicContact CB-CZ 3.31Å; W187-F189 HydrophobicContact CD2-CZ 4.2Å; W187-F189 HydrophobicContact CE3-CE1 4.31Å; W187-F189 HydrophobicContact CE3-CZ 4.31Å; W187-F189 HydrophobicContact CG-CE2 4.36Å; W187-F189 AromaticContact CG-CZ 3.83Å; W187-F189 HydrophobicContact CG-CZ 3.83Å; W187-L206 HydrophobicContact CD2-CD1 3.86Å; W187-L206 HydrophobicContact CE3-CB 4.31Å; W187-L206 HydrophobicContact CE3-CD1 4.04Å; W187-L206 HydrophobicContact CG-CD1 4.49Å; W187-L206 HydrophobicContact CH2-CD1 3.91Å; W187-L206 HydrophobicContact CH2-CD2 3.96Å; W187-L206 HydrophobicContact CH2-CG 4.37Å; W187-L206 HydrophobicContact CZ2-CD1 3.72Å; W187-L206 HydrophobicContact CZ2-CD2 4.36Å; W187-L206 HydrophobicContact CZ3-CB 4.12Å; W187-L206 HydrophobicContact CZ3-CD1 4.07Å; W187-L206 HydrophobicContact CZ3-CD2 4.36Å; W187-L206 HydrophobicContact CZ3-CG 4.42Å; W187-F244 AromaticContact CZ2-CD2 3.99Å; W187-F244 HydrophobicContact CZ2-CD2 3.99Å; W187-F244 AromaticContact CZ2-CE2 3.79Å; W187-F244 HydrophobicContact CZ2-CE2 3.79Å; W187-M247 HydrophobicContact CH2-CB 4.18Å; W187-M247 HydrophobicContact CZ2-CB 3.8Å; W187-L248 HydrophobicContact CH2-CB 4.41Å; W187-I252 HydrophobicContact CH2-CD1 3.95Å; W187-I252 HydrophobicContact CZ3-CD1 3.68Å; W187-I252 HydrophobicContact CZ3-CG1 4.07Å
188	K	77.1	Confident	69.5	Low	97 Å²	97	69.2 Å²	69.2	42%	0.422	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	126.1	167.3	-67	-176.2	-175.2	171.4	0	109.2	T204 E205	K188-T204 WeakPolarHBondContact O-CA 3.4Å; K188-E205 HydrophobicContact CB-CB 4.18Å; K188-E205 PolarHBondContact N-O 2.87Å; K188-E205 IonicContact NZ-OE2 2.82Å; K188-E205 PolarHBondContact O-N 2.64Å; K188-E205 VanDerWaalsContact O-N 3.15Å
189	F	75.5	Confident	68.5	Low	89 Å²	89	75.6 Å²	75.6	39%	0.39	39%	0.393	S	S	.	.			trans	-114.6	154.5	177.8	-58.1	-66.9	0	0	0	110.5	W187 M247 Y251	W187-F189 HydrophobicContact CB-CD2 4.37Å; W187-F189 HydrophobicContact CB-CE1 4.1Å; W187-F189 HydrophobicContact CB-CE2 3.5Å; W187-F189 VanDerWaalsContact CB-CE2 3.5Å; W187-F189 HydrophobicContact CB-CZ 3.31Å; W187-F189 HydrophobicContact CD2-CZ 4.2Å; W187-F189 HydrophobicContact CE3-CE1 4.31Å; W187-F189 HydrophobicContact CE3-CZ 4.31Å; W187-F189 HydrophobicContact CG-CE2 4.36Å; W187-F189 AromaticContact CG-CZ 3.83Å; W187-F189 HydrophobicContact CG-CZ 3.83Å; F189-M247 HydrophobicContact CE1-CE 3.88Å; F189-M247 HydrophobicContact CE2-CE 4.06Å; F189-M247 HydrophobicContact CZ-CE 3.21Å; F189-Y251 AromaticContact CD1-CD1 4Å; F189-Y251 HydrophobicContact CD1-CD1 4Å; F189-Y251 AromaticContact CD1-CE1 3.92Å; F189-Y251 HydrophobicContact CD1-CE1 3.92Å; F189-Y251 HydrophobicContact CD1-CG 4.41Å; F189-Y251 AromaticContact CE1-CD1 3.83Å; F189-Y251 HydrophobicContact CE1-CD1 3.83Å; F189-Y251 AromaticContact CE1-CD2 3.83Å; F189-Y251 HydrophobicContact CE1-CD2 3.83Å; F189-Y251 AromaticContact CE1-CE1 3.9Å; F189-Y251 HydrophobicContact CE1-CE1 3.9Å; F189-Y251 AromaticContact CE1-CE2 3.93Å; F189-Y251 HydrophobicContact CE1-CE2 3.93Å; F189-Y251 AromaticContact CE1-CG 3.8Å; F189-Y251 HydrophobicContact CE1-CG 3.8Å; F189-Y251 AromaticContact CE1-CZ 3.95Å; F189-Y251 HydrophobicContact CZ-CD2 4.47Å; F189-Y251 HydrophobicContact CZ-CE2 4.4Å
190	P	63.3	Low	67.6	Low	22 Å²	22	73 Å²	73	14%	0.143	38%	0.382	C	S	.	.			trans	-61.1	153.4	171.3	24.5	-34.5	0	0	0	112.3	S192 S200 Q203	P190-S192 VanDerWaalsContact C-N 3.31Å; P190-S192 PolarHBondContact O-N 3.45Å; P190-S200 WeakPolarHBondContact CG-O 3.45Å; P190-Q203 HydrophobicContact CB-CB 4.09Å; P190-Q203 VanDerWaalsContact CB-OE1 3.27Å
191	P	56.9	Low	67	Low	130 Å²	130	74.6 Å²	74.6	84%	0.844	39%	0.388	S	S	*	.	S	Bend	trans	-74.3	-13.9	-178.3	28.1	-32.6	0	0	0	114.4	Q203	P191-Q203 VanDerWaalsContact CD-OE1 3.32Å
192	S	55.3	Low	66.4	Low	61 Å²	61	76.3 Å²	76.3	43%	0.427	40%	0.398	S	S	.	.	S	Bend	trans	-97.8	147.4	178.1	59.8	0	0	0	0	112.1	P190 D194	P190-S192 VanDerWaalsContact C-N 3.31Å; P190-S192 PolarHBondContact O-N 3.45Å; S192-D194 PolarHBondContact O-N 2.87Å
193	K	54.5	Low	65.9	Low	201 Å²	201	74.4 Å²	74.4	87%	0.874	39%	0.39	S	S	*	.	S	Bend	trans	-76.9	-0.9	178.4	-73.2	-174.6	177.2	178.9	0	114.1	T195	K193-T195 PolarHBondContact O-N 3.34Å; K193-T195 VanDerWaalsContact O-N 3.09Å
194	D	46.9	Very low	65.9	Low	117 Å²	117	70 Å²	70	63%	0.626	37%	0.371	S	S	*	.			trans	-82.3	88.2	180	-69.3	-28.7	0	0	0	110	S192 S196	S192-D194 PolarHBondContact O-N 2.87Å; D194-S196 PolarHBondContact O-N 3.49Å; D194-S196 VanDerWaalsContact O-N 3.08Å
195	T	52.8	Low	66.2	Low	78 Å²	78	71.3 Å²	71.3	48%	0.479	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74	15.9	-174.7	40.9	0	0	0	0	115.6	K193 Y201	K193-T195 PolarHBondContact O-N 3.34Å; K193-T195 VanDerWaalsContact O-N 3.09Å; T195-Y201 PolarHBondContact O-OH 3.28Å
196	S	54.8	Low	66.3	Low	99 Å²	99	71 Å²	71	69%	0.692	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.6	5.8	-170.6	65.5	0	0	0	0	115.8	D194	D194-S196 PolarHBondContact O-N 3.49Å; D194-S196 VanDerWaalsContact O-N 3.08Å
197	S	60.9	Low	66.3	Low	46 Å²	46	69.4 Å²	69.4	32%	0.322	37%	0.365	S	S	.	.	S	Bend	trans	-93.3	146.8	176.4	66	0	0	0	0	111.6	E199 S200 Y201	S197-E199 PolarHBondContact O-N 3.45Å; S197-S200 PolarHBondContact N-OG 3.41Å; S197-S200 WeakPolarHBondContact O-CB 3.48Å; S197-S200 PolarHBondContact O-N 3.28Å; S197-S200 PolarHBondContact O-OG 2.9Å; S197-S200 WeakPolarHBondContact OG-CB 3.43Å; S197-S200 PolarHBondContact OG-N 3.32Å; S197-Y201 WeakPolarHBondContact O-CD2 3.45Å; S197-Y201 PolarHBondContact O-N 2.99Å
198	L	61.7	Low	66	Low	70 Å²	70	67.3 Å²	67.3	37%	0.366	36%	0.357	S	S	.	.	H	α-helix	trans	-55	-36	176.8	-168.7	72.4	0	0	0	111.9	S200 Y201 L202 L262	L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.27Å; L198-Y201 PolarHBondContact O-N 3.34Å; L198-L202 WeakPolarHBondContact O-CG 3.22Å; L198-L202 PolarHBondContact O-N 3.45Å; L198-L202 VanDerWaalsContact O-N 3.16Å; L198-L262 HydrophobicContact CD1-CD1 4.2Å; L198-L262 HydrophobicContact CD1-CD2 3.88Å; L198-L262 HydrophobicContact CD1-CG 3.81Å
199	E	60.5	Low	65.8	Low	145 Å²	145	66.1 Å²	66.1	68%	0.678	35%	0.35	S	S	*	.	H	α-helix	trans	-64.2	-34.5	175.4	-66.1	178.7	172.5	0	0	113.2	S197 Q203	S197-E199 PolarHBondContact O-N 3.45Å; E199-Q203 WeakPolarHBondContact O-CG 3.45Å; E199-Q203 PolarHBondContact O-N 3.43Å
200	S	63.5	Low	65.1	Low	6 Å²	6	63.9 Å²	63.9	4%	0.042	34%	0.344	C	S	.	.	H	α-helix	trans	-67.8	-35.9	176.7	77.1	0	0	0	0	111.9	P190 S197 L198 T204	P190-S200 WeakPolarHBondContact CG-O 3.45Å; S197-S200 PolarHBondContact N-OG 3.41Å; S197-S200 WeakPolarHBondContact O-CB 3.48Å; S197-S200 PolarHBondContact O-N 3.28Å; S197-S200 PolarHBondContact O-OG 2.9Å; S197-S200 WeakPolarHBondContact OG-CB 3.43Å; S197-S200 PolarHBondContact OG-N 3.32Å; L198-S200 VanDerWaalsContact C-N 3.34Å; L198-S200 PolarHBondContact O-N 3.27Å; S200-T204 PolarHBondContact O-OG1 2.92Å; S200-T204 VanDerWaalsContact O-OG1 3.12Å
201	Y	66.8	Low	64.6	Low	41 Å²	41	69.9 Å²	69.9	16%	0.161	37%	0.37	C	S	.	.	H	α-helix	trans	-72.1	-40.9	177.3	-60.8	-51.8	0	0	0	112	T195 S197 L198 Q203 T204 P255 L262 F276	T195-Y201 PolarHBondContact O-OH 3.28Å; S197-Y201 WeakPolarHBondContact O-CD2 3.45Å; S197-Y201 PolarHBondContact O-N 2.99Å; L198-Y201 PolarHBondContact O-N 3.34Å; Y201-Q203 PolarHBondContact O-N 2.98Å; Y201-T204 WeakPolarHBondContact O-CB 3.47Å; Y201-T204 PolarHBondContact O-N 2.97Å; Y201-P255 HydrophobicContact CD1-CB 3.76Å; Y201-P255 HydrophobicContact CD1-CG 3.57Å; Y201-P255 HydrophobicContact CD2-CB 4.43Å; Y201-P255 HydrophobicContact CE1-CB 3.92Å; Y201-P255 HydrophobicContact CE1-CG 3.43Å; Y201-P255 VanDerWaalsContact CE1-CG 3.43Å; Y201-P255 HydrophobicContact CG-CB 4.06Å; Y201-P255 HydrophobicContact CG-CG 4.37Å; Y201-L262 HydrophobicContact CD2-CD1 3.84Å; Y201-L262 HydrophobicContact CG-CD1 3.96Å; Y201-F276 WeakPolarHBondContact O-CD2 3.34Å
202	L	69.9	Low	64.2	Low	61 Å²	61	69.7 Å²	69.7	32%	0.319	36%	0.358	S	S	.	.	H	α-helix	trans	-62	-24	177.6	-68	171.8	0	0	0	113.8	L198 L262 F276	L198-L202 WeakPolarHBondContact O-CG 3.22Å; L198-L202 PolarHBondContact O-N 3.45Å; L198-L202 VanDerWaalsContact O-N 3.16Å; L202-L262 HydrophobicContact CD2-CD2 3.93Å; L202-L262 HydrophobicContact CG-CD2 4.35Å; L202-F276 HydrophobicContact CD2-CB 4.15Å; L202-F276 VanDerWaalsContact CD2-O 3.27Å; L202-F276 WeakPolarHBondContact CD2-O 3.25Å
203	Q	68.6	Low	63.2	Low	99 Å²	99	70.8 Å²	70.8	46%	0.463	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	-2.9	176.9	-66.4	177.5	7.7	0	0	113.4	P190 P191 E199 Y201	P190-Q203 HydrophobicContact CB-CB 4.09Å; P190-Q203 VanDerWaalsContact CB-OE1 3.27Å; P191-Q203 VanDerWaalsContact CD-OE1 3.32Å; E199-Q203 WeakPolarHBondContact O-CG 3.45Å; E199-Q203 PolarHBondContact O-N 3.43Å; Y201-Q203 PolarHBondContact O-N 2.98Å
204	T	78.8	Confident	62.6	Low	3 Å²	3	69.1 Å²	69.1	2%	0.018	36%	0.36	C	S	.	.			trans	-83.1	121.5	178.1	-57.9	0	0	0	0	109.8	K188 S200 Y201 F276	K188-T204 WeakPolarHBondContact O-CA 3.4Å; S200-T204 PolarHBondContact O-OG1 2.92Å; S200-T204 VanDerWaalsContact O-OG1 3.12Å; Y201-T204 WeakPolarHBondContact O-CB 3.47Å; Y201-T204 PolarHBondContact O-N 2.97Å; T204-F276 HydrophobicContact CG2-CE2 4.42Å
205	E	80.9	Confident	62.2	Low	32 Å²	32	72.6 Å²	72.6	15%	0.15	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	135	176.7	-47.4	-176.8	161.8	0	0	110.3	K188 H207 V273 I274 R275	K188-E205 HydrophobicContact CB-CB 4.18Å; K188-E205 PolarHBondContact N-O 2.87Å; K188-E205 IonicContact NZ-OE2 2.82Å; K188-E205 PolarHBondContact O-N 2.64Å; K188-E205 VanDerWaalsContact O-N 3.15Å; E205-H207 WeakPolarHBondContact CB-NE2 3.07Å; E205-H207 IonicContact OE2-CD2 2.83Å; E205-H207 IonicContact OE2-CE1 3.31Å; E205-H207 PolarHBondContact OE2-CE1 3.1Å; E205-H207 IonicContact OE2-NE2 2.79Å; E205-H207 PolarHBondContact OE2-NE2 3.36Å; E205-V273 HydrophobicContact CB-CG1 4.26Å; E205-I274 WeakPolarHBondContact CA-O 3.31Å; E205-R275 HydrophobicContact CG-CG 4.08Å; E205-R275 IonicContact OE1-CZ 3.45Å; E205-R275 IonicContact OE1-NE 3.33Å; E205-R275 PolarHBondContact OE1-NE 2.99Å; E205-R275 IonicContact OE1-NH2 2.74Å; E205-R275 PolarHBondContact OE1-NH2 3.41Å; E205-R275 VanDerWaalsContact OE1-NH2 3.15Å; E205-R275 IonicContact OE2-CZ 2.95Å; E205-R275 IonicContact OE2-NE 3.85Å; E205-R275 IonicContact OE2-NH2 3.24Å; E205-R275 PolarHBondContact OE2-NH2 3.49Å
206	L	82.1	Confident	61.7	Low	1 Å²	1	77.9 Å²	77.9	1%	0.005	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	120.5	169.5	172.9	63.5	0	0	0	109.3	I185 W187 L208 I252 V273 I274 L302	I185-L206 HydrophobicContact CG2-CD1 3.79Å; W187-L206 HydrophobicContact CD2-CD1 3.86Å; W187-L206 HydrophobicContact CE3-CB 4.31Å; W187-L206 HydrophobicContact CE3-CD1 4.04Å; W187-L206 HydrophobicContact CG-CD1 4.49Å; W187-L206 HydrophobicContact CH2-CD1 3.91Å; W187-L206 HydrophobicContact CH2-CD2 3.96Å; W187-L206 HydrophobicContact CH2-CG 4.37Å; W187-L206 HydrophobicContact CZ2-CD1 3.72Å; W187-L206 HydrophobicContact CZ2-CD2 4.36Å; W187-L206 HydrophobicContact CZ3-CB 4.12Å; W187-L206 HydrophobicContact CZ3-CD1 4.07Å; W187-L206 HydrophobicContact CZ3-CD2 4.36Å; W187-L206 HydrophobicContact CZ3-CG 4.42Å; L206-L208 HydrophobicContact CD1-CD2 4.27Å; L206-L208 HydrophobicContact CD2-CD2 4.48Å; L206-L208 HydrophobicContact CG-CD2 4.33Å; L206-L208 HydrophobicContact CG-CG 4.39Å; L206-I252 HydrophobicContact CB-CD1 3.85Å; L206-I252 HydrophobicContact CD2-CD1 3.76Å; L206-I252 HydrophobicContact CG-CD1 4.45Å; L206-V273 CarbonylContact O-C 3.6Å; L206-V273 WeakPolarHBondContact O-CA 3.14Å; L206-I274 HydrophobicContact CB-CB 4.31Å; L206-I274 HydrophobicContact CD2-CD1 4.22Å; L206-I274 PolarHBondContact N-O 3.45Å; L206-I274 PolarHBondContact O-N 3.16Å; L206-L302 HydrophobicContact CD2-CD2 4.46Å
207	H	79.6	Confident	60.8	Low	12 Å²	12	81.3 Å²	81.3	6%	0.056	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	120.4	-179.4	-65.1	-139.6	0	0	0	108.8	V186 E205 Y209 I272 V273	V186-H207 HydrophobicContact CB-CB 4.2Å; V186-H207 PolarHBondContact N-O 3.22Å; V186-H207 PolarHBondContact O-N 2.91Å; E205-H207 WeakPolarHBondContact CB-NE2 3.07Å; E205-H207 IonicContact OE2-CD2 2.83Å; E205-H207 IonicContact OE2-CE1 3.31Å; E205-H207 PolarHBondContact OE2-CE1 3.1Å; E205-H207 IonicContact OE2-NE2 2.79Å; E205-H207 PolarHBondContact OE2-NE2 3.36Å; H207-Y209 HydrophobicContact CB-CD2 4.39Å; H207-Y209 HydrophobicContact CB-CE2 3.62Å; H207-I272 WeakPolarHBondContact CA-O 3.29Å; H207-V273 WeakPolarHBondContact NE2-CG1 3.49Å
208	L	76.6	Confident	59.9	Low	4 Å²	4	89.5 Å²	89.5	2%	0.021	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.6	174.8	-56.9	172	0	0	0	108.7	I185 L206 I272 L302 L306	I185-L208 HydrophobicContact CD1-CD2 4.45Å; I185-L208 HydrophobicContact CG1-CD2 3.97Å; I185-L208 HydrophobicContact CG2-CD2 4.24Å; L206-L208 HydrophobicContact CD1-CD2 4.27Å; L206-L208 HydrophobicContact CD2-CD2 4.48Å; L206-L208 HydrophobicContact CG-CD2 4.33Å; L206-L208 HydrophobicContact CG-CG 4.39Å; L208-I272 HydrophobicContact CB-CB 4.31Å; L208-I272 PolarHBondContact N-O 2.79Å; L208-I272 PolarHBondContact O-N 2.95Å; L208-L302 HydrophobicContact CD1-CD2 3.81Å; L208-L306 HydrophobicContact CD2-CD1 4.2Å
209	Y	72.9	Confident	59.2	Low	72 Å²	72	89.4 Å²	89.4	28%	0.282	43%	0.426	S	S	.	.			trans	-100	111.4	179.8	-64	-99.1	0	0	0	109	K183 L184 V186 H207 N271	K183-Y209 WeakPolarHBondContact O-CD2 3.35Å; L184-Y209 WeakPolarHBondContact CD2-O 3.47Å; L184-Y209 PolarHBondContact O-N 2.95Å; V186-Y209 HydrophobicContact CB-CE2 4.22Å; V186-Y209 HydrophobicContact CG2-CD2 4.49Å; V186-Y209 HydrophobicContact CG2-CE2 3.83Å; H207-Y209 HydrophobicContact CB-CD2 4.39Å; H207-Y209 HydrophobicContact CB-CE2 3.62Å; Y209-N271 HydrophobicContact CD1-CB 4Å; Y209-N271 WeakPolarHBondContact CD1-ND2 3.38Å; Y209-N271 WeakPolarHBondContact CD1-OD1 3Å; Y209-N271 HydrophobicContact CE1-CB 4.15Å; Y209-N271 WeakPolarHBondContact CE1-ND2 3.04Å; Y209-N271 HydrophobicContact CG-CB 4.43Å
210	T	60.2	Low	59	Low	41 Å²	41	87.2 Å²	87.2	25%	0.252	43%	0.425	S	S	.	.			trans	-105.4	-31.3	-173	32.9	0	0	0	0	114.9
211	E	53.5	Low	58.7	Low	148 Å²	148	90.7 Å²	90.7	69%	0.692	44%	0.441	S	S	*	.	S	Bend	trans	-164.8	145.1	167.4	-118.4	170.9	-165.5	0	0	115.3
212	Q	46.8	Very low	58.6	Low	126 Å²	126	89.5 Å²	89.5	59%	0.589	44%	0.439	S	S	*	.			trans	0.5	100.8	174.6	-61	178.1	5.4	0	0	119.3	H214	Q212-H214 PolarHBondContact O-N 2.86Å
213	S	35.2	Very low	58.6	Low	84 Å²	84	89.4 Å²	89.4	59%	0.587	44%	0.442	S	S	*	.			trans	-83.3	107	148.8	58.4	0	0	0	0	109.4	K215	S213-K215 PolarHBondContact O-N 2.96Å
214	H	41	Very low	58.8	Low	166 Å²	166	85.2 Å²	85.2	77%	0.769	42%	0.422	S	S	*	.			trans	-53	102.5	163.2	-78.7	-78	0	0	0	109.5	Q212	Q212-H214 PolarHBondContact O-N 2.86Å
215	K	39.8	Very low	58.5	Low	190 Å²	190	86.7 Å²	86.7	83%	0.826	43%	0.433	S	S	*	.	S	Bend	trans	-174.2	113.1	143.2	-99.2	157.2	-171.5	-172.5	0	110.3	S213	S213-K215 PolarHBondContact O-N 2.96Å
216	E	40.9	Very low	58.2	Low	189 Å²	189	86.1 Å²	86.1	88%	0.883	43%	0.432	S	S	*	.	S	Bend	trans	73.1	37.2	150.1	-59.9	-175.9	169.3	0	0	120.7
217	E	37.8	Very low	58	Low	171 Å²	171	86 Å²	86	80%	0.799	43%	0.432	S	S	*	.			trans	-133.3	131.2	151.4	-76.2	-168.5	165.1	0	0	111.5	T219	E217-T219 PolarHBondContact O-N 2.64Å
218	K	42	Very low	57.9	Low	219 Å²	219	85.6 Å²	85.6	95%	0.952	43%	0.43	S	S	*	.	S	Bend	trans	-70.3	11.8	-170.7	-76.7	-178.7	175.5	177.1	0	115.2
219	T	46.2	Very low	57.9	Low	67 Å²	67	87.2 Å²	87.2	41%	0.411	44%	0.438	S	S	.	.	S	Bend	trans	-137.9	129.8	177.9	58.4	0	0	0	0	111.3	K129 E217	K129-T219 PolarHBondContact NZ-OG1 3.16Å; E217-T219 PolarHBondContact O-N 2.64Å
220	P	55.8	Low	58.2	Low	99 Å²	99	83.8 Å²	83.8	64%	0.643	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.7	136.6	178.1	25.8	-31.8	0	0	0	110.8
221	M	57.7	Low	59.2	Low	79 Å²	79	81.8 Å²	81.8	39%	0.389	41%	0.413	S	S	.	.	P	Polyproline II helix	trans	-76.8	134.7	175.8	-158	173	167.6	0	0	109	K183 L184	K183-M221 HydrophobicContact CB-CE 3.37Å; K183-M221 HydrophobicContact CD-CE 4.34Å; K183-M221 HydrophobicContact CG-CE 4.5Å; L184-M221 HydrophobicContact CD2-CE 3.59Å; L184-M221 HydrophobicContact CG-CE 3.73Å
222	P	65.3	Low	60.5	Low	16 Å²	16	77 Å²	77	10%	0.104	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-68.3	145.3	-179.2	31.5	-39.3	0	0	0	111.2	Y131 E180 S226 V227	Y131-P222 HydrophobicContact CD2-CB 4.27Å; Y131-P222 HydrophobicContact CD2-CG 4.14Å; Y131-P222 HydrophobicContact CE2-CB 4.38Å; Y131-P222 HydrophobicContact CE2-CG 3.86Å; E180-P222 HydrophobicContact CG-CG 4.34Å; E180-P222 WeakPolarHBondContact OE2-CD 3.49Å; P222-S226 WeakPolarHBondContact CB-OG 3.27Å; P222-V227 HydrophobicContact CB-CG2 4.49Å; P222-V227 HydrophobicContact CG-CG2 4.12Å
223	P	68.6	Low	62	Low	59 Å²	59	73 Å²	73	38%	0.383	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-65.5	147.3	176.1	27.3	-33.4	0	0	0	110.7	S225 S226 V227	P223-S225 PolarHBondContact O-N 3.31Å; P223-S225 VanDerWaalsContact O-N 3.12Å; P223-S226 WeakPolarHBondContact CD-OG 3.43Å; P223-S226 WeakPolarHBondContact O-CB 3.41Å; P223-S226 PolarHBondContact O-N 3.29Å; P223-S226 PolarHBondContact O-OG 3.16Å; P223-V227 PolarHBondContact O-N 3.47Å
224	I	73.8	Confident	64.2	Low	11 Å²	11	69.9 Å²	69.9	6%	0.056	36%	0.356	C	S	.	.	H	α-helix	trans	-57	-31.5	-177.9	-165.6	161.3	0	0	0	113.1	L184 I185 S226 V227 L228 L306 L309	L184-I224 HydrophobicContact CB-CD1 4.31Å; L184-I224 HydrophobicContact CD1-CB 4.12Å; L184-I224 HydrophobicContact CD1-CG1 4.08Å; I185-I224 HydrophobicContact CD1-CD1 4.41Å; I185-I224 HydrophobicContact CG1-CD1 4.34Å; I224-S226 VanDerWaalsContact C-N 3.33Å; I224-S226 PolarHBondContact O-N 3.01Å; I224-V227 PolarHBondContact O-N 3.09Å; I224-L228 HydrophobicContact CG1-CD1 4.13Å; I224-L228 HydrophobicContact CG1-CG 4.43Å; I224-L228 WeakPolarHBondContact O-CB 3.44Å; I224-L228 WeakPolarHBondContact O-CG 3.37Å; I224-L228 PolarHBondContact O-N 3.39Å; I224-L306 HydrophobicContact CD1-CD1 3.57Å; I224-L306 HydrophobicContact CD1-CG 4.26Å; I224-L309 HydrophobicContact CG2-CD1 4.06Å
225	S	71.9	Confident	66	Low	34 Å²	34	64.8 Å²	64.8	24%	0.238	35%	0.348	C	S	.	.	H	α-helix	trans	-57.5	-42.9	173.1	54.9	0	0	0	0	112.3	P223 V227 L228 L229	P223-S225 PolarHBondContact O-N 3.31Å; P223-S225 VanDerWaalsContact O-N 3.12Å; S225-V227 PolarHBondContact O-N 2.83Å; S225-L228 PolarHBondContact O-N 2.81Å; S225-L229 VanDerWaalsContact O-CB 3.31Å; S225-L229 WeakPolarHBondContact O-CB 3.4Å; S225-L229 WeakPolarHBondContact O-CG 3.25Å; S225-L229 PolarHBondContact O-N 2.96Å
226	S	73.9	Confident	68	Low	20 Å²	20	58.7 Å²	58.7	14%	0.14	32%	0.323	C	S	.	.	H	α-helix	trans	-68.7	-34.2	179.8	71	0	0	0	0	112.8	V132 P222 P223 I224 A230	V132-S226 VanDerWaalsContact CG2-O 3.3Å; V132-S226 WeakPolarHBondContact CG2-O 3.37Å; P222-S226 WeakPolarHBondContact CB-OG 3.27Å; P223-S226 WeakPolarHBondContact CD-OG 3.43Å; P223-S226 WeakPolarHBondContact O-CB 3.41Å; P223-S226 PolarHBondContact O-N 3.29Å; P223-S226 PolarHBondContact O-OG 3.16Å; I224-S226 VanDerWaalsContact C-N 3.33Å; I224-S226 PolarHBondContact O-N 3.01Å; S226-A230 WeakPolarHBondContact O-CB 3.47Å; S226-A230 PolarHBondContact O-N 3.12Å
227	V	79.7	Confident	69.9	Low	0 Å²	0	50.4 Å²	50.4	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-70.9	-43.4	175.9	176.1	0	0	0	0	110.4	L177 E180 W181 L184 P222 P223 I224 S225 A230 F231	L177-V227 HydrophobicContact CD2-CB 4.49Å; L177-V227 HydrophobicContact CD2-CG1 4.05Å; E180-V227 HydrophobicContact CB-CG2 4.29Å; W181-V227 HydrophobicContact CE3-CG1 4.44Å; L184-V227 HydrophobicContact CD1-CB 4.27Å; L184-V227 HydrophobicContact CD1-CG2 3.84Å; P222-V227 HydrophobicContact CB-CG2 4.49Å; P222-V227 HydrophobicContact CG-CG2 4.12Å; P223-V227 PolarHBondContact O-N 3.47Å; I224-V227 PolarHBondContact O-N 3.09Å; S225-V227 PolarHBondContact O-N 2.83Å; V227-A230 PolarHBondContact O-N 2.71Å; V227-F231 HydrophobicContact CG1-CD2 3.89Å; V227-F231 HydrophobicContact CG1-CE2 3.62Å; V227-F231 WeakPolarHBondContact O-CD2 3.33Å; V227-F231 PolarHBondContact O-N 3.16Å
228	L	77.3	Confident	72	Confident	2 Å²	2	47.5 Å²	47.5	1%	0.01	27%	0.271	C	S	.	.	H	α-helix	trans	-65.3	-41.1	176.2	-72.8	169.6	0	0	0	112.3	W181 I224 S225 F231 S232 L237 L309 L325	W181-L228 HydrophobicContact CH2-CD2 4.02Å; W181-L228 HydrophobicContact CZ3-CD2 3.57Å; W181-L228 HydrophobicContact CZ3-CG 4.18Å; I224-L228 HydrophobicContact CG1-CD1 4.13Å; I224-L228 HydrophobicContact CG1-CG 4.43Å; I224-L228 WeakPolarHBondContact O-CB 3.44Å; I224-L228 WeakPolarHBondContact O-CG 3.37Å; I224-L228 PolarHBondContact O-N 3.39Å; S225-L228 PolarHBondContact O-N 2.81Å; L228-F231 PolarHBondContact O-N 3.46Å; L228-S232 PolarHBondContact O-N 2.98Å; L228-L237 HydrophobicContact CD2-CD1 3.69Å; L228-L309 HydrophobicContact CD1-CD1 4.43Å; L228-L325 HydrophobicContact CD1-CD1 4.14Å
229	L	75.9	Confident	73.8	Confident	38 Å²	38	39.6 Å²	39.6	20%	0.199	24%	0.243	C	C	.	.	H	α-helix	trans	-61.3	-43.9	172.3	-77.9	167.7	0	0	0	111.6	V132 S225 F231 S232 V233 L311	V132-L229 HydrophobicContact CG2-CB 3.99Å; S225-L229 VanDerWaalsContact O-CB 3.31Å; S225-L229 WeakPolarHBondContact O-CB 3.4Å; S225-L229 WeakPolarHBondContact O-CG 3.25Å; S225-L229 PolarHBondContact O-N 2.96Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 PolarHBondContact O-N 3.35Å; L229-S232 PolarHBondContact O-N 3.37Å; L229-S232 VanDerWaalsContact O-N 3.16Å; L229-S232 PolarHBondContact O-OG 2.91Å; L229-V233 WeakPolarHBondContact O-CG2 3.33Å; L229-V233 PolarHBondContact O-N 3.44Å; L229-L311 HydrophobicContact CD1-CD2 4.32Å; L229-L311 HydrophobicContact CD2-CB 3.64Å; L229-L311 HydrophobicContact CD2-CD2 3.3Å; L229-L311 HydrophobicContact CD2-CG 3.97Å; L229-L311 HydrophobicContact CG-CD2 3.42Å; L229-L311 VanDerWaalsContact CG-CD2 3.42Å
230	A	79.6	Confident	75.5	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64	-39.8	176.9	0	0	0	0	0	111.9	A135 L177 S226 V227 S232 L234	A135-A230 HydrophobicContact CB-CB 4.24Å; L177-A230 HydrophobicContact CD1-CB 3.89Å; L177-A230 HydrophobicContact CD2-CB 3.71Å; L177-A230 HydrophobicContact CG-CB 4.45Å; S226-A230 WeakPolarHBondContact O-CB 3.47Å; S226-A230 PolarHBondContact O-N 3.12Å; V227-A230 PolarHBondContact O-N 2.71Å; A230-S232 VanDerWaalsContact C-N 3.31Å; A230-S232 PolarHBondContact O-N 2.95Å; A230-L234 WeakPolarHBondContact O-CB 2.85Å; A230-L234 VanDerWaalsContact O-CG 3.27Å; A230-L234 WeakPolarHBondContact O-CG 3.12Å; A230-L234 PolarHBondContact O-N 2.95Å; A230-L234 VanDerWaalsContact O-N 3.14Å
231	F	81.5	Confident	76.8	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-32.2	172.7	-79.9	-56.5	0	0	0	113.4	L174 L177 W181 V227 L228 L229 G235 E236 L237 K240	L174-F231 HydrophobicContact CD2-CD1 4.07Å; L174-F231 HydrophobicContact CD2-CE1 3.87Å; L177-F231 HydrophobicContact CB-CE1 3.79Å; L177-F231 HydrophobicContact CB-CE2 4.06Å; L177-F231 HydrophobicContact CB-CZ 3.51Å; L177-F231 HydrophobicContact CD1-CD1 4.26Å; L177-F231 HydrophobicContact CD1-CE1 4.22Å; W181-F231 HydrophobicContact CB-CE2 4.22Å; W181-F231 HydrophobicContact CE3-CE2 4.45Å; V227-F231 HydrophobicContact CG1-CD2 3.89Å; V227-F231 HydrophobicContact CG1-CE2 3.62Å; V227-F231 WeakPolarHBondContact O-CD2 3.33Å; V227-F231 PolarHBondContact O-N 3.16Å; L228-F231 PolarHBondContact O-N 3.46Å; L229-F231 VanDerWaalsContact C-N 3.34Å; L229-F231 PolarHBondContact O-N 3.35Å; F231-G235 PolarHBondContact O-N 3.21Å; F231-E236 HydrophobicContact CD1-CB 4.15Å; F231-E236 PolarHBondContact O-N 3.45Å; F231-L237 HydrophobicContact CB-CB 4.16Å; F231-L237 HydrophobicContact CB-CD1 4.3Å; F231-L237 PolarHBondContact O-N 3.17Å; F231-L237 VanDerWaalsContact O-N 3.15Å; F231-K240 HydrophobicContact CD1-CG 4.24Å; F231-K240 HydrophobicContact CE1-CG 4.05Å; F231-K240 HydrophobicContact CE2-CG 4.47Å; F231-K240 HydrophobicContact CZ-CD 4.43Å; F231-K240 HydrophobicContact CZ-CG 4.16Å
232	S	79.8	Confident	78	Confident	46 Å²	46	36.1 Å²	36.1	32%	0.322	21%	0.21	S	C	.	.	H	α-helix	trans	-68.9	-47.1	177.5	81.7	0	0	0	0	111.2	L228 L229 A230 L234 G235	L228-S232 PolarHBondContact O-N 2.98Å; L229-S232 PolarHBondContact O-N 3.37Å; L229-S232 VanDerWaalsContact O-N 3.16Å; L229-S232 PolarHBondContact O-OG 2.91Å; A230-S232 VanDerWaalsContact C-N 3.31Å; A230-S232 PolarHBondContact O-N 2.95Å; S232-L234 VanDerWaalsContact C-N 3.27Å; S232-L234 PolarHBondContact O-N 3.29Å; S232-G235 PolarHBondContact O-N 3.45Å
233	V	78.8	Confident	78.9	Confident	44 Å²	44	37.9 Å²	37.9	27%	0.267	22%	0.223	S	C	.	.	H	α-helix	trans	-60	-37.6	176.8	175	0	0	0	0	111.3	A135 E139 L229 G235	A135-V233 HydrophobicContact CB-CB 4.05Å; A135-V233 HydrophobicContact CB-CG1 3.89Å; E139-V233 HydrophobicContact CB-CG1 4.27Å; L229-V233 WeakPolarHBondContact O-CG2 3.33Å; L229-V233 PolarHBondContact O-N 3.44Å; V233-G235 VanDerWaalsContact C-N 3.3Å; V233-G235 PolarHBondContact O-N 3.5Å
234	L	80.8	Confident	79.7	Confident	18 Å²	18	35.3 Å²	35.3	9%	0.094	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-7.6	178.6	-65.7	172.6	0	0	0	114.5	A135 L138 K170 I173 L174 L177 A230 S232 E236	A135-L234 HydrophobicContact CB-CD1 4.41Å; A135-L234 HydrophobicContact CB-CD2 4.21Å; A135-L234 HydrophobicContact CB-CG 4Å; L138-L234 HydrophobicContact CD1-CD2 4.43Å; K170-L234 PolarHBondContact NZ-O 3.48Å; I173-L234 HydrophobicContact CD1-CD1 4.29Å; I173-L234 HydrophobicContact CG1-CD1 4.42Å; I173-L234 HydrophobicContact CG2-CD1 3.61Å; I173-L234 HydrophobicContact CG2-CD2 4.26Å; L174-L234 HydrophobicContact CD2-CD1 3.95Å; L174-L234 HydrophobicContact CG-CD1 4.44Å; L177-L234 HydrophobicContact CD1-CD1 3.57Å; A230-L234 WeakPolarHBondContact O-CB 2.85Å; A230-L234 VanDerWaalsContact O-CG 3.27Å; A230-L234 WeakPolarHBondContact O-CG 3.12Å; A230-L234 PolarHBondContact O-N 2.95Å; A230-L234 VanDerWaalsContact O-N 3.14Å; S232-L234 VanDerWaalsContact C-N 3.27Å; S232-L234 PolarHBondContact O-N 3.29Å; L234-E236 VanDerWaalsContact C-N 3.33Å
235	G	79.6	Confident	80.1	Confident	58 Å²	58	34.9 Å²	34.9	60%	0.598	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	14	-178.6	0	0	0	0	0	115.4	F231 S232 V233	F231-G235 PolarHBondContact O-N 3.21Å; S232-G235 PolarHBondContact O-N 3.45Å; V233-G235 VanDerWaalsContact C-N 3.3Å; V233-G235 PolarHBondContact O-N 3.5Å
236	E	81.8	Confident	80.8	Confident	62 Å²	62	38.7 Å²	38.7	29%	0.29	22%	0.218	S	C	.	.			trans	-103.6	0.1	-176.6	-67.2	-61.6	156.8	0	0	113.5	K170 L174 F231 L234 H238 S239 K240	K170-E236 IonicContact NZ-OE1 2.95Å; L174-E236 HydrophobicContact CD1-CG 4.08Å; L174-E236 HydrophobicContact CD2-CB 4.04Å; L174-E236 HydrophobicContact CD2-CG 3.78Å; F231-E236 HydrophobicContact CD1-CB 4.15Å; F231-E236 PolarHBondContact O-N 3.45Å; L234-E236 VanDerWaalsContact C-N 3.33Å; E236-H238 VanDerWaalsContact C-N 3.31Å; E236-H238 PolarHBondContact O-N 2.91Å; E236-S239 PolarHBondContact O-N 3.34Å; E236-S239 PolarHBondContact O-OG 2.98Å; E236-S239 PolarHBondContact OE2-OG 3.04Å; E236-S239 VanDerWaalsContact OE2-OG 3.07Å; E236-K240 PolarHBondContact O-N 3.28Å
237	L	80.9	Confident	81.2	Confident	15 Å²	15	40.4 Å²	40.4	8%	0.079	22%	0.224	C	C	.	.	H	α-helix	trans	-57.5	-42.1	-179.6	179.5	62.7	0	0	0	112.9	L228 F231 S239 K240 L241 L325 M328	L228-L237 HydrophobicContact CD2-CD1 3.69Å; F231-L237 HydrophobicContact CB-CB 4.16Å; F231-L237 HydrophobicContact CB-CD1 4.3Å; F231-L237 PolarHBondContact O-N 3.17Å; F231-L237 VanDerWaalsContact O-N 3.15Å; L237-S239 PolarHBondContact O-N 3.35Å; L237-K240 PolarHBondContact O-N 3.47Å; L237-L241 HydrophobicContact CD1-CD1 3.88Å; L237-L241 HydrophobicContact CD1-CG 4Å; L237-L241 HydrophobicContact CD2-CD1 4.47Å; L237-L241 HydrophobicContact CG-CD1 3.83Å; L237-L241 HydrophobicContact CG-CG 4.34Å; L237-L241 WeakPolarHBondContact O-CB 3.25Å; L237-L241 WeakPolarHBondContact O-CG 3.27Å; L237-L241 PolarHBondContact O-N 3.46Å; L237-L325 HydrophobicContact CD1-CD2 4.26Å; L237-L325 HydrophobicContact CD2-CD2 3.64Å; L237-L325 HydrophobicContact CG-CD2 4.36Å; L237-M328 HydrophobicContact CD2-CE 3.81Å; L237-M328 HydrophobicContact CG-CE 4.37Å
238	H	81	Confident	81.5	Confident	111 Å²	111	40.4 Å²	40.4	51%	0.514	22%	0.224	S	C	.	.	H	α-helix	trans	-63.1	-41.3	-179.4	-175.1	89.4	0	0	0	112.2	E236 K242 M332	E236-H238 VanDerWaalsContact C-N 3.31Å; E236-H238 PolarHBondContact O-N 2.91Å; H238-K242 VanDerWaalsContact O-CB 3.27Å; H238-K242 WeakPolarHBondContact O-CB 3.25Å; H238-K242 PolarHBondContact O-N 3.41Å; H238-M332 WeakPolarHBondContact CE1-CE 3.37Å; H238-M332 WeakPolarHBondContact ND1-CE 3.36Å; H238-M332 WeakPolarHBondContact NE2-CE 3.44Å; H238-M332 WeakPolarHBondContact O-CE 3.38Å
239	S	81	Confident	81.8	Confident	53 Å²	53	40.8 Å²	40.8	37%	0.371	23%	0.226	S	C	.	.	H	α-helix	trans	-67.5	-38.7	-179.6	68.6	0	0	0	0	111.4	E236 L237 S243	E236-S239 PolarHBondContact O-N 3.34Å; E236-S239 PolarHBondContact O-OG 2.98Å; E236-S239 PolarHBondContact OE2-OG 3.04Å; E236-S239 VanDerWaalsContact OE2-OG 3.07Å; L237-S239 PolarHBondContact O-N 3.35Å; S239-S243 PolarHBondContact O-N 3.35Å; S239-S243 VanDerWaalsContact O-N 3.16Å
240	K	82	Confident	82.2	Confident	65 Å²	65	43.9 Å²	43.9	28%	0.283	24%	0.238	S	C	.	.	H	α-helix	trans	-69	-48.5	176.1	-66.7	-62.8	-176.5	178.8	0	112.5	F231 E236 L237 K242 S243 F244	F231-K240 HydrophobicContact CD1-CG 4.24Å; F231-K240 HydrophobicContact CE1-CG 4.05Å; F231-K240 HydrophobicContact CE2-CG 4.47Å; F231-K240 HydrophobicContact CZ-CD 4.43Å; F231-K240 HydrophobicContact CZ-CG 4.16Å; E236-K240 PolarHBondContact O-N 3.28Å; L237-K240 PolarHBondContact O-N 3.47Å; K240-K242 VanDerWaalsContact C-N 3.26Å; K240-K242 PolarHBondContact O-N 2.86Å; K240-S243 PolarHBondContact O-N 3.21Å; K240-S243 VanDerWaalsContact O-N 3.17Å; K240-S243 PolarHBondContact O-OG 3.09Å; K240-F244 PolarHBondContact O-N 3.29Å
241	L	82.1	Confident	82.2	Confident	1 Å²	1	45.8 Å²	45.8	1%	0.005	25%	0.246	C	C	.	.	H	α-helix	trans	-60.3	-37.4	176	-74.5	175.3	0	0	0	112	L237 F244 G245 L325 M328 M332	L237-L241 HydrophobicContact CD1-CD1 3.88Å; L237-L241 HydrophobicContact CD1-CG 4Å; L237-L241 HydrophobicContact CD2-CD1 4.47Å; L237-L241 HydrophobicContact CG-CD1 3.83Å; L237-L241 HydrophobicContact CG-CG 4.34Å; L237-L241 WeakPolarHBondContact O-CB 3.25Å; L237-L241 WeakPolarHBondContact O-CG 3.27Å; L237-L241 PolarHBondContact O-N 3.46Å; L241-F244 PolarHBondContact O-N 2.88Å; L241-G245 PolarHBondContact O-N 3.12Å; L241-L325 HydrophobicContact CD1-CD2 4.1Å; L241-M328 HydrophobicContact CD1-CB 4.38Å; L241-M328 HydrophobicContact CD1-CE 3.78Å; L241-M332 HydrophobicContact CB-SD 4.32Å
242	K	82.8	Confident	82.3	Confident	105 Å²	105	45.9 Å²	45.9	46%	0.457	25%	0.246	S	C	.	.	H	α-helix	trans	-60.7	-47.4	174.3	-172.9	175	-177.3	172.8	0	112.3	H238 K240 F244 G245 Q246 M332	H238-K242 VanDerWaalsContact O-CB 3.27Å; H238-K242 WeakPolarHBondContact O-CB 3.25Å; H238-K242 PolarHBondContact O-N 3.41Å; K240-K242 VanDerWaalsContact C-N 3.26Å; K240-K242 PolarHBondContact O-N 2.86Å; K242-F244 VanDerWaalsContact C-N 3.32Å; K242-F244 PolarHBondContact O-N 3.17Å; K242-G245 PolarHBondContact O-N 3.41Å; K242-Q246 WeakPolarHBondContact O-CG 3.38Å; K242-Q246 PolarHBondContact O-N 3.41Å; K242-M332 WeakPolarHBondContact CA-SD 3.43Å; K242-M332 HydrophobicContact CB-CE 3.81Å; K242-M332 HydrophobicContact CB-SD 3.78Å; K242-M332 HydrophobicContact CG-SD 4.37Å; K242-M332 PolarHBondContact N-SD 3.24Å
243	S	83.8	Confident	82.5	Confident	54 Å²	54	43.7 Å²	43.7	38%	0.378	23%	0.231	S	C	.	.	H	α-helix	trans	-62.4	-40.8	177.3	71.3	0	0	0	0	111.9	S239 K240 M247	S239-S243 PolarHBondContact O-N 3.35Å; S239-S243 VanDerWaalsContact O-N 3.16Å; K240-S243 PolarHBondContact O-N 3.21Å; K240-S243 VanDerWaalsContact O-N 3.17Å; K240-S243 PolarHBondContact O-OG 3.09Å; S243-M247 VanDerWaalsContact O-CG 3.26Å; S243-M247 WeakPolarHBondContact O-CG 3.49Å; S243-M247 PolarHBondContact O-N 3.14Å
244	F	85.5	Confident	82.7	Confident	5 Å²	5	46.9 Å²	46.9	2%	0.022	24%	0.238	C	C	.	.	H	α-helix	trans	-64.8	-47.3	176.4	175.9	-100	0	0	0	112	W181 I185 W187 K240 L241 K242 Q246 M247 L248 L302 L329	W181-F244 HydrophobicContact CZ2-CB 4.25Å; W181-F244 HydrophobicContact CZ2-CD2 4.43Å; W181-F244 HydrophobicContact CZ2-CG 4.45Å; I185-F244 HydrophobicContact CD1-CD2 4.17Å; I185-F244 HydrophobicContact CD1-CE2 4.08Å; I185-F244 HydrophobicContact CG2-CD2 4.13Å; I185-F244 HydrophobicContact CG2-CE2 3.85Å; W187-F244 AromaticContact CZ2-CD2 3.99Å; W187-F244 HydrophobicContact CZ2-CD2 3.99Å; W187-F244 AromaticContact CZ2-CE2 3.79Å; W187-F244 HydrophobicContact CZ2-CE2 3.79Å; K240-F244 PolarHBondContact O-N 3.29Å; L241-F244 PolarHBondContact O-N 2.88Å; K242-F244 VanDerWaalsContact C-N 3.32Å; K242-F244 PolarHBondContact O-N 3.17Å; F244-Q246 VanDerWaalsContact C-N 3.33Å; F244-Q246 PolarHBondContact O-N 3Å; F244-M247 PolarHBondContact O-N 3.45Å; F244-M247 VanDerWaalsContact O-N 3.16Å; F244-L248 HydrophobicContact CE1-CD2 4.3Å; F244-L248 WeakPolarHBondContact O-CB 3.3Å; F244-L248 PolarHBondContact O-N 3.11Å; F244-L302 HydrophobicContact CZ-CD2 4.09Å; F244-L329 HydrophobicContact CD1-CD1 4.2Å; F244-L329 HydrophobicContact CD1-CD2 4.43Å; F244-L329 HydrophobicContact CE1-CD2 4.21Å
245	G	83.6	Confident	82.8	Confident	1 Å²	1	46.1 Å²	46.1	1%	0.01	23%	0.234	C	C	.	.	H	α-helix	trans	-60	-40.4	177.7	0	0	0	0	0	112.8	L241 K242 M247 L248 L249	L241-G245 PolarHBondContact O-N 3.12Å; K242-G245 PolarHBondContact O-N 3.41Å; G245-M247 PolarHBondContact O-N 2.8Å; G245-L248 PolarHBondContact O-N 3.4Å; G245-L249 VanDerWaalsContact O-CB 3.27Å; G245-L249 WeakPolarHBondContact O-CB 3.1Å; G245-L249 PolarHBondContact O-N 3.3Å
246	Q	85.2	Confident	82.9	Confident	115 Å²	115	43.4 Å²	43.4	54%	0.537	21%	0.206	S	C	.	.	H	α-helix	trans	-63.5	-40.3	174.9	-74.2	178.5	-15.3	0	0	112.6	K242 F244 K250	K242-Q246 WeakPolarHBondContact O-CG 3.38Å; K242-Q246 PolarHBondContact O-N 3.41Å; F244-Q246 VanDerWaalsContact C-N 3.33Å; F244-Q246 PolarHBondContact O-N 3Å; Q246-K250 VanDerWaalsContact O-CB 3.28Å; Q246-K250 WeakPolarHBondContact O-CB 3.46Å; Q246-K250 PolarHBondContact O-N 3.46Å
247	M	82.7	Confident	82.9	Confident	56 Å²	56	40.4 Å²	40.4	28%	0.276	19%	0.192	S	C	.	.	H	α-helix	trans	-68.5	-44.7	176.5	-65.5	-62.7	-70.1	0	0	111.3	W187 F189 S243 F244 G245 L249 K250 Y251	W187-M247 HydrophobicContact CH2-CB 4.18Å; W187-M247 HydrophobicContact CZ2-CB 3.8Å; F189-M247 HydrophobicContact CE1-CE 3.88Å; F189-M247 HydrophobicContact CE2-CE 4.06Å; F189-M247 HydrophobicContact CZ-CE 3.21Å; S243-M247 VanDerWaalsContact O-CG 3.26Å; S243-M247 WeakPolarHBondContact O-CG 3.49Å; S243-M247 PolarHBondContact O-N 3.14Å; F244-M247 PolarHBondContact O-N 3.45Å; F244-M247 VanDerWaalsContact O-N 3.16Å; G245-M247 PolarHBondContact O-N 2.8Å; M247-L249 VanDerWaalsContact C-N 3.35Å; M247-L249 PolarHBondContact O-N 3.16Å; M247-K250 PolarHBondContact O-N 3.18Å; M247-Y251 HydrophobicContact CB-CD2 4.48Å; M247-Y251 HydrophobicContact CE-CD2 3.66Å; M247-Y251 HydrophobicContact CE-CE2 3.32Å; M247-Y251 WeakPolarHBondContact O-CB 3.32Å; M247-Y251 WeakPolarHBondContact O-CD2 3.26Å; M247-Y251 PolarHBondContact O-N 2.86Å; M247-Y251 HydrophobicContact SD-CD2 4.11Å; M247-Y251 HydrophobicContact SD-CE2 3.67Å
248	L	85.1	Confident	82.8	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.1	-47.5	174.7	179.1	66.3	0	0	0	111.5	W187 F244 G245 I252 L253 V298 L302 L329	W187-L248 HydrophobicContact CH2-CB 4.41Å; F244-L248 HydrophobicContact CE1-CD2 4.3Å; F244-L248 WeakPolarHBondContact O-CB 3.3Å; F244-L248 PolarHBondContact O-N 3.11Å; G245-L248 PolarHBondContact O-N 3.4Å; L248-I252 HydrophobicContact CD1-CB 4.07Å; L248-I252 HydrophobicContact CD1-CD1 3.92Å; L248-I252 HydrophobicContact CD1-CG1 4.46Å; L248-I252 HydrophobicContact CD1-CG2 4.27Å; L248-I252 WeakPolarHBondContact O-CA 3.36Å; L248-I252 WeakPolarHBondContact O-CB 3.35Å; L248-I252 PolarHBondContact O-N 3.02Å; L248-L253 HydrophobicContact CD2-CD1 4.36Å; L248-L253 HydrophobicContact CG-CD1 4.1Å; L248-L253 HydrophobicContact CG-CG 4.16Å; L248-L253 PolarHBondContact O-N 3.47Å; L248-V298 HydrophobicContact CD1-CG1 4.42Å; L248-L302 HydrophobicContact CD1-CD1 3.7Å; L248-L302 HydrophobicContact CD2-CD1 3.57Å; L248-L302 HydrophobicContact CG-CD1 4.3Å; L248-L329 HydrophobicContact CD2-CD2 4.44Å
249	L	84.4	Confident	82.5	Confident	9 Å²	9	38.1 Å²	38.1	5%	0.047	19%	0.189	C	C	.	.	I	π-helix	trans	-61.6	-48.9	178.2	-176.6	76	0	0	0	111.4	G245 M247 L253 R254 D336 L337	G245-L249 VanDerWaalsContact O-CB 3.27Å; G245-L249 WeakPolarHBondContact O-CB 3.1Å; G245-L249 PolarHBondContact O-N 3.3Å; M247-L249 VanDerWaalsContact C-N 3.35Å; M247-L249 PolarHBondContact O-N 3.16Å; L249-L253 HydrophobicContact CD1-CB 4.44Å; L249-L253 HydrophobicContact CD1-CD1 4.37Å; L249-R254 HydrophobicContact CG-CG 4.37Å; L249-R254 WeakPolarHBondContact O-CB 3.36Å; L249-R254 VanDerWaalsContact O-CG 3.28Å; L249-R254 WeakPolarHBondContact O-CG 3.39Å; L249-R254 PolarHBondContact O-N 3.33Å; L249-D336 HydrophobicContact CD1-CB 4.33Å; L249-D336 HydrophobicContact CD2-CB 3.45Å; L249-D336 VanDerWaalsContact CD2-CB 3.45Å; L249-L337 HydrophobicContact CD1-CB 3.99Å; L249-L337 HydrophobicContact CD1-CD1 4.21Å
250	K	83.7	Confident	82.1	Confident	103 Å²	103	36.2 Å²	36.2	45%	0.448	18%	0.175	S	C	.	.	I	π-helix	trans	-69.8	-43.8	-174	-177.1	177.8	175.2	-164.8	0	113.2	Q246 M247 P255	Q246-K250 VanDerWaalsContact O-CB 3.28Å; Q246-K250 WeakPolarHBondContact O-CB 3.46Å; Q246-K250 PolarHBondContact O-N 3.46Å; M247-K250 PolarHBondContact O-N 3.18Å; K250-P255 WeakPolarHBondContact O-CD 3.28Å
251	Y	80.5	Confident	81.7	Confident	41 Å²	41	34 Å²	34	16%	0.161	17%	0.168	C	C	.	.	I	π-helix	trans	-102.2	-17.1	-168.1	-67.6	-77.2	0	0	0	114	F189 M247	F189-Y251 AromaticContact CD1-CD1 4Å; F189-Y251 HydrophobicContact CD1-CD1 4Å; F189-Y251 AromaticContact CD1-CE1 3.92Å; F189-Y251 HydrophobicContact CD1-CE1 3.92Å; F189-Y251 HydrophobicContact CD1-CG 4.41Å; F189-Y251 AromaticContact CE1-CD1 3.83Å; F189-Y251 HydrophobicContact CE1-CD1 3.83Å; F189-Y251 AromaticContact CE1-CD2 3.83Å; F189-Y251 HydrophobicContact CE1-CD2 3.83Å; F189-Y251 AromaticContact CE1-CE1 3.9Å; F189-Y251 HydrophobicContact CE1-CE1 3.9Å; F189-Y251 AromaticContact CE1-CE2 3.93Å; F189-Y251 HydrophobicContact CE1-CE2 3.93Å; F189-Y251 AromaticContact CE1-CG 3.8Å; F189-Y251 HydrophobicContact CE1-CG 3.8Å; F189-Y251 AromaticContact CE1-CZ 3.95Å; F189-Y251 HydrophobicContact CZ-CD2 4.47Å; F189-Y251 HydrophobicContact CZ-CE2 4.4Å; M247-Y251 HydrophobicContact CB-CD2 4.48Å; M247-Y251 HydrophobicContact CE-CD2 3.66Å; M247-Y251 HydrophobicContact CE-CE2 3.32Å; M247-Y251 WeakPolarHBondContact O-CB 3.32Å; M247-Y251 WeakPolarHBondContact O-CD2 3.26Å; M247-Y251 PolarHBondContact O-N 2.86Å; M247-Y251 HydrophobicContact SD-CD2 4.11Å; M247-Y251 HydrophobicContact SD-CE2 3.67Å
252	I	83.1	Confident	81.6	Confident	2 Å²	2	33.9 Å²	33.9	1%	0.01	17%	0.168	C	C	.	.	I	π-helix	trans	-119.5	-58.4	-179.2	-61.8	-179.6	0	0	0	111.9	W187 L206 L248 P255 L256 F276 V298	W187-I252 HydrophobicContact CH2-CD1 3.95Å; W187-I252 HydrophobicContact CZ3-CD1 3.68Å; W187-I252 HydrophobicContact CZ3-CG1 4.07Å; L206-I252 HydrophobicContact CB-CD1 3.85Å; L206-I252 HydrophobicContact CD2-CD1 3.76Å; L206-I252 HydrophobicContact CG-CD1 4.45Å; L248-I252 HydrophobicContact CD1-CB 4.07Å; L248-I252 HydrophobicContact CD1-CD1 3.92Å; L248-I252 HydrophobicContact CD1-CG1 4.46Å; L248-I252 HydrophobicContact CD1-CG2 4.27Å; L248-I252 WeakPolarHBondContact O-CA 3.36Å; L248-I252 WeakPolarHBondContact O-CB 3.35Å; L248-I252 PolarHBondContact O-N 3.02Å; I252-P255 WeakPolarHBondContact O-CD 3.19Å; I252-L256 HydrophobicContact CG2-CD1 4.02Å; I252-L256 WeakPolarHBondContact O-CB 3.17Å; I252-L256 VanDerWaalsContact O-CG 3.27Å; I252-L256 WeakPolarHBondContact O-CG 3.34Å; I252-L256 PolarHBondContact O-N 2.93Å; I252-F276 HydrophobicContact CB-CZ 4.16Å; I252-F276 HydrophobicContact CG1-CE2 4.38Å; I252-F276 HydrophobicContact CG1-CZ 4.11Å; I252-F276 HydrophobicContact CG2-CZ 3.98Å; I252-V298 HydrophobicContact CG2-CG1 3.94Å; I252-V298 HydrophobicContact CG2-CG2 4.29Å
253	L	84.3	Confident	81.3	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.156	C	C	.	.	I	π-helix	trans	-72.2	-43.9	-170.7	-56.2	178.1	0	0	0	113.1	L248 L249 L256 A257 I295 V298 I333 L337	L248-L253 HydrophobicContact CD2-CD1 4.36Å; L248-L253 HydrophobicContact CG-CD1 4.1Å; L248-L253 HydrophobicContact CG-CG 4.16Å; L248-L253 PolarHBondContact O-N 3.47Å; L249-L253 HydrophobicContact CD1-CB 4.44Å; L249-L253 HydrophobicContact CD1-CD1 4.37Å; L253-L256 PolarHBondContact O-N 2.88Å; L253-A257 PolarHBondContact O-N 3.32Å; L253-I295 HydrophobicContact CD2-CG1 4.41Å; L253-I295 HydrophobicContact CD2-CG2 4.07Å; L253-V298 HydrophobicContact CD2-CG1 4.43Å; L253-I333 HydrophobicContact CD1-CD1 4.22Å; L253-L337 HydrophobicContact CB-CD1 3.84Å; L253-L337 HydrophobicContact CD1-CD1 4.17Å; L253-L337 HydrophobicContact CD1-CD2 4.22Å
254	R	83.5	Confident	81	Confident	111 Å²	111	29.1 Å²	29.1	42%	0.419	14%	0.143	S	C	.	.	H	α-helix	trans	-63.1	-45.1	177.8	-75.6	-178.6	-178	-167.1	0.6	113.2	L249 A257 S258	L249-R254 HydrophobicContact CG-CG 4.37Å; L249-R254 WeakPolarHBondContact O-CB 3.36Å; L249-R254 VanDerWaalsContact O-CG 3.28Å; L249-R254 WeakPolarHBondContact O-CG 3.39Å; L249-R254 PolarHBondContact O-N 3.33Å; R254-A257 PolarHBondContact O-N 3.2Å; R254-S258 WeakPolarHBondContact O-CB 3.23Å; R254-S258 PolarHBondContact O-N 2.93Å; R254-S258 VanDerWaalsContact O-N 3.1Å; R254-S258 PolarHBondContact O-OG 2.79Å
255	P	82.6	Confident	80.7	Confident	2 Å²	2	30.8 Å²	30.8	1%	0.013	15%	0.153	C	C	.	.	H	α-helix	trans	-60.6	-42	174.8	-27.9	37.6	0	0	0	113.1	Y201 K250 I252 A257 S258 C259 L262	Y201-P255 HydrophobicContact CD1-CB 3.76Å; Y201-P255 HydrophobicContact CD1-CG 3.57Å; Y201-P255 HydrophobicContact CD2-CB 4.43Å; Y201-P255 HydrophobicContact CE1-CB 3.92Å; Y201-P255 HydrophobicContact CE1-CG 3.43Å; Y201-P255 VanDerWaalsContact CE1-CG 3.43Å; Y201-P255 HydrophobicContact CG-CB 4.06Å; Y201-P255 HydrophobicContact CG-CG 4.37Å; K250-P255 WeakPolarHBondContact O-CD 3.28Å; I252-P255 WeakPolarHBondContact O-CD 3.19Å; P255-A257 VanDerWaalsContact C-N 3.28Å; P255-A257 PolarHBondContact O-N 3.13Å; P255-S258 PolarHBondContact O-N 3.21Å; P255-C259 PolarHBondContact O-N 3.31Å; P255-L262 HydrophobicContact CB-CD1 4.03Å
256	L	81.6	Confident	80.4	Confident	0 Å²	0	33 Å²	33	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.6	-33	175.8	-74.6	173.4	0	0	0	113.2	I252 L253 A264 F276 K294 I295 V298	I252-L256 HydrophobicContact CG2-CD1 4.02Å; I252-L256 WeakPolarHBondContact O-CB 3.17Å; I252-L256 VanDerWaalsContact O-CG 3.27Å; I252-L256 WeakPolarHBondContact O-CG 3.34Å; I252-L256 PolarHBondContact O-N 2.93Å; L253-L256 PolarHBondContact O-N 2.88Å; L256-A264 HydrophobicContact CD1-CB 4.24Å; L256-A264 HydrophobicContact CD2-CB 4.32Å; L256-F276 HydrophobicContact CD1-CE1 4.08Å; L256-F276 HydrophobicContact CD2-CD1 4.08Å; L256-F276 HydrophobicContact CD2-CE1 3.62Å; L256-F276 HydrophobicContact CG-CE1 3.68Å; L256-F276 HydrophobicContact CG-CZ 4.39Å; L256-K294 HydrophobicContact CD2-CB 4.25Å; L256-K294 HydrophobicContact CD2-CD 4.32Å; L256-I295 HydrophobicContact CB-CG1 4.27Å; L256-V298 HydrophobicContact CD1-CG2 3.95Å
257	A	82.1	Confident	80.1	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-78.1	-24.1	176.9	0	0	0	0	0	113.9	L253 R254 P255 P286 V291 I295 L341	L253-A257 PolarHBondContact O-N 3.32Å; R254-A257 PolarHBondContact O-N 3.2Å; P255-A257 VanDerWaalsContact C-N 3.28Å; P255-A257 PolarHBondContact O-N 3.13Å; A257-P286 WeakPolarHBondContact O-CG 3.48Å; A257-V291 HydrophobicContact CB-CG1 4.19Å; A257-I295 HydrophobicContact CB-CD1 4.45Å; A257-L341 HydrophobicContact CB-CD2 3.97Å
258	S	79.1	Confident	79	Confident	50 Å²	50	32.8 Å²	32.8	35%	0.35	17%	0.171	S	C	.	.	H	α-helix	trans	-104.2	-27.9	-170.2	-47.5	0	0	0	0	113.5	R254 P255 N344	R254-S258 WeakPolarHBondContact O-CB 3.23Å; R254-S258 PolarHBondContact O-N 2.93Å; R254-S258 VanDerWaalsContact O-N 3.1Å; R254-S258 PolarHBondContact O-OG 2.79Å; P255-S258 PolarHBondContact O-N 3.21Å; S258-N344 PolarHBondContact OG-ND2 2.83Å
259	C	74.1	Confident	77.5	Confident	27 Å²	27	41.5 Å²	41.5	18%	0.182	21%	0.212	C	C	.	.			trans	-111.7	116.8	-175.5	-63.1	0	0	0	0	111.6	P255 S261 L262	P255-C259 PolarHBondContact O-N 3.31Å; C259-S261 VanDerWaalsContact C-N 3.34Å; C259-S261 PolarHBondContact O-N 3.37Å; C259-L262 HydrophobicContact CB-CB 4.19Å; C259-L262 HydrophobicContact CB-CD1 3.56Å; C259-L262 HydrophobicContact CB-CG 3.83Å; C259-L262 PolarHBondContact O-N 2.81Å
260	P	72.3	Confident	76.1	Confident	13 Å²	13	45.1 Å²	45.1	8%	0.084	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-34.8	-180	18.3	-25.1	0	0	0	114.1	L262 L283 P286 K294	P260-L262 PolarHBondContact O-N 3.29Å; P260-L283 VanDerWaalsContact CG-O 3.26Å; P260-L283 WeakPolarHBondContact CG-O 3.32Å; P260-P286 HydrophobicContact CB-CB 3.96Å; P260-K294 PolarHBondContact O-NZ 3.2Å
261	S	74.6	Confident	75.3	Confident	18 Å²	18	41.6 Å²	41.6	13%	0.126	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-23.5	-177	52.4	0	0	0	0	114.4	C259 H263 S278 I279	C259-S261 VanDerWaalsContact C-N 3.34Å; C259-S261 PolarHBondContact O-N 3.37Å; S261-H263 PolarHBondContact O-ND1 2.95Å; S261-S278 WeakPolarHBondContact O-CA 3.37Å; S261-I279 WeakPolarHBondContact CA-O 3.27Å; S261-I279 WeakPolarHBondContact CB-O 3.4Å; S261-I279 PolarHBondContact O-N 3.39Å
262	L	78.9	Confident	75.1	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	129.7	-176.4	-71.2	173.4	0	0	0	111.3	L198 Y201 L202 P255 C259 P260 F276 K294	L198-L262 HydrophobicContact CD1-CD1 4.2Å; L198-L262 HydrophobicContact CD1-CD2 3.88Å; L198-L262 HydrophobicContact CD1-CG 3.81Å; Y201-L262 HydrophobicContact CD2-CD1 3.84Å; Y201-L262 HydrophobicContact CG-CD1 3.96Å; L202-L262 HydrophobicContact CD2-CD2 3.93Å; L202-L262 HydrophobicContact CG-CD2 4.35Å; P255-L262 HydrophobicContact CB-CD1 4.03Å; C259-L262 HydrophobicContact CB-CB 4.19Å; C259-L262 HydrophobicContact CB-CD1 3.56Å; C259-L262 HydrophobicContact CB-CG 3.83Å; C259-L262 PolarHBondContact O-N 2.81Å; P260-L262 PolarHBondContact O-N 3.29Å; L262-F276 HydrophobicContact CD2-CB 3.98Å; L262-F276 HydrophobicContact CD2-CG 4.44Å; L262-K294 WeakPolarHBondContact O-CE 3.4Å; L262-K294 PolarHBondContact O-NZ 3.21Å
263	H	76.3	Confident	74.9	Confident	47 Å²	47	40.4 Å²	40.4	22%	0.218	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	136.2	174.4	-67.4	71.8	0	0	0	109.6	S261 F276 E277 I279 K294	S261-H263 PolarHBondContact O-ND1 2.95Å; H263-F276 WeakPolarHBondContact O-CA 3.28Å; H263-E277 PolarHBondContact N-O 3.22Å; H263-E277 PolarHBondContact O-N 2.97Å; H263-I279 HydrophobicContact CB-CD1 4.41Å; H263-K294 VanDerWaalsContact CD2-CE 3.4Å; H263-K294 WeakPolarHBondContact CD2-CE 3.48Å; H263-K294 PolarHBondContact CE1-NZ 2.99Å; H263-K294 VanDerWaalsContact CE1-NZ 3.33Å; H263-K294 WeakPolarHBondContact NE2-CE 3.41Å; H263-K294 PolarHBondContact NE2-NZ 3.42Å
264	A	77.6	Confident	74.7	Confident	11 Å²	11	40.4 Å²	40.4	9%	0.091	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	119.2	174	0	0	0	0	0	109.3	L256 I274 R275 F276 V298	L256-A264 HydrophobicContact CD1-CB 4.24Å; L256-A264 HydrophobicContact CD2-CB 4.32Å; A264-I274 HydrophobicContact CB-CG2 4.31Å; A264-R275 CarbonylContact C-O 3.59Å; A264-R275 WeakPolarHBondContact CA-O 3.45Å; A264-F276 HydrophobicContact CB-CE1 4.37Å; A264-V298 HydrophobicContact CB-CG2 3.66Å
265	V	78.7	Confident	74.5	Confident	40 Å²	40	38.5 Å²	38.5	24%	0.242	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	129.1	171.9	179.3	0	0	0	0	108.2	R275 E277	V265-R275 PolarHBondContact N-O 2.83Å; V265-R275 PolarHBondContact O-N 3.45Å; V265-E277 HydrophobicContact CB-CG 4.48Å; V265-E277 HydrophobicContact CG2-CB 4.01Å; V265-E277 HydrophobicContact CG2-CG 3.66Å
266	I	78.8	Confident	74.4	Confident	47 Å²	47	38.9 Å²	38.9	24%	0.241	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	110.2	179	-66.2	138.2	0	0	0	108.1	I272 I274 L297 V301	I266-I272 HydrophobicContact CG2-CG2 4.11Å; I266-I274 HydrophobicContact CG1-CG1 4.42Å; I266-L297 HydrophobicContact CD1-CD1 3.99Å; I266-L297 HydrophobicContact CD1-CD2 3.65Å; I266-L297 HydrophobicContact CD1-CG 3.43Å; I266-L297 VanDerWaalsContact CD1-CG 3.43Å; I266-V301 HydrophobicContact CD1-CB 4.48Å; I266-V301 HydrophobicContact CD1-CG2 3.53Å; I266-V301 HydrophobicContact CG1-CG2 4.09Å; I266-V301 HydrophobicContact CG2-CG1 4.39Å; I266-V301 HydrophobicContact CG2-CG2 4.14Å
267	E	77.2	Confident	74.2	Confident	86 Å²	86	44 Å²	44	40%	0.402	24%	0.238	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.5	169.3	-68.9	173.2	-154.7	0	0	108.3	I272 V273 R275	E267-I272 WeakPolarHBondContact O-CA 3.15Å; E267-V273 HydrophobicContact CB-CB 4.49Å; E267-V273 PolarHBondContact N-O 3.04Å; E267-V273 PolarHBondContact O-N 3.47Å; E267-R275 VanDerWaalsContact CD-NH1 3.26Å; E267-R275 IonicContact OE1-CZ 3.51Å; E267-R275 IonicContact OE1-NH1 3.88Å; E267-R275 PolarHBondContact OE1-NH1 3.2Å; E267-R275 IonicContact OE2-CZ 3.9Å; E267-R275 IonicContact OE2-NH1 3.94Å; E267-R275 PolarHBondContact OE2-NH1 2.86Å
268	S	59.5	Low	73.8	Confident	81 Å²	81	46.8 Å²	46.8	57%	0.566	26%	0.257	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.6	78.5	-176.5	175.9	0	0	0	0	111
269	Q	53.8	Low	73.5	Confident	183 Å²	183	48.4 Å²	48.4	86%	0.855	26%	0.261	S	S	*	.	S	Bend	trans	-171.5	134.3	154.5	-69.7	-150.8	-12.2	0	0	111.6	N271	Q269-N271 VanDerWaalsContact C-N 3.32Å
270	P	56.3	Low	72.6	Confident	86 Å²	86	55.6 Å²	55.6	56%	0.558	29%	0.294	S	S	*	.	S	Bend	cis	-79.8	-7.4	-29.7	34.9	-33	0	0	0	113
271	N	67.4	Low	72	Confident	28 Å²	28	57.4 Å²	57.4	15%	0.15	30%	0.304	C	S	.	.	S	Bend	trans	-109.5	153.7	172.4	-54.7	-47.1	0	0	0	108.7	Y209 Q269	Y209-N271 HydrophobicContact CD1-CB 4Å; Y209-N271 WeakPolarHBondContact CD1-ND2 3.38Å; Y209-N271 WeakPolarHBondContact CD1-OD1 3Å; Y209-N271 HydrophobicContact CE1-CB 4.15Å; Y209-N271 WeakPolarHBondContact CE1-ND2 3.04Å; Y209-N271 HydrophobicContact CG-CB 4.43Å; Q269-N271 VanDerWaalsContact C-N 3.32Å
272	I	75.8	Confident	71.2	Confident	6 Å²	6	64.5 Å²	64.5	3%	0.031	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	119.4	178.1	-66.3	173.7	0	0	0	108.2	H207 L208 I266 E267 V301 Q305	H207-I272 WeakPolarHBondContact CA-O 3.29Å; L208-I272 HydrophobicContact CB-CB 4.31Å; L208-I272 PolarHBondContact N-O 2.79Å; L208-I272 PolarHBondContact O-N 2.95Å; I266-I272 HydrophobicContact CG2-CG2 4.11Å; E267-I272 WeakPolarHBondContact O-CA 3.15Å; I272-V301 HydrophobicContact CG2-CG1 3.75Å; I272-Q305 HydrophobicContact CD1-CB 4.12Å; I272-Q305 HydrophobicContact CD1-CG 3.26Å
273	V	78.5	Confident	70.4	Confident	12 Å²	12	69.5 Å²	69.5	7%	0.073	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	121.3	176.6	-171.1	0	0	0	0	108.8	E205 L206 H207 E267 R275	E205-V273 HydrophobicContact CB-CG1 4.26Å; L206-V273 CarbonylContact O-C 3.6Å; L206-V273 WeakPolarHBondContact O-CA 3.14Å; H207-V273 WeakPolarHBondContact NE2-CG1 3.49Å; E267-V273 HydrophobicContact CB-CB 4.49Å; E267-V273 PolarHBondContact N-O 3.04Å; E267-V273 PolarHBondContact O-N 3.47Å; V273-R275 HydrophobicContact CG1-CG 3.64Å
274	I	80	Confident	69.7	Low	1 Å²	1	75 Å²	75	1%	0.005	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	114.4	169.3	-51.4	-174.3	0	0	0	107.4	E205 L206 A264 I266 V298	E205-I274 WeakPolarHBondContact CA-O 3.31Å; L206-I274 HydrophobicContact CB-CB 4.31Å; L206-I274 HydrophobicContact CD2-CD1 4.22Å; L206-I274 PolarHBondContact N-O 3.45Å; L206-I274 PolarHBondContact O-N 3.16Å; A264-I274 HydrophobicContact CB-CG2 4.31Å; I266-I274 HydrophobicContact CG1-CG1 4.42Å; I274-V298 HydrophobicContact CD1-CG1 4.13Å; I274-V298 HydrophobicContact CG2-CG2 4.47Å
275	R	80	Confident	69.3	Low	70 Å²	70	79.7 Å²	79.7	26%	0.264	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	164.9	176.9	-61.8	-170.1	157	132	5.4	110.9	E205 A264 V265 E267 V273	E205-R275 HydrophobicContact CG-CG 4.08Å; E205-R275 IonicContact OE1-CZ 3.45Å; E205-R275 IonicContact OE1-NE 3.33Å; E205-R275 PolarHBondContact OE1-NE 2.99Å; E205-R275 IonicContact OE1-NH2 2.74Å; E205-R275 PolarHBondContact OE1-NH2 3.41Å; E205-R275 VanDerWaalsContact OE1-NH2 3.15Å; E205-R275 IonicContact OE2-CZ 2.95Å; E205-R275 IonicContact OE2-NE 3.85Å; E205-R275 IonicContact OE2-NH2 3.24Å; E205-R275 PolarHBondContact OE2-NH2 3.49Å; A264-R275 CarbonylContact C-O 3.59Å; A264-R275 WeakPolarHBondContact CA-O 3.45Å; V265-R275 PolarHBondContact N-O 2.83Å; V265-R275 PolarHBondContact O-N 3.45Å; E267-R275 VanDerWaalsContact CD-NH1 3.26Å; E267-R275 IonicContact OE1-CZ 3.51Å; E267-R275 IonicContact OE1-NH1 3.88Å; E267-R275 PolarHBondContact OE1-NH1 3.2Å; E267-R275 IonicContact OE2-CZ 3.9Å; E267-R275 IonicContact OE2-NH1 3.94Å; E267-R275 PolarHBondContact OE2-NH1 2.86Å; V273-R275 HydrophobicContact CG1-CG 3.64Å
276	F	80.8	Confident	69.1	Low	10 Å²	10	78.1 Å²	78.1	4%	0.044	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	134.1	171.2	-64.9	-67.9	0	0	0	111.9	Y201 L202 T204 I252 L256 L262 H263 A264	Y201-F276 WeakPolarHBondContact O-CD2 3.34Å; L202-F276 HydrophobicContact CD2-CB 4.15Å; L202-F276 VanDerWaalsContact CD2-O 3.27Å; L202-F276 WeakPolarHBondContact CD2-O 3.25Å; T204-F276 HydrophobicContact CG2-CE2 4.42Å; I252-F276 HydrophobicContact CB-CZ 4.16Å; I252-F276 HydrophobicContact CG1-CE2 4.38Å; I252-F276 HydrophobicContact CG1-CZ 4.11Å; I252-F276 HydrophobicContact CG2-CZ 3.98Å; L256-F276 HydrophobicContact CD1-CE1 4.08Å; L256-F276 HydrophobicContact CD2-CD1 4.08Å; L256-F276 HydrophobicContact CD2-CE1 3.62Å; L256-F276 HydrophobicContact CG-CE1 3.68Å; L256-F276 HydrophobicContact CG-CZ 4.39Å; L262-F276 HydrophobicContact CD2-CB 3.98Å; L262-F276 HydrophobicContact CD2-CG 4.44Å; H263-F276 WeakPolarHBondContact O-CA 3.28Å; A264-F276 HydrophobicContact CB-CE1 4.37Å
277	E	76.7	Confident	69.1	Low	109 Å²	109	77.7 Å²	77.7	51%	0.509	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	145.9	165.7	-72.1	-174.5	179.2	0	0	110.2	H263 V265	H263-E277 PolarHBondContact N-O 3.22Å; H263-E277 PolarHBondContact O-N 2.97Å; V265-E277 HydrophobicContact CB-CG 4.48Å; V265-E277 HydrophobicContact CG2-CB 4.01Å; V265-E277 HydrophobicContact CG2-CG 3.66Å
278	S	73.9	Confident	69.3	Low	57 Å²	57	74 Å²	74	40%	0.399	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	112.7	175.4	174.5	0	0	0	0	109.5	S261	S261-S278 WeakPolarHBondContact O-CA 3.37Å
279	I	72	Confident	70.4	Confident	85 Å²	85	72.5 Å²	72.5	44%	0.436	37%	0.374	S	S	.	.			trans	-92.8	132.2	169.6	-55.2	-177.8	0	0	0	107.7	S261 H263 T281	S261-I279 WeakPolarHBondContact CA-O 3.27Å; S261-I279 WeakPolarHBondContact CB-O 3.4Å; S261-I279 PolarHBondContact O-N 3.39Å; H263-I279 HydrophobicContact CB-CD1 4.41Å; I279-T281 PolarHBondContact O-N 3.32Å; I279-T281 VanDerWaalsContact O-N 3.12Å
280	M	56.7	Low	71.7	Confident	178 Å²	178	67.5 Å²	67.5	88%	0.877	35%	0.351	S	S	*	.			trans	-64.8	114.4	177.9	-69.8	-162.8	75.2	0	0	110.4
281	T	57.8	Low	73	Confident	50 Å²	50	63.4 Å²	63.4	31%	0.307	32%	0.324	S	S	.	.			trans	-126.5	132.2	175.6	52.6	0	0	0	0	109.7	I279 L283	I279-T281 PolarHBondContact O-N 3.32Å; I279-T281 VanDerWaalsContact O-N 3.12Å; T281-L283 PolarHBondContact O-N 3.01Å
282	N	59	Low	73.9	Confident	168 Å²	168	62.4 Å²	62.4	90%	0.898	32%	0.318	S	S	*	.			trans	-83.9	7.1	176.6	-67.8	-21.4	0	0	0	113.4
283	L	61.4	Low	74.3	Confident	105 Å²	105	66.5 Å²	66.5	55%	0.55	34%	0.344	S	S	.	.			trans	-88.3	131.1	-178.5	-68.8	167.4	0	0	0	110.3	P260 T281 Y285	P260-L283 VanDerWaalsContact CG-O 3.26Å; P260-L283 WeakPolarHBondContact CG-O 3.32Å; T281-L283 PolarHBondContact O-N 3.01Å; L283-Y285 VanDerWaalsContact C-N 3.31Å
284	E	62	Low	74.6	Confident	163 Å²	163	66.6 Å²	66.6	76%	0.762	34%	0.343	S	S	*	.	S	Bend	trans	-70	-27	174.4	-78.4	-175.8	160.6	0	0	112.7
285	Y	68.8	Low	74.8	Confident	109 Å²	109	66.6 Å²	66.6	43%	0.427	34%	0.343	S	S	.	.	S	Bend	trans	-133.4	145.1	-176.7	-56.4	-81.9	0	0	0	111.1	L283 Y348	L283-Y285 VanDerWaalsContact C-N 3.31Å; Y285-Y348 AromaticContact CD1-CD1 3.81Å; Y285-Y348 HydrophobicContact CD1-CD1 3.81Å; Y285-Y348 AromaticContact CD1-CD2 3.56Å; Y285-Y348 HydrophobicContact CD1-CD2 3.56Å; Y285-Y348 AromaticContact CD1-CE1 3.97Å; Y285-Y348 HydrophobicContact CD1-CE1 3.97Å; Y285-Y348 AromaticContact CD1-CE2 3.72Å; Y285-Y348 HydrophobicContact CD1-CE2 3.72Å; Y285-Y348 AromaticContact CD1-CG 3.61Å; Y285-Y348 HydrophobicContact CD1-CG 3.61Å; Y285-Y348 AromaticContact CD1-CZ 3.92Å; Y285-Y348 HydrophobicContact CD2-CD1 4.36Å; Y285-Y348 HydrophobicContact CD2-CG 4.44Å; Y285-Y348 AromaticContact CE1-CD1 3.65Å; Y285-Y348 HydrophobicContact CE1-CD1 3.65Å; Y285-Y348 HydrophobicContact CE1-CD2 4Å; Y285-Y348 AromaticContact CE1-CE1 3.41Å; Y285-Y348 HydrophobicContact CE1-CE1 3.41Å; Y285-Y348 VanDerWaalsContact CE1-CE1 3.41Å; Y285-Y348 AromaticContact CE1-CE2 3.77Å; Y285-Y348 HydrophobicContact CE1-CE2 3.77Å; Y285-Y348 AromaticContact CE1-CG 3.95Å; Y285-Y348 HydrophobicContact CE1-CG 3.95Å; Y285-Y348 AromaticContact CE1-CZ 3.47Å; Y285-Y348 VanDerWaalsContact CE1-CZ 3.47Å; Y285-Y348 HydrophobicContact CE2-CD1 4.25Å; Y285-Y348 HydrophobicContact CG-CD1 4.17Å; Y285-Y348 HydrophobicContact CG-CD2 4.19Å; Y285-Y348 AromaticContact CG-CG 3.88Å; Y285-Y348 HydrophobicContact CG-CG 3.88Å; Y285-Y348 AromaticContact CZ-CD1 3.89Å; Y285-Y348 AromaticContact CZ-CE1 3.75Å
286	P	73.9	Confident	75.1	Confident	6 Å²	6	67.6 Å²	67.6	4%	0.039	35%	0.347	C	S	.	.			trans	-77	146.2	-179.5	32.8	-34.8	0	0	0	112.4	A257 P260 V291 C345	A257-P286 WeakPolarHBondContact O-CG 3.48Å; P260-P286 HydrophobicContact CB-CB 3.96Å; P286-V291 HydrophobicContact CB-CG2 3.52Å; P286-V291 HydrophobicContact CG-CG2 3.77Å; P286-C345 PolarHBondContact O-SG 2.98Å
287	S	79.6	Confident	75.3	Confident	38 Å²	38	70.6 Å²	70.6	27%	0.266	36%	0.363	S	S	.	.			trans	-73.9	139.2	174.5	73.8	0	0	0	0	110.6	S289 E290 V291	S287-S289 VanDerWaalsContact C-N 3.33Å; S287-S289 PolarHBondContact O-N 3.45Å; S287-E290 PolarHBondContact O-N 2.93Å; S287-E290 VanDerWaalsContact OG-CB 3.3Å; S287-E290 WeakPolarHBondContact OG-CB 3.2Å; S287-E290 WeakPolarHBondContact OG-CG 3.46Å; S287-E290 PolarHBondContact OG-OE1 2.93Å; S287-V291 WeakPolarHBondContact O-CG2 3.46Å; S287-V291 PolarHBondContact O-N 3.07Å; S287-V291 VanDerWaalsContact O-N 3.1Å
288	P	81.6	Confident	75.6	Confident	10 Å²	10	65.4 Å²	65.4	7%	0.065	34%	0.339	C	S	.	.	H	α-helix	trans	-54.1	-45.1	-178.8	-27.3	33.7	0	0	0	114	E290 V291 F292 C345 L346 I363	P288-E290 VanDerWaalsContact C-N 3.34Å; P288-E290 PolarHBondContact O-N 2.83Å; P288-V291 PolarHBondContact O-N 3.44Å; P288-F292 HydrophobicContact CB-CE2 3.94Å; P288-F292 HydrophobicContact CB-CZ 4.19Å; P288-F292 WeakPolarHBondContact O-CB 3.36Å; P288-F292 VanDerWaalsContact O-CD2 3.22Å; P288-F292 WeakPolarHBondContact O-CD2 3.29Å; P288-F292 WeakPolarHBondContact O-CG 3.24Å; P288-F292 PolarHBondContact O-N 3.12Å; P288-C345 WeakPolarHBondContact CA-SG 3.4Å; P288-L346 HydrophobicContact CB-CD2 4.1Å; P288-L346 HydrophobicContact CG-CD2 4.14Å; P288-I363 HydrophobicContact CB-CG2 3.94Å; P288-I363 HydrophobicContact CG-CD1 4.41Å; P288-I363 HydrophobicContact CG-CG2 3.97Å
289	S	82	Confident	76.1	Confident	49 Å²	49	62.9 Å²	62.9	34%	0.343	32%	0.321	S	S	.	.	H	α-helix	trans	-63.5	-37.1	-179	-49.2	0	0	0	0	112.6	S287 T293 S366	S287-S289 VanDerWaalsContact C-N 3.33Å; S287-S289 PolarHBondContact O-N 3.45Å; S289-T293 WeakPolarHBondContact O-CB 3.48Å; S289-T293 PolarHBondContact O-N 3.44Å; S289-T293 VanDerWaalsContact O-N 3.07Å; S289-T293 PolarHBondContact O-OG1 3.02Å; S289-S366 WeakPolarHBondContact OG-CB 3.37Å; S289-S366 PolarHBondContact OG-OG 2.9Å
290	E	81.9	Confident	76.6	Confident	77 Å²	77	61.2 Å²	61.2	36%	0.36	31%	0.311	S	S	.	.	H	α-helix	trans	-67.3	-45	174	-75.9	166	-138.9	0	0	111.7	S287 P288 F292 T293 K294	S287-E290 PolarHBondContact O-N 2.93Å; S287-E290 VanDerWaalsContact OG-CB 3.3Å; S287-E290 WeakPolarHBondContact OG-CB 3.2Å; S287-E290 WeakPolarHBondContact OG-CG 3.46Å; S287-E290 PolarHBondContact OG-OE1 2.93Å; P288-E290 VanDerWaalsContact C-N 3.34Å; P288-E290 PolarHBondContact O-N 2.83Å; E290-F292 VanDerWaalsContact C-N 3.35Å; E290-F292 PolarHBondContact O-N 3.41Å; E290-T293 PolarHBondContact O-N 2.92Å; E290-K294 VanDerWaalsContact O-CG 3.23Å; E290-K294 WeakPolarHBondContact O-CG 3.34Å; E290-K294 PolarHBondContact O-N 2.92Å
291	V	84.1	Confident	77.8	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-45.8	178.7	175	0	0	0	0	110.9	A257 P286 S287 P288 T293 K294 I295 L341	A257-V291 HydrophobicContact CB-CG1 4.19Å; P286-V291 HydrophobicContact CB-CG2 3.52Å; P286-V291 HydrophobicContact CG-CG2 3.77Å; S287-V291 WeakPolarHBondContact O-CG2 3.46Å; S287-V291 PolarHBondContact O-N 3.07Å; S287-V291 VanDerWaalsContact O-N 3.1Å; P288-V291 PolarHBondContact O-N 3.44Å; V291-T293 VanDerWaalsContact C-N 3.32Å; V291-T293 PolarHBondContact O-N 3.41Å; V291-K294 PolarHBondContact O-N 3.29Å; V291-I295 HydrophobicContact CG1-CD1 3.69Å; V291-I295 HydrophobicContact CG1-CG1 4.47Å; V291-I295 PolarHBondContact O-N 3.29Å; V291-L341 HydrophobicContact CG1-CD2 3.54Å
292	F	85.9	Confident	78.8	Confident	7 Å²	7	51.4 Å²	51.4	3%	0.031	26%	0.261	C	S	.	.	H	α-helix	trans	-60	-43.2	177.2	-63.7	-24.5	0	0	0	111.5	P288 E290 I295 R296 L341 L346 T367 F370 L387	P288-F292 HydrophobicContact CB-CE2 3.94Å; P288-F292 HydrophobicContact CB-CZ 4.19Å; P288-F292 WeakPolarHBondContact O-CB 3.36Å; P288-F292 VanDerWaalsContact O-CD2 3.22Å; P288-F292 WeakPolarHBondContact O-CD2 3.29Å; P288-F292 WeakPolarHBondContact O-CG 3.24Å; P288-F292 PolarHBondContact O-N 3.12Å; E290-F292 VanDerWaalsContact C-N 3.35Å; E290-F292 PolarHBondContact O-N 3.41Å; F292-I295 PolarHBondContact O-N 2.71Å; F292-R296 WeakPolarHBondContact O-CB 3.39Å; F292-R296 PolarHBondContact O-N 2.72Å; F292-L341 HydrophobicContact CE1-CD1 4.31Å; F292-L341 HydrophobicContact CE1-CD2 4.37Å; F292-L346 HydrophobicContact CZ-CD2 4.23Å; F292-T367 HydrophobicContact CE2-CG2 4.44Å; F292-T367 WeakPolarHBondContact CE2-OG1 3.47Å; F292-T367 HydrophobicContact CZ-CG2 4.28Å; F292-F370 HydrophobicContact CB-CB 3.94Å; F292-F370 HydrophobicContact CB-CD1 4.47Å; F292-F370 HydrophobicContact CB-CD2 3.67Å; F292-F370 HydrophobicContact CB-CE2 4.28Å; F292-F370 HydrophobicContact CB-CG 3.77Å; F292-F370 HydrophobicContact CD1-CB 4.47Å; F292-F370 AromaticContact CD1-CD1 3.77Å; F292-F370 HydrophobicContact CD1-CD1 3.77Å; F292-F370 HydrophobicContact CD1-CD2 4.37Å; F292-F370 HydrophobicContact CD1-CE1 4.03Å; F292-F370 AromaticContact CD1-CG 3.95Å; F292-F370 HydrophobicContact CD1-CG 3.95Å; F292-F370 HydrophobicContact CD1-CZ 4.43Å; F292-F370 HydrophobicContact CD2-CB 4.11Å; F292-F370 HydrophobicContact CD2-CG 4.45Å; F292-F370 HydrophobicContact CE1-CD1 4.2Å; F292-F370 HydrophobicContact CE1-CE1 4.47Å; F292-F370 HydrophobicContact CG-CB 3.93Å; F292-F370 HydrophobicContact CG-CD1 4.1Å; F292-F370 HydrophobicContact CG-CD2 4.18Å; F292-F370 AromaticContact CG-CG 3.81Å; F292-F370 HydrophobicContact CG-CG 3.81Å; F292-F370 WeakPolarHBondContact O-CE2 3.28Å; F292-L387 HydrophobicContact CE1-CD2 4.26Å; F292-L387 HydrophobicContact CZ-CD2 4.45Å
293	T	84.1	Confident	79.7	Confident	93 Å²	93	45.1 Å²	45.1	57%	0.571	23%	0.227	S	C	*	.	H	α-helix	trans	-62.6	-44.7	176.8	-54	0	0	0	0	111.8	S289 E290 V291 L297	S289-T293 WeakPolarHBondContact O-CB 3.48Å; S289-T293 PolarHBondContact O-N 3.44Å; S289-T293 VanDerWaalsContact O-N 3.07Å; S289-T293 PolarHBondContact O-OG1 3.02Å; E290-T293 PolarHBondContact O-N 2.92Å; V291-T293 VanDerWaalsContact C-N 3.32Å; V291-T293 PolarHBondContact O-N 3.41Å; T293-L297 WeakPolarHBondContact O-CB 3.3Å; T293-L297 PolarHBondContact O-N 3.02Å
294	K	84	Confident	80.3	Confident	14 Å²	14	47.1 Å²	47.1	6%	0.061	23%	0.231	C	C	.	.	H	α-helix	trans	-62.2	-47	179.1	-69.8	169.2	-171.4	-167.2	0	112.1	L256 P260 L262 H263 E290 V291 V298	L256-K294 HydrophobicContact CD2-CB 4.25Å; L256-K294 HydrophobicContact CD2-CD 4.32Å; P260-K294 PolarHBondContact O-NZ 3.2Å; L262-K294 WeakPolarHBondContact O-CE 3.4Å; L262-K294 PolarHBondContact O-NZ 3.21Å; H263-K294 VanDerWaalsContact CD2-CE 3.4Å; H263-K294 WeakPolarHBondContact CD2-CE 3.48Å; H263-K294 PolarHBondContact CE1-NZ 2.99Å; H263-K294 VanDerWaalsContact CE1-NZ 3.33Å; H263-K294 WeakPolarHBondContact NE2-CE 3.41Å; H263-K294 PolarHBondContact NE2-NZ 3.42Å; E290-K294 VanDerWaalsContact O-CG 3.23Å; E290-K294 WeakPolarHBondContact O-CG 3.34Å; E290-K294 PolarHBondContact O-N 2.92Å; V291-K294 PolarHBondContact O-N 3.29Å; K294-V298 PolarHBondContact O-N 3.48Å
295	I	85.6	Confident	80.7	Confident	0 Å²	0	42.6 Å²	42.6	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-70.2	-41.9	-179.2	-71.4	169.8	0	0	0	110.9	L253 L256 A257 V291 F292 L297 V298 L299 L337 L341 F370	L253-I295 HydrophobicContact CD2-CG1 4.41Å; L253-I295 HydrophobicContact CD2-CG2 4.07Å; L256-I295 HydrophobicContact CB-CG1 4.27Å; A257-I295 HydrophobicContact CB-CD1 4.45Å; V291-I295 HydrophobicContact CG1-CD1 3.69Å; V291-I295 HydrophobicContact CG1-CG1 4.47Å; V291-I295 PolarHBondContact O-N 3.29Å; F292-I295 PolarHBondContact O-N 2.71Å; I295-L297 VanDerWaalsContact C-N 3.3Å; I295-L297 PolarHBondContact O-N 3.06Å; I295-V298 PolarHBondContact O-N 2.94Å; I295-L299 HydrophobicContact CG2-CD1 3.74Å; I295-L299 HydrophobicContact CG2-CG 4.33Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.46Å; I295-L337 HydrophobicContact CD1-CD1 4.36Å; I295-L337 HydrophobicContact CG2-CD2 4.49Å; I295-L341 HydrophobicContact CD1-CD2 3.69Å; I295-F370 HydrophobicContact CB-CE2 4.37Å; I295-F370 HydrophobicContact CB-CZ 4.37Å; I295-F370 HydrophobicContact CG2-CE2 4.13Å; I295-F370 HydrophobicContact CG2-CZ 3.85Å
296	R	85.6	Confident	80.7	Confident	91 Å²	91	37.6 Å²	37.6	34%	0.343	19%	0.19	S	C	.	.	H	α-helix	trans	-54.9	-47.7	175.6	178.1	-179.9	169.9	158.9	5.1	111	F292 V298 L299 E300 F370 M377	F292-R296 WeakPolarHBondContact O-CB 3.39Å; F292-R296 PolarHBondContact O-N 2.72Å; R296-V298 VanDerWaalsContact C-N 3.34Å; R296-V298 PolarHBondContact O-N 3.32Å; R296-L299 PolarHBondContact O-N 2.9Å; R296-E300 HydrophobicContact CG-CG 4.25Å; R296-E300 WeakPolarHBondContact CG-OE1 3.46Å; R296-E300 IonicContact CZ-OE1 2.6Å; R296-E300 IonicContact NE-OE1 3.43Å; R296-E300 PolarHBondContact NE-OE1 2.92Å; R296-E300 IonicContact NH2-OE1 2.74Å; R296-E300 PolarHBondContact NH2-OE1 3.42Å; R296-E300 WeakPolarHBondContact O-CB 3.28Å; R296-E300 WeakPolarHBondContact O-CG 3.35Å; R296-E300 PolarHBondContact O-N 3.24Å; R296-F370 HydrophobicContact CB-CD2 4.19Å; R296-F370 HydrophobicContact CB-CE2 4.06Å; R296-M377 HydrophobicContact CG-CE 3.91Å
297	L	84.5	Confident	80.3	Confident	74 Å²	74	37.7 Å²	37.7	39%	0.387	19%	0.191	S	C	.	.	H	α-helix	trans	-56.9	-44.7	179.4	-176.5	70.3	0	0	0	112.5	I266 T293 I295 V301	I266-L297 HydrophobicContact CD1-CD1 3.99Å; I266-L297 HydrophobicContact CD1-CD2 3.65Å; I266-L297 HydrophobicContact CD1-CG 3.43Å; I266-L297 VanDerWaalsContact CD1-CG 3.43Å; T293-L297 WeakPolarHBondContact O-CB 3.3Å; T293-L297 PolarHBondContact O-N 3.02Å; I295-L297 VanDerWaalsContact C-N 3.3Å; I295-L297 PolarHBondContact O-N 3.06Å; L297-V301 WeakPolarHBondContact O-CG2 3.41Å; L297-V301 PolarHBondContact O-N 3.2Å
298	V	83.9	Confident	79.5	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.3	-45.2	177.5	171.6	0	0	0	0	111.3	L248 I252 L253 L256 A264 I274 K294 I295 R296 V301 L302	L248-V298 HydrophobicContact CD1-CG1 4.42Å; I252-V298 HydrophobicContact CG2-CG1 3.94Å; I252-V298 HydrophobicContact CG2-CG2 4.29Å; L253-V298 HydrophobicContact CD2-CG1 4.43Å; L256-V298 HydrophobicContact CD1-CG2 3.95Å; A264-V298 HydrophobicContact CB-CG2 3.66Å; I274-V298 HydrophobicContact CD1-CG1 4.13Å; I274-V298 HydrophobicContact CG2-CG2 4.47Å; K294-V298 PolarHBondContact O-N 3.48Å; I295-V298 PolarHBondContact O-N 2.94Å; R296-V298 VanDerWaalsContact C-N 3.34Å; R296-V298 PolarHBondContact O-N 3.32Å; V298-V301 PolarHBondContact O-N 3.03Å; V298-L302 HydrophobicContact CG1-CD1 4.01Å; V298-L302 WeakPolarHBondContact O-CG 3.45Å; V298-L302 PolarHBondContact O-N 3.5Å
299	L	83.9	Confident	78.4	Confident	4 Å²	4	44 Å²	44	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-68.8	-36.1	-178.8	-68.5	173.7	0	0	0	112.3	I295 R296 V301 L302 Q303 I333 L374 M377 F379	I295-L299 HydrophobicContact CG2-CD1 3.74Å; I295-L299 HydrophobicContact CG2-CG 4.33Å; I295-L299 WeakPolarHBondContact O-CG 3.34Å; I295-L299 PolarHBondContact O-N 3.46Å; R296-L299 PolarHBondContact O-N 2.9Å; L299-V301 PolarHBondContact O-N 3.36Å; L299-L302 HydrophobicContact CD2-CD1 4.47Å; L299-L302 PolarHBondContact O-N 3.2Å; L299-Q303 WeakPolarHBondContact O-CB 3.43Å; L299-Q303 PolarHBondContact O-N 2.85Å; L299-I333 HydrophobicContact CD2-CD1 4.36Å; L299-L374 HydrophobicContact CB-CD2 4.48Å; L299-L374 HydrophobicContact CD1-CD2 3.48Å; L299-L374 VanDerWaalsContact CD1-CD2 3.48Å; L299-M377 HydrophobicContact CB-SD 4.48Å; L299-F379 HydrophobicContact CB-CE2 4.13Å; L299-F379 HydrophobicContact CB-CZ 4.49Å; L299-F379 HydrophobicContact CD2-CE1 4.45Å; L299-F379 HydrophobicContact CD2-CZ 4.22Å
300	E	82.9	Confident	77	Confident	49 Å²	49	45.7 Å²	45.7	23%	0.229	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-41.9	173.5	-77.4	-179	-177.2	0	0	111.8	R296 Q303 K304 M377	R296-E300 HydrophobicContact CG-CG 4.25Å; R296-E300 WeakPolarHBondContact CG-OE1 3.46Å; R296-E300 IonicContact CZ-OE1 2.6Å; R296-E300 IonicContact NE-OE1 3.43Å; R296-E300 PolarHBondContact NE-OE1 2.92Å; R296-E300 IonicContact NH2-OE1 2.74Å; R296-E300 PolarHBondContact NH2-OE1 3.42Å; R296-E300 WeakPolarHBondContact O-CB 3.28Å; R296-E300 WeakPolarHBondContact O-CG 3.35Å; R296-E300 PolarHBondContact O-N 3.24Å; E300-Q303 PolarHBondContact O-N 2.6Å; E300-K304 WeakPolarHBondContact O-CG 3.34Å; E300-K304 PolarHBondContact O-N 3Å; E300-M377 HydrophobicContact CB-SD 4.29Å; E300-M377 HydrophobicContact CG-CE 3.58Å; E300-M377 HydrophobicContact CG-SD 3.54Å; E300-M377 VanDerWaalsContact CG-SD 3.54Å
301	V	80.8	Confident	75.6	Confident	22 Å²	22	43.8 Å²	43.8	13%	0.133	22%	0.224	C	C	.	.	H	α-helix	trans	-66	-45	176.6	170.8	0	0	0	0	111.1	I266 I272 L297 V298 L299 Q303 K304 Q305	I266-V301 HydrophobicContact CD1-CB 4.48Å; I266-V301 HydrophobicContact CD1-CG2 3.53Å; I266-V301 HydrophobicContact CG1-CG2 4.09Å; I266-V301 HydrophobicContact CG2-CG1 4.39Å; I266-V301 HydrophobicContact CG2-CG2 4.14Å; I272-V301 HydrophobicContact CG2-CG1 3.75Å; L297-V301 WeakPolarHBondContact O-CG2 3.41Å; L297-V301 PolarHBondContact O-N 3.2Å; V298-V301 PolarHBondContact O-N 3.03Å; L299-V301 PolarHBondContact O-N 3.36Å; V301-Q303 VanDerWaalsContact C-N 3.31Å; V301-Q303 PolarHBondContact O-N 3.1Å; V301-K304 PolarHBondContact O-N 3.02Å; V301-Q305 VanDerWaalsContact O-CB 3.32Å; V301-Q305 WeakPolarHBondContact O-CB 3.47Å; V301-Q305 VanDerWaalsContact O-CG 3.23Å; V301-Q305 WeakPolarHBondContact O-CG 3.4Å; V301-Q305 PolarHBondContact O-N 3.03Å
302	L	79	Confident	73.7	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-38.8	177	-72.2	172	0	0	0	111.9	L206 L208 F244 L248 V298 L299 L306 L307	L206-L302 HydrophobicContact CD2-CD2 4.46Å; L208-L302 HydrophobicContact CD1-CD2 3.81Å; F244-L302 HydrophobicContact CZ-CD2 4.09Å; L248-L302 HydrophobicContact CD1-CD1 3.7Å; L248-L302 HydrophobicContact CD2-CD1 3.57Å; L248-L302 HydrophobicContact CG-CD1 4.3Å; V298-L302 HydrophobicContact CG1-CD1 4.01Å; V298-L302 WeakPolarHBondContact O-CG 3.45Å; V298-L302 PolarHBondContact O-N 3.5Å; L299-L302 HydrophobicContact CD2-CD1 4.47Å; L299-L302 PolarHBondContact O-N 3.2Å; L302-L306 WeakPolarHBondContact O-CB 3.33Å; L302-L306 PolarHBondContact O-N 3.37Å; L302-L307 PolarHBondContact O-N 3.04Å
303	Q	77.8	Confident	71.6	Confident	37 Å²	37	51.8 Å²	51.8	17%	0.173	27%	0.273	C	S	.	.	I	π-helix	trans	-62.9	-54.5	177.4	-166.9	-162.4	3.1	0	0	111	L299 E300 V301 Q305 L307 D308 M377 F379	L299-Q303 WeakPolarHBondContact O-CB 3.43Å; L299-Q303 PolarHBondContact O-N 2.85Å; E300-Q303 PolarHBondContact O-N 2.6Å; V301-Q303 VanDerWaalsContact C-N 3.31Å; V301-Q303 PolarHBondContact O-N 3.1Å; Q303-Q305 PolarHBondContact O-N 2.93Å; Q303-Q305 VanDerWaalsContact O-N 3.16Å; Q303-L307 CarbonylContact O-C 3.46Å; Q303-L307 PolarHBondContact O-N 2.88Å; Q303-L307 VanDerWaalsContact O-N 3.12Å; Q303-D308 WeakPolarHBondContact O-CB 3.36Å; Q303-D308 PolarHBondContact O-N 3.03Å; Q303-M377 VanDerWaalsContact NE2-CA 3.33Å; Q303-M377 PolarHBondContact NE2-O 2.93Å; Q303-F379 HydrophobicContact CB-CE2 4.18Å; Q303-F379 HydrophobicContact CB-CZ 4.43Å
304	K	75.5	Confident	69.4	Low	147 Å²	147	55 Å²	55	64%	0.639	29%	0.286	S	S	*	.	I	π-helix	trans	-59.5	-29.1	-177.4	-75.1	177	179.8	171.6	0	114.1	E300 V301	E300-K304 WeakPolarHBondContact O-CG 3.34Å; E300-K304 PolarHBondContact O-N 3Å; V301-K304 PolarHBondContact O-N 3.02Å
305	Q	69.9	Low	67.3	Low	68 Å²	68	59.9 Å²	59.9	32%	0.318	31%	0.312	S	S	.	.	I	π-helix	trans	-108.5	-24.1	-166.9	-62.7	-73.5	-16.4	0	0	113.5	I272 V301 Q303	I272-Q305 HydrophobicContact CD1-CB 4.12Å; I272-Q305 HydrophobicContact CD1-CG 3.26Å; V301-Q305 VanDerWaalsContact O-CB 3.32Å; V301-Q305 WeakPolarHBondContact O-CB 3.47Å; V301-Q305 VanDerWaalsContact O-CG 3.23Å; V301-Q305 WeakPolarHBondContact O-CG 3.4Å; V301-Q305 PolarHBondContact O-N 3.03Å; Q303-Q305 PolarHBondContact O-N 2.93Å; Q303-Q305 VanDerWaalsContact O-N 3.16Å
306	L	68.6	Low	65.1	Low	3 Å²	3	69.6 Å²	69.6	2%	0.016	36%	0.358	C	S	.	.	I	π-helix	trans	-127.6	-27.5	-172.4	-161.8	128.9	0	0	0	113.5	I185 L208 I224 L302	I185-L306 HydrophobicContact CD1-CD1 3.85Å; L208-L306 HydrophobicContact CD2-CD1 4.2Å; I224-L306 HydrophobicContact CD1-CD1 3.57Å; I224-L306 HydrophobicContact CD1-CG 4.26Å; L302-L306 WeakPolarHBondContact O-CB 3.33Å; L302-L306 PolarHBondContact O-N 3.37Å
307	L	65.6	Low	62.6	Low	9 Å²	9	71.6 Å²	71.6	5%	0.047	38%	0.375	C	S	.	.	I	π-helix	trans	-117.9	-15.6	-167	-52.7	161.2	0	0	0	114.4	L302 Q303 L309 L325 A326 L329 F379	L302-L307 PolarHBondContact O-N 3.04Å; Q303-L307 CarbonylContact O-C 3.46Å; Q303-L307 PolarHBondContact O-N 2.88Å; Q303-L307 VanDerWaalsContact O-N 3.12Å; L307-L309 PolarHBondContact O-N 3.02Å; L307-L325 HydrophobicContact CB-CB 4.33Å; L307-L325 HydrophobicContact CD2-CB 3.6Å; L307-A326 HydrophobicContact CB-CB 4.02Å; L307-A326 HydrophobicContact CD1-CB 4.33Å; L307-L329 HydrophobicContact CD1-CD2 3.92Å; L307-L329 HydrophobicContact CD2-CD2 4.41Å; L307-F379 HydrophobicContact CD1-CE1 3.72Å; L307-F379 HydrophobicContact CD1-CZ 3.52Å
308	D	62.7	Low	60.5	Low	118 Å²	118	77 Å²	77	63%	0.631	40%	0.398	S	S	*	.			trans	-84.3	16.5	175.3	-158.6	29.4	0	0	0	113.4	Q303 S310	Q303-D308 WeakPolarHBondContact O-CB 3.36Å; Q303-D308 PolarHBondContact O-N 3.03Å; D308-S310 PolarHBondContact O-N 3.12Å
309	L	58.2	Low	58.3	Low	61 Å²	61	86.4 Å²	86.4	32%	0.319	44%	0.439	S	S	.	.			trans	-80.5	113.2	177.6	-66.8	164.2	0	0	0	109.1	I224 L228 L307 L311	I224-L309 HydrophobicContact CG2-CD1 4.06Å; L228-L309 HydrophobicContact CD1-CD1 4.43Å; L307-L309 PolarHBondContact O-N 3.02Å; L309-L311 PolarHBondContact O-N 2.92Å; L309-L311 VanDerWaalsContact O-N 3.09Å
310	S	52.5	Low	55.7	Low	86 Å²	86	91.7 Å²	91.7	60%	0.601	47%	0.472	S	S	*	.			trans	-63.4	109.9	166.4	-168.2	0	0	0	0	108.2	D308 D312	D308-S310 PolarHBondContact O-N 3.12Å; S310-D312 PolarHBondContact O-N 3.15Å; S310-D312 PolarHBondContact OG-OD2 2.74Å
311	L	53.3	Low	53.5	Low	37 Å²	37	94.2 Å²	94.2	19%	0.194	50%	0.495	C	S	.	.			trans	-79.4	64.4	171.7	-61.2	170.6	0	0	0	108	L229 L309 S313 L325	L229-L311 HydrophobicContact CD1-CD2 4.32Å; L229-L311 HydrophobicContact CD2-CB 3.64Å; L229-L311 HydrophobicContact CD2-CD2 3.3Å; L229-L311 HydrophobicContact CD2-CG 3.97Å; L229-L311 HydrophobicContact CG-CD2 3.42Å; L229-L311 VanDerWaalsContact CG-CD2 3.42Å; L309-L311 PolarHBondContact O-N 2.92Å; L309-L311 VanDerWaalsContact O-N 3.09Å; L311-S313 PolarHBondContact O-N 3.43Å; L311-S313 VanDerWaalsContact O-N 3.16Å; L311-L325 HydrophobicContact CD1-CD1 4.15Å; L311-L325 HydrophobicContact CD1-CD2 4.07Å; L311-L325 HydrophobicContact CD1-CG 4.04Å
312	D	43.1	Very low	51.7	Low	112 Å²	112	97.9 Å²	97.9	60%	0.599	52%	0.518	S	S	*	.			trans	-73.1	105.9	171.2	-78.8	-47.9	0	0	0	108.2	S310 D314	S310-D312 PolarHBondContact O-N 3.15Å; S310-D312 PolarHBondContact OG-OD2 2.74Å; D312-D314 PolarHBondContact O-N 3.09Å
313	S	41.3	Very low	50.6	Low	63 Å²	63	101.2 Å²	101.2	44%	0.441	54%	0.538	S	S	.	.			trans	-77.5	111.8	156.7	60.5	0	0	0	0	106.9	L311 L315	L311-S313 PolarHBondContact O-N 3.43Å; L311-S313 VanDerWaalsContact O-N 3.16Å; S313-L315 PolarHBondContact O-N 3.33Å
314	D	37.9	Very low	50.1	Low	161 Å²	161	100.8 Å²	100.8	86%	0.861	54%	0.538	S	S	*	.			trans	-60.2	80.4	165.9	-73.7	-38.3	0	0	0	109.7	D312	D312-D314 PolarHBondContact O-N 3.09Å
315	L	40.3	Very low	50	Low	116 Å²	116	93.9 Å²	93.9	61%	0.607	51%	0.508	S	S	*	.			trans	-142.4	119.1	173	-73.4	174.3	0	0	0	108.6	S313 N317	S313-L315 PolarHBondContact O-N 3.33Å; L315-N317 PolarHBondContact O-N 3.39Å
316	E	39.6	Very low	50.2	Low	204 Å²	204	90.8 Å²	90.8	95%	0.953	50%	0.495	S	S	*	.			trans	-64.1	50.1	173.1	-63.5	-178.5	142	0	0	113.2
317	N	32.9	Very low	50.7	Low	133 Å²	133	92.8 Å²	92.8	71%	0.711	50%	0.504	S	S	*	.			trans	-123.5	113.9	172.5	-83.1	-37.5	0	0	0	110.4	L315 K319	L315-N317 PolarHBondContact O-N 3.39Å; N317-K319 PolarHBondContact O-N 2.95Å
318	E	40.6	Very low	51.2	Low	186 Å²	186	94.2 Å²	94.2	87%	0.869	51%	0.511	S	S	*	.	S	Bend	trans	-50.6	130.5	173.7	-66.6	-178.6	143.3	0	0	111.9
319	K	37.9	Very low	52.1	Low	198 Å²	198	88.6 Å²	88.6	86%	0.861	48%	0.48	S	S	*	.			trans	76.6	68.1	165	-54.3	176.8	-175.8	174.5	0	117.5	N317	N317-K319 PolarHBondContact O-N 2.95Å
320	T	30.4	Very low	53.2	Low	115 Å²	115	85.8 Å²	85.8	71%	0.706	47%	0.467	S	S	*	.			trans	-117.9	110.6	144.3	45.3	0	0	0	0	108.7	T322	T320-T322 PolarHBondContact O-N 3.09Å
321	S	35.6	Very low	54.6	Low	102 Å²	102	86.3 Å²	86.3	71%	0.713	46%	0.463	S	S	*	.			trans	-57.9	121.5	176.2	58.9	0	0	0	0	109.2	V323	S321-V323 PolarHBondContact O-N 3.19Å
322	T	43.9	Very low	56	Low	100 Å²	100	86.5 Å²	86.5	61%	0.613	46%	0.463	S	S	*	.			trans	-55.4	101.1	165	34.4	0	0	0	0	108.2	T320 P324	T320-T322 PolarHBondContact O-N 3.09Å; T322-P324 VanDerWaalsContact O-CD 3.25Å; T322-P324 WeakPolarHBondContact O-CD 3.42Å
323	V	55.4	Low	58	Low	70 Å²	70	81.5 Å²	81.5	42%	0.424	44%	0.436	S	S	.	.			trans	-79.5	114.2	172.2	-178.6	0	0	0	0	106.5	S321 L325 M328	S321-V323 PolarHBondContact O-N 3.19Å; V323-L325 PolarHBondContact O-N 3.46Å; V323-M328 HydrophobicContact CG1-CE 4.4Å; V323-M328 HydrophobicContact CG1-CG 3.75Å; V323-M328 HydrophobicContact CG1-SD 4.05Å
324	P	67.8	Low	60.2	Low	27 Å²	27	80 Å²	80	18%	0.175	42%	0.421	C	S	.	.			trans	-63.9	126.9	178.9	-18.5	33.8	0	0	0	109.1	T322 A326 E327 M328	T322-P324 VanDerWaalsContact O-CD 3.25Å; T322-P324 WeakPolarHBondContact O-CD 3.42Å; P324-A326 PolarHBondContact O-N 3.47Å; P324-A326 VanDerWaalsContact O-N 3.16Å; P324-E327 HydrophobicContact CB-CB 4.42Å; P324-E327 HydrophobicContact CB-CG 4.02Å; P324-E327 VanDerWaalsContact CD-CD 3.5Å; P324-E327 WeakPolarHBondContact CD-OE2 3.47Å; P324-E327 HydrophobicContact CG-CG 4.06Å; P324-E327 WeakPolarHBondContact CG-OE1 3.27Å; P324-E327 WeakPolarHBondContact O-CB 3.44Å; P324-E327 PolarHBondContact O-N 2.86Å; P324-M328 PolarHBondContact O-N 3.38Å
325	L	72.9	Confident	62.4	Low	2 Å²	2	79.7 Å²	79.7	1%	0.01	41%	0.414	C	S	.	.	H	α-helix	trans	-55.9	-33.5	178.6	-66.9	169.2	0	0	0	111.9	L228 L237 L241 L307 L311 V323 E327 M328 L329	L228-L325 HydrophobicContact CD1-CD1 4.14Å; L237-L325 HydrophobicContact CD1-CD2 4.26Å; L237-L325 HydrophobicContact CD2-CD2 3.64Å; L237-L325 HydrophobicContact CG-CD2 4.36Å; L241-L325 HydrophobicContact CD1-CD2 4.1Å; L307-L325 HydrophobicContact CB-CB 4.33Å; L307-L325 HydrophobicContact CD2-CB 3.6Å; L311-L325 HydrophobicContact CD1-CD1 4.15Å; L311-L325 HydrophobicContact CD1-CD2 4.07Å; L311-L325 HydrophobicContact CD1-CG 4.04Å; V323-L325 PolarHBondContact O-N 3.46Å; L325-E327 VanDerWaalsContact C-N 3.32Å; L325-E327 PolarHBondContact O-N 3.4Å; L325-M328 HydrophobicContact CD2-CE 3.65Å; L325-M328 PolarHBondContact O-N 3.46Å; L325-L329 PolarHBondContact O-N 3.04Å; L325-L329 VanDerWaalsContact O-N 3.11Å
326	A	73.8	Confident	64.5	Low	4 Å²	4	77.4 Å²	77.4	3%	0.033	40%	0.403	C	S	.	.	H	α-helix	trans	-59.6	-39.7	175.9	0	0	0	0	0	112.7	L307 P324 L329 G330 R378 F379	L307-A326 HydrophobicContact CB-CB 4.02Å; L307-A326 HydrophobicContact CD1-CB 4.33Å; P324-A326 PolarHBondContact O-N 3.47Å; P324-A326 VanDerWaalsContact O-N 3.16Å; A326-L329 PolarHBondContact O-N 2.87Å; A326-G330 PolarHBondContact O-N 2.98Å; A326-R378 CarbonylContact C-O 3.58Å; A326-R378 HydrophobicContact CB-CB 4.47Å; A326-F379 HydrophobicContact CB-CD1 4.46Å; A326-F379 HydrophobicContact CB-CE1 4.28Å; A326-F379 HydrophobicContact CB-CZ 4.42Å; A326-F379 VanDerWaalsContact O-CD1 3.27Å; A326-F379 WeakPolarHBondContact O-CD1 3.35Å
327	E	78.8	Confident	66.7	Low	45 Å²	45	67.8 Å²	67.8	21%	0.21	36%	0.358	C	S	.	.	H	α-helix	trans	-65.9	-43.3	178.6	-74.1	-179.6	-167.9	0	0	111.4	P324 L325 L329 G330 D331 R378 K381	P324-E327 HydrophobicContact CB-CB 4.42Å; P324-E327 HydrophobicContact CB-CG 4.02Å; P324-E327 VanDerWaalsContact CD-CD 3.5Å; P324-E327 WeakPolarHBondContact CD-OE2 3.47Å; P324-E327 HydrophobicContact CG-CG 4.06Å; P324-E327 WeakPolarHBondContact CG-OE1 3.27Å; P324-E327 WeakPolarHBondContact O-CB 3.44Å; P324-E327 PolarHBondContact O-N 2.86Å; L325-E327 VanDerWaalsContact C-N 3.32Å; L325-E327 PolarHBondContact O-N 3.4Å; E327-L329 VanDerWaalsContact C-N 3.34Å; E327-L329 PolarHBondContact O-N 3.49Å; E327-G330 PolarHBondContact O-N 3.38Å; E327-D331 WeakPolarHBondContact O-CB 3.3Å; E327-D331 VanDerWaalsContact O-CG 3.24Å; E327-D331 PolarHBondContact O-N 3Å; E327-R378 VanDerWaalsContact CA-O 3.25Å; E327-R378 WeakPolarHBondContact CA-O 3.29Å; E327-R378 HydrophobicContact CG-CB 4.06Å; E327-R378 WeakPolarHBondContact CG-O 3.31Å; E327-R378 PolarHBondContact N-O 2.89Å; E327-K381 WeakPolarHBondContact OE2-CE 3.26Å; E327-K381 IonicContact OE2-NZ 3.99Å; E327-K381 PolarHBondContact OE2-NZ 2.85Å
328	M	76.9	Confident	69.2	Low	38 Å²	38	61.7 Å²	61.7	19%	0.187	33%	0.326	C	S	.	.	H	α-helix	trans	-65.1	-38.7	178.5	-70.6	-168.1	-67.7	0	0	112.3	L237 L241 V323 P324 L325 M332	L237-M328 HydrophobicContact CD2-CE 3.81Å; L237-M328 HydrophobicContact CG-CE 4.37Å; L241-M328 HydrophobicContact CD1-CB 4.38Å; L241-M328 HydrophobicContact CD1-CE 3.78Å; V323-M328 HydrophobicContact CG1-CE 4.4Å; V323-M328 HydrophobicContact CG1-CG 3.75Å; V323-M328 HydrophobicContact CG1-SD 4.05Å; P324-M328 PolarHBondContact O-N 3.38Å; L325-M328 HydrophobicContact CD2-CE 3.65Å; L325-M328 PolarHBondContact O-N 3.46Å; M328-M332 VanDerWaalsContact O-CG 3.25Å; M328-M332 WeakPolarHBondContact O-CG 3.26Å; M328-M332 PolarHBondContact O-N 3.31Å
329	L	80.4	Confident	71.3	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-69.8	-41.8	176.7	-172.8	64.2	0	0	0	110.8	F244 L248 L307 L325 A326 E327 M332 I333 F379	F244-L329 HydrophobicContact CD1-CD1 4.2Å; F244-L329 HydrophobicContact CD1-CD2 4.43Å; F244-L329 HydrophobicContact CE1-CD2 4.21Å; L248-L329 HydrophobicContact CD2-CD2 4.44Å; L307-L329 HydrophobicContact CD1-CD2 3.92Å; L307-L329 HydrophobicContact CD2-CD2 4.41Å; L325-L329 PolarHBondContact O-N 3.04Å; L325-L329 VanDerWaalsContact O-N 3.11Å; A326-L329 PolarHBondContact O-N 2.87Å; E327-L329 VanDerWaalsContact C-N 3.34Å; E327-L329 PolarHBondContact O-N 3.49Å; L329-M332 WeakPolarHBondContact O-CB 3.4Å; L329-M332 PolarHBondContact O-N 3.2Å; L329-M332 VanDerWaalsContact O-N 3.17Å; L329-I333 HydrophobicContact CD1-CG2 4.28Å; L329-I333 HydrophobicContact CG-CD1 4.37Å; L329-I333 WeakPolarHBondContact O-CG1 3.34Å; L329-I333 PolarHBondContact O-N 2.74Å; L329-I333 VanDerWaalsContact O-N 3.14Å; L329-F379 HydrophobicContact CB-CE1 4.41Å; L329-F379 HydrophobicContact CD2-CE1 4.19Å
330	G	82.3	Confident	73.5	Confident	3 Å²	3	48.4 Å²	48.4	3%	0.031	27%	0.268	C	S	.	.	H	α-helix	trans	-57.5	-50.3	175.7	0	0	0	0	0	112.7	A326 E327 M332 I333 W334 F379	A326-G330 PolarHBondContact O-N 2.98Å; E327-G330 PolarHBondContact O-N 3.38Å; G330-M332 PolarHBondContact O-N 2.93Å; G330-M332 VanDerWaalsContact O-N 3.09Å; G330-I333 PolarHBondContact O-N 3.46Å; G330-W334 WeakPolarHBondContact O-CB 3.5Å; G330-W334 PolarHBondContact O-N 3Å; G330-F379 WeakPolarHBondContact CA-O 3.37Å
331	D	81.5	Confident	76.1	Confident	96 Å²	96	42.9 Å²	42.9	51%	0.513	23%	0.234	S	C	.	.	H	α-helix	trans	-57.5	-25.7	177.2	-71.8	-22.5	0	0	0	112.5	E327 K381	E327-D331 WeakPolarHBondContact O-CB 3.3Å; E327-D331 VanDerWaalsContact O-CG 3.24Å; E327-D331 PolarHBondContact O-N 3Å; D331-K381 IonicContact OD2-NZ 3.62Å; D331-K381 PolarHBondContact OD2-NZ 3.46Å
332	M	82.4	Confident	78.4	Confident	42 Å²	42	39.4 Å²	39.4	21%	0.207	21%	0.207	C	C	.	.	H	α-helix	trans	-88.2	-32.8	179.7	-69.8	173	173.9	0	0	114.8	H238 L241 K242 M328 L329 G330	H238-M332 WeakPolarHBondContact CE1-CE 3.37Å; H238-M332 WeakPolarHBondContact ND1-CE 3.36Å; H238-M332 WeakPolarHBondContact NE2-CE 3.44Å; H238-M332 WeakPolarHBondContact O-CE 3.38Å; L241-M332 HydrophobicContact CB-SD 4.32Å; K242-M332 WeakPolarHBondContact CA-SD 3.43Å; K242-M332 HydrophobicContact CB-CE 3.81Å; K242-M332 HydrophobicContact CB-SD 3.78Å; K242-M332 HydrophobicContact CG-SD 4.37Å; K242-M332 PolarHBondContact N-SD 3.24Å; M328-M332 VanDerWaalsContact O-CG 3.25Å; M328-M332 WeakPolarHBondContact O-CG 3.26Å; M328-M332 PolarHBondContact O-N 3.31Å; L329-M332 WeakPolarHBondContact O-CB 3.4Å; L329-M332 PolarHBondContact O-N 3.2Å; L329-M332 VanDerWaalsContact O-N 3.17Å; G330-M332 PolarHBondContact O-N 2.93Å; G330-M332 VanDerWaalsContact O-N 3.09Å
333	I	85.2	Confident	80.2	Confident	6 Å²	6	40.1 Å²	40.1	3%	0.031	20%	0.202	C	C	.	.	H	α-helix	trans	-103.7	-22.9	-171.5	69.2	-178.8	0	0	0	113.1	L253 L299 L329 G330 L337	L253-I333 HydrophobicContact CD1-CD1 4.22Å; L299-I333 HydrophobicContact CD2-CD1 4.36Å; L329-I333 HydrophobicContact CD1-CG2 4.28Å; L329-I333 HydrophobicContact CG-CD1 4.37Å; L329-I333 WeakPolarHBondContact O-CG1 3.34Å; L329-I333 PolarHBondContact O-N 2.74Å; L329-I333 VanDerWaalsContact O-N 3.14Å; G330-I333 PolarHBondContact O-N 3.46Å; I333-L337 WeakPolarHBondContact O-CB 3.46Å; I333-L337 PolarHBondContact O-N 3.41Å
334	W	87.4	Confident	81.4	Confident	33 Å²	33	39.4 Å²	39.4	13%	0.125	20%	0.195	C	C	.	.	H	α-helix	trans	-66.4	-42.8	-166.6	179.1	-112.7	0	0	0	113.9	G330 L337 S338 F370 E371 L374 L380 T385 L387	G330-W334 WeakPolarHBondContact O-CB 3.5Å; G330-W334 PolarHBondContact O-N 3Å; W334-L337 HydrophobicContact CE3-CD2 4.24Å; W334-L337 HydrophobicContact CZ3-CD2 4.37Å; W334-L337 PolarHBondContact O-N 3.12Å; W334-S338 VanDerWaalsContact O-CB 3.28Å; W334-S338 WeakPolarHBondContact O-CB 3.3Å; W334-S338 PolarHBondContact O-N 2.88Å; W334-S338 PolarHBondContact O-OG 3.5Å; W334-F370 HydrophobicContact CH2-CE1 4.36Å; W334-F370 HydrophobicContact CZ3-CE1 4.27Å; W334-E371 HydrophobicContact CH2-CG 4.27Å; W334-E371 HydrophobicContact CZ2-CG 4.45Å; W334-L374 HydrophobicContact CE3-CD1 4.14Å; W334-L374 HydrophobicContact CH2-CD1 3.86Å; W334-L374 HydrophobicContact CZ3-CD1 3.33Å; W334-L380 HydrophobicContact CB-CD2 4.27Å; W334-L380 HydrophobicContact CD2-CD2 3.34Å; W334-L380 VanDerWaalsContact CE2-CD2 3.45Å; W334-L380 HydrophobicContact CE3-CD2 3.82Å; W334-L380 HydrophobicContact CG-CD2 3.52Å; W334-L380 HydrophobicContact CH2-CD1 4.2Å; W334-L380 HydrophobicContact CH2-CD2 4.41Å; W334-L380 HydrophobicContact CZ2-CD1 4.15Å; W334-L380 HydrophobicContact CZ2-CD2 4.01Å; W334-L380 HydrophobicContact CZ3-CD2 4.34Å; W334-T385 HydrophobicContact CZ2-CG2 3.89Å; W334-L387 HydrophobicContact CH2-CD2 4.04Å; W334-L387 HydrophobicContact CZ2-CB 4.23Å
335	E	85.3	Confident	82	Confident	153 Å²	153	38.2 Å²	38.2	72%	0.715	19%	0.188	S	C	*	.	H	α-helix	trans	-57.5	-54.8	179.9	-171.8	176.3	-176.1	0	0	110.6	L337 S338 E339	E335-L337 VanDerWaalsContact C-N 3.34Å; E335-L337 PolarHBondContact O-N 3.36Å; E335-S338 PolarHBondContact O-N 3.23Å; E335-S338 PolarHBondContact O-OG 3.42Å; E335-E339 PolarHBondContact O-N 3.39Å; E335-E339 VanDerWaalsContact O-N 3.13Å
336	D	84.3	Confident	82.3	Confident	68 Å²	68	38.1 Å²	38.1	36%	0.364	19%	0.187	S	C	.	.	H	α-helix	trans	-64.9	-35.2	178.4	-71.6	-41.2	0	0	0	113.2	L249 C340	L249-D336 HydrophobicContact CD1-CB 4.33Å; L249-D336 HydrophobicContact CD2-CB 3.45Å; L249-D336 VanDerWaalsContact CD2-CB 3.45Å; D336-C340 WeakPolarHBondContact O-CB 3.49Å; D336-C340 PolarHBondContact O-N 3.06Å; D336-C340 VanDerWaalsContact O-N 3.1Å
337	L	85.1	Confident	82.6	Confident	2 Å²	2	40.4 Å²	40.4	1%	0.01	20%	0.201	C	C	.	.	H	α-helix	trans	-68.5	-45	178.5	-178.7	62.8	0	0	0	110.9	L249 L253 I295 I333 W334 E335 E339 C340 L341	L249-L337 HydrophobicContact CD1-CB 3.99Å; L249-L337 HydrophobicContact CD1-CD1 4.21Å; L253-L337 HydrophobicContact CB-CD1 3.84Å; L253-L337 HydrophobicContact CD1-CD1 4.17Å; L253-L337 HydrophobicContact CD1-CD2 4.22Å; I295-L337 HydrophobicContact CD1-CD1 4.36Å; I295-L337 HydrophobicContact CG2-CD2 4.49Å; I333-L337 WeakPolarHBondContact O-CB 3.46Å; I333-L337 PolarHBondContact O-N 3.41Å; W334-L337 HydrophobicContact CE3-CD2 4.24Å; W334-L337 HydrophobicContact CZ3-CD2 4.37Å; W334-L337 PolarHBondContact O-N 3.12Å; E335-L337 VanDerWaalsContact C-N 3.34Å; E335-L337 PolarHBondContact O-N 3.36Å; L337-E339 VanDerWaalsContact C-N 3.35Å; L337-E339 PolarHBondContact O-N 3.43Å; L337-C340 WeakPolarHBondContact O-CB 3.41Å; L337-C340 PolarHBondContact O-N 3.04Å; L337-L341 HydrophobicContact CD1-CD1 4.41Å; L337-L341 HydrophobicContact CD1-CG 4.4Å; L337-L341 HydrophobicContact CG-CD1 4.05Å; L337-L341 HydrophobicContact CG-CG 4.46Å; L337-L341 VanDerWaalsContact O-CG 3.29Å; L337-L341 WeakPolarHBondContact O-CG 3.05Å; L337-L341 PolarHBondContact O-N 2.96Å
338	S	85	Confident	82.4	Confident	6 Å²	6	43.5 Å²	43.5	4%	0.042	21%	0.211	C	C	.	.	H	α-helix	trans	-61.9	-42.9	178.7	72.3	0	0	0	0	111.3	W334 E335 C340 L341 I342	W334-S338 VanDerWaalsContact O-CB 3.28Å; W334-S338 WeakPolarHBondContact O-CB 3.3Å; W334-S338 PolarHBondContact O-N 2.88Å; W334-S338 PolarHBondContact O-OG 3.5Å; E335-S338 PolarHBondContact O-N 3.23Å; E335-S338 PolarHBondContact O-OG 3.42Å; S338-C340 VanDerWaalsContact C-N 3.35Å; S338-C340 PolarHBondContact O-N 2.89Å; S338-L341 PolarHBondContact O-N 3.39Å; S338-I342 VanDerWaalsContact O-CG1 3.24Å; S338-I342 WeakPolarHBondContact O-CG1 3.42Å; S338-I342 PolarHBondContact O-N 2.99Å
339	E	85.6	Confident	82.3	Confident	92 Å²	92	42.9 Å²	42.9	43%	0.43	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-41.4	175.7	-167.2	-173	179.6	0	0	111.7	E335 L337 I342 K343	E335-E339 PolarHBondContact O-N 3.39Å; E335-E339 VanDerWaalsContact O-N 3.13Å; L337-E339 VanDerWaalsContact C-N 3.35Å; L337-E339 PolarHBondContact O-N 3.43Å; E339-I342 PolarHBondContact O-N 3.04Å; E339-K343 HydrophobicContact CG-CD 4.2Å; E339-K343 WeakPolarHBondContact O-CB 3.49Å; E339-K343 WeakPolarHBondContact O-CG 3.27Å; E339-K343 PolarHBondContact O-N 3.1Å; E339-K343 VanDerWaalsContact OE1-CE 3.3Å; E339-K343 WeakPolarHBondContact OE1-CE 3.42Å; E339-K343 IonicContact OE1-NZ 3.73Å; E339-K343 PolarHBondContact OE1-NZ 2.99Å
340	C	84.3	Confident	82	Confident	12 Å²	12	43.4 Å²	43.4	8%	0.081	21%	0.213	C	C	.	.	H	α-helix	trans	-61.2	-47	175.5	-176.4	0	0	0	0	111.7	D336 L337 S338 I342 K343 N344	D336-C340 WeakPolarHBondContact O-CB 3.49Å; D336-C340 PolarHBondContact O-N 3.06Å; D336-C340 VanDerWaalsContact O-N 3.1Å; L337-C340 WeakPolarHBondContact O-CB 3.41Å; L337-C340 PolarHBondContact O-N 3.04Å; S338-C340 VanDerWaalsContact C-N 3.35Å; S338-C340 PolarHBondContact O-N 2.89Å; C340-I342 VanDerWaalsContact C-N 3.33Å; C340-I342 PolarHBondContact O-N 2.77Å; C340-K343 PolarHBondContact O-N 3.24Å; C340-N344 VanDerWaalsContact O-CB 3.31Å; C340-N344 WeakPolarHBondContact O-CB 3.49Å; C340-N344 PolarHBondContact O-N 3.21Å; C340-N344 PolarHBondContact SG-ND2 3.36Å; C340-N344 VanDerWaalsContact SG-ND2 3.43Å
341	L	84.5	Confident	81.4	Confident	0 Å²	0	44 Å²	44	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-63.3	-39.3	178.4	-71	172.2	0	0	0	112	A257 V291 F292 I295 L337 S338 C345 L346 F370 L387	A257-L341 HydrophobicContact CB-CD2 3.97Å; V291-L341 HydrophobicContact CG1-CD2 3.54Å; F292-L341 HydrophobicContact CE1-CD1 4.31Å; F292-L341 HydrophobicContact CE1-CD2 4.37Å; I295-L341 HydrophobicContact CD1-CD2 3.69Å; L337-L341 HydrophobicContact CD1-CD1 4.41Å; L337-L341 HydrophobicContact CD1-CG 4.4Å; L337-L341 HydrophobicContact CG-CD1 4.05Å; L337-L341 HydrophobicContact CG-CG 4.46Å; L337-L341 VanDerWaalsContact O-CG 3.29Å; L337-L341 WeakPolarHBondContact O-CG 3.05Å; L337-L341 PolarHBondContact O-N 2.96Å; S338-L341 PolarHBondContact O-N 3.39Å; L341-C345 WeakPolarHBondContact O-CA 3.47Å; L341-C345 VanDerWaalsContact O-CB 3.3Å; L341-C345 WeakPolarHBondContact O-CB 3.31Å; L341-C345 PolarHBondContact O-N 3.25Å; L341-C345 VanDerWaalsContact O-N 3.12Å; L341-L346 PolarHBondContact O-N 3.41Å; L341-F370 HydrophobicContact CD1-CE1 4.16Å; L341-L387 HydrophobicContact CB-CD1 3.9Å; L341-L387 HydrophobicContact CD1-CD2 4.17Å
342	I	84.1	Confident	80.7	Confident	28 Å²	28	42.9 Å²	42.9	14%	0.144	21%	0.213	C	C	.	.	I	π-helix	trans	-62.3	-54.5	175.6	-69.3	166	0	0	0	110.2	S338 E339 C340 L346 V347 L387 Y390	S338-I342 VanDerWaalsContact O-CG1 3.24Å; S338-I342 WeakPolarHBondContact O-CG1 3.42Å; S338-I342 PolarHBondContact O-N 2.99Å; E339-I342 PolarHBondContact O-N 3.04Å; C340-I342 VanDerWaalsContact C-N 3.33Å; C340-I342 PolarHBondContact O-N 2.77Å; I342-L346 HydrophobicContact CG1-CD1 4.27Å; I342-L346 PolarHBondContact O-N 3.17Å; I342-V347 HydrophobicContact CG2-CG2 4.35Å; I342-V347 WeakPolarHBondContact O-CG2 3.2Å; I342-V347 PolarHBondContact O-N 2.86Å; I342-L387 HydrophobicContact CD1-CD1 4.49Å; I342-L387 HydrophobicContact CG1-CD1 3.81Å; I342-Y390 HydrophobicContact CD1-CD2 4.28Å; I342-Y390 HydrophobicContact CD1-CG 4.09Å; I342-Y390 HydrophobicContact CG1-CD1 4.2Å; I342-Y390 HydrophobicContact CG1-CD2 4.44Å; I342-Y390 HydrophobicContact CG1-CG 4.03Å; I342-Y390 HydrophobicContact CG2-CD1 4.08Å; I342-Y390 HydrophobicContact CG2-CD2 3.75Å; I342-Y390 HydrophobicContact CG2-CE1 3.91Å; I342-Y390 HydrophobicContact CG2-CE2 3.54Å; I342-Y390 HydrophobicContact CG2-CG 4.02Å
343	K	82.1	Confident	79.8	Confident	115 Å²	115	44.3 Å²	44.3	50%	0.5	22%	0.222	S	C	.	.	I	π-helix	trans	-68.5	-41.7	-174.1	-75.6	177.9	173	172.2	0	113.8	E339 C340 Y348	E339-K343 HydrophobicContact CG-CD 4.2Å; E339-K343 WeakPolarHBondContact O-CB 3.49Å; E339-K343 WeakPolarHBondContact O-CG 3.27Å; E339-K343 PolarHBondContact O-N 3.1Å; E339-K343 VanDerWaalsContact OE1-CE 3.3Å; E339-K343 WeakPolarHBondContact OE1-CE 3.42Å; E339-K343 IonicContact OE1-NZ 3.73Å; E339-K343 PolarHBondContact OE1-NZ 2.99Å; C340-K343 PolarHBondContact O-N 3.24Å; K343-Y348 VanDerWaalsContact O-CE2 3.28Å; K343-Y348 WeakPolarHBondContact O-CE2 3.45Å
344	N	79.4	Confident	78.9	Confident	55 Å²	55	46 Å²	46	29%	0.294	23%	0.234	S	C	.	.	I	π-helix	trans	-96.7	-12.2	-169.6	-62.8	-18.9	0	0	0	113.3	S258 C340 Y348	S258-N344 PolarHBondContact OG-ND2 2.83Å; C340-N344 VanDerWaalsContact O-CB 3.31Å; C340-N344 WeakPolarHBondContact O-CB 3.49Å; C340-N344 PolarHBondContact O-N 3.21Å; C340-N344 PolarHBondContact SG-ND2 3.36Å; C340-N344 VanDerWaalsContact SG-ND2 3.43Å; N344-Y348 WeakPolarHBondContact O-CD2 3.36Å
345	C	80.1	Confident	77.6	Confident	2 Å²	2	48.4 Å²	48.4	1%	0.014	26%	0.256	C	S	.	.	I	π-helix	trans	-132.2	-62.7	-177.5	-170	0	0	0	0	113.1	P286 P288 L341 V347 Y348 S349	P286-C345 PolarHBondContact O-SG 2.98Å; P288-C345 WeakPolarHBondContact CA-SG 3.4Å; L341-C345 WeakPolarHBondContact O-CA 3.47Å; L341-C345 VanDerWaalsContact O-CB 3.3Å; L341-C345 WeakPolarHBondContact O-CB 3.31Å; L341-C345 PolarHBondContact O-N 3.25Å; L341-C345 VanDerWaalsContact O-N 3.12Å; C345-V347 PolarHBondContact O-N 2.73Å; C345-Y348 PolarHBondContact O-N 2.95Å; C345-S349 PolarHBondContact O-N 2.98Å
346	L	79.8	Confident	76.7	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	24%	0.242	C	C	.	.	I	π-helix	trans	-65.4	-34.9	-171.4	-68.9	175.7	0	0	0	113.6	P288 F292 L341 I342 Y348 S349 I363 L387 Y390	P288-L346 HydrophobicContact CB-CD2 4.1Å; P288-L346 HydrophobicContact CG-CD2 4.14Å; F292-L346 HydrophobicContact CZ-CD2 4.23Å; L341-L346 PolarHBondContact O-N 3.41Å; I342-L346 HydrophobicContact CG1-CD1 4.27Å; I342-L346 PolarHBondContact O-N 3.17Å; L346-Y348 VanDerWaalsContact C-N 3.3Å; L346-Y348 PolarHBondContact O-N 3.18Å; L346-S349 WeakPolarHBondContact CA-OG 3.38Å; L346-S349 PolarHBondContact O-N 3.15Å; L346-S349 PolarHBondContact O-OG 2.93Å; L346-I363 HydrophobicContact CD2-CG2 3.93Å; L346-L387 HydrophobicContact CD1-CD1 3.4Å; L346-L387 HydrophobicContact CD1-CG 4.15Å; L346-Y390 HydrophobicContact CB-CD1 4.2Å; L346-Y390 HydrophobicContact CB-CE1 3.94Å; L346-Y390 HydrophobicContact CD1-CD1 4.04Å
347	V	79.4	Confident	75.9	Confident	52 Å²	52	44 Å²	44	32%	0.315	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-39.7	176.9	168.1	0	0	0	0	112.4	I342 C345 S349 I350 Y390	I342-V347 HydrophobicContact CG2-CG2 4.35Å; I342-V347 WeakPolarHBondContact O-CG2 3.2Å; I342-V347 PolarHBondContact O-N 2.86Å; C345-V347 PolarHBondContact O-N 2.73Å; V347-S349 VanDerWaalsContact C-N 3.31Å; V347-I350 WeakPolarHBondContact O-CD1 3.42Å; V347-I350 WeakPolarHBondContact O-CG1 3.44Å; V347-I350 PolarHBondContact O-N 3.38Å; V347-Y390 VanDerWaalsContact CG2-OH 3.25Å; V347-Y390 WeakPolarHBondContact CG2-OH 3.45Å
348	Y	75.1	Confident	75	Confident	110 Å²	110	51.9 Å²	51.9	43%	0.431	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-22.6	-178.9	-58.6	-70.4	0	0	0	112.6	Y285 K343 N344 C345 L346 I350	Y285-Y348 AromaticContact CD1-CD1 3.81Å; Y285-Y348 HydrophobicContact CD1-CD1 3.81Å; Y285-Y348 AromaticContact CD1-CD2 3.56Å; Y285-Y348 HydrophobicContact CD1-CD2 3.56Å; Y285-Y348 AromaticContact CD1-CE1 3.97Å; Y285-Y348 HydrophobicContact CD1-CE1 3.97Å; Y285-Y348 AromaticContact CD1-CE2 3.72Å; Y285-Y348 HydrophobicContact CD1-CE2 3.72Å; Y285-Y348 AromaticContact CD1-CG 3.61Å; Y285-Y348 HydrophobicContact CD1-CG 3.61Å; Y285-Y348 AromaticContact CD1-CZ 3.92Å; Y285-Y348 HydrophobicContact CD2-CD1 4.36Å; Y285-Y348 HydrophobicContact CD2-CG 4.44Å; Y285-Y348 AromaticContact CE1-CD1 3.65Å; Y285-Y348 HydrophobicContact CE1-CD1 3.65Å; Y285-Y348 HydrophobicContact CE1-CD2 4Å; Y285-Y348 AromaticContact CE1-CE1 3.41Å; Y285-Y348 HydrophobicContact CE1-CE1 3.41Å; Y285-Y348 VanDerWaalsContact CE1-CE1 3.41Å; Y285-Y348 AromaticContact CE1-CE2 3.77Å; Y285-Y348 HydrophobicContact CE1-CE2 3.77Å; Y285-Y348 AromaticContact CE1-CG 3.95Å; Y285-Y348 HydrophobicContact CE1-CG 3.95Å; Y285-Y348 AromaticContact CE1-CZ 3.47Å; Y285-Y348 VanDerWaalsContact CE1-CZ 3.47Å; Y285-Y348 HydrophobicContact CE2-CD1 4.25Å; Y285-Y348 HydrophobicContact CG-CD1 4.17Å; Y285-Y348 HydrophobicContact CG-CD2 4.19Å; Y285-Y348 AromaticContact CG-CG 3.88Å; Y285-Y348 HydrophobicContact CG-CG 3.88Å; Y285-Y348 AromaticContact CZ-CD1 3.89Å; Y285-Y348 AromaticContact CZ-CE1 3.75Å; K343-Y348 VanDerWaalsContact O-CE2 3.28Å; K343-Y348 WeakPolarHBondContact O-CE2 3.45Å; N344-Y348 WeakPolarHBondContact O-CD2 3.36Å; C345-Y348 PolarHBondContact O-N 2.95Å; L346-Y348 VanDerWaalsContact C-N 3.3Å; L346-Y348 PolarHBondContact O-N 3.18Å; Y348-I350 VanDerWaalsContact C-N 3.26Å; Y348-I350 PolarHBondContact O-N 3.08Å
349	S	74.1	Confident	74.3	Confident	25 Å²	25	57.2 Å²	57.2	18%	0.175	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	-9.4	175.9	71.6	0	0	0	0	114.2	C345 L346 V347 P351 Y360	C345-S349 PolarHBondContact O-N 2.98Å; L346-S349 WeakPolarHBondContact CA-OG 3.38Å; L346-S349 PolarHBondContact O-N 3.15Å; L346-S349 PolarHBondContact O-OG 2.93Å; V347-S349 VanDerWaalsContact C-N 3.31Å; S349-P351 WeakPolarHBondContact O-CD 3.36Å; S349-Y360 WeakPolarHBondContact O-CD2 3.22Å; S349-Y360 WeakPolarHBondContact O-CE2 3.47Å; S349-Y360 VanDerWaalsContact OG-CE2 3.31Å; S349-Y360 WeakPolarHBondContact OG-CE2 3.25Å; S349-Y360 PolarHBondContact OG-OH 3.12Å
350	I	75	Confident	73.9	Confident	12 Å²	12	53 Å²	53	6%	0.062	27%	0.274	C	S	.	.	S	Bend	trans	-64.4	119.9	179.2	-60.5	167.2	0	0	0	109.8	V347 Y348 I394 H397 F398 K401	V347-I350 WeakPolarHBondContact O-CD1 3.42Å; V347-I350 WeakPolarHBondContact O-CG1 3.44Å; V347-I350 PolarHBondContact O-N 3.38Å; Y348-I350 VanDerWaalsContact C-N 3.26Å; Y348-I350 PolarHBondContact O-N 3.08Å; I350-I394 HydrophobicContact CB-CD1 4.22Å; I350-I394 HydrophobicContact CG1-CD1 3.81Å; I350-I394 HydrophobicContact CG2-CD1 3.96Å; I350-H397 HydrophobicContact CD1-CB 3.85Å; I350-F398 HydrophobicContact CG2-CB 4.26Å; I350-K401 HydrophobicContact CB-CD 4.41Å; I350-K401 HydrophobicContact CG2-CD 4.08Å; I350-K401 PolarHBondContact O-NZ 2.96Å
351	P	70.3	Confident	73.4	Confident	16 Å²	16	58 Å²	58	10%	0.104	30%	0.296	C	S	.	.			trans	-61.5	157.2	-177.9	-21.5	32.3	0	0	0	113.2	S349 K356 Y360 F398	S349-P351 WeakPolarHBondContact O-CD 3.36Å; P351-K356 HydrophobicContact CB-CB 3.77Å; P351-K356 HydrophobicContact CG-CB 4.38Å; P351-Y360 HydrophobicContact CG-CD2 4.1Å; P351-F398 HydrophobicContact CB-CD2 4.46Å; P351-F398 HydrophobicContact CB-CE2 4.49Å; P351-F398 WeakPolarHBondContact O-CD2 3.42Å; P351-F398 VanDerWaalsContact O-CE2 3.3Å; P351-F398 WeakPolarHBondContact O-CE2 3.31Å
352	T	66.9	Low	73.2	Confident	71 Å²	71	64.4 Å²	64.4	44%	0.436	33%	0.326	S	S	.	.	S	Bend	trans	-96	-15.7	173.3	49.7	0	0	0	0	113.5
353	N	63.6	Low	73.1	Confident	73 Å²	73	64.5 Å²	64.5	39%	0.39	33%	0.326	S	S	.	.	S	Bend	trans	-127.9	143.1	-177.6	-65.4	-15	0	0	0	111.2	S355 K356	N353-S355 PolarHBondContact O-N 3.3Å; N353-K356 PolarHBondContact O-N 2.61Å
354	S	64.6	Low	73.1	Confident	40 Å²	40	59.7 Å²	59.7	28%	0.28	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-58.9	-29	176.9	58.7	0	0	0	0	113.9	K356 L357	S354-K356 VanDerWaalsContact C-N 3.28Å; S354-K356 PolarHBondContact O-N 3.35Å; S354-L357 WeakPolarHBondContact O-CB 3.44Å; S354-L357 PolarHBondContact O-N 2.95Å
355	S	61.5	Low	73.3	Confident	84 Å²	84	62.2 Å²	62.2	59%	0.587	32%	0.316	S	S	*	.	G	3₁₀ helix	trans	-68.1	-25.4	175.6	54.4	0	0	0	0	114	N353 L357	N353-S355 PolarHBondContact O-N 3.3Å; S355-L357 VanDerWaalsContact C-N 3.35Å
356	K	65.1	Low	73.5	Confident	97 Å²	97	63.4 Å²	63.4	42%	0.422	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	-89.3	-3.5	177.2	-67.7	-175.9	178.6	-175.6	0	112.7	P351 N353 S354 Q358 Q359 Y360	P351-K356 HydrophobicContact CB-CB 3.77Å; P351-K356 HydrophobicContact CG-CB 4.38Å; N353-K356 PolarHBondContact O-N 2.61Å; S354-K356 VanDerWaalsContact C-N 3.28Å; S354-K356 PolarHBondContact O-N 3.35Å; K356-Q358 VanDerWaalsContact C-N 3.26Å; K356-Q358 PolarHBondContact O-N 3.46Å; K356-Q359 WeakPolarHBondContact O-CB 3.35Å; K356-Q359 PolarHBondContact O-N 3.35Å; K356-Y360 PolarHBondContact O-N 3.44Å
357	L	67.7	Low	73.8	Confident	33 Å²	33	63.4 Å²	63.4	17%	0.173	32%	0.324	C	S	.	.	H	α-helix	trans	-66.9	-31	177	-129.1	154.7	0	0	0	111.1	S354 S355 Q359 Y360 I394 F398	S354-L357 WeakPolarHBondContact O-CB 3.44Å; S354-L357 PolarHBondContact O-N 2.95Å; S355-L357 VanDerWaalsContact C-N 3.35Å; L357-Q359 VanDerWaalsContact C-N 3.3Å; L357-Q359 PolarHBondContact O-N 3.19Å; L357-Y360 VanDerWaalsContact O-CB 3.29Å; L357-Y360 WeakPolarHBondContact O-CB 3.4Å; L357-Y360 PolarHBondContact O-N 3.16Å; L357-Y360 VanDerWaalsContact O-N 3.1Å; L357-I394 HydrophobicContact CD2-CG1 4.38Å; L357-I394 HydrophobicContact CD2-CG2 4.21Å; L357-F398 HydrophobicContact CD1-CB 4.32Å; L357-F398 HydrophobicContact CD1-CD1 3.6Å; L357-F398 HydrophobicContact CD1-CD2 4.09Å; L357-F398 HydrophobicContact CD1-CE1 3.9Å; L357-F398 HydrophobicContact CD1-CE2 4.37Å; L357-F398 HydrophobicContact CD1-CG 3.71Å; L357-F398 HydrophobicContact CD1-CZ 4.29Å
358	Q	67.1	Low	74.1	Confident	166 Å²	166	64.3 Å²	64.3	78%	0.776	33%	0.325	S	S	*	.	H	α-helix	trans	-62.7	-35.7	172	-67.7	-178.9	-9.6	0	0	112.7	K356 Y360 E361	K356-Q358 VanDerWaalsContact C-N 3.26Å; K356-Q358 PolarHBondContact O-N 3.46Å; Q358-Y360 PolarHBondContact O-N 3.21Å; Q358-E361 WeakPolarHBondContact O-CB 3.47Å; Q358-E361 PolarHBondContact O-N 3.23Å
359	Q	70.8	Confident	74.6	Confident	118 Å²	118	64 Å²	64	55%	0.551	33%	0.328	S	S	*	.	H	α-helix	trans	-71	-19.8	176.7	-61.8	174.3	-17.2	0	0	111.9	K356 L357 E361 E362	K356-Q359 WeakPolarHBondContact O-CB 3.35Å; K356-Q359 PolarHBondContact O-N 3.35Å; L357-Q359 VanDerWaalsContact C-N 3.3Å; L357-Q359 PolarHBondContact O-N 3.19Å; Q359-E361 VanDerWaalsContact C-N 3.27Å; Q359-E362 PolarHBondContact O-N 3.25Å
360	Y	75.8	Confident	75.2	Confident	3 Å²	3	63 Å²	63	1%	0.012	32%	0.32	C	S	.	.	H	α-helix	trans	-74.4	-20.1	176	-159.1	-90.5	0	0	0	112.5	S349 P351 K356 L357 Q358 E362 I363 I364 I394	S349-Y360 WeakPolarHBondContact O-CD2 3.22Å; S349-Y360 WeakPolarHBondContact O-CE2 3.47Å; S349-Y360 VanDerWaalsContact OG-CE2 3.31Å; S349-Y360 WeakPolarHBondContact OG-CE2 3.25Å; S349-Y360 PolarHBondContact OG-OH 3.12Å; P351-Y360 HydrophobicContact CG-CD2 4.1Å; K356-Y360 PolarHBondContact O-N 3.44Å; L357-Y360 VanDerWaalsContact O-CB 3.29Å; L357-Y360 WeakPolarHBondContact O-CB 3.4Å; L357-Y360 PolarHBondContact O-N 3.16Å; L357-Y360 VanDerWaalsContact O-N 3.1Å; Q358-Y360 PolarHBondContact O-N 3.21Å; Y360-E362 PolarHBondContact O-N 2.72Å; Y360-I363 HydrophobicContact CD2-CB 4.43Å; Y360-I363 HydrophobicContact CD2-CD1 3.66Å; Y360-I363 HydrophobicContact CE1-CG2 4.46Å; Y360-I363 HydrophobicContact CE2-CB 4.45Å; Y360-I363 HydrophobicContact CE2-CD1 3.87Å; Y360-I363 HydrophobicContact CE2-CG2 4.29Å; Y360-I363 HydrophobicContact CG-CB 4.49Å; Y360-I363 HydrophobicContact CG-CD1 4.37Å; Y360-I363 WeakPolarHBondContact O-CA 3.38Å; Y360-I363 WeakPolarHBondContact O-CB 3.42Å; Y360-I363 PolarHBondContact O-N 2.95Å; Y360-I364 HydrophobicContact CD1-CD1 4.08Å; Y360-I364 HydrophobicContact CD1-CG1 3.85Å; Y360-I364 HydrophobicContact CE1-CD1 4.5Å; Y360-I364 HydrophobicContact CE1-CG1 4Å; Y360-I364 PolarHBondContact O-N 3.26Å; Y360-I394 HydrophobicContact CD1-CB 3.75Å; Y360-I394 HydrophobicContact CD1-CD1 3.91Å; Y360-I394 HydrophobicContact CD1-CG1 3.44Å; Y360-I394 VanDerWaalsContact CD1-CG1 3.44Å; Y360-I394 HydrophobicContact CD1-CG2 3.97Å; Y360-I394 HydrophobicContact CD2-CD1 4.06Å; Y360-I394 HydrophobicContact CD2-CG1 4.27Å; Y360-I394 HydrophobicContact CE1-CB 3.62Å; Y360-I394 HydrophobicContact CE1-CD1 3.58Å; Y360-I394 HydrophobicContact CE1-CG1 3.53Å; Y360-I394 HydrophobicContact CE1-CG2 4.26Å; Y360-I394 HydrophobicContact CE2-CD1 3.74Å; Y360-I394 HydrophobicContact CE2-CG1 4.34Å; Y360-I394 HydrophobicContact CG-CD1 4.13Å; Y360-I394 HydrophobicContact CG-CG1 3.83Å; Y360-I394 VanDerWaalsContact CZ-CD1 3.5Å
361	E	75.1	Confident	75.7	Confident	118 Å²	118	62.5 Å²	62.5	55%	0.551	32%	0.318	S	S	*	.	H	α-helix	trans	-59.5	-35.9	174.2	-162.9	64.2	-153.4	0	0	111.2	Q358 Q359 I363 I364 Q365	Q358-E361 WeakPolarHBondContact O-CB 3.47Å; Q358-E361 PolarHBondContact O-N 3.23Å; Q359-E361 VanDerWaalsContact C-N 3.27Å; E361-I363 PolarHBondContact O-N 3.25Å; E361-I364 PolarHBondContact O-N 3.45Å; E361-Q365 PolarHBondContact O-N 3.43Å
362	E	79.4	Confident	76.4	Confident	135 Å²	135	65.2 Å²	65.2	63%	0.631	33%	0.331	S	S	*	.	H	α-helix	trans	-61.8	-32.1	174	-60.9	177.9	-175	0	0	112.1	Q359 Y360 S366	Q359-E362 PolarHBondContact O-N 3.25Å; Y360-E362 PolarHBondContact O-N 2.72Å; E362-S366 WeakPolarHBondContact O-CB 3.2Å; E362-S366 PolarHBondContact O-N 2.92Å; E362-S366 PolarHBondContact O-OG 3.25Å
363	I	82.2	Confident	77.3	Confident	29 Å²	29	62 Å²	62	15%	0.149	31%	0.312	C	S	.	.	H	α-helix	trans	-76.8	-38.1	177.1	-62.9	168.4	0	0	0	110.3	P288 L346 Y360 E361 Q365 S366 T367	P288-I363 HydrophobicContact CB-CG2 3.94Å; P288-I363 HydrophobicContact CG-CD1 4.41Å; P288-I363 HydrophobicContact CG-CG2 3.97Å; L346-I363 HydrophobicContact CD2-CG2 3.93Å; Y360-I363 HydrophobicContact CD2-CB 4.43Å; Y360-I363 HydrophobicContact CD2-CD1 3.66Å; Y360-I363 HydrophobicContact CE1-CG2 4.46Å; Y360-I363 HydrophobicContact CE2-CB 4.45Å; Y360-I363 HydrophobicContact CE2-CD1 3.87Å; Y360-I363 HydrophobicContact CE2-CG2 4.29Å; Y360-I363 HydrophobicContact CG-CB 4.49Å; Y360-I363 HydrophobicContact CG-CD1 4.37Å; Y360-I363 WeakPolarHBondContact O-CA 3.38Å; Y360-I363 WeakPolarHBondContact O-CB 3.42Å; Y360-I363 PolarHBondContact O-N 2.95Å; E361-I363 PolarHBondContact O-N 3.25Å; I363-Q365 VanDerWaalsContact C-N 3.32Å; I363-S366 PolarHBondContact O-N 3.37Å; I363-T367 WeakPolarHBondContact O-CB 3.12Å; I363-T367 PolarHBondContact O-N 3.18Å; I363-T367 PolarHBondContact O-OG1 3.44Å
364	I	81.9	Confident	78.3	Confident	14 Å²	14	58.6 Å²	58.6	7%	0.072	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-47.2	173.1	-64.2	172.9	0	0	0	109.2	Y360 E361 T367 E368 A391 R392 I394	Y360-I364 HydrophobicContact CD1-CD1 4.08Å; Y360-I364 HydrophobicContact CD1-CG1 3.85Å; Y360-I364 HydrophobicContact CE1-CD1 4.5Å; Y360-I364 HydrophobicContact CE1-CG1 4Å; Y360-I364 PolarHBondContact O-N 3.26Å; E361-I364 PolarHBondContact O-N 3.45Å; I364-T367 WeakPolarHBondContact O-CB 3.43Å; I364-T367 PolarHBondContact O-N 3.17Å; I364-E368 PolarHBondContact O-N 3.14Å; I364-A391 HydrophobicContact CG1-CB 4.41Å; I364-R392 HydrophobicContact CG2-CG 4.37Å; I364-I394 HydrophobicContact CD1-CG2 4.11Å
365	Q	83.9	Confident	79.2	Confident	108 Å²	108	59.2 Å²	59.2	51%	0.505	29%	0.291	S	S	.	.	H	α-helix	trans	-61.8	-46.1	176.4	-173.5	177.4	-10.6	0	0	111.9	E361 I363 T367 E368 E369	E361-Q365 PolarHBondContact O-N 3.43Å; I363-Q365 VanDerWaalsContact C-N 3.32Å; Q365-T367 PolarHBondContact O-N 2.94Å; Q365-E368 PolarHBondContact O-N 3.12Å; Q365-E368 VanDerWaalsContact O-N 3.16Å; Q365-E369 HydrophobicContact CG-CG 4.5Å; Q365-E369 PolarHBondContact NE2-OE1 3.16Å; Q365-E369 WeakPolarHBondContact O-CG 3.23Å; Q365-E369 PolarHBondContact O-N 2.92Å
366	S	84.1	Confident	80.2	Confident	27 Å²	27	62.8 Å²	62.8	19%	0.189	30%	0.299	C	S	.	.	H	α-helix	trans	-58.5	-36.5	174.8	-61.9	0	0	0	0	112.6	S289 E362 I363 F370	S289-S366 WeakPolarHBondContact OG-CB 3.37Å; S289-S366 PolarHBondContact OG-OG 2.9Å; E362-S366 WeakPolarHBondContact O-CB 3.2Å; E362-S366 PolarHBondContact O-N 2.92Å; E362-S366 PolarHBondContact O-OG 3.25Å; I363-S366 PolarHBondContact O-N 3.37Å; S366-F370 WeakPolarHBondContact O-CB 3.47Å; S366-F370 PolarHBondContact O-N 2.71Å
367	T	85.5	Confident	80.8	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-69.3	-41.4	177.3	-53	0	0	0	0	111	F292 I363 I364 Q365 F370 E371 L387 L388 A391	F292-T367 HydrophobicContact CE2-CG2 4.44Å; F292-T367 WeakPolarHBondContact CE2-OG1 3.47Å; F292-T367 HydrophobicContact CZ-CG2 4.28Å; I363-T367 WeakPolarHBondContact O-CB 3.12Å; I363-T367 PolarHBondContact O-N 3.18Å; I363-T367 PolarHBondContact O-OG1 3.44Å; I364-T367 WeakPolarHBondContact O-CB 3.43Å; I364-T367 PolarHBondContact O-N 3.17Å; Q365-T367 PolarHBondContact O-N 2.94Å; T367-F370 PolarHBondContact O-N 2.87Å; T367-E371 PolarHBondContact O-N 3.29Å; T367-L387 HydrophobicContact CG2-CD2 3.88Å; T367-L387 HydrophobicContact CG2-CG 3.83Å; T367-L388 HydrophobicContact CG2-CD1 4.43Å; T367-A391 HydrophobicContact CG2-CB 4.27Å
368	E	85.9	Confident	81.3	Confident	72 Å²	72	64 Å²	64	34%	0.336	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-43.1	176.7	-173.3	162.1	-132.2	0	0	111.9	I364 Q365 F370 E371 N372 L388 R392	I364-E368 PolarHBondContact O-N 3.14Å; Q365-E368 PolarHBondContact O-N 3.12Å; Q365-E368 VanDerWaalsContact O-N 3.16Å; E368-F370 VanDerWaalsContact C-N 3.33Å; E368-F370 PolarHBondContact O-N 2.89Å; E368-E371 PolarHBondContact O-N 3.31Å; E368-N372 WeakPolarHBondContact O-CB 3.48Å; E368-N372 PolarHBondContact O-N 2.64Å; E368-N372 PolarHBondContact O-ND2 3.38Å; E368-L388 HydrophobicContact CB-CD1 4.09Å; E368-R392 IonicContact OE1-NH2 3.29Å; E368-R392 PolarHBondContact OE1-NH2 3.41Å
369	E	86.6	Confident	82	Confident	103 Å²	103	56.5 Å²	56.5	48%	0.481	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-40.9	174.1	-73	176.2	-167.3	0	0	112	Q365 A373	Q365-E369 HydrophobicContact CG-CG 4.5Å; Q365-E369 PolarHBondContact NE2-OE1 3.16Å; Q365-E369 WeakPolarHBondContact O-CG 3.23Å; Q365-E369 PolarHBondContact O-N 2.92Å; E369-A373 PolarHBondContact O-N 3.49Å
370	F	87	Confident	82.5	Confident	5 Å²	5	51.8 Å²	51.8	2%	0.022	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-47	175.9	176.8	-112.2	0	0	0	112.3	F292 I295 R296 W334 L341 S366 T367 E368 N372 A373 L374 L387	F292-F370 HydrophobicContact CB-CB 3.94Å; F292-F370 HydrophobicContact CB-CD1 4.47Å; F292-F370 HydrophobicContact CB-CD2 3.67Å; F292-F370 HydrophobicContact CB-CE2 4.28Å; F292-F370 HydrophobicContact CB-CG 3.77Å; F292-F370 HydrophobicContact CD1-CB 4.47Å; F292-F370 AromaticContact CD1-CD1 3.77Å; F292-F370 HydrophobicContact CD1-CD1 3.77Å; F292-F370 HydrophobicContact CD1-CD2 4.37Å; F292-F370 HydrophobicContact CD1-CE1 4.03Å; F292-F370 AromaticContact CD1-CG 3.95Å; F292-F370 HydrophobicContact CD1-CG 3.95Å; F292-F370 HydrophobicContact CD1-CZ 4.43Å; F292-F370 HydrophobicContact CD2-CB 4.11Å; F292-F370 HydrophobicContact CD2-CG 4.45Å; F292-F370 HydrophobicContact CE1-CD1 4.2Å; F292-F370 HydrophobicContact CE1-CE1 4.47Å; F292-F370 HydrophobicContact CG-CB 3.93Å; F292-F370 HydrophobicContact CG-CD1 4.1Å; F292-F370 HydrophobicContact CG-CD2 4.18Å; F292-F370 AromaticContact CG-CG 3.81Å; F292-F370 HydrophobicContact CG-CG 3.81Å; F292-F370 WeakPolarHBondContact O-CE2 3.28Å; I295-F370 HydrophobicContact CB-CE2 4.37Å; I295-F370 HydrophobicContact CB-CZ 4.37Å; I295-F370 HydrophobicContact CG2-CE2 4.13Å; I295-F370 HydrophobicContact CG2-CZ 3.85Å; R296-F370 HydrophobicContact CB-CD2 4.19Å; R296-F370 HydrophobicContact CB-CE2 4.06Å; W334-F370 HydrophobicContact CH2-CE1 4.36Å; W334-F370 HydrophobicContact CZ3-CE1 4.27Å; L341-F370 HydrophobicContact CD1-CE1 4.16Å; S366-F370 WeakPolarHBondContact O-CB 3.47Å; S366-F370 PolarHBondContact O-N 2.71Å; T367-F370 PolarHBondContact O-N 2.87Å; E368-F370 VanDerWaalsContact C-N 3.33Å; E368-F370 PolarHBondContact O-N 2.89Å; F370-N372 PolarHBondContact O-N 3.19Å; F370-A373 PolarHBondContact O-N 3.36Å; F370-L374 HydrophobicContact CD1-CD1 4.18Å; F370-L374 HydrophobicContact CE1-CD1 3.6Å; F370-L374 HydrophobicContact CE1-CG 4.49Å; F370-L374 HydrophobicContact CE2-CD1 4.22Å; F370-L374 HydrophobicContact CE2-CG 4.36Å; F370-L374 HydrophobicContact CZ-CD1 3.63Å; F370-L374 HydrophobicContact CZ-CG 4.25Å; F370-L374 WeakPolarHBondContact O-CG 3.4Å; F370-L374 PolarHBondContact O-N 3.21Å; F370-L387 HydrophobicContact CD1-CD2 4.25Å; F370-L387 HydrophobicContact CE1-CD2 4.38Å
371	E	85.6	Confident	82.1	Confident	1 Å²	1	57.4 Å²	57.4	1%	0.005	27%	0.267	C	S	.	.	H	α-helix	trans	-64.7	-39	177	-76.6	-175.9	-152.2	0	0	112.5	W334 T367 E368 A373 L374 K375 L380 T385 L387 L388	W334-E371 HydrophobicContact CH2-CG 4.27Å; W334-E371 HydrophobicContact CZ2-CG 4.45Å; T367-E371 PolarHBondContact O-N 3.29Å; E368-E371 PolarHBondContact O-N 3.31Å; E371-A373 VanDerWaalsContact C-N 3.35Å; E371-L374 PolarHBondContact O-N 3.01Å; E371-K375 WeakPolarHBondContact O-CG 3.33Å; E371-K375 PolarHBondContact O-N 3.5Å; E371-L380 HydrophobicContact CB-CD1 4.47Å; E371-L380 HydrophobicContact CG-CD1 4.49Å; E371-T385 PolarHBondContact OE1-OG1 2.92Å; E371-T385 WeakPolarHBondContact OE2-CB 3.43Å; E371-T385 VanDerWaalsContact OE2-CG2 3.31Å; E371-T385 WeakPolarHBondContact OE2-CG2 3.5Å; E371-T385 PolarHBondContact OE2-OG1 3.22Å; E371-L387 WeakPolarHBondContact OE1-CB 3.23Å; E371-L388 VanDerWaalsContact OE1-CB 3.27Å; E371-L388 WeakPolarHBondContact OE1-CB 3.36Å; E371-L388 PolarHBondContact OE1-N 3.01Å
372	N	85.2	Confident	81.6	Confident	72 Å²	72	53.5 Å²	53.5	39%	0.385	26%	0.258	S	S	.	.	H	α-helix	trans	-63.2	-41.9	175.7	-72.4	-24.7	0	0	0	111.3	E368 F370 L374 K375 E376	E368-N372 WeakPolarHBondContact O-CB 3.48Å; E368-N372 PolarHBondContact O-N 2.64Å; E368-N372 PolarHBondContact O-ND2 3.38Å; F370-N372 PolarHBondContact O-N 3.19Å; N372-L374 VanDerWaalsContact C-N 3.33Å; N372-L374 PolarHBondContact O-N 3.36Å; N372-K375 WeakPolarHBondContact O-CB 3.47Å; N372-K375 PolarHBondContact O-N 3.44Å; N372-E376 WeakPolarHBondContact O-CG 3.27Å; N372-E376 PolarHBondContact O-N 2.91Å
373	A	84.9	Confident	80.7	Confident	4 Å²	4	53.7 Å²	53.7	3%	0.033	26%	0.263	C	S	.	.	H	α-helix	trans	-58.9	-44.3	173	0	0	0	0	0	111.4	E369 F370 E371 K375 E376 M377	E369-A373 PolarHBondContact O-N 3.49Å; F370-A373 PolarHBondContact O-N 3.36Å; E371-A373 VanDerWaalsContact C-N 3.35Å; A373-K375 VanDerWaalsContact C-N 3.32Å; A373-K375 PolarHBondContact O-N 3.25Å; A373-E376 PolarHBondContact O-N 3.27Å; A373-M377 HydrophobicContact CB-CE 3.96Å; A373-M377 WeakPolarHBondContact O-CE 3.2Å; A373-M377 WeakPolarHBondContact O-CG 3.45Å; A373-M377 PolarHBondContact O-N 3.23Å
374	L	83.8	Confident	79.4	Confident	2 Å²	2	56.3 Å²	56.3	1%	0.01	28%	0.281	C	S	.	.	H	α-helix	trans	-66.1	-31.8	177.6	-67.8	179.6	0	0	0	113.7	L299 W334 F370 E371 N372 M377 R378 F379 L380	L299-L374 HydrophobicContact CB-CD2 4.48Å; L299-L374 HydrophobicContact CD1-CD2 3.48Å; L299-L374 VanDerWaalsContact CD1-CD2 3.48Å; W334-L374 HydrophobicContact CE3-CD1 4.14Å; W334-L374 HydrophobicContact CH2-CD1 3.86Å; W334-L374 HydrophobicContact CZ3-CD1 3.33Å; F370-L374 HydrophobicContact CD1-CD1 4.18Å; F370-L374 HydrophobicContact CE1-CD1 3.6Å; F370-L374 HydrophobicContact CE1-CG 4.49Å; F370-L374 HydrophobicContact CE2-CD1 4.22Å; F370-L374 HydrophobicContact CE2-CG 4.36Å; F370-L374 HydrophobicContact CZ-CD1 3.63Å; F370-L374 HydrophobicContact CZ-CG 4.25Å; F370-L374 WeakPolarHBondContact O-CG 3.4Å; F370-L374 PolarHBondContact O-N 3.21Å; E371-L374 PolarHBondContact O-N 3.01Å; N372-L374 VanDerWaalsContact C-N 3.33Å; N372-L374 PolarHBondContact O-N 3.36Å; L374-M377 HydrophobicContact CD2-CE 4.15Å; L374-M377 CarbonylContact O-C 3.57Å; L374-M377 PolarHBondContact O-N 3.1Å; L374-R378 PolarHBondContact O-N 2.74Å; L374-F379 HydrophobicContact CB-CB 4.49Å; L374-F379 HydrophobicContact CD2-CD2 4.28Å; L374-F379 PolarHBondContact O-N 3.35Å; L374-L380 HydrophobicContact CB-CD1 3.57Å; L374-L380 HydrophobicContact CB-CG 3.96Å; L374-L380 HydrophobicContact CD1-CD1 4.12Å
375	K	83.8	Confident	79.1	Confident	53 Å²	53	56.2 Å²	56.2	23%	0.23	28%	0.281	C	S	.	.	H	α-helix	trans	-67.8	-44.8	172.2	-71.2	173.1	-171.3	-177.6	0	111.6	E371 N372 A373 M377 R378 L380 G382 D383	E371-K375 WeakPolarHBondContact O-CG 3.33Å; E371-K375 PolarHBondContact O-N 3.5Å; N372-K375 WeakPolarHBondContact O-CB 3.47Å; N372-K375 PolarHBondContact O-N 3.44Å; A373-K375 VanDerWaalsContact C-N 3.32Å; A373-K375 PolarHBondContact O-N 3.25Å; K375-M377 PolarHBondContact O-N 3.07Å; K375-R378 WeakPolarHBondContact O-CA 3.41Å; K375-R378 PolarHBondContact O-N 3.39Å; K375-L380 HydrophobicContact CG-CB 3.91Å; K375-L380 HydrophobicContact CG-CD1 4.3Å; K375-G382 WeakPolarHBondContact CE-O 3.31Å; K375-G382 PolarHBondContact NZ-O 3.47Å; K375-D383 PolarHBondContact NZ-O 3.49Å
376	E	82.7	Confident	78.9	Confident	159 Å²	159	55.1 Å²	55.1	74%	0.743	28%	0.279	S	S	*	.	H	α-helix	trans	-57.6	-37.7	173.3	-72.6	-179.3	171.4	0	0	111.1	N372 A373 R378	N372-E376 WeakPolarHBondContact O-CG 3.27Å; N372-E376 PolarHBondContact O-N 2.91Å; A373-E376 PolarHBondContact O-N 3.27Å; E376-R378 PolarHBondContact O-N 2.9Å
377	M	77.8	Confident	78.8	Confident	9 Å²	9	53.9 Å²	53.9	4%	0.044	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	0	175.4	-62.1	-170.9	-117.1	0	0	114.7	R296 L299 E300 Q303 A373 L374 K375 F379	R296-M377 HydrophobicContact CG-CE 3.91Å; L299-M377 HydrophobicContact CB-SD 4.48Å; E300-M377 HydrophobicContact CB-SD 4.29Å; E300-M377 HydrophobicContact CG-CE 3.58Å; E300-M377 HydrophobicContact CG-SD 3.54Å; E300-M377 VanDerWaalsContact CG-SD 3.54Å; Q303-M377 VanDerWaalsContact NE2-CA 3.33Å; Q303-M377 PolarHBondContact NE2-O 2.93Å; A373-M377 HydrophobicContact CB-CE 3.96Å; A373-M377 WeakPolarHBondContact O-CE 3.2Å; A373-M377 WeakPolarHBondContact O-CG 3.45Å; A373-M377 PolarHBondContact O-N 3.23Å; L374-M377 HydrophobicContact CD2-CE 4.15Å; L374-M377 CarbonylContact O-C 3.57Å; L374-M377 PolarHBondContact O-N 3.1Å; K375-M377 PolarHBondContact O-N 3.07Å; M377-F379 VanDerWaalsContact C-N 3.27Å; M377-F379 HydrophobicContact CB-CD2 3.56Å; M377-F379 HydrophobicContact CB-CE2 3.87Å; M377-F379 PolarHBondContact O-N 3.33Å; M377-F379 HydrophobicContact SD-CD2 4.41Å; M377-F379 HydrophobicContact SD-CE2 4.21Å
378	R	79.3	Confident	78.6	Confident	146 Å²	146	54.1 Å²	54.1	55%	0.551	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	25.6	-176.2	-55.4	-171.7	-178.3	163	1.5	115.6	A326 E327 L374 K375 E376 L380	A326-R378 CarbonylContact C-O 3.58Å; A326-R378 HydrophobicContact CB-CB 4.47Å; E327-R378 VanDerWaalsContact CA-O 3.25Å; E327-R378 WeakPolarHBondContact CA-O 3.29Å; E327-R378 HydrophobicContact CG-CB 4.06Å; E327-R378 WeakPolarHBondContact CG-O 3.31Å; E327-R378 PolarHBondContact N-O 2.89Å; L374-R378 PolarHBondContact O-N 2.74Å; K375-R378 WeakPolarHBondContact O-CA 3.41Å; K375-R378 PolarHBondContact O-N 3.39Å; E376-R378 PolarHBondContact O-N 2.9Å; R378-L380 VanDerWaalsContact C-N 3.32Å
379	F	80.4	Confident	78.4	Confident	8 Å²	8	55.2 Å²	55.2	4%	0.035	28%	0.275	C	S	.	.			trans	-80.3	-14.5	171.1	-73.4	-75.3	0	0	0	112.9	L299 Q303 L307 A326 L329 G330 L374 M377	L299-F379 HydrophobicContact CB-CE2 4.13Å; L299-F379 HydrophobicContact CB-CZ 4.49Å; L299-F379 HydrophobicContact CD2-CE1 4.45Å; L299-F379 HydrophobicContact CD2-CZ 4.22Å; Q303-F379 HydrophobicContact CB-CE2 4.18Å; Q303-F379 HydrophobicContact CB-CZ 4.43Å; L307-F379 HydrophobicContact CD1-CE1 3.72Å; L307-F379 HydrophobicContact CD1-CZ 3.52Å; A326-F379 HydrophobicContact CB-CD1 4.46Å; A326-F379 HydrophobicContact CB-CE1 4.28Å; A326-F379 HydrophobicContact CB-CZ 4.42Å; A326-F379 VanDerWaalsContact O-CD1 3.27Å; A326-F379 WeakPolarHBondContact O-CD1 3.35Å; L329-F379 HydrophobicContact CB-CE1 4.41Å; L329-F379 HydrophobicContact CD2-CE1 4.19Å; G330-F379 WeakPolarHBondContact CA-O 3.37Å; L374-F379 HydrophobicContact CB-CB 4.49Å; L374-F379 HydrophobicContact CD2-CD2 4.28Å; L374-F379 PolarHBondContact O-N 3.35Å; M377-F379 VanDerWaalsContact C-N 3.27Å; M377-F379 HydrophobicContact CB-CD2 3.56Å; M377-F379 HydrophobicContact CB-CE2 3.87Å; M377-F379 PolarHBondContact O-N 3.33Å; M377-F379 HydrophobicContact SD-CD2 4.41Å; M377-F379 HydrophobicContact SD-CE2 4.21Å
380	L	80.8	Confident	78.2	Confident	20 Å²	20	52 Å²	52	11%	0.105	26%	0.259	C	S	.	.			trans	-128.9	138.4	-175.6	-61.2	175.4	0	0	0	111.8	W334 E371 L374 K375 R378 T385	W334-L380 HydrophobicContact CB-CD2 4.27Å; W334-L380 HydrophobicContact CD2-CD2 3.34Å; W334-L380 VanDerWaalsContact CE2-CD2 3.45Å; W334-L380 HydrophobicContact CE3-CD2 3.82Å; W334-L380 HydrophobicContact CG-CD2 3.52Å; W334-L380 HydrophobicContact CH2-CD1 4.2Å; W334-L380 HydrophobicContact CH2-CD2 4.41Å; W334-L380 HydrophobicContact CZ2-CD1 4.15Å; W334-L380 HydrophobicContact CZ2-CD2 4.01Å; W334-L380 HydrophobicContact CZ3-CD2 4.34Å; E371-L380 HydrophobicContact CB-CD1 4.47Å; E371-L380 HydrophobicContact CG-CD1 4.49Å; L374-L380 HydrophobicContact CB-CD1 3.57Å; L374-L380 HydrophobicContact CB-CG 3.96Å; L374-L380 HydrophobicContact CD1-CD1 4.12Å; K375-L380 HydrophobicContact CG-CB 3.91Å; K375-L380 HydrophobicContact CG-CD1 4.3Å; R378-L380 VanDerWaalsContact C-N 3.32Å; L380-T385 HydrophobicContact CD1-CG2 4.06Å; L380-T385 HydrophobicContact CD2-CG2 4.41Å
381	K	69.3	Low	77.8	Confident	121 Å²	121	51.8 Å²	51.8	53%	0.526	26%	0.257	S	S	.	.			trans	-108.7	9.1	-176.1	-74.7	176.9	176.4	157.6	0	115.7	E327 D331	E327-K381 WeakPolarHBondContact OE2-CE 3.26Å; E327-K381 IonicContact OE2-NZ 3.99Å; E327-K381 PolarHBondContact OE2-NZ 2.85Å; D331-K381 IonicContact OD2-NZ 3.62Å; D331-K381 PolarHBondContact OD2-NZ 3.46Å
382	G	64.2	Low	77.4	Confident	36 Å²	36	57.6 Å²	57.6	37%	0.371	28%	0.28	S	S	.	.			trans	-144	155.7	-172.7	0	0	0	0	0	114.8	K375	K375-G382 WeakPolarHBondContact CE-O 3.31Å; K375-G382 PolarHBondContact NZ-O 3.47Å
383	D	59	Low	77.1	Confident	138 Å²	138	58.3 Å²	58.3	74%	0.738	28%	0.283	S	S	*	.	S	Bend	trans	-75.1	-30.3	-176.7	-69.6	-34.5	0	0	0	113.5	K375	K375-D383 PolarHBondContact NZ-O 3.49Å
384	T	56.8	Low	76.6	Confident	84 Å²	84	58.3 Å²	58.3	52%	0.515	28%	0.283	S	S	.	.			trans	-123.4	106.6	-179.8	60.4	0	0	0	0	111.4
385	T	75.1	Confident	76	Confident	12 Å²	12	61 Å²	61	7%	0.074	30%	0.297	C	S	.	.			trans	-90.8	167.8	172.9	79.5	0	0	0	0	111.6	W334 E371 L380 L387 K389	W334-T385 HydrophobicContact CZ2-CG2 3.89Å; E371-T385 PolarHBondContact OE1-OG1 2.92Å; E371-T385 WeakPolarHBondContact OE2-CB 3.43Å; E371-T385 VanDerWaalsContact OE2-CG2 3.31Å; E371-T385 WeakPolarHBondContact OE2-CG2 3.5Å; E371-T385 PolarHBondContact OE2-OG1 3.22Å; L380-T385 HydrophobicContact CD1-CG2 4.06Å; L380-T385 HydrophobicContact CD2-CG2 4.41Å; T385-L387 PolarHBondContact O-N 3.39Å; T385-L387 PolarHBondContact OG1-N 2.86Å; T385-K389 VanDerWaalsContact O-CG 3.29Å; T385-K389 WeakPolarHBondContact O-CG 3.33Å; T385-K389 PolarHBondContact O-N 2.96Å; T385-K389 VanDerWaalsContact O-N 3.12Å
386	D	78.4	Confident	75.6	Confident	86 Å²	86	59.1 Å²	59.1	46%	0.46	29%	0.291	S	S	.	.	H	α-helix	trans	-69.5	-23.7	-180	-61	-34.9	0	0	0	113	K389 Y390	D386-K389 IonicContact OD1-NZ 2.68Å; D386-K389 PolarHBondContact OD1-NZ 2.83Å; D386-Y390 WeakPolarHBondContact O-CB 3.44Å; D386-Y390 PolarHBondContact O-N 2.98Å
387	L	82.7	Confident	75.4	Confident	0 Å²	0	53.9 Å²	53.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-69.9	-51.2	176.5	-172.3	74.2	0	0	0	111.1	F292 W334 L341 I342 L346 T367 F370 E371 T385 K389 Y390 A391	F292-L387 HydrophobicContact CE1-CD2 4.26Å; F292-L387 HydrophobicContact CZ-CD2 4.45Å; W334-L387 HydrophobicContact CH2-CD2 4.04Å; W334-L387 HydrophobicContact CZ2-CB 4.23Å; L341-L387 HydrophobicContact CB-CD1 3.9Å; L341-L387 HydrophobicContact CD1-CD2 4.17Å; I342-L387 HydrophobicContact CD1-CD1 4.49Å; I342-L387 HydrophobicContact CG1-CD1 3.81Å; L346-L387 HydrophobicContact CD1-CD1 3.4Å; L346-L387 HydrophobicContact CD1-CG 4.15Å; T367-L387 HydrophobicContact CG2-CD2 3.88Å; T367-L387 HydrophobicContact CG2-CG 3.83Å; F370-L387 HydrophobicContact CD1-CD2 4.25Å; F370-L387 HydrophobicContact CE1-CD2 4.38Å; E371-L387 WeakPolarHBondContact OE1-CB 3.23Å; T385-L387 PolarHBondContact O-N 3.39Å; T385-L387 PolarHBondContact OG1-N 2.86Å; L387-K389 PolarHBondContact O-N 3.17Å; L387-Y390 WeakPolarHBondContact O-CB 3.37Å; L387-Y390 PolarHBondContact O-N 2.99Å; L387-A391 PolarHBondContact O-N 3.35Å
388	L	82.1	Confident	75.4	Confident	5 Å²	5	53.5 Å²	53.5	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-64.5	-37.5	175	-166	63.5	0	0	0	112.8	T367 E368 E371 Y390 A391 R392	T367-L388 HydrophobicContact CG2-CD1 4.43Å; E368-L388 HydrophobicContact CB-CD1 4.09Å; E371-L388 VanDerWaalsContact OE1-CB 3.27Å; E371-L388 WeakPolarHBondContact OE1-CB 3.36Å; E371-L388 PolarHBondContact OE1-N 3.01Å; L388-Y390 VanDerWaalsContact C-N 3.3Å; L388-Y390 PolarHBondContact O-N 3Å; L388-A391 PolarHBondContact O-N 3.34Å; L388-R392 HydrophobicContact CD1-CG 4.45Å; L388-R392 HydrophobicContact CG-CG 4.34Å; L388-R392 VanDerWaalsContact O-CB 3.31Å; L388-R392 WeakPolarHBondContact O-CB 3.5Å; L388-R392 VanDerWaalsContact O-CG 3.29Å; L388-R392 WeakPolarHBondContact O-CG 3.12Å; L388-R392 PolarHBondContact O-N 3.12Å
389	K	82.1	Confident	75.3	Confident	96 Å²	96	46.6 Å²	46.6	42%	0.417	24%	0.238	S	C	.	.	H	α-helix	trans	-60.3	-42	173.4	-74.6	173.8	-166.2	162.1	0	111.3	T385 D386 L387 N393	T385-K389 VanDerWaalsContact O-CG 3.29Å; T385-K389 WeakPolarHBondContact O-CG 3.33Å; T385-K389 PolarHBondContact O-N 2.96Å; T385-K389 VanDerWaalsContact O-N 3.12Å; D386-K389 IonicContact OD1-NZ 2.68Å; D386-K389 PolarHBondContact OD1-NZ 2.83Å; L387-K389 PolarHBondContact O-N 3.17Å; K389-N393 WeakPolarHBondContact O-CB 3.35Å; K389-N393 PolarHBondContact O-N 3.41Å; K389-N393 VanDerWaalsContact O-N 3.09Å
390	Y	80.8	Confident	75.4	Confident	35 Å²	35	49.7 Å²	49.7	14%	0.137	26%	0.255	C	S	.	.	H	α-helix	trans	-64.6	-49	176.1	-175.2	-86.7	0	0	0	111.5	I342 L346 V347 D386 L387 L388 R392 N393 H397	I342-Y390 HydrophobicContact CD1-CD2 4.28Å; I342-Y390 HydrophobicContact CD1-CG 4.09Å; I342-Y390 HydrophobicContact CG1-CD1 4.2Å; I342-Y390 HydrophobicContact CG1-CD2 4.44Å; I342-Y390 HydrophobicContact CG1-CG 4.03Å; I342-Y390 HydrophobicContact CG2-CD1 4.08Å; I342-Y390 HydrophobicContact CG2-CD2 3.75Å; I342-Y390 HydrophobicContact CG2-CE1 3.91Å; I342-Y390 HydrophobicContact CG2-CE2 3.54Å; I342-Y390 HydrophobicContact CG2-CG 4.02Å; L346-Y390 HydrophobicContact CB-CD1 4.2Å; L346-Y390 HydrophobicContact CB-CE1 3.94Å; L346-Y390 HydrophobicContact CD1-CD1 4.04Å; V347-Y390 VanDerWaalsContact CG2-OH 3.25Å; V347-Y390 WeakPolarHBondContact CG2-OH 3.45Å; D386-Y390 WeakPolarHBondContact O-CB 3.44Å; D386-Y390 PolarHBondContact O-N 2.98Å; L387-Y390 WeakPolarHBondContact O-CB 3.37Å; L387-Y390 PolarHBondContact O-N 2.99Å; L388-Y390 VanDerWaalsContact C-N 3.3Å; L388-Y390 PolarHBondContact O-N 3Å; Y390-R392 PolarHBondContact O-N 3.05Å; Y390-N393 PolarHBondContact O-N 2.7Å; Y390-H397 AromaticContact CD2-CE1 3.77Å; Y390-H397 AromaticContact CD2-NE2 3.4Å; Y390-H397 WeakPolarHBondContact CD2-NE2 3.37Å; Y390-H397 AromaticContact CE2-CD2 3.9Å; Y390-H397 AromaticContact CE2-CE1 3.26Å; Y390-H397 WeakPolarHBondContact CE2-CE1 3.17Å; Y390-H397 AromaticContact CE2-ND1 3.85Å; Y390-H397 AromaticContact CE2-NE2 3.3Å; Y390-H397 VanDerWaalsContact CE2-NE2 3.3Å; Y390-H397 WeakPolarHBondContact CE2-NE2 3.32Å; Y390-H397 AromaticContact CZ-CD2 3.98Å; Y390-H397 AromaticContact CZ-CE1 3.9Å; Y390-H397 AromaticContact CZ-NE2 3.87Å
391	A	78.9	Confident	75.6	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-60.7	-42.2	178.9	0	0	0	0	0	112.3	I364 T367 L387 L388 N393 I394	I364-A391 HydrophobicContact CG1-CB 4.41Å; T367-A391 HydrophobicContact CG2-CB 4.27Å; L387-A391 PolarHBondContact O-N 3.35Å; L388-A391 PolarHBondContact O-N 3.34Å; A391-N393 VanDerWaalsContact C-N 3.32Å; A391-N393 PolarHBondContact O-N 3.43Å; A391-I394 WeakPolarHBondContact O-CB 3.41Å; A391-I394 PolarHBondContact O-N 3.25Å
392	R	77.9	Confident	76.2	Confident	124 Å²	124	47.4 Å²	47.4	47%	0.468	24%	0.244	S	C	.	.	H	α-helix	trans	-69	-27.7	177	-71.9	178.9	177.1	175.5	0.6	113.1	I364 E368 L388 Y390 I394	I364-R392 HydrophobicContact CG2-CG 4.37Å; E368-R392 IonicContact OE1-NH2 3.29Å; E368-R392 PolarHBondContact OE1-NH2 3.41Å; L388-R392 HydrophobicContact CD1-CG 4.45Å; L388-R392 HydrophobicContact CG-CG 4.34Å; L388-R392 VanDerWaalsContact O-CB 3.31Å; L388-R392 WeakPolarHBondContact O-CB 3.5Å; L388-R392 VanDerWaalsContact O-CG 3.29Å; L388-R392 WeakPolarHBondContact O-CG 3.12Å; L388-R392 PolarHBondContact O-N 3.12Å; Y390-R392 PolarHBondContact O-N 3.05Å; R392-I394 PolarHBondContact O-N 3.38Å
393	N	77.6	Confident	77.3	Confident	86 Å²	86	46.4 Å²	46.4	46%	0.46	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	17.1	174.1	-83.8	-22.7	0	0	0	113.8	K389 Y390 A391 N395 S396 H397	K389-N393 WeakPolarHBondContact O-CB 3.35Å; K389-N393 PolarHBondContact O-N 3.41Å; K389-N393 VanDerWaalsContact O-N 3.09Å; Y390-N393 PolarHBondContact O-N 2.7Å; A391-N393 VanDerWaalsContact C-N 3.32Å; A391-N393 PolarHBondContact O-N 3.43Å; N393-N395 PolarHBondContact O-N 3.06Å; N393-N395 VanDerWaalsContact O-N 3.12Å; N393-S396 PolarHBondContact O-N 3.26Å; N393-S396 PolarHBondContact O-OG 3.32Å; N393-H397 PolarHBondContact O-CD2 3.13Å; N393-H397 VanDerWaalsContact O-CD2 3.25Å; N393-H397 PolarHBondContact O-N 2.88Å
394	I	75.1	Confident	78.6	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-50.7	-39.3	179.8	-175.6	60.3	0	0	0	113.2	I350 L357 Y360 I364 A391 R392 S396 H397 F398	I350-I394 HydrophobicContact CB-CD1 4.22Å; I350-I394 HydrophobicContact CG1-CD1 3.81Å; I350-I394 HydrophobicContact CG2-CD1 3.96Å; L357-I394 HydrophobicContact CD2-CG1 4.38Å; L357-I394 HydrophobicContact CD2-CG2 4.21Å; Y360-I394 HydrophobicContact CD1-CB 3.75Å; Y360-I394 HydrophobicContact CD1-CD1 3.91Å; Y360-I394 HydrophobicContact CD1-CG1 3.44Å; Y360-I394 VanDerWaalsContact CD1-CG1 3.44Å; Y360-I394 HydrophobicContact CD1-CG2 3.97Å; Y360-I394 HydrophobicContact CD2-CD1 4.06Å; Y360-I394 HydrophobicContact CD2-CG1 4.27Å; Y360-I394 HydrophobicContact CE1-CB 3.62Å; Y360-I394 HydrophobicContact CE1-CD1 3.58Å; Y360-I394 HydrophobicContact CE1-CG1 3.53Å; Y360-I394 HydrophobicContact CE1-CG2 4.26Å; Y360-I394 HydrophobicContact CE2-CD1 3.74Å; Y360-I394 HydrophobicContact CE2-CG1 4.34Å; Y360-I394 HydrophobicContact CG-CD1 4.13Å; Y360-I394 HydrophobicContact CG-CG1 3.83Å; Y360-I394 VanDerWaalsContact CZ-CD1 3.5Å; I364-I394 HydrophobicContact CD1-CG2 4.11Å; A391-I394 WeakPolarHBondContact O-CB 3.41Å; A391-I394 PolarHBondContact O-N 3.25Å; R392-I394 PolarHBondContact O-N 3.38Å; I394-S396 PolarHBondContact O-N 3Å; I394-H397 PolarHBondContact O-N 3.18Å; I394-H397 VanDerWaalsContact O-N 3.12Å; I394-F398 WeakPolarHBondContact O-CB 3.3Å; I394-F398 PolarHBondContact O-N 2.83Å
395	N	71.3	Confident	80.1	Confident	57 Å²	57	45.9 Å²	45.9	31%	0.305	22%	0.221	S	C	.	.	H	α-helix	trans	-58.1	-38.8	179.5	-76.9	-53.7	0	0	0	112	N393 A399 S500	N393-N395 PolarHBondContact O-N 3.06Å; N393-N395 VanDerWaalsContact O-N 3.12Å; N395-A399 WeakPolarHBondContact O-CB 3.42Å; N395-A399 PolarHBondContact O-N 3.05Å; N395-S500 PolarHBondContact OD1-OG 3Å
396	S	75.9	Confident	80.9	Confident	15 Å²	15	45.5 Å²	45.5	11%	0.105	22%	0.219	C	C	.	.	H	α-helix	trans	-73.2	-38.8	176.8	75.4	0	0	0	0	112.4	N393 I394 N400	N393-S396 PolarHBondContact O-N 3.26Å; N393-S396 PolarHBondContact O-OG 3.32Å; I394-S396 PolarHBondContact O-N 3Å; S396-N400 WeakPolarHBondContact O-CB 3.38Å; S396-N400 PolarHBondContact O-N 2.96Å; S396-N400 PolarHBondContact O-ND2 2.86Å; S396-N400 VanDerWaalsContact O-ND2 3.14Å
397	H	77.7	Confident	81.5	Confident	48 Å²	48	42.7 Å²	42.7	22%	0.222	20%	0.203	C	C	.	.	H	α-helix	trans	-70.9	-43	179.2	-68.7	-65.1	0	0	0	112	I350 Y390 N393 I394 N400 K401	I350-H397 HydrophobicContact CD1-CB 3.85Å; Y390-H397 AromaticContact CD2-CE1 3.77Å; Y390-H397 AromaticContact CD2-NE2 3.4Å; Y390-H397 WeakPolarHBondContact CD2-NE2 3.37Å; Y390-H397 AromaticContact CE2-CD2 3.9Å; Y390-H397 AromaticContact CE2-CE1 3.26Å; Y390-H397 WeakPolarHBondContact CE2-CE1 3.17Å; Y390-H397 AromaticContact CE2-ND1 3.85Å; Y390-H397 AromaticContact CE2-NE2 3.3Å; Y390-H397 VanDerWaalsContact CE2-NE2 3.3Å; Y390-H397 WeakPolarHBondContact CE2-NE2 3.32Å; Y390-H397 AromaticContact CZ-CD2 3.98Å; Y390-H397 AromaticContact CZ-CE1 3.9Å; Y390-H397 AromaticContact CZ-NE2 3.87Å; N393-H397 PolarHBondContact O-CD2 3.13Å; N393-H397 VanDerWaalsContact O-CD2 3.25Å; N393-H397 PolarHBondContact O-N 2.88Å; I394-H397 PolarHBondContact O-N 3.18Å; I394-H397 VanDerWaalsContact O-N 3.12Å; H397-N400 PolarHBondContact O-N 3.12Å; H397-K401 WeakPolarHBondContact O-CB 3.48Å; H397-K401 PolarHBondContact O-N 3.3Å
398	F	78.6	Confident	82	Confident	2 Å²	2	46.2 Å²	46.2	1%	0.009	23%	0.225	C	C	.	.	H	α-helix	trans	-56.8	-52.4	171.4	173.9	-97	0	0	0	110.6	I350 P351 L357 I394 N400 K401 K402	I350-F398 HydrophobicContact CG2-CB 4.26Å; P351-F398 HydrophobicContact CB-CD2 4.46Å; P351-F398 HydrophobicContact CB-CE2 4.49Å; P351-F398 WeakPolarHBondContact O-CD2 3.42Å; P351-F398 VanDerWaalsContact O-CE2 3.3Å; P351-F398 WeakPolarHBondContact O-CE2 3.31Å; L357-F398 HydrophobicContact CD1-CB 4.32Å; L357-F398 HydrophobicContact CD1-CD1 3.6Å; L357-F398 HydrophobicContact CD1-CD2 4.09Å; L357-F398 HydrophobicContact CD1-CE1 3.9Å; L357-F398 HydrophobicContact CD1-CE2 4.37Å; L357-F398 HydrophobicContact CD1-CG 3.71Å; L357-F398 HydrophobicContact CD1-CZ 4.29Å; I394-F398 WeakPolarHBondContact O-CB 3.3Å; I394-F398 PolarHBondContact O-N 2.83Å; F398-N400 PolarHBondContact O-N 3.19Å; F398-K401 PolarHBondContact O-N 3.48Å; F398-K402 VanDerWaalsContact O-CB 3.3Å; F398-K402 WeakPolarHBondContact O-CB 3.2Å; F398-K402 PolarHBondContact O-N 3.22Å
399	A	76.9	Confident	82.5	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-45.1	-179.6	0	0	0	0	0	111.3	N395 K401 K402 C403 C503 Q506	N395-A399 WeakPolarHBondContact O-CB 3.42Å; N395-A399 PolarHBondContact O-N 3.05Å; A399-K401 PolarHBondContact O-N 3.34Å; A399-K402 PolarHBondContact O-N 2.83Å; A399-C403 VanDerWaalsContact O-CB 3.32Å; A399-C403 WeakPolarHBondContact O-CB 3.44Å; A399-C403 PolarHBondContact O-N 3.45Å; A399-C403 PolarHBondContact O-SG 3.35Å; A399-C503 HydrophobicContact CB-CB 3.82Å; A399-C503 VanDerWaalsContact CB-SG 3.55Å; A399-Q506 HydrophobicContact CB-CB 4.34Å
400	N	83.1	Confident	83.1	Confident	73 Å²	73	43.2 Å²	43.2	39%	0.39	22%	0.219	S	C	.	.	H	α-helix	trans	-59.1	-47.9	175.2	-74.9	-28.9	0	0	0	113	S396 H397 F398 C403 Q404 Q506	S396-N400 WeakPolarHBondContact O-CB 3.38Å; S396-N400 PolarHBondContact O-N 2.96Å; S396-N400 PolarHBondContact O-ND2 2.86Å; S396-N400 VanDerWaalsContact O-ND2 3.14Å; H397-N400 PolarHBondContact O-N 3.12Å; F398-N400 PolarHBondContact O-N 3.19Å; N400-C403 PolarHBondContact O-N 3.44Å; N400-Q404 WeakPolarHBondContact O-CG 3.17Å; N400-Q404 PolarHBondContact O-N 3.48Å; N400-Q506 PolarHBondContact OD1-NE2 3.49Å; N400-Q506 PolarHBondContact OD1-OE1 3.22Å
401	K	83.1	Confident	83.8	Confident	63 Å²	63	47.7 Å²	47.7	27%	0.274	24%	0.235	S	C	.	.	H	α-helix	trans	-61.7	-45.4	178.2	-176	176.1	-179.7	178.5	0	110.9	I350 H397 F398 A399 C403 Q404 D405	I350-K401 HydrophobicContact CB-CD 4.41Å; I350-K401 HydrophobicContact CG2-CD 4.08Å; I350-K401 PolarHBondContact O-NZ 2.96Å; H397-K401 WeakPolarHBondContact O-CB 3.48Å; H397-K401 PolarHBondContact O-N 3.3Å; F398-K401 PolarHBondContact O-N 3.48Å; A399-K401 PolarHBondContact O-N 3.34Å; K401-C403 PolarHBondContact O-N 3.44Å; K401-Q404 WeakPolarHBondContact O-CB 3.33Å; K401-Q404 PolarHBondContact O-N 2.86Å; K401-Q404 VanDerWaalsContact O-N 3.14Å; K401-D405 PolarHBondContact O-N 2.93Å
402	K	82.8	Confident	84.5	Confident	31 Å²	31	52.2 Å²	52.2	14%	0.135	26%	0.26	C	S	.	.	H	α-helix	trans	-62.3	-43.6	177.6	-174.8	62.7	177	-127.7	0	112.1	F398 A399 Q404 D405 V406 E495 L507	F398-K402 VanDerWaalsContact O-CB 3.3Å; F398-K402 WeakPolarHBondContact O-CB 3.2Å; F398-K402 PolarHBondContact O-N 3.22Å; A399-K402 PolarHBondContact O-N 2.83Å; K402-Q404 VanDerWaalsContact C-N 3.28Å; K402-Q404 PolarHBondContact O-N 3.29Å; K402-D405 PolarHBondContact O-N 2.76Å; K402-V406 HydrophobicContact CD-CG2 4.42Å; K402-V406 HydrophobicContact CG-CG2 4.46Å; K402-V406 WeakPolarHBondContact O-CB 3.46Å; K402-V406 VanDerWaalsContact O-CG2 3.26Å; K402-V406 WeakPolarHBondContact O-CG2 3.4Å; K402-V406 PolarHBondContact O-N 2.95Å; K402-E495 WeakPolarHBondContact CE-OE2 3.29Å; K402-E495 IonicContact NZ-OE1 2.93Å; K402-E495 PolarHBondContact NZ-OE1 2.98Å; K402-E495 IonicContact NZ-OE2 2.7Å; K402-E495 PolarHBondContact NZ-OE2 2.64Å; K402-L507 HydrophobicContact CB-CD2 4.27Å; K402-L507 HydrophobicContact CG-CD2 3.72Å
403	C	86.7	Confident	85.3	Confident	14 Å²	14	48 Å²	48	10%	0.095	25%	0.246	C	C	.	.	H	α-helix	trans	-58.5	-42.5	174.7	-67.9	0	0	0	0	111	A399 N400 K401 I407 S510	A399-C403 VanDerWaalsContact O-CB 3.32Å; A399-C403 WeakPolarHBondContact O-CB 3.44Å; A399-C403 PolarHBondContact O-N 3.45Å; A399-C403 PolarHBondContact O-SG 3.35Å; N400-C403 PolarHBondContact O-N 3.44Å; K401-C403 PolarHBondContact O-N 3.44Å; C403-I407 WeakPolarHBondContact O-CB 3.41Å; C403-I407 WeakPolarHBondContact O-CG1 3.47Å; C403-I407 PolarHBondContact O-N 2.84Å; C403-S510 WeakPolarHBondContact CB-OG 3.3Å; C403-S510 PolarHBondContact SG-OG 3.22Å
404	Q	87.8	Confident	86.1	Confident	133 Å²	133	44.1 Å²	44.1	62%	0.621	23%	0.225	S	C	*	.	H	α-helix	trans	-62.3	-48.4	175	-72.4	179.8	-4.6	0	0	112.2	N400 K401 K402 V406 I407 V408	N400-Q404 WeakPolarHBondContact O-CG 3.17Å; N400-Q404 PolarHBondContact O-N 3.48Å; K401-Q404 WeakPolarHBondContact O-CB 3.33Å; K401-Q404 PolarHBondContact O-N 2.86Å; K401-Q404 VanDerWaalsContact O-N 3.14Å; K402-Q404 VanDerWaalsContact C-N 3.28Å; K402-Q404 PolarHBondContact O-N 3.29Å; Q404-V406 VanDerWaalsContact C-N 3.33Å; Q404-V406 PolarHBondContact O-N 2.92Å; Q404-I407 PolarHBondContact O-N 3.37Å; Q404-V408 WeakPolarHBondContact O-CG2 3.13Å; Q404-V408 PolarHBondContact O-N 3.41Å
405	D	88	Confident	86.9	Confident	78 Å²	78	46.2 Å²	46.2	42%	0.417	24%	0.239	S	C	.	.	H	α-helix	trans	-59.6	-43.9	179.6	-68.4	-20.9	0	0	0	111.6	K401 K402 I407 V408 A409	K401-D405 PolarHBondContact O-N 2.93Å; K402-D405 PolarHBondContact O-N 2.76Å; D405-I407 PolarHBondContact O-N 2.85Å; D405-V408 PolarHBondContact O-N 3.01Å; D405-A409 WeakPolarHBondContact O-CB 3.18Å; D405-A409 PolarHBondContact O-N 3.45Å
406	V	90.6	Very high	87.9	Confident	5 Å²	5	45.9 Å²	45.9	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-61.5	-44.2	176.1	168.9	0	0	0	0	111.1	K402 Q404 A409 A410 L488 T492 I514	K402-V406 HydrophobicContact CD-CG2 4.42Å; K402-V406 HydrophobicContact CG-CG2 4.46Å; K402-V406 WeakPolarHBondContact O-CB 3.46Å; K402-V406 VanDerWaalsContact O-CG2 3.26Å; K402-V406 WeakPolarHBondContact O-CG2 3.4Å; K402-V406 PolarHBondContact O-N 2.95Å; Q404-V406 VanDerWaalsContact C-N 3.33Å; Q404-V406 PolarHBondContact O-N 2.92Å; V406-A409 PolarHBondContact O-N 3.41Å; V406-A410 VanDerWaalsContact O-CB 3.28Å; V406-A410 WeakPolarHBondContact O-CB 3.42Å; V406-A410 PolarHBondContact O-N 3.16Å; V406-L488 HydrophobicContact CG1-CD1 4.5Å; V406-L488 HydrophobicContact CG1-CD2 4.38Å; V406-L488 HydrophobicContact CG1-CG 4.36Å; V406-T492 HydrophobicContact CG1-CG2 4.34Å; V406-T492 HydrophobicContact CG2-CG2 4.24Å; V406-I514 HydrophobicContact CG1-CD1 3.52Å; V406-I514 HydrophobicContact CG1-CG1 4.14Å
407	I	92.5	Very high	88.4	Confident	26 Å²	26	51.9 Å²	51.9	13%	0.133	27%	0.267	C	S	.	.	H	α-helix	trans	-67.5	-38.7	178.7	-68	-67.6	0	0	0	111.6	C403 Q404 D405 A410 R411 N513 I514 L517	C403-I407 WeakPolarHBondContact O-CB 3.41Å; C403-I407 WeakPolarHBondContact O-CG1 3.47Å; C403-I407 PolarHBondContact O-N 2.84Å; Q404-I407 PolarHBondContact O-N 3.37Å; D405-I407 PolarHBondContact O-N 2.85Å; I407-A410 PolarHBondContact O-N 3.43Å; I407-R411 WeakPolarHBondContact O-CG 3.3Å; I407-R411 PolarHBondContact O-N 3.44Å; I407-N513 HydrophobicContact CD1-CB 3.81Å; I407-I514 HydrophobicContact CD1-CG1 4.14Å; I407-L517 HydrophobicContact CG2-CD2 4.17Å
408	V	92.5	Very high	88.9	Confident	75 Å²	75	50 Å²	50	46%	0.455	26%	0.258	S	S	.	.	H	α-helix	trans	-64.3	-46.5	175.3	171.1	0	0	0	0	110.6	Q404 D405 A410 R411 N412	Q404-V408 WeakPolarHBondContact O-CG2 3.13Å; Q404-V408 PolarHBondContact O-N 3.41Å; D405-V408 PolarHBondContact O-N 3.01Å; V408-A410 VanDerWaalsContact C-N 3.32Å; V408-A410 PolarHBondContact O-N 3.14Å; V408-R411 PolarHBondContact O-N 3.43Å; V408-N412 PolarHBondContact O-N 3Å; V408-N412 VanDerWaalsContact O-N 3.07Å; V408-N412 PolarHBondContact O-ND2 3.41Å
409	A	92.9	Very high	89.2	Confident	38 Å²	38	55.3 Å²	55.3	31%	0.314	28%	0.283	S	S	.	.	H	α-helix	trans	-59	-43.9	175.3	0	0	0	0	0	111.6	D405 V406 R411 N412 L413 L488	D405-A409 WeakPolarHBondContact O-CB 3.18Å; D405-A409 PolarHBondContact O-N 3.45Å; V406-A409 PolarHBondContact O-N 3.41Å; A409-R411 PolarHBondContact O-N 3.2Å; A409-N412 PolarHBondContact O-N 3.37Å; A409-L413 WeakPolarHBondContact O-CG 3.26Å; A409-L413 PolarHBondContact O-N 2.93Å; A409-L413 VanDerWaalsContact O-N 3.1Å; A409-L488 HydrophobicContact CB-CD2 3.97Å
410	A	95	Very high	89.8	Confident	0 Å²	0	59 Å²	59	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-61	-43.1	176.7	0	0	0	0	0	112.5	V406 I407 V408 L413 M414 L485 L488 I514	V406-A410 VanDerWaalsContact O-CB 3.28Å; V406-A410 WeakPolarHBondContact O-CB 3.42Å; V406-A410 PolarHBondContact O-N 3.16Å; I407-A410 PolarHBondContact O-N 3.43Å; V408-A410 VanDerWaalsContact C-N 3.32Å; V408-A410 PolarHBondContact O-N 3.14Å; A410-L413 PolarHBondContact O-N 3.31Å; A410-M414 HydrophobicContact CB-CE 3.92Å; A410-M414 VanDerWaalsContact O-CG 3.25Å; A410-M414 WeakPolarHBondContact O-CG 3.45Å; A410-M414 PolarHBondContact O-N 2.92Å; A410-L485 HydrophobicContact CB-CD1 3.8Å; A410-L488 HydrophobicContact CB-CD2 4.13Å; A410-I514 HydrophobicContact CB-CB 4.42Å; A410-I514 HydrophobicContact CB-CD1 4.49Å; A410-I514 HydrophobicContact CB-CG1 3.9Å; A410-I514 HydrophobicContact CB-CG2 3.98Å
411	R	93.9	Very high	90.2	Very high	128 Å²	128	56.7 Å²	56.7	48%	0.483	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-47.4	175.3	-75.7	179.8	-166.5	169.1	4.6	112.1	I407 V408 A409 L413 M414 T415 L517	I407-R411 WeakPolarHBondContact O-CG 3.3Å; I407-R411 PolarHBondContact O-N 3.44Å; V408-R411 PolarHBondContact O-N 3.43Å; A409-R411 PolarHBondContact O-N 3.2Å; R411-L413 PolarHBondContact O-N 3.31Å; R411-M414 WeakPolarHBondContact O-CB 3.43Å; R411-M414 PolarHBondContact O-N 2.95Å; R411-T415 PolarHBondContact O-N 2.88Å; R411-T415 PolarHBondContact O-OG1 2.66Å; R411-T415 VanDerWaalsContact O-OG1 3.11Å; R411-L517 HydrophobicContact CG-CD2 3.39Å; R411-L517 HydrophobicContact CG-CG 4.41Å
412	N	94.2	Very high	90.7	Very high	95 Å²	95	55.6 Å²	55.6	51%	0.508	29%	0.29	S	S	.	.	H	α-helix	trans	-59.3	-38.6	179.9	-67.8	-19.1	0	0	0	111.3	V408 A409 T415 S416	V408-N412 PolarHBondContact O-N 3Å; V408-N412 VanDerWaalsContact O-N 3.07Å; V408-N412 PolarHBondContact O-ND2 3.41Å; A409-N412 PolarHBondContact O-N 3.37Å; N412-T415 PolarHBondContact O-OG1 3.43Å; N412-S416 PolarHBondContact O-N 3.41Å; N412-S416 VanDerWaalsContact O-N 3.14Å; N412-S416 PolarHBondContact O-OG 2.99Å
413	L	94.5	Very high	91.1	Very high	35 Å²	35	58.5 Å²	58.5	18%	0.183	30%	0.303	C	S	.	.	H	α-helix	trans	-67	-40.3	173.8	-68.3	172.2	0	0	0	112.4	A409 A410 R411 S416 S481 K484 L485 L488	A409-L413 WeakPolarHBondContact O-CG 3.26Å; A409-L413 PolarHBondContact O-N 2.93Å; A409-L413 VanDerWaalsContact O-N 3.1Å; A410-L413 PolarHBondContact O-N 3.31Å; R411-L413 PolarHBondContact O-N 3.31Å; L413-S416 WeakPolarHBondContact O-CB 3.28Å; L413-S416 PolarHBondContact O-N 3.22Å; L413-S481 WeakPolarHBondContact O-CB 3.34Å; L413-K484 HydrophobicContact CD1-CB 4.1Å; L413-K484 HydrophobicContact CD2-CB 3.87Å; L413-K484 HydrophobicContact CD2-CD 4.17Å; L413-L485 HydrophobicContact CB-CD1 4.31Å; L413-L485 HydrophobicContact CD1-CB 4.28Å; L413-L485 HydrophobicContact CD1-CD1 4.11Å; L413-L488 HydrophobicContact CD1-CD2 4.37Å
414	M	93.9	Very high	91.2	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.025	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-34.4	178.6	-68.9	166.9	-159.4	0	0	113.1	A410 R411 S416 L485 I514 L517 F518 V521 V522 H526	A410-M414 HydrophobicContact CB-CE 3.92Å; A410-M414 VanDerWaalsContact O-CG 3.25Å; A410-M414 WeakPolarHBondContact O-CG 3.45Å; A410-M414 PolarHBondContact O-N 2.92Å; R411-M414 WeakPolarHBondContact O-CB 3.43Å; R411-M414 PolarHBondContact O-N 2.95Å; M414-S416 VanDerWaalsContact C-N 3.35Å; M414-L485 HydrophobicContact CE-CD1 3.97Å; M414-L485 HydrophobicContact CE-CD2 4.15Å; M414-I514 HydrophobicContact CE-CG2 3.96Å; M414-I514 WeakPolarHBondContact CE-O 3.29Å; M414-L517 HydrophobicContact CE-CB 4.09Å; M414-L517 HydrophobicContact CE-CD2 4.23Å; M414-L517 HydrophobicContact CE-CG 4.26Å; M414-L517 HydrophobicContact SD-CB 4.17Å; M414-L517 HydrophobicContact SD-CD2 4.07Å; M414-L517 HydrophobicContact SD-CG 3.83Å; M414-F518 HydrophobicContact CE-CB 3.94Å; M414-F518 HydrophobicContact CG-CD2 4.1Å; M414-F518 HydrophobicContact SD-CB 4.27Å; M414-V521 HydrophobicContact CB-CG1 4.04Å; M414-V521 HydrophobicContact SD-CB 4.25Å; M414-V522 HydrophobicContact CB-CG2 3.77Å; M414-V522 HydrophobicContact CG-CG2 3.93Å; M414-H526 PolarHBondContact O-NE2 3.13Å
415	T	93.2	Very high	91.1	Very high	50 Å²	50	56 Å²	56	31%	0.307	29%	0.291	S	S	.	.	H	α-helix	trans	-86.3	-6.8	177.5	56.5	0	0	0	0	113.3	R411 N412 V521 Y525	R411-T415 PolarHBondContact O-N 2.88Å; R411-T415 PolarHBondContact O-OG1 2.66Å; R411-T415 VanDerWaalsContact O-OG1 3.11Å; N412-T415 PolarHBondContact O-OG1 3.43Å; T415-V521 HydrophobicContact CG2-CG1 4.25Å; T415-Y525 HydrophobicContact CG2-CD2 4.15Å; T415-Y525 HydrophobicContact CG2-CE2 4.24Å; T415-Y525 HydrophobicContact CG2-CG 4.33Å; T415-Y525 WeakPolarHBondContact O-CE1 3.33Å
416	S	92.2	Very high	90.3	Very high	50 Å²	50	54.4 Å²	54.4	35%	0.35	29%	0.286	S	S	.	.	S	Bend	trans	-67	157.5	174.6	-66.5	0	0	0	0	111.7	N412 L413 M414 H526	N412-S416 PolarHBondContact O-N 3.41Å; N412-S416 VanDerWaalsContact O-N 3.14Å; N412-S416 PolarHBondContact O-OG 2.99Å; L413-S416 WeakPolarHBondContact O-CB 3.28Å; L413-S416 PolarHBondContact O-N 3.22Å; M414-S416 VanDerWaalsContact C-N 3.35Å; S416-H526 PolarHBondContact O-CE1 3.13Å; S416-H526 VanDerWaalsContact O-CE1 3.26Å; S416-H526 PolarHBondContact O-NE2 3.29Å
417	E	86.9	Confident	89	Confident	140 Å²	140	59.7 Å²	59.7	65%	0.654	31%	0.314	S	S	*	.			trans	-68.3	136.9	-178.4	-56.2	-169.2	-155.2	0	0	112.7	H419	E417-H419 VanDerWaalsContact C-N 3.34Å; E417-H419 VanDerWaalsContact CB-CE1 3.47Å; E417-H419 WeakPolarHBondContact CB-CE1 3.17Å; E417-H419 WeakPolarHBondContact CB-ND1 3.16Å; E417-H419 IonicContact OE2-CE1 2.7Å; E417-H419 PolarHBondContact OE2-CE1 3.24Å; E417-H419 IonicContact OE2-ND1 3.17Å; E417-H419 PolarHBondContact OE2-ND1 3.16Å
418	I	88.5	Confident	87.5	Confident	8 Å²	8	60.9 Å²	60.9	4%	0.041	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-13.4	-174.5	-57.9	172.3	0	0	0	112.1	N420 H526 L530 L536 I539	I418-N420 VanDerWaalsContact C-N 3.29Å; I418-N420 PolarHBondContact O-N 3.46Å; I418-H526 HydrophobicContact CD1-CB 3.89Å; I418-H526 VanDerWaalsContact CD1-CG 3.48Å; I418-L530 HydrophobicContact CD1-CD2 4.33Å; I418-L536 HydrophobicContact CB-CD2 4.17Å; I418-L536 HydrophobicContact CG2-CD2 4.14Å; I418-I539 HydrophobicContact CG2-CB 4.27Å; I418-I539 HydrophobicContact CG2-CG2 3.68Å
419	H	83.1	Confident	85.9	Confident	115 Å²	115	66 Å²	66	53%	0.532	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-24.7	-171	70.7	-97.7	0	0	0	113.8	E417 T421	E417-H419 VanDerWaalsContact C-N 3.34Å; E417-H419 VanDerWaalsContact CB-CE1 3.47Å; E417-H419 WeakPolarHBondContact CB-CE1 3.17Å; E417-H419 WeakPolarHBondContact CB-ND1 3.16Å; E417-H419 IonicContact OE2-CE1 2.7Å; E417-H419 PolarHBondContact OE2-CE1 3.24Å; E417-H419 IonicContact OE2-ND1 3.17Å; E417-H419 PolarHBondContact OE2-ND1 3.16Å; H419-T421 PolarHBondContact O-N 3.18Å
420	N	89.8	Confident	84.3	Confident	76 Å²	76	65 Å²	65	41%	0.406	33%	0.329	S	S	.	.			trans	-81.6	114	177.7	-173.3	3.9	0	0	0	109.8	I418 S479 E480	I418-N420 VanDerWaalsContact C-N 3.29Å; I418-N420 PolarHBondContact O-N 3.46Å; N420-S479 CarbonylContact O-C 3.54Å; N420-S479 WeakPolarHBondContact O-CA 3.3Å; N420-E480 PolarHBondContact ND2-OE2 3.2Å; N420-E480 PolarHBondContact O-N 3.27Å
421	T	92.6	Very high	82	Confident	26 Å²	26	71.4 Å²	71.4	16%	0.16	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.8	-169.2	65.4	0	0	0	0	113.5	H419 R477 I478 I539	H419-T421 PolarHBondContact O-N 3.18Å; T421-R477 PolarHBondContact OG1-NH1 2.92Å; T421-R477 VanDerWaalsContact OG1-NH1 3.09Å; T421-I478 CarbonylContact C-O 3.57Å; T421-I478 WeakPolarHBondContact CA-O 3.38Å; T421-I478 WeakPolarHBondContact CB-O 3.44Å; T421-I539 HydrophobicContact CG2-CD1 3.48Å; T421-I539 VanDerWaalsContact CG2-CD1 3.48Å; T421-I539 HydrophobicContact CG2-CG1 4.03Å; T421-I539 HydrophobicContact CG2-CG2 4.38Å
422	V	92.9	Very high	79.8	Confident	39 Å²	39	67.3 Å²	67.3	24%	0.236	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	139.5	171.2	-177.3	0	0	0	0	109.2	R477 I478 E480 K483	V422-R477 WeakPolarHBondContact O-CA 3.39Å; V422-I478 PolarHBondContact N-O 2.85Å; V422-I478 PolarHBondContact O-N 3.27Å; V422-E480 HydrophobicContact CG2-CB 4.09Å; V422-E480 HydrophobicContact CG2-CG 4.13Å; V422-K483 HydrophobicContact CG1-CD 4.26Å; V422-K483 HydrophobicContact CG2-CD 4.42Å
423	K	91.4	Very high	77.4	Confident	93 Å²	93	66.2 Å²	66.2	40%	0.404	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	123.7	175.5	-172.9	168.6	179.7	165.1	0	110.2	I425 T475 R477 D641	K423-I425 HydrophobicContact CG-CG1 4.43Å; K423-T475 HydrophobicContact CG-CG2 4.37Å; K423-R477 HydrophobicContact CB-CG 4.25Å; K423-D641 WeakPolarHBondContact CE-OD1 3.42Å; K423-D641 IonicContact NZ-OD1 2.92Å; K423-D641 PolarHBondContact NZ-OD1 3.28Å
424	I	89	Confident	74.8	Confident	11 Å²	11	73.7 Å²	73.7	6%	0.056	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	131.6	175.1	-56.3	-56.3	0	0	0	107.6	S428 L473 T475 C476 I478 Y546	I424-S428 VanDerWaalsContact CG2-OG 3.27Å; I424-S428 WeakPolarHBondContact CG2-OG 3.21Å; I424-L473 HydrophobicContact CG2-CD2 4.25Å; I424-T475 VanDerWaalsContact O-CA 3.23Å; I424-T475 WeakPolarHBondContact O-CA 3.3Å; I424-T475 WeakPolarHBondContact O-CG2 3.43Å; I424-C476 PolarHBondContact N-O 3.44Å; I424-C476 PolarHBondContact O-N 2.89Å; I424-C476 VanDerWaalsContact O-N 3.09Å; I424-I478 HydrophobicContact CD1-CD1 3.78Å; I424-I478 HydrophobicContact CD1-CG1 4.06Å; I424-I478 HydrophobicContact CG1-CD1 3.73Å; I424-I478 HydrophobicContact CG1-CG1 3.72Å; I424-I478 HydrophobicContact CG1-CG2 4.2Å; I424-Y546 HydrophobicContact CD1-CE2 4.16Å; I424-Y546 HydrophobicContact CG1-CD2 4.27Å; I424-Y546 HydrophobicContact CG1-CE2 4.12Å; I424-Y546 HydrophobicContact CG2-CD2 4.31Å; I424-Y546 HydrophobicContact CG2-CE2 4.11Å
425	I	84.8	Confident	72.3	Confident	83 Å²	83	75.8 Å²	75.8	43%	0.426	40%	0.396	S	S	.	.			trans	-120.7	152.3	178.8	-57.9	173.9	0	0	0	106.6	K423 D427 S428 T475	K423-I425 HydrophobicContact CG-CG1 4.43Å; I425-D427 PolarHBondContact O-N 2.68Å; I425-S428 PolarHBondContact N-OG 3.09Å; I425-S428 WeakPolarHBondContact O-CB 3.47Å; I425-S428 PolarHBondContact O-N 2.83Å; I425-S428 PolarHBondContact O-OG 3.25Å; I425-T475 HydrophobicContact CG1-CG2 4.38Å
426	P	72.9	Confident	69.8	Low	45 Å²	45	77.8 Å²	77.8	29%	0.292	41%	0.41	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.7	-32.1	175.9	-37	38.8	0	0	0	116.1	H469 S472 T475	P426-H469 HydrophobicContact CB-CB 4.43Å; P426-S472 WeakPolarHBondContact CB-OG 3.22Å; P426-T475 WeakPolarHBondContact CD-OG1 3.46Å
427	D	62.8	Low	67	Low	116 Å²	116	80.2 Å²	80.2	62%	0.62	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-4.9	179.1	-59.1	-37.4	0	0	0	114.7	I425 K429 H469	I425-D427 PolarHBondContact O-N 2.68Å; D427-K429 PolarHBondContact O-N 3.16Å; D427-H469 IonicContact OD1-CE1 2.83Å; D427-H469 PolarHBondContact OD1-CE1 3.3Å; D427-H469 VanDerWaalsContact OD1-CE1 3.25Å; D427-H469 IonicContact OD1-ND1 2.66Å
428	S	59.7	Low	64.6	Low	51 Å²	51	78.9 Å²	78.9	36%	0.357	43%	0.426	S	S	.	.			trans	-73.5	95	-178.7	59.5	0	0	0	0	110.5	I424 I425	I424-S428 VanDerWaalsContact CG2-OG 3.27Å; I424-S428 WeakPolarHBondContact CG2-OG 3.21Å; I425-S428 PolarHBondContact N-OG 3.09Å; I425-S428 WeakPolarHBondContact O-CB 3.47Å; I425-S428 PolarHBondContact O-N 2.83Å; I425-S428 PolarHBondContact O-OG 3.25Å
429	K	59.7	Low	62.1	Low	183 Å²	183	84.5 Å²	84.5	80%	0.796	46%	0.456	S	S	*	.			trans	-70.7	138	168.8	-62.7	-178	-177.4	178.5	0	108.7	D427 N431	D427-K429 PolarHBondContact O-N 3.16Å; K429-N431 PolarHBondContact O-N 3.4Å
430	I	58.4	Low	60	Low	16 Å²	16	87.7 Å²	87.7	8%	0.082	47%	0.472	C	S	.	.			trans	-58.9	135.7	157.1	-64.3	176.4	0	0	0	105.6	V432 M486 E487 Y490 Y546 H550	I430-V432 HydrophobicContact CB-CG2 3.92Å; I430-V432 HydrophobicContact CG2-CG2 3.72Å; I430-V432 PolarHBondContact O-N 3.21Å; I430-M486 HydrophobicContact CD1-CB 4.21Å; I430-M486 HydrophobicContact CD1-CG 3.51Å; I430-E487 HydrophobicContact CG2-CG 3.86Å; I430-Y490 HydrophobicContact CD1-CD2 3.91Å; I430-Y490 HydrophobicContact CD1-CE2 3.5Å; I430-Y490 HydrophobicContact CG2-CD2 4.37Å; I430-Y546 VanDerWaalsContact CD1-OH 3.3Å; I430-Y546 WeakPolarHBondContact CD1-OH 3.22Å; I430-Y546 WeakPolarHBondContact CG1-OH 3.42Å; I430-H550 WeakPolarHBondContact CD1-CE1 3.39Å; I430-H550 WeakPolarHBondContact CD1-NE2 3.45Å
431	N	48.3	Very low	57.3	Low	135 Å²	135	91.4 Å²	91.4	72%	0.722	49%	0.491	S	S	*	.			trans	-68.3	69.8	170.3	-73	-27.3	0	0	0	108.6	K429	K429-N431 PolarHBondContact O-N 3.4Å
432	V	48.1	Very low	54.3	Low	41 Å²	41	97.2 Å²	97.2	25%	0.248	52%	0.522	C	S	.	.			trans	-78.8	130.8	165.5	-168.2	0	0	0	0	105	I430 E434 Y490	I430-V432 HydrophobicContact CB-CG2 3.92Å; I430-V432 HydrophobicContact CG2-CG2 3.72Å; I430-V432 PolarHBondContact O-N 3.21Å; V432-E434 PolarHBondContact O-N 2.96Å; V432-Y490 HydrophobicContact CG1-CD1 3.97Å; V432-Y490 HydrophobicContact CG2-CD1 3.7Å; V432-Y490 HydrophobicContact CG2-CD2 4.33Å; V432-Y490 HydrophobicContact CG2-CE1 3.97Å; V432-Y490 HydrophobicContact CG2-CG 3.92Å
433	P	43.6	Very low	51.4	Low	73 Å²	73	105.1 Å²	105.1	47%	0.474	55%	0.553	S	S	.	*			trans	-48.1	132.7	168.1	-24.5	33.7	0	0	0	108.7	L435 L494	P433-L435 PolarHBondContact O-N 2.7Å; P433-L494 HydrophobicContact CB-CD2 4.1Å; P433-L494 HydrophobicContact CG-CD2 3.79Å
434	E	38.2	Very low	48.4	Very low	191 Å²	191	107.7 Å²	107.7	89%	0.893	57%	0.57	S	S	*	*			trans	-51.2	111.1	177.8	-81.5	-178.4	161.4	0	0	108.5	V432 P436	V432-E434 PolarHBondContact O-N 2.96Å; E434-P436 WeakPolarHBondContact O-CD 3.33Å
435	L	41.7	Very low	45.6	Very low	49 Å²	49	116.2 Å²	116.2	26%	0.257	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-62.5	117.6	175.4	-79.5	168.1	0	0	0	105.7	P433 T437 L494 F558	P433-L435 PolarHBondContact O-N 2.7Å; L435-T437 PolarHBondContact O-N 3.24Å; L435-L494 HydrophobicContact CD2-CD1 3.74Å; L435-F558 HydrophobicContact CD2-CE1 4.21Å
436	P	40.3	Very low	42.9	Very low	93 Å²	93	118.7 Å²	118.7	60%	0.604	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-53.5	135.1	-179.4	16.3	-27.9	0	0	0	108.7	E434 R561	E434-P436 WeakPolarHBondContact O-CD 3.33Å; P436-R561 PolarHBondContact O-NH1 2.9Å; P436-R561 PolarHBondContact O-NH2 3.39Å
437	T	35.2	Very low	40.7	Very low	101 Å²	101	124.7 Å²	124.7	62%	0.62	65%	0.653	S	S	*	*	P	Polyproline II helix	trans	-52.1	142	173.7	37.8	0	0	0	0	108.6	L435 D439	L435-T437 PolarHBondContact O-N 3.24Å; T437-D439 PolarHBondContact O-N 3.36Å; T437-D439 PolarHBondContact OG1-OD1 3.1Å
438	P	36.5	Very low	39.1	Very low	112 Å²	112	128.9 Å²	128.9	73%	0.727	67%	0.665	S	S	*	*			trans	-64	91.3	167.2	26.4	-28.9	0	0	0	107	E440	P438-E440 PolarHBondContact O-N 3.45Å
439	D	35.6	Very low	37.5	Very low	125 Å²	125	132.6 Å²	132.6	67%	0.668	69%	0.685	S	S	*	*			trans	-63.3	118.9	176.1	-84.9	-6.9	0	0	0	109.1	T437 D441	T437-D439 PolarHBondContact O-N 3.36Å; T437-D439 PolarHBondContact OG1-OD1 3.1Å; D439-D441 PolarHBondContact O-N 3.43Å
440	E	38.4	Very low	35.9	Very low	183 Å²	183	127.8 Å²	127.8	86%	0.855	68%	0.675	S	S	*	*	S	Bend	trans	25.7	-6.4	141.8	-56.3	-149.9	139.8	0	0	123.7	P438	P438-E440 PolarHBondContact O-N 3.45Å
441	D	33.1	Very low	34.4	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	72%	0.715	S	S	*	*			trans	-102.1	0.8	-170	-93.9	-16.3	0	0	0	116.4	D439	D439-D441 PolarHBondContact O-N 3.43Å
442	N	29.9	Very low	33.4	Very low	148 Å²	148	134.5 Å²	134.5	79%	0.791	72%	0.715	S	S	*	*			trans	-119.8	74.4	170.9	-83.6	-32.9	0	0	0	111.9	L444	N442-L444 PolarHBondContact O-N 3.19Å
443	K	31.3	Very low	32.6	Very low	205 Å²	205	140.9 Å²	140.9	89%	0.891	74%	0.743	S	S	*	*			trans	-66.4	81.5	152.2	-79	179.5	179.1	167.8	0	109
444	L	29.8	Very low	31.8	Very low	147 Å²	147	148 Å²	148	77%	0.77	76%	0.762	S	S	*	*			trans	-103	120.3	154	-76.9	168	0	0	0	107.6	N442 V446	N442-L444 PolarHBondContact O-N 3.19Å; L444-V446 PolarHBondContact O-N 3.45Å
445	E	29.8	Very low	31.4	Very low	190 Å²	190	145.8 Å²	145.8	89%	0.888	76%	0.756	S	S	*	*			trans	-52.9	100	-168.5	-61.9	177.4	150.7	0	0	112.7	Q447	E445-Q447 PolarHBondContact O-N 3.19Å
446	V	28.2	Very low	31.2	Very low	135 Å²	135	152.3 Å²	152.3	82%	0.818	79%	0.785	S	S	*	*			trans	-75.7	110.1	150.9	-179.7	0	0	0	0	105.9	L444 K448	L444-V446 PolarHBondContact O-N 3.45Å; V446-K448 PolarHBondContact O-N 3.07Å
447	Q	26.3	Very low	30.7	Very low	171 Å²	171	154.3 Å²	154.3	80%	0.799	80%	0.795	S	S	*	*			trans	-45	108.6	174.3	-76.1	175.3	-2.8	0	0	110.4	E445 V449	E445-Q447 PolarHBondContact O-N 3.19Å; Q447-V449 PolarHBondContact O-N 3.4Å
448	K	28.5	Very low	30.4	Very low	204 Å²	204	155 Å²	155	89%	0.887	80%	0.799	S	S	*	*			trans	-63.1	100.2	161.7	-78.7	177.9	173.9	176.6	0	107.8	V446 S450	V446-K448 PolarHBondContact O-N 3.07Å; K448-S450 PolarHBondContact O-N 3.34Å
449	V	26.6	Very low	30.6	Very low	128 Å²	128	157.3 Å²	157.3	78%	0.776	81%	0.805	S	S	*	*			trans	-76.9	85.7	156.9	-175.3	0	0	0	0	107	Q447	Q447-V449 PolarHBondContact O-N 3.4Å
450	S	25.9	Very low	30.7	Very low	82 Å²	82	158.7 Å²	158.7	57%	0.573	81%	0.812	S	S	*	*			trans	29	99.1	149.4	51.9	0	0	0	0	118.1	K448 T452	K448-S450 PolarHBondContact O-N 3.34Å; S450-T452 PolarHBondContact O-N 3Å; S450-T452 VanDerWaalsContact O-N 3.17Å
451	N	28	Very low	30.7	Very low	172 Å²	172	158.1 Å²	158.1	92%	0.92	81%	0.809	S	S	*	*			trans	-54.8	110.5	144.2	-84.5	-12.8	0	0	0	108.7
452	T	25.5	Very low	31.2	Very low	121 Å²	121	155.3 Å²	155.3	74%	0.742	80%	0.799	S	S	*	*			trans	-97.5	127.5	158.3	7.3	0	0	0	0	108.2	S450 Y454	S450-T452 PolarHBondContact O-N 3Å; S450-T452 VanDerWaalsContact O-N 3.17Å; T452-Y454 PolarHBondContact O-N 3Å
453	Q	31.8	Very low	31.9	Very low	175 Å²	175	157.1 Å²	157.1	82%	0.818	80%	0.803	S	S	*	*			trans	-53.9	128.2	178.6	-70.7	158.7	-27.7	0	0	111.6
454	Y	27.2	Very low	32.9	Very low	223 Å²	223	154.5 Å²	154.5	88%	0.875	80%	0.799	S	S	*	*			trans	-123.5	104.4	145.2	-81.4	-81.5	0	0	0	107.3	T452	T452-Y454 PolarHBondContact O-N 3Å
455	N	29.5	Very low	33.8	Very low	144 Å²	144	153.2 Å²	153.2	77%	0.77	80%	0.797	S	S	*	*			trans	-71.8	143.9	161.5	-83.3	-17	0	0	0	108.9
456	E	37.5	Very low	35.1	Very low	185 Å²	185	150.7 Å²	150.7	86%	0.864	79%	0.789	S	S	*	*			trans	59.9	87.8	160.7	-66	-177.1	165.4	0	0	118.2
457	V	29.8	Very low	37.3	Very low	136 Å²	136	149.1 Å²	149.1	82%	0.824	78%	0.776	S	S	*	*			trans	-144.5	107.2	138.9	-169.1	0	0	0	0	109.2
458	V	30	Very low	39.1	Very low	115 Å²	115	149.7 Å²	149.7	70%	0.697	78%	0.779	S	S	*	*			trans	46.3	119.3	144.5	-172	0	0	0	0	118.3	L460	V458-L460 PolarHBondContact O-N 3.12Å
459	N	40.4	Very low	41.1	Very low	160 Å²	160	143.3 Å²	143.3	86%	0.856	75%	0.752	S	S	*	*			trans	-41	99.8	155.3	-82.7	-28.5	0	0	0	111.5
460	L	37.1	Very low	43.3	Very low	155 Å²	155	140 Å²	140	81%	0.812	73%	0.734	S	S	*	*			trans	-108.1	94.8	151.2	-76.1	162.4	0	0	0	104.7	V458 P462	V458-L460 PolarHBondContact O-N 3.12Å; L460-P462 VanDerWaalsContact O-CD 3.28Å; L460-P462 WeakPolarHBondContact O-CD 3.47Å
461	E	38.8	Very low	45.9	Very low	170 Å²	170	144.4 Å²	144.4	79%	0.794	74%	0.744	S	S	*	*			trans	-55.2	120.5	160.9	-68.3	-171.9	163.3	0	0	106.8	E463	E461-E463 PolarHBondContact O-N 3.41Å
462	P	43.8	Very low	48.5	Very low	95 Å²	95	138 Å²	138	62%	0.617	71%	0.712	S	S	*	*			trans	-70.6	104.9	170	27.3	-28.1	0	0	0	106.7	L460 N464	L460-P462 VanDerWaalsContact O-CD 3.28Å; L460-P462 WeakPolarHBondContact O-CD 3.47Å; P462-N464 PolarHBondContact O-N 3.48Å
463	E	43.6	Very low	51.4	Low	187 Å²	187	133.3 Å²	133.3	87%	0.874	68%	0.683	S	S	*	*	S	Bend	trans	-57.1	3.2	173.9	-75.8	-176.3	150.1	0	0	114.2	E461	E461-E463 PolarHBondContact O-N 3.41Å
464	N	52.8	Low	54.1	Low	150 Å²	150	128.2 Å²	128.2	80%	0.802	66%	0.664	S	S	*	*			trans	-131.6	65.5	177.8	-64.4	-47.4	0	0	0	110.6	P462 L466	P462-N464 PolarHBondContact O-N 3.48Å; N464-L466 PolarHBondContact O-N 3.27Å
465	T	48.4	Very low	57.1	Low	120 Å²	120	120.4 Å²	120.4	74%	0.736	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-68.9	122.8	160.8	48.2	0	0	0	0	108	D467	T465-D467 PolarHBondContact O-N 3.41Å
466	L	58.4	Low	60.2	Low	136 Å²	136	113.8 Å²	113.8	71%	0.712	61%	0.605	S	S	*	*	P	Polyproline II helix	trans	-57.2	132.1	172.3	-73.7	167.9	0	0	0	108.3	N464	N464-L466 PolarHBondContact O-N 3.27Å
467	D	72.4	Confident	62.9	Low	103 Å²	103	108.7 Å²	108.7	55%	0.551	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-53.8	143.3	177.2	178.4	47.8	0	0	0	110.3	T465 H469 S470	T465-D467 PolarHBondContact O-N 3.41Å; D467-H469 PolarHBondContact O-N 2.89Å; D467-H469 WeakPolarHBondContact OD2-CB 3.31Å; D467-H469 IonicContact OD2-CD2 3.16Å; D467-H469 IonicContact OD2-CG 2.71Å; D467-H469 PolarHBondContact OD2-N 2.89Å; D467-S470 PolarHBondContact N-OG 3.01Å; D467-S470 VanDerWaalsContact O-CB 3.26Å; D467-S470 WeakPolarHBondContact O-CB 3.4Å; D467-S470 PolarHBondContact O-N 3.4Å; D467-S470 PolarHBondContact O-OG 3.21Å
468	Q	66.1	Low	66	Low	183 Å²	183	102.2 Å²	102.2	86%	0.855	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-22	-176.2	-170.4	171.9	4.3	0	0	112.1
469	H	70	Confident	69.2	Low	69 Å²	69	96.8 Å²	96.8	32%	0.319	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.8	9.2	179.3	-53.6	-72.3	0	0	0	114	P426 D427 D467 F471 S472	P426-H469 HydrophobicContact CB-CB 4.43Å; D427-H469 IonicContact OD1-CE1 2.83Å; D427-H469 PolarHBondContact OD1-CE1 3.3Å; D427-H469 VanDerWaalsContact OD1-CE1 3.25Å; D427-H469 IonicContact OD1-ND1 2.66Å; D467-H469 PolarHBondContact O-N 2.89Å; D467-H469 WeakPolarHBondContact OD2-CB 3.31Å; D467-H469 IonicContact OD2-CD2 3.16Å; D467-H469 IonicContact OD2-CG 2.71Å; D467-H469 PolarHBondContact OD2-N 2.89Å; H469-F471 PolarHBondContact O-N 3.39Å; H469-S472 WeakPolarHBondContact CB-OG 3.29Å; H469-S472 WeakPolarHBondContact O-CB 3.32Å; H469-S472 PolarHBondContact O-N 3.37Å; H469-S472 PolarHBondContact O-OG 3.5Å
470	S	73	Confident	71.7	Confident	58 Å²	58	91.9 Å²	91.9	41%	0.406	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	-28.5	-176.2	-64.4	0	0	0	0	114.5	D467	D467-S470 PolarHBondContact N-OG 3.01Å; D467-S470 VanDerWaalsContact O-CB 3.26Å; D467-S470 WeakPolarHBondContact O-CB 3.4Å; D467-S470 PolarHBondContact O-N 3.4Å; D467-S470 PolarHBondContact O-OG 3.21Å
471	F	79.6	Confident	74.5	Confident	176 Å²	176	85.3 Å²	85.3	77%	0.772	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	3.8	177.5	-60.9	-69.9	0	0	0	113.6	H469 H549	H469-F471 PolarHBondContact O-N 3.39Å; F471-H549 PolarHBondContact O-CE1 2.93Å; F471-H549 VanDerWaalsContact O-CE1 3.25Å
472	S	82.3	Confident	77.2	Confident	37 Å²	37	77.4 Å²	77.4	26%	0.259	41%	0.408	S	S	.	.	S	Bend	trans	-75	152.3	178.4	71.9	0	0	0	0	111.4	P426 H469	P426-S472 WeakPolarHBondContact CB-OG 3.22Å; H469-S472 WeakPolarHBondContact CB-OG 3.29Å; H469-S472 WeakPolarHBondContact O-CB 3.32Å; H469-S472 PolarHBondContact O-N 3.37Å; H469-S472 PolarHBondContact O-OG 3.5Å
473	L	86.6	Confident	79.5	Confident	23 Å²	23	75.4 Å²	75.4	12%	0.12	39%	0.39	C	S	.	.	P	Polyproline II helix	trans	-68.4	130.9	168.1	-169.7	77.7	0	0	0	108.9	I424 Y546 H549	I424-L473 HydrophobicContact CG2-CD2 4.25Å; L473-Y546 HydrophobicContact CD2-CD2 3.6Å; L473-Y546 HydrophobicContact CD2-CG 4.35Å; L473-H549 HydrophobicContact CD1-CB 3.93Å
474	P	89.3	Confident	81.9	Confident	67 Å²	67	70.9 Å²	70.9	44%	0.435	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-63.9	154.5	177.6	28.3	-36.4	0	0	0	111.2	C476 P644	P474-C476 PolarHBondContact O-N 3.17Å; P474-P644 HydrophobicContact CB-CB 4.05Å; P474-P644 HydrophobicContact CB-CG 4.43Å; P474-P644 HydrophobicContact CG-CB 3.92Å; P474-P644 HydrophobicContact CG-CG 3.9Å
475	T	90.5	Very high	84	Confident	59 Å²	59	63.9 Å²	63.9	36%	0.362	33%	0.329	S	S	.	.	S	Bend	trans	-55.5	124.9	179.6	-54.3	0	0	0	0	111.3	K423 I424 I425 P426	K423-T475 HydrophobicContact CG-CG2 4.37Å; I424-T475 VanDerWaalsContact O-CA 3.23Å; I424-T475 WeakPolarHBondContact O-CA 3.3Å; I424-T475 WeakPolarHBondContact O-CG2 3.43Å; I425-T475 HydrophobicContact CG1-CG2 4.38Å; P426-T475 WeakPolarHBondContact CD-OG1 3.46Å
476	C	93.4	Very high	86.1	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.034	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	166.7	-179.2	70.7	0	0	0	0	111.2	I424 P474 N542 V642 P644	I424-C476 PolarHBondContact N-O 3.44Å; I424-C476 PolarHBondContact O-N 2.89Å; I424-C476 VanDerWaalsContact O-N 3.09Å; P474-C476 PolarHBondContact O-N 3.17Å; C476-N542 HydrophobicContact CB-CB 4.44Å; C476-V642 WeakPolarHBondContact CA-O 3.12Å; C476-P644 HydrophobicContact CB-CG 4Å
477	R	94.5	Very high	87.8	Confident	79 Å²	79	54 Å²	54	30%	0.298	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	135.7	169	-76.1	176.9	178.2	-129.5	5.6	111.3	T421 V422 K423 N542 D641 V642	T421-R477 PolarHBondContact OG1-NH1 2.92Å; T421-R477 VanDerWaalsContact OG1-NH1 3.09Å; V422-R477 WeakPolarHBondContact O-CA 3.39Å; K423-R477 HydrophobicContact CB-CG 4.25Å; R477-N542 VanDerWaalsContact O-CB 3.28Å; R477-N542 WeakPolarHBondContact O-CB 3.29Å; R477-N542 PolarHBondContact O-ND2 3.41Å; R477-D641 WeakPolarHBondContact CD-O 3.15Å; R477-D641 WeakPolarHBondContact CG-O 3.5Å; R477-D641 IonicContact CZ-OD2 2.73Å; R477-D641 PolarHBondContact NE-O 3.01Å; R477-D641 IonicContact NE-OD2 3.64Å; R477-D641 PolarHBondContact NE-OD2 3.4Å; R477-D641 IonicContact NH2-OD2 2.67Å; R477-D641 PolarHBondContact NH2-OD2 3.17Å; R477-V642 PolarHBondContact N-O 3.08Å
478	I	95.7	Very high	88.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	163.8	172.8	67.7	170.8	0	0	0	109.6	T421 V422 I424 K483 N542 N543 Y546	T421-I478 CarbonylContact C-O 3.57Å; T421-I478 WeakPolarHBondContact CA-O 3.38Å; T421-I478 WeakPolarHBondContact CB-O 3.44Å; V422-I478 PolarHBondContact N-O 2.85Å; V422-I478 PolarHBondContact O-N 3.27Å; I424-I478 HydrophobicContact CD1-CD1 3.78Å; I424-I478 HydrophobicContact CD1-CG1 4.06Å; I424-I478 HydrophobicContact CG1-CD1 3.73Å; I424-I478 HydrophobicContact CG1-CG1 3.72Å; I424-I478 HydrophobicContact CG1-CG2 4.2Å; I478-K483 HydrophobicContact CD1-CB 4.09Å; I478-N542 HydrophobicContact CG2-CB 4.17Å; I478-N543 WeakPolarHBondContact CA-OD1 3.33Å; I478-N543 VanDerWaalsContact CB-OD1 3.22Å; I478-N543 WeakPolarHBondContact CB-OD1 3.39Å; I478-Y546 HydrophobicContact CD1-CD1 3.65Å; I478-Y546 HydrophobicContact CD1-CD2 4.02Å; I478-Y546 HydrophobicContact CD1-CE1 3.61Å; I478-Y546 HydrophobicContact CD1-CE2 4.03Å; I478-Y546 HydrophobicContact CD1-CG 3.85Å; I478-Y546 HydrophobicContact CG2-CD2 4.43Å; I478-Y546 HydrophobicContact CG2-CG 4.12Å
479	S	95.8	Very high	90.1	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	144.5	172.7	66	0	0	0	0	111.6	N420 S481 V482 K483 N543	N420-S479 CarbonylContact O-C 3.54Å; N420-S479 WeakPolarHBondContact O-CA 3.3Å; S479-S481 PolarHBondContact O-N 3.48Å; S479-S481 PolarHBondContact OG-OG 3.25Å; S479-V482 PolarHBondContact O-N 2.95Å; S479-V482 VanDerWaalsContact O-N 3.08Å; S479-V482 WeakPolarHBondContact OG-CG2 3.44Å; S479-V482 PolarHBondContact OG-N 2.9Å; S479-K483 PolarHBondContact O-N 3.35Å; S479-N543 PolarHBondContact N-OD1 2.87Å; S479-N543 PolarHBondContact OG-ND2 3.43Å
480	E	94.2	Very high	91.1	Very high	56 Å²	56	39 Å²	39	26%	0.262	20%	0.199	S	C	.	.	H	α-helix	trans	-59.7	-34.1	176.2	-168.3	-177.1	154.3	0	0	111.2	N420 V422 V482 K483 K484	N420-E480 PolarHBondContact ND2-OE2 3.2Å; N420-E480 PolarHBondContact O-N 3.27Å; V422-E480 HydrophobicContact CG2-CB 4.09Å; V422-E480 HydrophobicContact CG2-CG 4.13Å; E480-V482 VanDerWaalsContact C-N 3.3Å; E480-V482 PolarHBondContact O-N 3.42Å; E480-K483 PolarHBondContact O-N 2.88Å; E480-K484 HydrophobicContact CG-CD 4.46Å; E480-K484 WeakPolarHBondContact O-CG 3.14Å; E480-K484 PolarHBondContact O-N 3.39Å; E480-K484 WeakPolarHBondContact OE1-CE 3.14Å; E480-K484 IonicContact OE1-NZ 2.95Å; E480-K484 PolarHBondContact OE1-NZ 3.26Å
481	S	94.6	Very high	91.9	Very high	17 Å²	17	41.7 Å²	41.7	12%	0.119	21%	0.205	C	C	.	.	H	α-helix	trans	-58.2	-39.4	174.7	57.1	0	0	0	0	113.1	L413 S479 L485	L413-S481 WeakPolarHBondContact O-CB 3.34Å; S479-S481 PolarHBondContact O-N 3.48Å; S479-S481 PolarHBondContact OG-OG 3.25Å; S481-L485 VanDerWaalsContact O-CB 3.29Å; S481-L485 WeakPolarHBondContact O-CB 3.38Å; S481-L485 PolarHBondContact O-N 2.84Å
482	V	95.6	Very high	92.4	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.024	17%	0.169	C	C	.	.	H	α-helix	trans	-75.2	-35.8	179.3	165.7	0	0	0	0	111.5	S479 E480 L485 M486 F518 N543 Y546 I547	S479-V482 PolarHBondContact O-N 2.95Å; S479-V482 VanDerWaalsContact O-N 3.08Å; S479-V482 WeakPolarHBondContact OG-CG2 3.44Å; S479-V482 PolarHBondContact OG-N 2.9Å; E480-V482 VanDerWaalsContact C-N 3.3Å; E480-V482 PolarHBondContact O-N 3.42Å; V482-L485 PolarHBondContact O-N 3.46Å; V482-M486 PolarHBondContact O-N 3.07Å; V482-F518 HydrophobicContact CG2-CE2 3.7Å; V482-F518 HydrophobicContact CG2-CZ 4.13Å; V482-N543 HydrophobicContact CB-CB 4.4Å; V482-N543 HydrophobicContact CG1-CB 4.22Å; V482-N543 HydrophobicContact CG2-CB 3.94Å; V482-N543 WeakPolarHBondContact CG2-ND2 3.33Å; V482-Y546 HydrophobicContact CG1-CD1 3.99Å; V482-I547 HydrophobicContact CG1-CD1 3.92Å; V482-I547 HydrophobicContact CG1-CG1 3.85Å
483	K	93.4	Very high	92.7	Very high	54 Å²	54	31.7 Å²	31.7	24%	0.235	16%	0.157	C	C	.	.	H	α-helix	trans	-58.7	-51	170.7	-172.7	-178.7	174.6	-174.7	0	110.8	V422 I478 S479 E480 L485 M486 E487	V422-K483 HydrophobicContact CG1-CD 4.26Å; V422-K483 HydrophobicContact CG2-CD 4.42Å; I478-K483 HydrophobicContact CD1-CB 4.09Å; S479-K483 PolarHBondContact O-N 3.35Å; E480-K483 PolarHBondContact O-N 2.88Å; K483-L485 VanDerWaalsContact C-N 3.31Å; K483-L485 PolarHBondContact O-N 3.38Å; K483-M486 PolarHBondContact O-N 3.46Å; K483-E487 VanDerWaalsContact CE-OE1 3.27Å; K483-E487 WeakPolarHBondContact CE-OE1 3.4Å; K483-E487 WeakPolarHBondContact O-CG 3.29Å; K483-E487 PolarHBondContact O-N 3.11Å
484	K	93.9	Very high	92.8	Very high	91 Å²	91	32.8 Å²	32.8	40%	0.396	16%	0.162	S	C	.	.	H	α-helix	trans	-62.2	-36.4	176.6	-72.5	178.1	-178.9	167.7	0	112.7	L413 E480 M486 E487 L488	L413-K484 HydrophobicContact CD1-CB 4.1Å; L413-K484 HydrophobicContact CD2-CB 3.87Å; L413-K484 HydrophobicContact CD2-CD 4.17Å; E480-K484 HydrophobicContact CG-CD 4.46Å; E480-K484 WeakPolarHBondContact O-CG 3.14Å; E480-K484 PolarHBondContact O-N 3.39Å; E480-K484 WeakPolarHBondContact OE1-CE 3.14Å; E480-K484 IonicContact OE1-NZ 2.95Å; E480-K484 PolarHBondContact OE1-NZ 3.26Å; K484-M486 VanDerWaalsContact C-N 3.34Å; K484-E487 PolarHBondContact O-N 3.31Å; K484-L488 WeakPolarHBondContact O-CB 3.1Å; K484-L488 PolarHBondContact O-N 3.36Å
485	L	95.3	Very high	92.5	Very high	3 Å²	3	31 Å²	31	2%	0.016	15%	0.148	C	C	.	.	H	α-helix	trans	-63.9	-41.5	176.4	-170.9	71.5	0	0	0	111.3	A410 L413 M414 S481 V482 K483 L488 A489 I514 F518	A410-L485 HydrophobicContact CB-CD1 3.8Å; L413-L485 HydrophobicContact CB-CD1 4.31Å; L413-L485 HydrophobicContact CD1-CB 4.28Å; L413-L485 HydrophobicContact CD1-CD1 4.11Å; M414-L485 HydrophobicContact CE-CD1 3.97Å; M414-L485 HydrophobicContact CE-CD2 4.15Å; S481-L485 VanDerWaalsContact O-CB 3.29Å; S481-L485 WeakPolarHBondContact O-CB 3.38Å; S481-L485 PolarHBondContact O-N 2.84Å; V482-L485 PolarHBondContact O-N 3.46Å; K483-L485 VanDerWaalsContact C-N 3.31Å; K483-L485 PolarHBondContact O-N 3.38Å; L485-L488 PolarHBondContact O-N 3.29Å; L485-A489 PolarHBondContact O-N 3.42Å; L485-I514 HydrophobicContact CD1-CG2 3.59Å; L485-I514 HydrophobicContact CD2-CG2 4.24Å; L485-I514 HydrophobicContact CG-CG2 3.91Å; L485-F518 HydrophobicContact CD2-CD2 3.55Å; L485-F518 HydrophobicContact CD2-CE2 4.19Å; L485-F518 HydrophobicContact CD2-CG 4.42Å
486	M	94.1	Very high	92.2	Very high	2 Å²	2	28.3 Å²	28.3	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-68.5	-41.8	175.9	-162.8	60.6	-116.7	0	0	111	I430 V482 K483 K484 L488 A489 Y490 F515 Y546 H550 L554	I430-M486 HydrophobicContact CD1-CB 4.21Å; I430-M486 HydrophobicContact CD1-CG 3.51Å; V482-M486 PolarHBondContact O-N 3.07Å; K483-M486 PolarHBondContact O-N 3.46Å; K484-M486 VanDerWaalsContact C-N 3.34Å; M486-L488 VanDerWaalsContact C-N 3.33Å; M486-L488 PolarHBondContact O-N 3.03Å; M486-A489 HydrophobicContact CE-CB 3.74Å; M486-A489 WeakPolarHBondContact O-CB 3.26Å; M486-A489 PolarHBondContact O-N 3.12Å; M486-Y490 HydrophobicContact CE-CD2 3.37Å; M486-Y490 HydrophobicContact CE-CE2 3.26Å; M486-Y490 HydrophobicContact CE-CG 4.32Å; M486-Y490 HydrophobicContact CG-CD2 3.93Å; M486-Y490 HydrophobicContact CG-CE2 3.8Å; M486-Y490 VanDerWaalsContact O-CD2 3.29Å; M486-Y490 WeakPolarHBondContact O-CD2 3.28Å; M486-Y490 PolarHBondContact O-N 3Å; M486-Y490 HydrophobicContact SD-CD2 4.5Å; M486-Y490 HydrophobicContact SD-CE2 4.23Å; M486-F515 HydrophobicContact CE-CZ 3.95Å; M486-F515 HydrophobicContact SD-CE1 4.19Å; M486-F515 HydrophobicContact SD-CZ 3.89Å; M486-Y546 HydrophobicContact CB-CE1 4.21Å; M486-Y546 HydrophobicContact CG-CE1 4.35Å; M486-H550 HydrophobicContact CE-CB 4.4Å; M486-H550 HydrophobicContact CG-CB 4.4Å; M486-H550 HydrophobicContact SD-CB 3.86Å; M486-L554 HydrophobicContact CE-CD1 3.94Å; M486-L554 HydrophobicContact CE-CD2 3.78Å
487	E	92.9	Very high	91.7	Very high	48 Å²	48	29.8 Å²	29.8	22%	0.224	14%	0.141	C	C	.	.	H	α-helix	trans	-57.2	-44.3	172.8	-72.1	167.4	179.6	0	0	111.9	I430 K483 K484 A489 Y490 Q491	I430-E487 HydrophobicContact CG2-CG 3.86Å; K483-E487 VanDerWaalsContact CE-OE1 3.27Å; K483-E487 WeakPolarHBondContact CE-OE1 3.4Å; K483-E487 WeakPolarHBondContact O-CG 3.29Å; K483-E487 PolarHBondContact O-N 3.11Å; K484-E487 PolarHBondContact O-N 3.31Å; E487-A489 PolarHBondContact O-N 3.04Å; E487-Y490 PolarHBondContact O-N 2.93Å; E487-Q491 WeakPolarHBondContact O-CB 3.43Å; E487-Q491 VanDerWaalsContact O-CG 3.3Å; E487-Q491 WeakPolarHBondContact O-CG 3.28Å; E487-Q491 PolarHBondContact O-N 3.48Å
488	L	93.4	Very high	91.1	Very high	29 Å²	29	30.9 Å²	30.9	15%	0.152	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-43.6	174.6	177.9	64.8	0	0	0	111.9	V406 A409 A410 L413 K484 L485 M486 Q491 T492 I514	V406-L488 HydrophobicContact CG1-CD1 4.5Å; V406-L488 HydrophobicContact CG1-CD2 4.38Å; V406-L488 HydrophobicContact CG1-CG 4.36Å; A409-L488 HydrophobicContact CB-CD2 3.97Å; A410-L488 HydrophobicContact CB-CD2 4.13Å; L413-L488 HydrophobicContact CD1-CD2 4.37Å; K484-L488 WeakPolarHBondContact O-CB 3.1Å; K484-L488 PolarHBondContact O-N 3.36Å; L485-L488 PolarHBondContact O-N 3.29Å; M486-L488 VanDerWaalsContact C-N 3.33Å; M486-L488 PolarHBondContact O-N 3.03Å; L488-Q491 PolarHBondContact O-N 2.95Å; L488-T492 WeakPolarHBondContact O-CB 3.49Å; L488-T492 PolarHBondContact O-N 3.21Å; L488-T492 PolarHBondContact O-OG1 3.01Å; L488-I514 HydrophobicContact CD2-CD1 4.48Å
489	A	93.6	Very high	90.2	Very high	0 Å²	0	32 Å²	32	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-62.7	-44.3	176.1	0	0	0	0	0	112.1	L485 M486 E487 T492 L493 V511 F515	L485-A489 PolarHBondContact O-N 3.42Å; M486-A489 HydrophobicContact CE-CB 3.74Å; M486-A489 WeakPolarHBondContact O-CB 3.26Å; M486-A489 PolarHBondContact O-N 3.12Å; E487-A489 PolarHBondContact O-N 3.04Å; A489-T492 PolarHBondContact O-N 3.34Å; A489-L493 WeakPolarHBondContact O-CG 3.26Å; A489-L493 PolarHBondContact O-N 3.25Å; A489-V511 HydrophobicContact CB-CG1 3.73Å; A489-F515 HydrophobicContact CB-CE2 4.25Å; A489-F515 HydrophobicContact CB-CZ 3.77Å
490	Y	91.3	Very high	89.3	Confident	11 Å²	11	33.9 Å²	33.9	4%	0.043	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-45.3	175.5	-89.4	-78.4	0	0	0	112.4	I430 V432 M486 E487 T492 L493 L494 H550 L554 Q557 F558	I430-Y490 HydrophobicContact CD1-CD2 3.91Å; I430-Y490 HydrophobicContact CD1-CE2 3.5Å; I430-Y490 HydrophobicContact CG2-CD2 4.37Å; V432-Y490 HydrophobicContact CG1-CD1 3.97Å; V432-Y490 HydrophobicContact CG2-CD1 3.7Å; V432-Y490 HydrophobicContact CG2-CD2 4.33Å; V432-Y490 HydrophobicContact CG2-CE1 3.97Å; V432-Y490 HydrophobicContact CG2-CG 3.92Å; M486-Y490 HydrophobicContact CE-CD2 3.37Å; M486-Y490 HydrophobicContact CE-CE2 3.26Å; M486-Y490 HydrophobicContact CE-CG 4.32Å; M486-Y490 HydrophobicContact CG-CD2 3.93Å; M486-Y490 HydrophobicContact CG-CE2 3.8Å; M486-Y490 VanDerWaalsContact O-CD2 3.29Å; M486-Y490 WeakPolarHBondContact O-CD2 3.28Å; M486-Y490 PolarHBondContact O-N 3Å; M486-Y490 HydrophobicContact SD-CD2 4.5Å; M486-Y490 HydrophobicContact SD-CE2 4.23Å; E487-Y490 PolarHBondContact O-N 2.93Å; Y490-T492 VanDerWaalsContact C-N 3.34Å; Y490-T492 PolarHBondContact O-N 3.21Å; Y490-L493 PolarHBondContact O-N 3.08Å; Y490-L494 WeakPolarHBondContact O-CB 3.31Å; Y490-L494 PolarHBondContact O-N 3.34Å; Y490-H550 AromaticContact CE2-ND1 3.86Å; Y490-H550 PolarHBondContact OH-ND1 2.88Å; Y490-L554 HydrophobicContact CD1-CD1 3.96Å; Y490-L554 HydrophobicContact CD2-CD1 4.41Å; Y490-L554 HydrophobicContact CE1-CD1 3.44Å; Y490-L554 VanDerWaalsContact CE1-CD1 3.44Å; Y490-L554 HydrophobicContact CE2-CD1 3.95Å; Y490-L554 HydrophobicContact CG-CD1 4.4Å; Y490-L554 VanDerWaalsContact CZ-CD1 3.42Å; Y490-Q557 VanDerWaalsContact CE1-OE1 3.27Å; Y490-Q557 PolarHBondContact OH-OE1 3.29Å; Y490-F558 AromaticContact CD1-CE2 3.84Å; Y490-F558 HydrophobicContact CD1-CE2 3.84Å; Y490-F558 AromaticContact CD1-CZ 3.93Å; Y490-F558 HydrophobicContact CD1-CZ 3.93Å; Y490-F558 AromaticContact CE1-CE2 3.98Å; Y490-F558 HydrophobicContact CE1-CE2 3.98Å; Y490-F558 HydrophobicContact CE1-CZ 4.44Å
491	Q	90.2	Very high	88.6	Confident	113 Å²	113	35.3 Å²	35.3	53%	0.528	19%	0.186	S	C	.	.	H	α-helix	trans	-62.6	-41.6	177.5	-73.6	174.5	-1.3	0	0	111.7	E487 L488 L494 E495	E487-Q491 WeakPolarHBondContact O-CB 3.43Å; E487-Q491 VanDerWaalsContact O-CG 3.3Å; E487-Q491 WeakPolarHBondContact O-CG 3.28Å; E487-Q491 PolarHBondContact O-N 3.48Å; L488-Q491 PolarHBondContact O-N 2.95Å; Q491-L494 PolarHBondContact O-N 3.49Å; Q491-E495 PolarHBondContact O-N 3.32Å
492	T	90.1	Very high	87.7	Confident	3 Å²	3	39.6 Å²	39.6	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-65.3	-40.3	178.1	-54.6	0	0	0	0	111.5	V406 L488 A489 Y490 E495 A496 L507 V511	V406-T492 HydrophobicContact CG1-CG2 4.34Å; V406-T492 HydrophobicContact CG2-CG2 4.24Å; L488-T492 WeakPolarHBondContact O-CB 3.49Å; L488-T492 PolarHBondContact O-N 3.21Å; L488-T492 PolarHBondContact O-OG1 3.01Å; A489-T492 PolarHBondContact O-N 3.34Å; Y490-T492 VanDerWaalsContact C-N 3.34Å; Y490-T492 PolarHBondContact O-N 3.21Å; T492-E495 PolarHBondContact O-N 3.15Å; T492-A496 PolarHBondContact O-N 3.09Å; T492-L507 HydrophobicContact CG2-CB 4.14Å; T492-L507 HydrophobicContact CG2-CD2 4.02Å; T492-V511 HydrophobicContact CG2-CG2 3.53Å
493	L	89.2	Confident	87	Confident	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-68.5	-37.7	174.1	-72.7	174.3	0	0	0	112.4	A489 Y490 E495 A496 T497 F508 V511 L554 F558 F573	A489-L493 WeakPolarHBondContact O-CG 3.26Å; A489-L493 PolarHBondContact O-N 3.25Å; Y490-L493 PolarHBondContact O-N 3.08Å; L493-E495 VanDerWaalsContact C-N 3.35Å; L493-A496 WeakPolarHBondContact O-CB 3.42Å; L493-A496 PolarHBondContact O-N 3.37Å; L493-T497 WeakPolarHBondContact O-CG2 3.35Å; L493-T497 PolarHBondContact O-N 3.23Å; L493-F508 HydrophobicContact CD2-CD2 3.83Å; L493-V511 HydrophobicContact CD1-CG1 4.28Å; L493-V511 HydrophobicContact CD2-CB 4.37Å; L493-V511 HydrophobicContact CD2-CG2 4.25Å; L493-V511 HydrophobicContact CG-CB 4.41Å; L493-V511 HydrophobicContact CG-CG1 4.28Å; L493-V511 HydrophobicContact CG-CG2 4.07Å; L493-L554 HydrophobicContact CD1-CD1 3.76Å; L493-L554 HydrophobicContact CD1-CD2 3.82Å; L493-L554 HydrophobicContact CD1-CG 3.64Å; L493-F558 HydrophobicContact CB-CD1 4.06Å; L493-F558 HydrophobicContact CB-CD2 4.08Å; L493-F558 HydrophobicContact CB-CE1 3.86Å; L493-F558 HydrophobicContact CB-CE2 3.89Å; L493-F558 HydrophobicContact CB-CG 4.17Å; L493-F558 HydrophobicContact CB-CZ 3.77Å; L493-F558 HydrophobicContact CD1-CD2 3.81Å; L493-F558 HydrophobicContact CD1-CE2 3.85Å; L493-F573 HydrophobicContact CD1-CE2 4.18Å; L493-F573 HydrophobicContact CD1-CZ 4.21Å; L493-F573 HydrophobicContact CD2-CZ 4.29Å
494	L	87	Confident	86.5	Confident	46 Å²	46	36.9 Å²	36.9	24%	0.241	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-44.5	174.9	-176.7	65.7	0	0	0	111	P433 L435 Y490 Q491 A496 T497 F558	P433-L494 HydrophobicContact CB-CD2 4.1Å; P433-L494 HydrophobicContact CG-CD2 3.79Å; L435-L494 HydrophobicContact CD2-CD1 3.74Å; Y490-L494 WeakPolarHBondContact O-CB 3.31Å; Y490-L494 PolarHBondContact O-N 3.34Å; Q491-L494 PolarHBondContact O-N 3.49Å; L494-A496 VanDerWaalsContact C-N 3.27Å; L494-A496 PolarHBondContact O-N 3.36Å; L494-T497 PolarHBondContact O-N 3.38Å; L494-T497 VanDerWaalsContact O-N 3.09Å; L494-T497 PolarHBondContact O-OG1 3.16Å; L494-F558 HydrophobicContact CB-CE1 4.45Å
495	E	83.3	Confident	86.1	Confident	30 Å²	30	34.3 Å²	34.3	14%	0.14	18%	0.184	C	C	.	.	H	α-helix	trans	-64.4	-32.4	175	-170.3	171.1	179.8	0	0	112.2	K402 Q491 T492 L493 T497 T498 S499 L507	K402-E495 WeakPolarHBondContact CE-OE2 3.29Å; K402-E495 IonicContact NZ-OE1 2.93Å; K402-E495 PolarHBondContact NZ-OE1 2.98Å; K402-E495 IonicContact NZ-OE2 2.7Å; K402-E495 PolarHBondContact NZ-OE2 2.64Å; Q491-E495 PolarHBondContact O-N 3.32Å; T492-E495 PolarHBondContact O-N 3.15Å; L493-E495 VanDerWaalsContact C-N 3.35Å; E495-T497 VanDerWaalsContact C-N 3.25Å; E495-T497 PolarHBondContact O-N 3.47Å; E495-T498 PolarHBondContact O-N 2.89Å; E495-T498 PolarHBondContact O-OG1 3.25Å; E495-S499 WeakPolarHBondContact O-CB 3.39Å; E495-S499 PolarHBondContact O-N 3.29Å; E495-S499 PolarHBondContact O-OG 3.2Å; E495-L507 HydrophobicContact CG-CD1 4.33Å
496	A	85.6	Confident	85.6	Confident	2 Å²	2	36.5 Å²	36.5	2%	0.017	20%	0.195	C	C	.	.	H	α-helix	trans	-62.2	-31.9	172.7	0	0	0	0	0	112.6	T492 L493 L494 T498 A504 L507 L562	T492-A496 PolarHBondContact O-N 3.09Å; L493-A496 WeakPolarHBondContact O-CB 3.42Å; L493-A496 PolarHBondContact O-N 3.37Å; L494-A496 VanDerWaalsContact C-N 3.27Å; L494-A496 PolarHBondContact O-N 3.36Å; A496-T498 VanDerWaalsContact C-N 3.31Å; A496-T498 PolarHBondContact O-N 3.09Å; A496-A504 HydrophobicContact CB-CB 4.37Å; A496-A504 WeakPolarHBondContact O-CB 3.39Å; A496-L507 HydrophobicContact CB-CB 3.83Å; A496-L507 HydrophobicContact CB-CD1 4.12Å; A496-L562 HydrophobicContact CB-CD2 3.97Å
497	T	82.7	Confident	85.3	Confident	36 Å²	36	36.4 Å²	36.4	22%	0.221	19%	0.194	C	C	.	.	H	α-helix	trans	-72.4	-21.3	178	66.9	0	0	0	0	114.2	L493 L494 E495 F558 R561 L562	L493-T497 WeakPolarHBondContact O-CG2 3.35Å; L493-T497 PolarHBondContact O-N 3.23Å; L494-T497 PolarHBondContact O-N 3.38Å; L494-T497 VanDerWaalsContact O-N 3.09Å; L494-T497 PolarHBondContact O-OG1 3.16Å; E495-T497 VanDerWaalsContact C-N 3.25Å; E495-T497 PolarHBondContact O-N 3.47Å; T497-F558 HydrophobicContact CG2-CD1 3.8Å; T497-F558 HydrophobicContact CG2-CE1 4.44Å; T497-R561 WeakPolarHBondContact CB-O 3.3Å; T497-R561 HydrophobicContact CG2-CB 3.62Å; T497-L562 HydrophobicContact CG2-CD2 4.34Å
498	T	80.3	Confident	85.2	Confident	101 Å²	101	34.2 Å²	34.2	62%	0.62	18%	0.184	S	C	*	.	H	α-helix	trans	-103	-0.6	179.8	57.1	0	0	0	0	112.9	E495 A496	E495-T498 PolarHBondContact O-N 2.89Å; E495-T498 PolarHBondContact O-OG1 3.25Å; A496-T498 VanDerWaalsContact C-N 3.31Å; A496-T498 PolarHBondContact O-N 3.09Å
499	S	77.8	Confident	85	Confident	23 Å²	23	38 Å²	38	16%	0.161	20%	0.197	C	C	.	.	S	Bend	trans	-97.6	167.6	-176	-65.6	0	0	0	0	112.4	E495	E495-S499 WeakPolarHBondContact O-CB 3.39Å; E495-S499 PolarHBondContact O-N 3.29Å; E495-S499 PolarHBondContact O-OG 3.2Å
500	S	77.5	Confident	85	Confident	41 Å²	41	38.4 Å²	38.4	29%	0.287	20%	0.2	S	C	.	.			trans	-60.7	153.9	171.4	55.8	0	0	0	0	112.3	N395 Q502 C503 A504	N395-S500 PolarHBondContact OD1-OG 3Å; S500-Q502 VanDerWaalsContact C-N 3.29Å; S500-Q502 PolarHBondContact O-N 3.4Å; S500-C503 WeakPolarHBondContact O-CA 3.29Å; S500-C503 WeakPolarHBondContact O-CB 3.38Å; S500-C503 PolarHBondContact O-N 3.35Å; S500-C503 WeakPolarHBondContact OG-CB 3.41Å; S500-A504 PolarHBondContact O-N 3.01Å
501	D	78.4	Confident	85.1	Confident	86 Å²	86	37.9 Å²	37.9	46%	0.46	20%	0.197	S	C	.	.	H	α-helix	trans	-51.5	-44.5	-175.1	-69.1	-16.8	0	0	0	113.5	A504 V505 A563 I565	D501-A504 PolarHBondContact O-N 3.49Å; D501-V505 VanDerWaalsContact O-CG2 3.31Å; D501-V505 WeakPolarHBondContact O-CG2 3.46Å; D501-V505 PolarHBondContact O-N 3.15Å; D501-V505 VanDerWaalsContact O-N 3.12Å; D501-A563 HydrophobicContact CB-CB 4.07Å; D501-A563 VanDerWaalsContact OD1-CB 3.26Å; D501-A563 WeakPolarHBondContact OD1-CB 2.89Å; D501-I565 HydrophobicContact CB-CD1 4.36Å
502	Q	76.3	Confident	85.2	Confident	107 Å²	107	34 Å²	34	50%	0.5	18%	0.178	S	C	.	.	H	α-helix	trans	-66.3	-41.1	179	-173.3	176.4	0.7	0	0	112.3	S500 Q506	S500-Q502 VanDerWaalsContact C-N 3.29Å; S500-Q502 PolarHBondContact O-N 3.4Å; Q502-Q506 PolarHBondContact O-N 3.38Å
503	C	80.1	Confident	85.4	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.014	20%	0.198	C	C	.	.	H	α-helix	trans	-66.2	-43.1	176	-179.6	0	0	0	0	110.9	A399 S500 V505 Q506 L507	A399-C503 HydrophobicContact CB-CB 3.82Å; A399-C503 VanDerWaalsContact CB-SG 3.55Å; S500-C503 WeakPolarHBondContact O-CA 3.29Å; S500-C503 WeakPolarHBondContact O-CB 3.38Å; S500-C503 PolarHBondContact O-N 3.35Å; S500-C503 WeakPolarHBondContact OG-CB 3.41Å; C503-V505 VanDerWaalsContact C-N 3.31Å; C503-V505 PolarHBondContact O-N 2.94Å; C503-Q506 PolarHBondContact O-N 3.06Å; C503-Q506 VanDerWaalsContact O-N 3.13Å; C503-L507 WeakPolarHBondContact O-CB 3.28Å; C503-L507 WeakPolarHBondContact O-CG 3.42Å; C503-L507 PolarHBondContact O-N 3.42Å
504	A	83.3	Confident	85.7	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.5	-43.3	178.4	0	0	0	0	0	112	A496 S500 D501 F508 A563	A496-A504 HydrophobicContact CB-CB 4.37Å; A496-A504 WeakPolarHBondContact O-CB 3.39Å; S500-A504 PolarHBondContact O-N 3.01Å; D501-A504 PolarHBondContact O-N 3.49Å; A504-F508 VanDerWaalsContact O-CB 3.31Å; A504-F508 WeakPolarHBondContact O-CB 3.49Å; A504-F508 PolarHBondContact O-N 3.18Å; A504-A563 HydrophobicContact CB-CB 4.26Å
505	V	84.8	Confident	86.2	Confident	36 Å²	36	35.5 Å²	35.5	22%	0.218	19%	0.186	C	C	.	.	H	α-helix	trans	-60.9	-48.1	174.8	174.2	0	0	0	0	111.3	D501 C503 F508 Y509 L566	D501-V505 VanDerWaalsContact O-CG2 3.31Å; D501-V505 WeakPolarHBondContact O-CG2 3.46Å; D501-V505 PolarHBondContact O-N 3.15Å; D501-V505 VanDerWaalsContact O-N 3.12Å; C503-V505 VanDerWaalsContact C-N 3.31Å; C503-V505 PolarHBondContact O-N 2.94Å; V505-F508 PolarHBondContact O-N 3.22Å; V505-Y509 HydrophobicContact CG1-CD2 3.78Å; V505-Y509 HydrophobicContact CG1-CE2 3.73Å; V505-Y509 VanDerWaalsContact O-CD2 3.23Å; V505-Y509 WeakPolarHBondContact O-CD2 3.33Å; V505-Y509 PolarHBondContact O-N 2.93Å; V505-L566 HydrophobicContact CG2-CD1 4.07Å; V505-L566 HydrophobicContact CG2-CD2 4.01Å; V505-L566 HydrophobicContact CG2-CG 3.9Å
506	Q	86.4	Confident	86.7	Confident	50 Å²	50	38 Å²	38	23%	0.234	20%	0.198	C	C	.	.	H	α-helix	trans	-65.8	-41.1	-179.1	-71.1	-171.4	-22.1	0	0	112.9	A399 N400 Q502 C503 Y509 S510	A399-Q506 HydrophobicContact CB-CB 4.34Å; N400-Q506 PolarHBondContact OD1-NE2 3.49Å; N400-Q506 PolarHBondContact OD1-OE1 3.22Å; Q502-Q506 PolarHBondContact O-N 3.38Å; C503-Q506 PolarHBondContact O-N 3.06Å; C503-Q506 VanDerWaalsContact O-N 3.13Å; Q506-Y509 PolarHBondContact O-N 3.45Å; Q506-S510 WeakPolarHBondContact O-CB 3.37Å; Q506-S510 PolarHBondContact O-N 2.92Å; Q506-S510 PolarHBondContact O-OG 3.02Å
507	L	88.2	Confident	87.1	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-41.2	176.3	-68.9	177.5	0	0	0	111.3	K402 T492 E495 A496 C503 S510 V511	K402-L507 HydrophobicContact CB-CD2 4.27Å; K402-L507 HydrophobicContact CG-CD2 3.72Å; T492-L507 HydrophobicContact CG2-CB 4.14Å; T492-L507 HydrophobicContact CG2-CD2 4.02Å; E495-L507 HydrophobicContact CG-CD1 4.33Å; A496-L507 HydrophobicContact CB-CB 3.83Å; A496-L507 HydrophobicContact CB-CD1 4.12Å; C503-L507 WeakPolarHBondContact O-CB 3.28Å; C503-L507 WeakPolarHBondContact O-CG 3.42Å; C503-L507 PolarHBondContact O-N 3.42Å; L507-S510 WeakPolarHBondContact O-CB 3.44Å; L507-S510 PolarHBondContact O-N 3.03Å; L507-V511 PolarHBondContact O-N 2.82Å
508	F	89.6	Confident	87.8	Confident	1 Å²	1	38 Å²	38	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-57.9	-50.7	174.3	177.5	-91.6	0	0	0	111.9	L493 A504 V505 S510 V511 R512 L562 L566 A571 F573	L493-F508 HydrophobicContact CD2-CD2 3.83Å; A504-F508 VanDerWaalsContact O-CB 3.31Å; A504-F508 WeakPolarHBondContact O-CB 3.49Å; A504-F508 PolarHBondContact O-N 3.18Å; V505-F508 PolarHBondContact O-N 3.22Å; F508-S510 VanDerWaalsContact C-N 3.28Å; F508-S510 PolarHBondContact O-N 3.05Å; F508-V511 PolarHBondContact O-N 3.46Å; F508-R512 HydrophobicContact CE1-CG 4.18Å; F508-R512 HydrophobicContact CZ-CG 4.47Å; F508-R512 PolarHBondContact O-N 2.71Å; F508-R512 VanDerWaalsContact O-N 3.16Å; F508-L562 HydrophobicContact CD2-CD1 4.04Å; F508-L562 HydrophobicContact CE2-CD1 4.41Å; F508-L566 HydrophobicContact CB-CD1 4.18Å; F508-L566 HydrophobicContact CD1-CD2 4.2Å; F508-L566 HydrophobicContact CG-CD1 4.46Å; F508-L566 HydrophobicContact CG-CD2 4.41Å; F508-A571 HydrophobicContact CD2-CB 4.38Å; F508-A571 HydrophobicContact CE1-CB 4.34Å; F508-A571 HydrophobicContact CE2-CB 3.71Å; F508-A571 HydrophobicContact CZ-CB 3.72Å; F508-F573 HydrophobicContact CD2-CE2 4.28Å; F508-F573 HydrophobicContact CD2-CZ 4.07Å; F508-F573 HydrophobicContact CE2-CD2 4.39Å; F508-F573 AromaticContact CE2-CE2 3.42Å; F508-F573 HydrophobicContact CE2-CE2 3.42Å; F508-F573 VanDerWaalsContact CE2-CE2 3.42Å; F508-F573 AromaticContact CE2-CZ 3.51Å; F508-F573 HydrophobicContact CE2-CZ 3.51Å; F508-F573 AromaticContact CZ-CE2 3.88Å; F508-F573 HydrophobicContact CZ-CE2 3.88Å; F508-F573 AromaticContact CZ-CZ 3.85Å; F508-F573 HydrophobicContact CZ-CZ 3.85Å
509	Y	89.8	Confident	88.4	Confident	110 Å²	110	36.7 Å²	36.7	43%	0.431	18%	0.182	S	C	.	.	H	α-helix	trans	-66.8	-29.7	177	-78.5	-67	0	0	0	112.7	V505 Q506 V511 R512 N513	V505-Y509 HydrophobicContact CG1-CD2 3.78Å; V505-Y509 HydrophobicContact CG1-CE2 3.73Å; V505-Y509 VanDerWaalsContact O-CD2 3.23Å; V505-Y509 WeakPolarHBondContact O-CD2 3.33Å; V505-Y509 PolarHBondContact O-N 2.93Å; Q506-Y509 PolarHBondContact O-N 3.45Å; Y509-V511 VanDerWaalsContact C-N 3.34Å; Y509-R512 WeakPolarHBondContact O-CB 3.35Å; Y509-R512 PolarHBondContact O-N 2.66Å; Y509-N513 PolarHBondContact O-N 3.49Å; Y509-N513 PolarHBondContact O-ND2 2.91Å
510	S	92.3	Very high	89	Confident	7 Å²	7	40.3 Å²	40.3	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-64.5	-39	173	-69.6	0	0	0	0	112.3	C403 Q506 L507 F508 R512 N513 I514	C403-S510 WeakPolarHBondContact CB-OG 3.3Å; C403-S510 PolarHBondContact SG-OG 3.22Å; Q506-S510 WeakPolarHBondContact O-CB 3.37Å; Q506-S510 PolarHBondContact O-N 2.92Å; Q506-S510 PolarHBondContact O-OG 3.02Å; L507-S510 WeakPolarHBondContact O-CB 3.44Å; L507-S510 PolarHBondContact O-N 3.03Å; F508-S510 VanDerWaalsContact C-N 3.28Å; F508-S510 PolarHBondContact O-N 3.05Å; S510-R512 VanDerWaalsContact C-N 3.33Å; S510-R512 PolarHBondContact O-N 3.01Å; S510-N513 CarbonylContact O-C 3.56Å; S510-N513 WeakPolarHBondContact O-CA 3.07Å; S510-N513 WeakPolarHBondContact O-CB 3.43Å; S510-N513 PolarHBondContact O-N 3.4Å; S510-N513 VanDerWaalsContact O-N 3.12Å; S510-I514 WeakPolarHBondContact O-CG1 3.15Å; S510-I514 PolarHBondContact O-N 3.09Å
511	V	93.9	Very high	89.8	Confident	0 Å²	0	40 Å²	40	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-64.4	-39.1	172.7	174.7	0	0	0	0	111.5	A489 T492 L493 L507 F508 Y509 N513 I514 F515 F573	A489-V511 HydrophobicContact CB-CG1 3.73Å; T492-V511 HydrophobicContact CG2-CG2 3.53Å; L493-V511 HydrophobicContact CD1-CG1 4.28Å; L493-V511 HydrophobicContact CD2-CB 4.37Å; L493-V511 HydrophobicContact CD2-CG2 4.25Å; L493-V511 HydrophobicContact CG-CB 4.41Å; L493-V511 HydrophobicContact CG-CG1 4.28Å; L493-V511 HydrophobicContact CG-CG2 4.07Å; L507-V511 PolarHBondContact O-N 2.82Å; F508-V511 PolarHBondContact O-N 3.46Å; Y509-V511 VanDerWaalsContact C-N 3.34Å; V511-N513 VanDerWaalsContact C-N 3.31Å; V511-N513 PolarHBondContact O-N 2.86Å; V511-I514 HydrophobicContact CG2-CD1 4.38Å; V511-I514 WeakPolarHBondContact O-CB 3.46Å; V511-I514 PolarHBondContact O-N 3.41Å; V511-F515 HydrophobicContact CG1-CD2 4.24Å; V511-F515 HydrophobicContact CG1-CE2 3.58Å; V511-F515 HydrophobicContact CG1-CZ 4.41Å; V511-F515 WeakPolarHBondContact O-CD2 3.38Å; V511-F515 PolarHBondContact O-N 3.37Å; V511-F573 HydrophobicContact CB-CE1 4.41Å; V511-F573 HydrophobicContact CB-CZ 4.38Å; V511-F573 HydrophobicContact CG1-CE1 3.85Å; V511-F573 HydrophobicContact CG1-CZ 3.92Å
512	R	93.4	Very high	90.6	Very high	33 Å²	33	36.2 Å²	36.2	13%	0.125	18%	0.176	C	C	.	.	H	α-helix	trans	-60	-43	170.3	-68.8	-173.4	58.3	89	7.3	111.7	F508 Y509 S510 I514 F515 H516 T572 F573 D575	F508-R512 HydrophobicContact CE1-CG 4.18Å; F508-R512 HydrophobicContact CZ-CG 4.47Å; F508-R512 PolarHBondContact O-N 2.71Å; F508-R512 VanDerWaalsContact O-N 3.16Å; Y509-R512 WeakPolarHBondContact O-CB 3.35Å; Y509-R512 PolarHBondContact O-N 2.66Å; S510-R512 VanDerWaalsContact C-N 3.33Å; S510-R512 PolarHBondContact O-N 3.01Å; R512-I514 VanDerWaalsContact C-N 3.32Å; R512-I514 PolarHBondContact O-N 3.25Å; R512-F515 PolarHBondContact O-N 3.24Å; R512-F515 VanDerWaalsContact O-N 3.12Å; R512-H516 PolarHBondContact O-CD2 3.1Å; R512-H516 VanDerWaalsContact O-CD2 3.22Å; R512-H516 PolarHBondContact O-N 3.44Å; R512-T572 PolarHBondContact NH1-O 3.3Å; R512-F573 HydrophobicContact CB-CE1 4.33Å; R512-F573 HydrophobicContact CG-CD1 3.8Å; R512-F573 HydrophobicContact CG-CE1 3.33Å; R512-F573 HydrophobicContact CG-CZ 4.14Å; R512-D575 IonicContact CZ-OD1 3.18Å; R512-D575 IonicContact CZ-OD2 3.94Å; R512-D575 IonicContact NH1-OD1 3.84Å; R512-D575 PolarHBondContact NH1-OD1 3.43Å; R512-D575 IonicContact NH1-OD2 3.65Å; R512-D575 PolarHBondContact NH1-OD2 3.34Å; R512-D575 IonicContact NH2-OD1 3.15Å; R512-D575 IonicContact NH2-OD2 3.25Å; R512-D575 PolarHBondContact NH2-OD2 3.04Å
513	N	93.7	Very high	91.3	Very high	80 Å²	80	32.7 Å²	32.7	43%	0.428	16%	0.162	S	C	.	.	H	α-helix	trans	-63.5	-34.1	177.6	-68.7	-22.6	0	0	0	112.6	I407 Y509 S510 V511 F515 H516 L517	I407-N513 HydrophobicContact CD1-CB 3.81Å; Y509-N513 PolarHBondContact O-N 3.49Å; Y509-N513 PolarHBondContact O-ND2 2.91Å; S510-N513 CarbonylContact O-C 3.56Å; S510-N513 WeakPolarHBondContact O-CA 3.07Å; S510-N513 WeakPolarHBondContact O-CB 3.43Å; S510-N513 PolarHBondContact O-N 3.4Å; S510-N513 VanDerWaalsContact O-N 3.12Å; V511-N513 VanDerWaalsContact C-N 3.31Å; V511-N513 PolarHBondContact O-N 2.86Å; N513-F515 VanDerWaalsContact C-N 3.29Å; N513-F515 PolarHBondContact O-N 3.36Å; N513-H516 PolarHBondContact O-N 3.2Å; N513-L517 WeakPolarHBondContact O-CB 3.41Å; N513-L517 PolarHBondContact O-N 3.22Å
514	I	95.9	Very high	92	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-55.4	-47.5	171.5	-66.9	169.8	0	0	0	110.2	V406 I407 A410 M414 L485 L488 S510 V511 R512 L517 F518	V406-I514 HydrophobicContact CG1-CD1 3.52Å; V406-I514 HydrophobicContact CG1-CG1 4.14Å; I407-I514 HydrophobicContact CD1-CG1 4.14Å; A410-I514 HydrophobicContact CB-CB 4.42Å; A410-I514 HydrophobicContact CB-CD1 4.49Å; A410-I514 HydrophobicContact CB-CG1 3.9Å; A410-I514 HydrophobicContact CB-CG2 3.98Å; M414-I514 HydrophobicContact CE-CG2 3.96Å; M414-I514 WeakPolarHBondContact CE-O 3.29Å; L485-I514 HydrophobicContact CD1-CG2 3.59Å; L485-I514 HydrophobicContact CD2-CG2 4.24Å; L485-I514 HydrophobicContact CG-CG2 3.91Å; L488-I514 HydrophobicContact CD2-CD1 4.48Å; S510-I514 WeakPolarHBondContact O-CG1 3.15Å; S510-I514 PolarHBondContact O-N 3.09Å; V511-I514 HydrophobicContact CG2-CD1 4.38Å; V511-I514 WeakPolarHBondContact O-CB 3.46Å; V511-I514 PolarHBondContact O-N 3.41Å; R512-I514 VanDerWaalsContact C-N 3.32Å; R512-I514 PolarHBondContact O-N 3.25Å; I514-L517 PolarHBondContact O-N 3.33Å; I514-F518 PolarHBondContact O-N 3.2Å
515	F	96.1	Very high	92.5	Very high	1 Å²	1	44.6 Å²	44.6	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-73.4	-36.9	-177.1	-64.5	-56.1	0	0	0	113.1	M486 A489 V511 R512 N513 L517 F518 H519 I547 L551 L554 F573 L576 F580	M486-F515 HydrophobicContact CE-CZ 3.95Å; M486-F515 HydrophobicContact SD-CE1 4.19Å; M486-F515 HydrophobicContact SD-CZ 3.89Å; A489-F515 HydrophobicContact CB-CE2 4.25Å; A489-F515 HydrophobicContact CB-CZ 3.77Å; V511-F515 HydrophobicContact CG1-CD2 4.24Å; V511-F515 HydrophobicContact CG1-CE2 3.58Å; V511-F515 HydrophobicContact CG1-CZ 4.41Å; V511-F515 WeakPolarHBondContact O-CD2 3.38Å; V511-F515 PolarHBondContact O-N 3.37Å; R512-F515 PolarHBondContact O-N 3.24Å; R512-F515 VanDerWaalsContact O-N 3.12Å; N513-F515 VanDerWaalsContact C-N 3.29Å; N513-F515 PolarHBondContact O-N 3.36Å; F515-L517 VanDerWaalsContact C-N 3.32Å; F515-F518 PolarHBondContact O-N 3.23Å; F515-H519 PolarHBondContact O-N 3.05Å; F515-I547 HydrophobicContact CD1-CG2 3.81Å; F515-I547 HydrophobicContact CE1-CG2 3.82Å; F515-L551 HydrophobicContact CD1-CD2 4.39Å; F515-L551 HydrophobicContact CD2-CD2 3.69Å; F515-L551 HydrophobicContact CE1-CD2 4.17Å; F515-L551 HydrophobicContact CE2-CD2 3.41Å; F515-L551 VanDerWaalsContact CE2-CD2 3.41Å; F515-L551 HydrophobicContact CG-CD2 4.19Å; F515-L551 HydrophobicContact CZ-CD2 3.69Å; F515-L554 HydrophobicContact CE2-CD2 4.14Å; F515-L554 HydrophobicContact CZ-CD2 4.46Å; F515-F573 HydrophobicContact CD2-CD1 4.19Å; F515-F573 HydrophobicContact CD2-CE1 4.31Å; F515-F573 HydrophobicContact CE2-CD1 4.33Å; F515-F573 HydrophobicContact CE2-CE1 4.3Å; F515-L576 HydrophobicContact CB-CD1 3.94Å; F515-L576 HydrophobicContact CD2-CD1 4.5Å; F515-F580 HydrophobicContact CB-CE2 3.87Å; F515-F580 HydrophobicContact CB-CZ 3.81Å; F515-F580 HydrophobicContact CD1-CZ 4.02Å; F515-F580 HydrophobicContact CG-CE2 4.48Å; F515-F580 HydrophobicContact CG-CZ 4.33Å; F515-F580 WeakPolarHBondContact O-CZ 3.36Å
516	H	94.4	Very high	92.9	Very high	82 Å²	82	43.2 Å²	43.2	38%	0.38	21%	0.212	S	C	.	.	H	α-helix	trans	-60.3	-44.9	169.6	-74.8	-60.7	0	0	0	111.4	R512 N513 F518 H519 D520 L576	R512-H516 PolarHBondContact O-CD2 3.1Å; R512-H516 VanDerWaalsContact O-CD2 3.22Å; R512-H516 PolarHBondContact O-N 3.44Å; N513-H516 PolarHBondContact O-N 3.2Å; H516-F518 VanDerWaalsContact C-N 3.33Å; H516-F518 PolarHBondContact O-N 2.98Å; H516-H519 WeakPolarHBondContact O-CB 3.31Å; H516-H519 PolarHBondContact O-N 3.04Å; H516-H519 VanDerWaalsContact O-N 3.16Å; H516-D520 PolarHBondContact O-N 3.3Å; H516-L576 WeakPolarHBondContact CE1-CD2 3.29Å
517	L	95	Very high	93.2	Very high	34 Å²	34	46.7 Å²	46.7	18%	0.178	23%	0.226	C	C	.	.	H	α-helix	trans	-64.9	-37.6	179.2	-170.2	67.8	0	0	0	112.2	I407 R411 M414 N513 I514 F515 H519 D520 V521	I407-L517 HydrophobicContact CG2-CD2 4.17Å; R411-L517 HydrophobicContact CG-CD2 3.39Å; R411-L517 HydrophobicContact CG-CG 4.41Å; M414-L517 HydrophobicContact CE-CB 4.09Å; M414-L517 HydrophobicContact CE-CD2 4.23Å; M414-L517 HydrophobicContact CE-CG 4.26Å; M414-L517 HydrophobicContact SD-CB 4.17Å; M414-L517 HydrophobicContact SD-CD2 4.07Å; M414-L517 HydrophobicContact SD-CG 3.83Å; N513-L517 WeakPolarHBondContact O-CB 3.41Å; N513-L517 PolarHBondContact O-N 3.22Å; I514-L517 PolarHBondContact O-N 3.33Å; F515-L517 VanDerWaalsContact C-N 3.32Å; L517-H519 VanDerWaalsContact C-N 3.28Å; L517-H519 PolarHBondContact O-N 3.3Å; L517-D520 PolarHBondContact O-N 2.99Å; L517-V521 HydrophobicContact CD1-CG2 3.53Å; L517-V521 HydrophobicContact CG-CG2 3.76Å; L517-V521 VanDerWaalsContact O-CB 3.29Å; L517-V521 WeakPolarHBondContact O-CB 3.42Å; L517-V521 VanDerWaalsContact O-CG2 3.31Å; L517-V521 WeakPolarHBondContact O-CG2 3.31Å; L517-V521 PolarHBondContact O-N 2.92Å
518	F	96.3	Very high	93.4	Very high	4 Å²	4	52.4 Å²	52.4	2%	0.018	25%	0.252	C	S	.	.	H	α-helix	trans	-56.8	-45.4	173.6	-176.3	-82.2	0	0	0	111.5	M414 V482 L485 I514 F515 H516 D520 V522 P523 I547 F580 L583	M414-F518 HydrophobicContact CE-CB 3.94Å; M414-F518 HydrophobicContact CG-CD2 4.1Å; M414-F518 HydrophobicContact SD-CB 4.27Å; V482-F518 HydrophobicContact CG2-CE2 3.7Å; V482-F518 HydrophobicContact CG2-CZ 4.13Å; L485-F518 HydrophobicContact CD2-CD2 3.55Å; L485-F518 HydrophobicContact CD2-CE2 4.19Å; L485-F518 HydrophobicContact CD2-CG 4.42Å; I514-F518 PolarHBondContact O-N 3.2Å; F515-F518 PolarHBondContact O-N 3.23Å; H516-F518 VanDerWaalsContact C-N 3.33Å; H516-F518 PolarHBondContact O-N 2.98Å; F518-D520 PolarHBondContact O-N 3.37Å; F518-V522 HydrophobicContact CD1-CG2 4.4Å; F518-V522 HydrophobicContact CD2-CG2 3.64Å; F518-V522 HydrophobicContact CE1-CB 4.36Å; F518-V522 HydrophobicContact CE1-CG2 4.39Å; F518-V522 HydrophobicContact CE2-CB 4.35Å; F518-V522 HydrophobicContact CE2-CG2 3.6Å; F518-V522 HydrophobicContact CG-CG2 4.07Å; F518-V522 HydrophobicContact CZ-CB 4.26Å; F518-V522 HydrophobicContact CZ-CG1 4.19Å; F518-V522 HydrophobicContact CZ-CG2 4.01Å; F518-V522 PolarHBondContact O-N 3.48Å; F518-P523 WeakPolarHBondContact O-CD 3.41Å; F518-I547 HydrophobicContact CD1-CD1 4.3Å; F518-I547 HydrophobicContact CD2-CD1 4.2Å; F518-I547 HydrophobicContact CE1-CD1 4.03Å; F518-I547 HydrophobicContact CE2-CD1 3.93Å; F518-I547 HydrophobicContact CG-CD1 4.37Å; F518-I547 HydrophobicContact CZ-CD1 3.83Å; F518-F580 HydrophobicContact CB-CE1 4.39Å; F518-F580 HydrophobicContact CB-CZ 4.34Å; F518-F580 HydrophobicContact CD1-CD1 4.27Å; F518-F580 AromaticContact CD1-CE1 3.39Å; F518-F580 HydrophobicContact CD1-CE1 3.39Å; F518-F580 HydrophobicContact CD1-CZ 4.12Å; F518-F580 HydrophobicContact CE1-CD1 4.39Å; F518-F580 AromaticContact CE1-CE1 3.86Å; F518-F580 HydrophobicContact CE1-CE1 3.86Å; F518-F580 HydrophobicContact CG-CE1 4.06Å; F518-F580 HydrophobicContact CG-CZ 4.49Å; F518-L583 HydrophobicContact CE1-CD2 4.4Å
519	H	92.6	Very high	93.5	Very high	73 Å²	73	55.9 Å²	55.9	34%	0.338	27%	0.271	S	S	.	.	H	α-helix	trans	-59.5	-33.1	-177.7	-174.6	-79.5	0	0	0	112.2	F515 H516 L517 P523	F515-H519 PolarHBondContact O-N 3.05Å; H516-H519 WeakPolarHBondContact O-CB 3.31Å; H516-H519 PolarHBondContact O-N 3.04Å; H516-H519 VanDerWaalsContact O-N 3.16Å; L517-H519 VanDerWaalsContact C-N 3.28Å; L517-H519 PolarHBondContact O-N 3.3Å; H519-P523 VanDerWaalsContact O-CD 3.28Å; H519-P523 WeakPolarHBondContact O-CD 3.35Å; H519-P523 VanDerWaalsContact O-CG 3.26Å; H519-P523 WeakPolarHBondContact O-CG 3.49Å
520	D	91.8	Very high	93.7	Very high	99 Å²	99	51.1 Å²	51.1	53%	0.529	25%	0.253	S	S	.	.	H	α-helix	trans	-96.1	-40	-177	-60.5	-26.4	0	0	0	112.7	H516 L517 F518 T524	H516-D520 PolarHBondContact O-N 3.3Å; L517-D520 PolarHBondContact O-N 2.99Å; F518-D520 PolarHBondContact O-N 3.37Å; D520-T524 VanDerWaalsContact O-CB 3.28Å; D520-T524 WeakPolarHBondContact O-CB 3.46Å; D520-T524 PolarHBondContact O-OG1 3.45Å
521	V	94.3	Very high	93.6	Very high	36 Å²	36	56.5 Å²	56.5	22%	0.218	28%	0.277	C	S	.	.	H	α-helix	trans	-77.6	-48.8	-173	174.8	0	0	0	0	112.1	M414 T415 L517 T524 Y525	M414-V521 HydrophobicContact CB-CG1 4.04Å; M414-V521 HydrophobicContact SD-CB 4.25Å; T415-V521 HydrophobicContact CG2-CG1 4.25Å; L517-V521 HydrophobicContact CD1-CG2 3.53Å; L517-V521 HydrophobicContact CG-CG2 3.76Å; L517-V521 VanDerWaalsContact O-CB 3.29Å; L517-V521 WeakPolarHBondContact O-CB 3.42Å; L517-V521 VanDerWaalsContact O-CG2 3.31Å; L517-V521 WeakPolarHBondContact O-CG2 3.31Å; L517-V521 PolarHBondContact O-N 2.92Å; V521-T524 PolarHBondContact O-N 3.26Å; V521-Y525 VanDerWaalsContact O-CB 3.28Å; V521-Y525 WeakPolarHBondContact O-CB 3.23Å; V521-Y525 PolarHBondContact O-N 2.91Å
522	V	94.7	Very high	93.5	Very high	5 Å²	5	63 Å²	63	3%	0.03	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-47.3	-172.2	174.5	0	0	0	0	112.2	M414 F518 T524 H526	M414-V522 HydrophobicContact CB-CG2 3.77Å; M414-V522 HydrophobicContact CG-CG2 3.93Å; F518-V522 HydrophobicContact CD1-CG2 4.4Å; F518-V522 HydrophobicContact CD2-CG2 3.64Å; F518-V522 HydrophobicContact CE1-CB 4.36Å; F518-V522 HydrophobicContact CE1-CG2 4.39Å; F518-V522 HydrophobicContact CE2-CB 4.35Å; F518-V522 HydrophobicContact CE2-CG2 3.6Å; F518-V522 HydrophobicContact CG-CG2 4.07Å; F518-V522 HydrophobicContact CZ-CB 4.26Å; F518-V522 HydrophobicContact CZ-CG1 4.19Å; F518-V522 HydrophobicContact CZ-CG2 4.01Å; F518-V522 PolarHBondContact O-N 3.48Å; V522-T524 VanDerWaalsContact C-N 3.27Å; V522-T524 PolarHBondContact O-N 2.7Å; V522-H526 WeakPolarHBondContact O-CB 3.5Å; V522-H526 PolarHBondContact O-CD2 3.32Å; V522-H526 PolarHBondContact O-N 3.49Å
523	P	91.8	Very high	93.5	Very high	33 Å²	33	65.5 Å²	65.5	21%	0.214	32%	0.321	C	S	.	.	H	α-helix	trans	-67.4	-29.7	179.2	-21.2	36.1	0	0	0	112.7	F518 H519 K527 L583	F518-P523 WeakPolarHBondContact O-CD 3.41Å; H519-P523 VanDerWaalsContact O-CD 3.28Å; H519-P523 WeakPolarHBondContact O-CD 3.35Å; H519-P523 VanDerWaalsContact O-CG 3.26Å; H519-P523 WeakPolarHBondContact O-CG 3.49Å; P523-K527 WeakPolarHBondContact O-CA 3.49Å; P523-K527 VanDerWaalsContact O-CB 3.29Å; P523-K527 WeakPolarHBondContact O-CB 3.25Å; P523-K527 PolarHBondContact O-N 3.14Å; P523-L583 HydrophobicContact CB-CD1 4.22Å; P523-L583 HydrophobicContact CG-CD1 3.5Å; P523-L583 HydrophobicContact CG-CD2 3.92Å; P523-L583 HydrophobicContact CG-CG 4.18Å
524	T	92.9	Very high	93.6	Very high	107 Å²	107	63 Å²	63	66%	0.656	31%	0.309	S	S	*	.	H	α-helix	trans	-76.5	-50.2	179.8	-56.7	0	0	0	0	111.3	D520 V521 V522	D520-T524 VanDerWaalsContact O-CB 3.28Å; D520-T524 WeakPolarHBondContact O-CB 3.46Å; D520-T524 PolarHBondContact O-OG1 3.45Å; V521-T524 PolarHBondContact O-N 3.26Å; V522-T524 VanDerWaalsContact C-N 3.27Å; V522-T524 PolarHBondContact O-N 2.7Å
525	Y	94	Very high	93.5	Very high	146 Å²	146	67.2 Å²	67.2	57%	0.573	33%	0.329	S	S	*	.	H	α-helix	trans	-70	-42.5	-176.7	-174.1	-91.2	0	0	0	112.1	T415 V521	T415-Y525 HydrophobicContact CG2-CD2 4.15Å; T415-Y525 HydrophobicContact CG2-CE2 4.24Å; T415-Y525 HydrophobicContact CG2-CG 4.33Å; T415-Y525 WeakPolarHBondContact O-CE1 3.33Å; V521-Y525 VanDerWaalsContact O-CB 3.28Å; V521-Y525 WeakPolarHBondContact O-CB 3.23Å; V521-Y525 PolarHBondContact O-N 2.91Å
526	H	93.6	Very high	93.5	Very high	7 Å²	7	68 Å²	68	3%	0.032	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	10.5	-176.8	-62	-79.3	0	0	0	113.7	M414 S416 I418 V522 E528 N529 L530	M414-H526 PolarHBondContact O-NE2 3.13Å; S416-H526 PolarHBondContact O-CE1 3.13Å; S416-H526 VanDerWaalsContact O-CE1 3.26Å; S416-H526 PolarHBondContact O-NE2 3.29Å; I418-H526 HydrophobicContact CD1-CB 3.89Å; I418-H526 VanDerWaalsContact CD1-CG 3.48Å; V522-H526 WeakPolarHBondContact O-CB 3.5Å; V522-H526 PolarHBondContact O-CD2 3.32Å; V522-H526 PolarHBondContact O-N 3.49Å; H526-E528 VanDerWaalsContact C-N 3.34Å; H526-E528 PolarHBondContact O-N 3.11Å; H526-N529 PolarHBondContact O-N 3.45Å; H526-L530 HydrophobicContact CB-CD1 4.07Å; H526-L530 HydrophobicContact CB-CG 4.01Å; H526-L530 WeakPolarHBondContact O-CG 3.34Å; H526-L530 PolarHBondContact O-N 2.9Å
527	K	92.7	Very high	93.5	Very high	123 Å²	123	64 Å²	64	54%	0.535	32%	0.315	S	S	.	.	H	α-helix	trans	-47.8	-51.2	-172	-172.4	176.7	177.9	-179.9	0	113.5	P523 Q531	P523-K527 WeakPolarHBondContact O-CA 3.49Å; P523-K527 VanDerWaalsContact O-CB 3.29Å; P523-K527 WeakPolarHBondContact O-CB 3.25Å; P523-K527 PolarHBondContact O-N 3.14Å; K527-Q531 VanDerWaalsContact O-CG 3.3Å; K527-Q531 WeakPolarHBondContact O-CG 3.29Å; K527-Q531 PolarHBondContact O-N 3.06Å; K527-Q531 VanDerWaalsContact O-N 3.11Å
528	E	92.4	Very high	93.6	Very high	119 Å²	119	62.4 Å²	62.4	56%	0.556	31%	0.306	S	S	*	.	H	α-helix	trans	-65.4	-43.1	-178.2	-67.4	-162.4	-168.3	0	0	112.5	H526 Q531 K532	H526-E528 VanDerWaalsContact C-N 3.34Å; H526-E528 PolarHBondContact O-N 3.11Å; E528-Q531 PolarHBondContact O-N 3.19Å; E528-K532 WeakPolarHBondContact O-CB 3.36Å; E528-K532 VanDerWaalsContact O-CG 3.29Å; E528-K532 WeakPolarHBondContact O-CG 3.3Å; E528-K532 PolarHBondContact O-N 2.94Å; E528-K532 IonicContact OE2-NZ 2.86Å; E528-K532 PolarHBondContact OE2-NZ 2.72Å
529	N	92.3	Very high	93.6	Very high	74 Å²	74	62.2 Å²	62.2	40%	0.396	31%	0.305	S	S	.	.	H	α-helix	trans	-66	-41.4	-179	-69.6	-20	0	0	0	111	H526 Q531 K532 L533 L536	H526-N529 PolarHBondContact O-N 3.45Å; N529-Q531 VanDerWaalsContact C-N 3.31Å; N529-Q531 PolarHBondContact O-N 2.78Å; N529-K532 PolarHBondContact O-N 2.72Å; N529-L533 WeakPolarHBondContact O-CB 3.45Å; N529-L533 PolarHBondContact O-N 2.84Å; N529-L536 HydrophobicContact CB-CD1 3.91Å
530	L	93.4	Very high	93.8	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.052	29%	0.29	C	S	.	.	H	α-helix	trans	-65.7	-32.2	176.6	-66.4	176.2	0	0	0	112.5	I418 H526 L536 H540	I418-L530 HydrophobicContact CD1-CD2 4.33Å; H526-L530 HydrophobicContact CB-CD1 4.07Å; H526-L530 HydrophobicContact CB-CG 4.01Å; H526-L530 WeakPolarHBondContact O-CG 3.34Å; H526-L530 PolarHBondContact O-N 2.9Å; L530-L536 HydrophobicContact CD2-CB 4.21Å; L530-H540 HydrophobicContact CD2-CB 3.62Å
531	Q	91.4	Very high	94.1	Very high	120 Å²	120	54.7 Å²	54.7	56%	0.561	27%	0.267	S	S	*	.	H	α-helix	trans	-80.3	-34.8	176.9	-72.7	179.3	-12.2	0	0	113.3	K527 E528 N529 Q591	K527-Q531 VanDerWaalsContact O-CG 3.3Å; K527-Q531 WeakPolarHBondContact O-CG 3.29Å; K527-Q531 PolarHBondContact O-N 3.06Å; K527-Q531 VanDerWaalsContact O-N 3.11Å; E528-Q531 PolarHBondContact O-N 3.19Å; N529-Q531 VanDerWaalsContact C-N 3.31Å; N529-Q531 PolarHBondContact O-N 2.78Å; Q531-Q591 PolarHBondContact O-OE1 3.01Å; Q531-Q591 VanDerWaalsContact O-OE1 3.13Å
532	K	90.9	Very high	94.2	Very high	137 Å²	137	53 Å²	53	60%	0.596	26%	0.257	S	S	*	.	H	α-helix	trans	-85.9	-35.2	-175.6	-70.7	169.9	-179.9	166.9	0	112.7	E528 N529 P534	E528-K532 WeakPolarHBondContact O-CB 3.36Å; E528-K532 VanDerWaalsContact O-CG 3.29Å; E528-K532 WeakPolarHBondContact O-CG 3.3Å; E528-K532 PolarHBondContact O-N 2.94Å; E528-K532 IonicContact OE2-NZ 2.86Å; E528-K532 PolarHBondContact OE2-NZ 2.72Å; N529-K532 PolarHBondContact O-N 2.72Å; K532-P534 WeakPolarHBondContact O-CD 3.32Å
533	L	94.1	Very high	94.3	Very high	85 Å²	85	52.9 Å²	52.9	45%	0.445	26%	0.256	S	S	.	.			trans	-110	108.7	-168.8	-59.9	175.1	0	0	0	111.6	N529 Q535 L536 A537	N529-L533 WeakPolarHBondContact O-CB 3.45Å; N529-L533 PolarHBondContact O-N 2.84Å; L533-Q535 PolarHBondContact O-N 3.43Å; L533-L536 HydrophobicContact CB-CB 4.27Å; L533-L536 HydrophobicContact CB-CD1 4.08Å; L533-L536 HydrophobicContact CB-CG 4.01Å; L533-L536 HydrophobicContact CD1-CD1 3.56Å; L533-L536 HydrophobicContact CD1-CG 4.2Å; L533-L536 HydrophobicContact CG-CD1 4.42Å; L533-L536 PolarHBondContact O-N 3.15Å; L533-L536 VanDerWaalsContact O-N 3.15Å; L533-A537 PolarHBondContact O-N 3.08Å
534	P	94.4	Very high	94.5	Very high	28 Å²	28	51.3 Å²	51.3	18%	0.182	25%	0.246	C	C	.	.	H	α-helix	trans	-59.7	-31.4	-177.2	-16.2	21.4	0	0	0	114.4	K532 A538 Q591 L635 V638 W639	K532-P534 WeakPolarHBondContact O-CD 3.32Å; P534-A538 PolarHBondContact O-N 2.94Å; P534-Q591 HydrophobicContact CB-CG 4.2Å; P534-Q591 VanDerWaalsContact CG-NE2 3.33Å; P534-L635 HydrophobicContact CB-CD1 3.63Å; P534-L635 HydrophobicContact CG-CD1 4.01Å; P534-V638 HydrophobicContact CB-CG1 4.44Å; P534-W639 HydrophobicContact CB-CZ2 4.34Å; P534-W639 PolarHBondContact O-NE1 3.29Å
535	Q	94.6	Very high	94.7	Very high	88 Å²	88	48.5 Å²	48.5	41%	0.411	23%	0.226	S	C	.	.	H	α-helix	trans	-65.6	-45.4	178.4	-160.9	-179.4	2.3	0	0	111.5	L533 A538 I539 V638 V642	L533-Q535 PolarHBondContact O-N 3.43Å; Q535-A538 WeakPolarHBondContact O-CB 3.42Å; Q535-A538 PolarHBondContact O-N 2.91Å; Q535-I539 HydrophobicContact CG-CD1 4.03Å; Q535-I539 WeakPolarHBondContact O-CG1 3.47Å; Q535-I539 PolarHBondContact O-N 2.95Å; Q535-V638 HydrophobicContact CB-CG1 3.56Å; Q535-V638 HydrophobicContact CG-CG1 4.02Å; Q535-V642 HydrophobicContact CG-CG2 4.39Å
536	L	95	Very high	94.7	Very high	17 Å²	17	41.9 Å²	41.9	9%	0.089	20%	0.2	C	C	.	.	H	α-helix	trans	-69.4	-36	-177.1	-62.4	-174.2	0	0	0	111.6	I418 N529 L530 L533 A538 I539 H540	I418-L536 HydrophobicContact CB-CD2 4.17Å; I418-L536 HydrophobicContact CG2-CD2 4.14Å; N529-L536 HydrophobicContact CB-CD1 3.91Å; L530-L536 HydrophobicContact CD2-CB 4.21Å; L533-L536 HydrophobicContact CB-CB 4.27Å; L533-L536 HydrophobicContact CB-CD1 4.08Å; L533-L536 HydrophobicContact CB-CG 4.01Å; L533-L536 HydrophobicContact CD1-CD1 3.56Å; L533-L536 HydrophobicContact CD1-CG 4.2Å; L533-L536 HydrophobicContact CG-CD1 4.42Å; L533-L536 PolarHBondContact O-N 3.15Å; L533-L536 VanDerWaalsContact O-N 3.15Å; L536-A538 VanDerWaalsContact C-N 3.32Å; L536-A538 PolarHBondContact O-N 3Å; L536-I539 HydrophobicContact CD2-CD1 4.16Å; L536-I539 PolarHBondContact O-N 3.06Å; L536-H540 WeakPolarHBondContact O-CB 3.42Å; L536-H540 PolarHBondContact O-N 3.12Å
537	A	96.1	Very high	94.9	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-41.6	172.2	0	0	0	0	0	112	L533 H540 H541 Q591	L533-A537 PolarHBondContact O-N 3.08Å; A537-H540 PolarHBondContact O-N 3.26Å; A537-H541 PolarHBondContact O-N 3.49Å; A537-Q591 HydrophobicContact CB-CB 3.85Å; A537-Q591 HydrophobicContact CB-CG 4Å
538	A	96.5	Very high	95	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-67.5	-41.8	175.8	0	0	0	0	0	112.3	P534 Q535 L536 H541 N542 F588 V642 L643	P534-A538 PolarHBondContact O-N 2.94Å; Q535-A538 WeakPolarHBondContact O-CB 3.42Å; Q535-A538 PolarHBondContact O-N 2.91Å; L536-A538 VanDerWaalsContact C-N 3.32Å; L536-A538 PolarHBondContact O-N 3Å; A538-H541 WeakPolarHBondContact O-CB 3.44Å; A538-H541 PolarHBondContact O-N 2.88Å; A538-N542 PolarHBondContact O-N 2.97Å; A538-N542 VanDerWaalsContact O-N 3.09Å; A538-F588 HydrophobicContact CB-CD2 4.43Å; A538-F588 HydrophobicContact CB-CE2 4.13Å; A538-V642 HydrophobicContact CB-CG1 3.92Å; A538-L643 HydrophobicContact CB-CD1 4.37Å; A538-L643 HydrophobicContact CB-CD2 3.8Å; A538-L643 HydrophobicContact CB-CG 4Å
539	I	96.5	Very high	95	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.5	-43.8	174.8	-66.6	160	0	0	0	110.4	I418 T421 Q535 L536 H541 N542 N543 V642	I418-I539 HydrophobicContact CG2-CB 4.27Å; I418-I539 HydrophobicContact CG2-CG2 3.68Å; T421-I539 HydrophobicContact CG2-CD1 3.48Å; T421-I539 VanDerWaalsContact CG2-CD1 3.48Å; T421-I539 HydrophobicContact CG2-CG1 4.03Å; T421-I539 HydrophobicContact CG2-CG2 4.38Å; Q535-I539 HydrophobicContact CG-CD1 4.03Å; Q535-I539 WeakPolarHBondContact O-CG1 3.47Å; Q535-I539 PolarHBondContact O-N 2.95Å; L536-I539 HydrophobicContact CD2-CD1 4.16Å; L536-I539 PolarHBondContact O-N 3.06Å; I539-H541 VanDerWaalsContact C-N 3.33Å; I539-H541 PolarHBondContact O-N 3.19Å; I539-N542 PolarHBondContact O-N 3.31Å; I539-N543 WeakPolarHBondContact O-CB 3.45Å; I539-N543 PolarHBondContact O-N 2.92Å; I539-N543 PolarHBondContact O-OD1 3.08Å; I539-V642 HydrophobicContact CG1-CG1 3.79Å
540	H	96.5	Very high	95	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-64.5	-37.4	178.5	-177.7	68	0	0	0	112.5	L530 L536 A537 N543 C544	L530-H540 HydrophobicContact CD2-CB 3.62Å; L536-H540 WeakPolarHBondContact O-CB 3.42Å; L536-H540 PolarHBondContact O-N 3.12Å; A537-H540 PolarHBondContact O-N 3.26Å; H540-N543 WeakPolarHBondContact O-CB 3.3Å; H540-N543 PolarHBondContact O-N 3.28Å; H540-C544 PolarHBondContact O-N 3.01Å; H540-C544 PolarHBondContact O-SG 3.26Å
541	H	97.1	Very high	94.9	Very high	12 Å²	12	30.1 Å²	30.1	6%	0.056	14%	0.144	C	C	.	.	H	α-helix	trans	-55.9	-51.8	170.1	178.7	80.3	0	0	0	111.4	A537 A538 I539 N543 C544 M545 G584 F588	A537-H541 PolarHBondContact O-N 3.49Å; A538-H541 WeakPolarHBondContact O-CB 3.44Å; A538-H541 PolarHBondContact O-N 2.88Å; I539-H541 VanDerWaalsContact C-N 3.33Å; I539-H541 PolarHBondContact O-N 3.19Å; H541-N543 PolarHBondContact O-N 3.2Å; H541-C544 PolarHBondContact O-N 3.46Å; H541-M545 WeakPolarHBondContact CE1-CE 3.26Å; H541-M545 WeakPolarHBondContact O-CG 3.32Å; H541-M545 PolarHBondContact O-N 3.48Å; H541-G584 PolarHBondContact ND1-O 2.9Å; H541-G584 VanDerWaalsContact ND1-O 3.08Å; H541-F588 HydrophobicContact CB-CB 4.03Å; H541-F588 HydrophobicContact CB-CG 4.43Å
542	N	96.6	Very high	94.9	Very high	2 Å²	2	27.9 Å²	27.9	1%	0.011	14%	0.136	C	C	.	.	H	α-helix	trans	-63.4	-40.9	178.6	-67.1	-16.5	0	0	0	112.4	C476 R477 I478 A538 I539 C544 M545 Y546 V642	C476-N542 HydrophobicContact CB-CB 4.44Å; R477-N542 VanDerWaalsContact O-CB 3.28Å; R477-N542 WeakPolarHBondContact O-CB 3.29Å; R477-N542 PolarHBondContact O-ND2 3.41Å; I478-N542 HydrophobicContact CG2-CB 4.17Å; A538-N542 PolarHBondContact O-N 2.97Å; A538-N542 VanDerWaalsContact O-N 3.09Å; I539-N542 PolarHBondContact O-N 3.31Å; N542-C544 VanDerWaalsContact C-N 3.29Å; N542-C544 PolarHBondContact O-N 3.18Å; N542-M545 PolarHBondContact O-N 3.37Å; N542-Y546 VanDerWaalsContact O-CB 3.26Å; N542-Y546 WeakPolarHBondContact O-CB 3.3Å; N542-Y546 PolarHBondContact O-N 2.79Å; N542-V642 PolarHBondContact ND2-O 2.78Å
543	N	96.6	Very high	94.6	Very high	2 Å²	2	24.4 Å²	24.4	1%	0.011	13%	0.126	C	C	.	.	H	α-helix	trans	-54.2	-47.3	174.9	-75.9	-4.6	0	0	0	111.1	I478 S479 V482 I539 H540 H541 Y546 I547	I478-N543 WeakPolarHBondContact CA-OD1 3.33Å; I478-N543 VanDerWaalsContact CB-OD1 3.22Å; I478-N543 WeakPolarHBondContact CB-OD1 3.39Å; S479-N543 PolarHBondContact N-OD1 2.87Å; S479-N543 PolarHBondContact OG-ND2 3.43Å; V482-N543 HydrophobicContact CB-CB 4.4Å; V482-N543 HydrophobicContact CG1-CB 4.22Å; V482-N543 HydrophobicContact CG2-CB 3.94Å; V482-N543 WeakPolarHBondContact CG2-ND2 3.33Å; I539-N543 WeakPolarHBondContact O-CB 3.45Å; I539-N543 PolarHBondContact O-N 2.92Å; I539-N543 PolarHBondContact O-OD1 3.08Å; H540-N543 WeakPolarHBondContact O-CB 3.3Å; H540-N543 PolarHBondContact O-N 3.28Å; H541-N543 PolarHBondContact O-N 3.2Å; N543-Y546 PolarHBondContact O-N 3.37Å; N543-I547 VanDerWaalsContact O-CG1 3.32Å; N543-I547 WeakPolarHBondContact O-CG1 3.5Å; N543-I547 PolarHBondContact O-N 3.28Å
544	C	97.4	Very high	94.3	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-66.6	-40.7	178.7	-66.7	0	0	0	0	112.1	H540 H541 N542 Y546 A548 F580	H540-C544 PolarHBondContact O-N 3.01Å; H540-C544 PolarHBondContact O-SG 3.26Å; H541-C544 PolarHBondContact O-N 3.46Å; N542-C544 VanDerWaalsContact C-N 3.29Å; N542-C544 PolarHBondContact O-N 3.18Å; C544-Y546 VanDerWaalsContact C-N 3.34Å; C544-A548 WeakPolarHBondContact O-CB 3.38Å; C544-A548 PolarHBondContact O-N 2.98Å; C544-F580 VanDerWaalsContact CB-O 3.31Å; C544-F580 WeakPolarHBondContact CB-O 3.46Å
545	M	96.3	Very high	93.8	Very high	48 Å²	48	19.3 Å²	19.3	24%	0.236	10%	0.099	C	C	.	.	H	α-helix	trans	-66.5	-37.2	176.5	-66.4	-57.8	173.1	0	0	112.2	H541 N542 H549 R581 T585	H541-M545 WeakPolarHBondContact CE1-CE 3.26Å; H541-M545 WeakPolarHBondContact O-CG 3.32Å; H541-M545 PolarHBondContact O-N 3.48Å; N542-M545 PolarHBondContact O-N 3.37Å; M545-H549 VanDerWaalsContact O-CB 3.3Å; M545-H549 WeakPolarHBondContact O-CB 3.37Å; M545-H549 PolarHBondContact O-N 3.03Å; M545-R581 HydrophobicContact CE-CB 4.42Å; M545-R581 HydrophobicContact SD-CB 4.45Å; M545-R581 HydrophobicContact SD-CG 3.94Å; M545-T585 WeakPolarHBondContact CE-OG1 3.18Å
546	Y	95.2	Very high	93.2	Very high	6 Å²	6	21.8 Å²	21.8	2%	0.024	11%	0.111	C	C	.	.	H	α-helix	trans	-64.5	-51.1	175.6	178.5	-99.5	0	0	0	111.4	I424 I430 L473 I478 V482 M486 N542 N543 C544 A548 H549 H550	I424-Y546 HydrophobicContact CD1-CE2 4.16Å; I424-Y546 HydrophobicContact CG1-CD2 4.27Å; I424-Y546 HydrophobicContact CG1-CE2 4.12Å; I424-Y546 HydrophobicContact CG2-CD2 4.31Å; I424-Y546 HydrophobicContact CG2-CE2 4.11Å; I430-Y546 VanDerWaalsContact CD1-OH 3.3Å; I430-Y546 WeakPolarHBondContact CD1-OH 3.22Å; I430-Y546 WeakPolarHBondContact CG1-OH 3.42Å; L473-Y546 HydrophobicContact CD2-CD2 3.6Å; L473-Y546 HydrophobicContact CD2-CG 4.35Å; I478-Y546 HydrophobicContact CD1-CD1 3.65Å; I478-Y546 HydrophobicContact CD1-CD2 4.02Å; I478-Y546 HydrophobicContact CD1-CE1 3.61Å; I478-Y546 HydrophobicContact CD1-CE2 4.03Å; I478-Y546 HydrophobicContact CD1-CG 3.85Å; I478-Y546 HydrophobicContact CG2-CD2 4.43Å; I478-Y546 HydrophobicContact CG2-CG 4.12Å; V482-Y546 HydrophobicContact CG1-CD1 3.99Å; M486-Y546 HydrophobicContact CB-CE1 4.21Å; M486-Y546 HydrophobicContact CG-CE1 4.35Å; N542-Y546 VanDerWaalsContact O-CB 3.26Å; N542-Y546 WeakPolarHBondContact O-CB 3.3Å; N542-Y546 PolarHBondContact O-N 2.79Å; N543-Y546 PolarHBondContact O-N 3.37Å; C544-Y546 VanDerWaalsContact C-N 3.34Å; Y546-A548 PolarHBondContact O-N 3.33Å; Y546-H549 WeakPolarHBondContact O-CB 3.43Å; Y546-H549 PolarHBondContact O-N 3.36Å; Y546-H550 AromaticContact CE1-CD2 3.78Å; Y546-H550 AromaticContact CE1-NE2 3.95Å; Y546-H550 AromaticContact CE2-CD2 3.76Å; Y546-H550 AromaticContact CE2-NE2 3.31Å; Y546-H550 VanDerWaalsContact CE2-NE2 3.31Å; Y546-H550 WeakPolarHBondContact CE2-NE2 3.34Å; Y546-H550 AromaticContact CZ-CD2 3.58Å; Y546-H550 AromaticContact CZ-NE2 3.25Å; Y546-H550 VanDerWaalsContact CZ-NE2 3.25Å; Y546-H550 PolarHBondContact O-CD2 3.22Å; Y546-H550 VanDerWaalsContact O-CD2 3.31Å; Y546-H550 PolarHBondContact O-N 3.21Å; Y546-H550 VanDerWaalsContact O-N 3.12Å; Y546-H550 PolarHBondContact OH-NE2 2.87Å
547	I	95.9	Very high	92.6	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-58	-51.4	174.8	-66.3	166.7	0	0	0	109.6	V482 F515 F518 N543 H549 H550 L551 F580	V482-I547 HydrophobicContact CG1-CD1 3.92Å; V482-I547 HydrophobicContact CG1-CG1 3.85Å; F515-I547 HydrophobicContact CD1-CG2 3.81Å; F515-I547 HydrophobicContact CE1-CG2 3.82Å; F518-I547 HydrophobicContact CD1-CD1 4.3Å; F518-I547 HydrophobicContact CD2-CD1 4.2Å; F518-I547 HydrophobicContact CE1-CD1 4.03Å; F518-I547 HydrophobicContact CE2-CD1 3.93Å; F518-I547 HydrophobicContact CG-CD1 4.37Å; F518-I547 HydrophobicContact CZ-CD1 3.83Å; N543-I547 VanDerWaalsContact O-CG1 3.32Å; N543-I547 WeakPolarHBondContact O-CG1 3.5Å; N543-I547 PolarHBondContact O-N 3.28Å; I547-H549 PolarHBondContact O-N 2.95Å; I547-H550 PolarHBondContact O-N 3.41Å; I547-L551 HydrophobicContact CG2-CD1 3.74Å; I547-L551 HydrophobicContact CG2-CG 3.99Å; I547-L551 VanDerWaalsContact O-CG 3.3Å; I547-L551 WeakPolarHBondContact O-CG 3.21Å; I547-L551 PolarHBondContact O-N 2.96Å; I547-F580 HydrophobicContact CB-CD1 4.06Å; I547-F580 HydrophobicContact CB-CE1 4.14Å; I547-F580 HydrophobicContact CD1-CD1 4.21Å; I547-F580 HydrophobicContact CD1-CE1 3.74Å; I547-F580 HydrophobicContact CG2-CD1 3.81Å; I547-F580 HydrophobicContact CG2-CD2 4.27Å; I547-F580 HydrophobicContact CG2-CE1 3.62Å; I547-F580 HydrophobicContact CG2-CE2 4.14Å; I547-F580 HydrophobicContact CG2-CG 4.13Å; I547-F580 HydrophobicContact CG2-CZ 3.81Å
548	A	95.7	Very high	91.8	Very high	1 Å²	1	24.6 Å²	24.6	1%	0.008	12%	0.123	C	C	.	.	H	α-helix	trans	-55.7	-37.1	179	0	0	0	0	0	113	C544 Y546 L552 V577 F580 R581	C544-A548 WeakPolarHBondContact O-CB 3.38Å; C544-A548 PolarHBondContact O-N 2.98Å; Y546-A548 PolarHBondContact O-N 3.33Å; A548-L552 WeakPolarHBondContact O-CG 3.45Å; A548-L552 PolarHBondContact O-N 2.94Å; A548-V577 HydrophobicContact CB-CG1 4.22Å; A548-F580 HydrophobicContact CB-CB 4.03Å; A548-R581 HydrophobicContact CB-CG 3.96Å
549	H	93	Very high	90.7	Very high	59 Å²	59	30.8 Å²	30.8	27%	0.273	15%	0.146	S	C	.	.	H	α-helix	trans	-64.6	-47	175.9	176.7	74	0	0	0	111.8	F471 L473 M545 Y546 I547 L552	F471-H549 PolarHBondContact O-CE1 2.93Å; F471-H549 VanDerWaalsContact O-CE1 3.25Å; L473-H549 HydrophobicContact CD1-CB 3.93Å; M545-H549 VanDerWaalsContact O-CB 3.3Å; M545-H549 WeakPolarHBondContact O-CB 3.37Å; M545-H549 PolarHBondContact O-N 3.03Å; Y546-H549 WeakPolarHBondContact O-CB 3.43Å; Y546-H549 PolarHBondContact O-N 3.36Å; I547-H549 PolarHBondContact O-N 2.95Å; H549-L552 WeakPolarHBondContact O-CB 3.48Å; H549-L552 PolarHBondContact O-N 3.25Å
550	H	91.4	Very high	89.2	Confident	25 Å²	25	38.4 Å²	38.4	12%	0.116	19%	0.186	C	C	.	.	H	α-helix	trans	-64.5	-40.8	177	-79.1	-75.6	0	0	0	112.8	I430 M486 Y490 Y546 I547 L552 T553 L554	I430-H550 WeakPolarHBondContact CD1-CE1 3.39Å; I430-H550 WeakPolarHBondContact CD1-NE2 3.45Å; M486-H550 HydrophobicContact CE-CB 4.4Å; M486-H550 HydrophobicContact CG-CB 4.4Å; M486-H550 HydrophobicContact SD-CB 3.86Å; Y490-H550 AromaticContact CE2-ND1 3.86Å; Y490-H550 PolarHBondContact OH-ND1 2.88Å; Y546-H550 AromaticContact CE1-CD2 3.78Å; Y546-H550 AromaticContact CE1-NE2 3.95Å; Y546-H550 AromaticContact CE2-CD2 3.76Å; Y546-H550 AromaticContact CE2-NE2 3.31Å; Y546-H550 VanDerWaalsContact CE2-NE2 3.31Å; Y546-H550 WeakPolarHBondContact CE2-NE2 3.34Å; Y546-H550 AromaticContact CZ-CD2 3.58Å; Y546-H550 AromaticContact CZ-NE2 3.25Å; Y546-H550 VanDerWaalsContact CZ-NE2 3.25Å; Y546-H550 PolarHBondContact O-CD2 3.22Å; Y546-H550 VanDerWaalsContact O-CD2 3.31Å; Y546-H550 PolarHBondContact O-N 3.21Å; Y546-H550 VanDerWaalsContact O-N 3.12Å; Y546-H550 PolarHBondContact OH-NE2 2.87Å; I547-H550 PolarHBondContact O-N 3.41Å; H550-L552 PolarHBondContact O-N 2.68Å; H550-L552 VanDerWaalsContact O-N 3.16Å; H550-T553 PolarHBondContact O-N 2.89Å; H550-T553 VanDerWaalsContact O-N 3.15Å; H550-L554 WeakPolarHBondContact O-CB 3.4Å; H550-L554 PolarHBondContact O-N 3.45Å
551	L	92.4	Very high	87.8	Confident	0 Å²	0	42 Å²	42	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-62.6	-22.4	-179.3	-63.5	180	0	0	0	113.6	F515 I547 T553 L554 F573 L576 V577 F580	F515-L551 HydrophobicContact CD1-CD2 4.39Å; F515-L551 HydrophobicContact CD2-CD2 3.69Å; F515-L551 HydrophobicContact CE1-CD2 4.17Å; F515-L551 HydrophobicContact CE2-CD2 3.41Å; F515-L551 VanDerWaalsContact CE2-CD2 3.41Å; F515-L551 HydrophobicContact CG-CD2 4.19Å; F515-L551 HydrophobicContact CZ-CD2 3.69Å; I547-L551 HydrophobicContact CG2-CD1 3.74Å; I547-L551 HydrophobicContact CG2-CG 3.99Å; I547-L551 VanDerWaalsContact O-CG 3.3Å; I547-L551 WeakPolarHBondContact O-CG 3.21Å; I547-L551 PolarHBondContact O-N 2.96Å; L551-T553 VanDerWaalsContact C-N 3.3Å; L551-T553 PolarHBondContact O-N 3.18Å; L551-L554 HydrophobicContact CD2-CD2 3.96Å; L551-F573 HydrophobicContact CB-CB 4.02Å; L551-F573 HydrophobicContact CD2-CB 3.81Å; L551-F573 HydrophobicContact CD2-CD1 4.12Å; L551-F573 HydrophobicContact CD2-CG 4.12Å; L551-F573 HydrophobicContact CG-CB 4.39Å; L551-L576 HydrophobicContact CD1-CB 3.95Å; L551-V577 HydrophobicContact CB-CG2 3.78Å; L551-F580 HydrophobicContact CD1-CD2 3.82Å; L551-F580 HydrophobicContact CD1-CE2 3.88Å
552	L	89.8	Confident	86.5	Confident	73 Å²	73	41.9 Å²	41.9	38%	0.382	20%	0.2	S	C	.	.	H	α-helix	trans	-60.9	-38.8	175.2	-71.8	167.2	0	0	0	112.4	A548 H549 H550 V577	A548-L552 WeakPolarHBondContact O-CG 3.45Å; A548-L552 PolarHBondContact O-N 2.94Å; H549-L552 WeakPolarHBondContact O-CB 3.48Å; H549-L552 PolarHBondContact O-N 3.25Å; H550-L552 PolarHBondContact O-N 2.68Å; H550-L552 VanDerWaalsContact O-N 3.16Å; L552-V577 HydrophobicContact CD2-CG1 4.14Å; L552-V577 HydrophobicContact CD2-CG2 4.08Å; L552-V577 HydrophobicContact CG-CG2 4.24Å
553	T	86.3	Confident	84.9	Confident	64 Å²	64	42.3 Å²	42.3	39%	0.393	20%	0.203	S	C	.	.	H	α-helix	trans	-112	-14.8	-174.3	60.1	0	0	0	0	113.2	H550 L551 G555 H556 Q557	H550-T553 PolarHBondContact O-N 2.89Å; H550-T553 VanDerWaalsContact O-N 3.15Å; L551-T553 VanDerWaalsContact C-N 3.3Å; L551-T553 PolarHBondContact O-N 3.18Å; T553-G555 PolarHBondContact O-N 3.18Å; T553-H556 PolarHBondContact O-N 3Å; T553-H556 VanDerWaalsContact O-N 3.08Å; T553-Q557 WeakPolarHBondContact O-CG 3.32Å; T553-Q557 PolarHBondContact O-N 3.49Å; T553-Q557 PolarHBondContact OG1-NE2 2.82Å; T553-Q557 VanDerWaalsContact OG1-NE2 3.08Å
554	L	87.2	Confident	83.3	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-54	-50.8	-174.1	-170.7	65.8	0	0	0	112.5	M486 Y490 L493 F515 H550 L551 H556 Q557 F558 F573	M486-L554 HydrophobicContact CE-CD1 3.94Å; M486-L554 HydrophobicContact CE-CD2 3.78Å; Y490-L554 HydrophobicContact CD1-CD1 3.96Å; Y490-L554 HydrophobicContact CD2-CD1 4.41Å; Y490-L554 HydrophobicContact CE1-CD1 3.44Å; Y490-L554 VanDerWaalsContact CE1-CD1 3.44Å; Y490-L554 HydrophobicContact CE2-CD1 3.95Å; Y490-L554 HydrophobicContact CG-CD1 4.4Å; Y490-L554 VanDerWaalsContact CZ-CD1 3.42Å; L493-L554 HydrophobicContact CD1-CD1 3.76Å; L493-L554 HydrophobicContact CD1-CD2 3.82Å; L493-L554 HydrophobicContact CD1-CG 3.64Å; F515-L554 HydrophobicContact CE2-CD2 4.14Å; F515-L554 HydrophobicContact CZ-CD2 4.46Å; H550-L554 WeakPolarHBondContact O-CB 3.4Å; H550-L554 PolarHBondContact O-N 3.45Å; L551-L554 HydrophobicContact CD2-CD2 3.96Å; L554-H556 VanDerWaalsContact C-N 3.3Å; L554-H556 PolarHBondContact O-N 3.38Å; L554-Q557 PolarHBondContact O-N 3.09Å; L554-F558 HydrophobicContact CD1-CD2 4.34Å; L554-F558 HydrophobicContact CD1-CE2 3.93Å; L554-F558 WeakPolarHBondContact O-CD2 3.42Å; L554-F573 HydrophobicContact CB-CD2 4.06Å; L554-F573 HydrophobicContact CD2-CD1 4.45Å; L554-F573 HydrophobicContact CD2-CD2 3.93Å; L554-F573 HydrophobicContact CD2-CE1 4.44Å; L554-F573 HydrophobicContact CD2-CE2 3.91Å; L554-F573 HydrophobicContact CD2-CG 4.21Å; L554-F573 HydrophobicContact CD2-CZ 4.19Å; L554-F573 HydrophobicContact CG-CD2 4.06Å; L554-F573 HydrophobicContact CG-CE2 4.05Å
555	G	83.3	Confident	81.5	Confident	6 Å²	6	52 Å²	52	6%	0.062	26%	0.259	C	S	.	.	H	α-helix	trans	-62.8	-38.2	179.3	0	0	0	0	0	112.6	T553 F558 R559	T553-G555 PolarHBondContact O-N 3.18Å; G555-F558 PolarHBondContact O-N 2.84Å; G555-R559 PolarHBondContact O-N 3.08Å; G555-R559 VanDerWaalsContact O-N 3.15Å
556	H	81.6	Confident	79.8	Confident	141 Å²	141	50 Å²	50	65%	0.653	25%	0.249	S	C	*	.	H	α-helix	trans	-67.7	-39.3	179	-171.7	71	0	0	0	112.5	T553 L554 F558 R559	T553-H556 PolarHBondContact O-N 3Å; T553-H556 VanDerWaalsContact O-N 3.08Å; L554-H556 VanDerWaalsContact C-N 3.3Å; L554-H556 PolarHBondContact O-N 3.38Å; H556-F558 PolarHBondContact O-N 3.44Å; H556-R559 WeakPolarHBondContact O-CB 3.42Å; H556-R559 PolarHBondContact O-N 3.37Å
557	Q	82.4	Confident	78.1	Confident	75 Å²	75	51.4 Å²	51.4	35%	0.35	26%	0.259	S	S	.	.	H	α-helix	trans	-59	-33.2	179.9	-73.5	168.7	1.3	0	0	112.8	Y490 T553 L554	Y490-Q557 VanDerWaalsContact CE1-OE1 3.27Å; Y490-Q557 PolarHBondContact OH-OE1 3.29Å; T553-Q557 WeakPolarHBondContact O-CG 3.32Å; T553-Q557 PolarHBondContact O-N 3.49Å; T553-Q557 PolarHBondContact OG1-NE2 2.82Å; T553-Q557 VanDerWaalsContact OG1-NE2 3.08Å; L554-Q557 PolarHBondContact O-N 3.09Å
558	F	80.3	Confident	76.4	Confident	1 Å²	1	58.4 Å²	58.4	0%	0.004	30%	0.297	C	S	.	.	H	α-helix	trans	-101.5	-4	-178.9	-67.8	-85.4	0	0	0	113.8	L435 Y490 L493 L494 T497 L554 G555 H556 L560 R561 L562	L435-F558 HydrophobicContact CD2-CE1 4.21Å; Y490-F558 AromaticContact CD1-CE2 3.84Å; Y490-F558 HydrophobicContact CD1-CE2 3.84Å; Y490-F558 AromaticContact CD1-CZ 3.93Å; Y490-F558 HydrophobicContact CD1-CZ 3.93Å; Y490-F558 AromaticContact CE1-CE2 3.98Å; Y490-F558 HydrophobicContact CE1-CE2 3.98Å; Y490-F558 HydrophobicContact CE1-CZ 4.44Å; L493-F558 HydrophobicContact CB-CD1 4.06Å; L493-F558 HydrophobicContact CB-CD2 4.08Å; L493-F558 HydrophobicContact CB-CE1 3.86Å; L493-F558 HydrophobicContact CB-CE2 3.89Å; L493-F558 HydrophobicContact CB-CG 4.17Å; L493-F558 HydrophobicContact CB-CZ 3.77Å; L493-F558 HydrophobicContact CD1-CD2 3.81Å; L493-F558 HydrophobicContact CD1-CE2 3.85Å; L494-F558 HydrophobicContact CB-CE1 4.45Å; T497-F558 HydrophobicContact CG2-CD1 3.8Å; T497-F558 HydrophobicContact CG2-CE1 4.44Å; L554-F558 HydrophobicContact CD1-CD2 4.34Å; L554-F558 HydrophobicContact CD1-CE2 3.93Å; L554-F558 WeakPolarHBondContact O-CD2 3.42Å; G555-F558 PolarHBondContact O-N 2.84Å; H556-F558 PolarHBondContact O-N 3.44Å; F558-L560 VanDerWaalsContact C-N 3.33Å; F558-L560 PolarHBondContact O-N 3.27Å; F558-R561 PolarHBondContact O-N 2.92Å; F558-L562 HydrophobicContact CB-CD1 3.76Å; F558-L562 HydrophobicContact CB-CG 4.04Å; F558-L562 WeakPolarHBondContact O-CG 3.33Å; F558-L562 PolarHBondContact O-N 3.46Å; F558-L562 VanDerWaalsContact O-N 3.09Å
559	R	73.4	Confident	74.6	Confident	129 Å²	129	61 Å²	61	49%	0.487	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.9	-172.8	-175.5	-179.3	-179.6	-169.4	0.7	114.1	G555 H556 R561 C567	G555-R559 PolarHBondContact O-N 3.08Å; G555-R559 VanDerWaalsContact O-N 3.15Å; H556-R559 WeakPolarHBondContact O-CB 3.42Å; H556-R559 PolarHBondContact O-N 3.37Å; R559-R561 VanDerWaalsContact C-N 3.29Å; R559-R561 PolarHBondContact O-N 2.89Å; R559-C567 PolarHBondContact O-SG 3.26Å
560	L	65.7	Low	73.1	Confident	160 Å²	160	62.1 Å²	62.1	84%	0.838	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-6	-177	-64.8	175.4	0	0	0	113.7	F558	F558-L560 VanDerWaalsContact C-N 3.33Å; F558-L560 PolarHBondContact O-N 3.27Å
561	R	66.8	Low	72.2	Confident	77 Å²	77	61.6 Å²	61.6	29%	0.291	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.1	-10.3	-171.4	-56	-180	-164.1	-130.4	-5.1	113.4	P436 T497 F558 R559	P436-R561 PolarHBondContact O-NH1 2.9Å; P436-R561 PolarHBondContact O-NH2 3.39Å; T497-R561 WeakPolarHBondContact CB-O 3.3Å; T497-R561 HydrophobicContact CG2-CB 3.62Å; F558-R561 PolarHBondContact O-N 2.92Å; R559-R561 VanDerWaalsContact C-N 3.29Å; R559-R561 PolarHBondContact O-N 2.89Å
562	L	69.3	Low	71.8	Confident	10 Å²	10	64 Å²	64	5%	0.052	35%	0.35	C	S	.	.	S	Bend	trans	-83.1	158.1	174.9	-73.7	167.2	0	0	0	110	A496 T497 F508 F558 L566 C567 A571	A496-L562 HydrophobicContact CB-CD2 3.97Å; T497-L562 HydrophobicContact CG2-CD2 4.34Å; F508-L562 HydrophobicContact CD2-CD1 4.04Å; F508-L562 HydrophobicContact CE2-CD1 4.41Å; F558-L562 HydrophobicContact CB-CD1 3.76Å; F558-L562 HydrophobicContact CB-CG 4.04Å; F558-L562 WeakPolarHBondContact O-CG 3.33Å; F558-L562 PolarHBondContact O-N 3.46Å; F558-L562 VanDerWaalsContact O-N 3.09Å; L562-L566 HydrophobicContact CB-CB 4.22Å; L562-L566 HydrophobicContact CB-CD1 4.15Å; L562-L566 HydrophobicContact CD2-CD1 4.21Å; L562-C567 PolarHBondContact O-SG 3.15Å; L562-A571 HydrophobicContact CD1-CB 4.39Å
563	A	63.7	Low	71.9	Confident	10 Å²	10	60.6 Å²	60.6	8%	0.083	33%	0.332	C	S	.	.			trans	-51.2	143.8	178.6	0	0	0	0	0	111.6	D501 A504 I565 L566 C567	D501-A563 HydrophobicContact CB-CB 4.07Å; D501-A563 VanDerWaalsContact OD1-CB 3.26Å; D501-A563 WeakPolarHBondContact OD1-CB 2.89Å; A504-A563 HydrophobicContact CB-CB 4.26Å; A563-I565 PolarHBondContact O-N 3.21Å; A563-L566 WeakPolarHBondContact O-CB 3.42Å; A563-L566 PolarHBondContact O-N 3.47Å; A563-C567 PolarHBondContact O-SG 3.21Å; A563-C567 VanDerWaalsContact O-SG 3.41Å
564	P	61.3	Low	72.1	Confident	92 Å²	92	60.9 Å²	60.9	60%	0.597	33%	0.334	S	S	*	.	H	α-helix	trans	-51.8	-33.1	-174.9	-26.2	32.6	0	0	0	114.2	L566 C567	P564-L566 PolarHBondContact O-N 3.23Å; P564-C567 WeakPolarHBondContact O-CB 3.32Å; P564-C567 PolarHBondContact O-N 2.94Å
565	I	61.4	Low	72.4	Confident	113 Å²	113	65 Å²	65	58%	0.579	36%	0.355	S	S	*	.	H	α-helix	trans	-60.3	-28.5	178.7	-54.5	168.7	0	0	0	112.3	D501 A563	D501-I565 HydrophobicContact CB-CD1 4.36Å; A563-I565 PolarHBondContact O-N 3.21Å
566	L	60.5	Low	72.9	Confident	6 Å²	6	65.5 Å²	65.5	3%	0.031	36%	0.357	C	S	.	.	H	α-helix	trans	-90	-15.8	177.8	-67.7	170.7	0	0	0	112.6	V505 F508 L562 A563 P564 A571	V505-L566 HydrophobicContact CG2-CD1 4.07Å; V505-L566 HydrophobicContact CG2-CD2 4.01Å; V505-L566 HydrophobicContact CG2-CG 3.9Å; F508-L566 HydrophobicContact CB-CD1 4.18Å; F508-L566 HydrophobicContact CD1-CD2 4.2Å; F508-L566 HydrophobicContact CG-CD1 4.46Å; F508-L566 HydrophobicContact CG-CD2 4.41Å; L562-L566 HydrophobicContact CB-CB 4.22Å; L562-L566 HydrophobicContact CB-CD1 4.15Å; L562-L566 HydrophobicContact CD2-CD1 4.21Å; A563-L566 WeakPolarHBondContact O-CB 3.42Å; A563-L566 PolarHBondContact O-N 3.47Å; P564-L566 PolarHBondContact O-N 3.23Å; L566-A571 HydrophobicContact CB-CB 4.09Å; L566-A571 WeakPolarHBondContact O-CB 3.33Å; L566-A571 PolarHBondContact O-N 3.27Å
567	C	59.8	Low	73.6	Confident	36 Å²	36	59 Å²	59	24%	0.243	33%	0.327	C	S	.	.	H	α-helix	trans	-79.9	-15.1	-172.3	-64.7	0	0	0	0	114	R559 L562 A563 P564 G569	R559-C567 PolarHBondContact O-SG 3.26Å; L562-C567 PolarHBondContact O-SG 3.15Å; A563-C567 PolarHBondContact O-SG 3.21Å; A563-C567 VanDerWaalsContact O-SG 3.41Å; P564-C567 WeakPolarHBondContact O-CB 3.32Å; P564-C567 PolarHBondContact O-N 2.94Å; C567-G569 PolarHBondContact O-N 3.29Å
568	D	59.7	Low	74.3	Confident	149 Å²	149	59 Å²	59	80%	0.797	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	23.8	179.7	-83.2	-9.1	0	0	0	114.7
569	G	56.8	Low	75	Confident	56 Å²	56	60.1 Å²	60.1	58%	0.577	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.3	1.5	172.2	0	0	0	0	0	115.6	C567	C567-G569 PolarHBondContact O-N 3.29Å
570	T	61.8	Low	76.2	Confident	81 Å²	81	54.2 Å²	54.2	50%	0.497	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.9	-21.6	177.2	50.3	0	0	0	0	113.4	T572	T570-T572 VanDerWaalsContact C-N 3.32Å; T570-T572 PolarHBondContact O-N 3.38Å
571	A	71.8	Confident	77.7	Confident	15 Å²	15	52.1 Å²	52.1	12%	0.124	31%	0.305	C	S	.	.			trans	-82.4	66.7	179.8	0	0	0	0	0	113.6	F508 L562 L566	F508-A571 HydrophobicContact CD2-CB 4.38Å; F508-A571 HydrophobicContact CE1-CB 4.34Å; F508-A571 HydrophobicContact CE2-CB 3.71Å; F508-A571 HydrophobicContact CZ-CB 3.72Å; L562-A571 HydrophobicContact CD1-CB 4.39Å; L566-A571 HydrophobicContact CB-CB 4.09Å; L566-A571 WeakPolarHBondContact O-CB 3.33Å; L566-A571 PolarHBondContact O-N 3.27Å
572	T	85.2	Confident	79.1	Confident	51 Å²	51	56 Å²	56	31%	0.313	32%	0.319	S	S	.	.			trans	-118	160.4	174.1	-172.7	0	0	0	0	111.8	R512 T570 V574	R512-T572 PolarHBondContact NH1-O 3.3Å; T570-T572 VanDerWaalsContact C-N 3.32Å; T570-T572 PolarHBondContact O-N 3.38Å; T572-V574 WeakPolarHBondContact OG1-CG2 3.47Å; T572-V574 PolarHBondContact OG1-N 3.03Å; T572-V574 VanDerWaalsContact OG1-N 3.16Å
573	F	91.3	Very high	80.4	Confident	1 Å²	1	56.6 Å²	56.6	0%	0.004	32%	0.322	C	S	.	.			trans	-123.8	0.7	168.9	-63.4	-90	0	0	0	112.2	L493 F508 V511 R512 F515 L551 L554 D575 L576	L493-F573 HydrophobicContact CD1-CE2 4.18Å; L493-F573 HydrophobicContact CD1-CZ 4.21Å; L493-F573 HydrophobicContact CD2-CZ 4.29Å; F508-F573 HydrophobicContact CD2-CE2 4.28Å; F508-F573 HydrophobicContact CD2-CZ 4.07Å; F508-F573 HydrophobicContact CE2-CD2 4.39Å; F508-F573 AromaticContact CE2-CE2 3.42Å; F508-F573 HydrophobicContact CE2-CE2 3.42Å; F508-F573 VanDerWaalsContact CE2-CE2 3.42Å; F508-F573 AromaticContact CE2-CZ 3.51Å; F508-F573 HydrophobicContact CE2-CZ 3.51Å; F508-F573 AromaticContact CZ-CE2 3.88Å; F508-F573 HydrophobicContact CZ-CE2 3.88Å; F508-F573 AromaticContact CZ-CZ 3.85Å; F508-F573 HydrophobicContact CZ-CZ 3.85Å; V511-F573 HydrophobicContact CB-CE1 4.41Å; V511-F573 HydrophobicContact CB-CZ 4.38Å; V511-F573 HydrophobicContact CG1-CE1 3.85Å; V511-F573 HydrophobicContact CG1-CZ 3.92Å; R512-F573 HydrophobicContact CB-CE1 4.33Å; R512-F573 HydrophobicContact CG-CD1 3.8Å; R512-F573 HydrophobicContact CG-CE1 3.33Å; R512-F573 HydrophobicContact CG-CZ 4.14Å; F515-F573 HydrophobicContact CD2-CD1 4.19Å; F515-F573 HydrophobicContact CD2-CE1 4.31Å; F515-F573 HydrophobicContact CE2-CD1 4.33Å; F515-F573 HydrophobicContact CE2-CE1 4.3Å; L551-F573 HydrophobicContact CB-CB 4.02Å; L551-F573 HydrophobicContact CD2-CB 3.81Å; L551-F573 HydrophobicContact CD2-CD1 4.12Å; L551-F573 HydrophobicContact CD2-CG 4.12Å; L551-F573 HydrophobicContact CG-CB 4.39Å; L554-F573 HydrophobicContact CB-CD2 4.06Å; L554-F573 HydrophobicContact CD2-CD1 4.45Å; L554-F573 HydrophobicContact CD2-CD2 3.93Å; L554-F573 HydrophobicContact CD2-CE1 4.44Å; L554-F573 HydrophobicContact CD2-CE2 3.91Å; L554-F573 HydrophobicContact CD2-CG 4.21Å; L554-F573 HydrophobicContact CD2-CZ 4.19Å; L554-F573 HydrophobicContact CG-CD2 4.06Å; L554-F573 HydrophobicContact CG-CE2 4.05Å; F573-D575 PolarHBondContact O-N 2.99Å; F573-L576 HydrophobicContact CD1-CD1 4.32Å; F573-L576 WeakPolarHBondContact O-CB 3.23Å; F573-L576 PolarHBondContact O-N 3.11Å; F573-L576 VanDerWaalsContact O-N 3.09Å
574	V	91.8	Very high	81.9	Confident	70 Å²	70	56.1 Å²	56.1	42%	0.424	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-64.4	-28.8	-174.8	178.6	0	0	0	0	111.2	T572 L576 V577	T572-V574 WeakPolarHBondContact OG1-CG2 3.47Å; T572-V574 PolarHBondContact OG1-N 3.03Å; T572-V574 VanDerWaalsContact OG1-N 3.16Å; V574-L576 PolarHBondContact O-N 3.42Å; V574-V577 WeakPolarHBondContact O-CB 3.44Å; V574-V577 PolarHBondContact O-N 3.19Å
575	D	92.4	Very high	83.6	Confident	85 Å²	85	54.2 Å²	54.2	46%	0.455	31%	0.305	S	S	.	.	G	3₁₀ helix	trans	-62.1	-26.3	176.2	64.1	-60.9	0	0	0	113.3	R512 F573 P578	R512-D575 IonicContact CZ-OD1 3.18Å; R512-D575 IonicContact CZ-OD2 3.94Å; R512-D575 IonicContact NH1-OD1 3.84Å; R512-D575 PolarHBondContact NH1-OD1 3.43Å; R512-D575 IonicContact NH1-OD2 3.65Å; R512-D575 PolarHBondContact NH1-OD2 3.34Å; R512-D575 IonicContact NH2-OD1 3.15Å; R512-D575 IonicContact NH2-OD2 3.25Å; R512-D575 PolarHBondContact NH2-OD2 3.04Å; F573-D575 PolarHBondContact O-N 2.99Å; D575-P578 WeakPolarHBondContact O-CD 3.5Å
576	L	94.4	Very high	85.2	Confident	17 Å²	17	54 Å²	54	9%	0.089	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-82.4	-21	178.3	-57.1	-179.7	0	0	0	112.8	F515 H516 L551 F573 V574 G579 F580	F515-L576 HydrophobicContact CB-CD1 3.94Å; F515-L576 HydrophobicContact CD2-CD1 4.5Å; H516-L576 WeakPolarHBondContact CE1-CD2 3.29Å; L551-L576 HydrophobicContact CD1-CB 3.95Å; F573-L576 HydrophobicContact CD1-CD1 4.32Å; F573-L576 WeakPolarHBondContact O-CB 3.23Å; F573-L576 PolarHBondContact O-N 3.11Å; F573-L576 VanDerWaalsContact O-N 3.09Å; V574-L576 PolarHBondContact O-N 3.42Å; L576-G579 PolarHBondContact O-N 2.94Å; L576-G579 VanDerWaalsContact O-N 3.07Å; L576-F580 HydrophobicContact CB-CD2 4.35Å; L576-F580 HydrophobicContact CB-CE2 4.37Å; L576-F580 WeakPolarHBondContact O-CD2 3.43Å; L576-F580 PolarHBondContact O-N 3.5Å
577	V	95.7	Very high	86.9	Confident	5 Å²	5	55 Å²	55	3%	0.03	31%	0.309	C	S	.	.	H	α-helix	trans	-56	-47	-174.4	172	0	0	0	0	113.1	A548 L551 L552 V574 G579 F580 R581	A548-V577 HydrophobicContact CB-CG1 4.22Å; L551-V577 HydrophobicContact CB-CG2 3.78Å; L552-V577 HydrophobicContact CD2-CG1 4.14Å; L552-V577 HydrophobicContact CD2-CG2 4.08Å; L552-V577 HydrophobicContact CG-CG2 4.24Å; V574-V577 WeakPolarHBondContact O-CB 3.44Å; V574-V577 PolarHBondContact O-N 3.19Å; V577-G579 VanDerWaalsContact C-N 3.26Å; V577-G579 PolarHBondContact O-N 2.82Å; V577-F580 PolarHBondContact O-N 3.23Å; V577-R581 HydrophobicContact CG1-CG 4.44Å; V577-R581 WeakPolarHBondContact O-CG 3.33Å; V577-R581 PolarHBondContact O-N 2.63Å
578	P	96.6	Very high	88.6	Confident	74 Å²	74	54 Å²	54	48%	0.481	30%	0.3	S	S	.	.	H	α-helix	trans	-61.4	-35.2	177.9	-22.5	34.8	0	0	0	112.9	D575 R582	D575-P578 WeakPolarHBondContact O-CD 3.5Å; P578-R582 VanDerWaalsContact O-CB 3.3Å; P578-R582 WeakPolarHBondContact O-CB 3.46Å; P578-R582 PolarHBondContact O-N 3.17Å
579	G	96.4	Very high	90.4	Very high	26 Å²	26	50.6 Å²	50.6	27%	0.268	28%	0.281	S	S	.	.	H	α-helix	trans	-62.6	-51.4	177.8	0	0	0	0	0	111.6	L576 V577 R581 R582 L583	L576-G579 PolarHBondContact O-N 2.94Å; L576-G579 VanDerWaalsContact O-N 3.07Å; V577-G579 VanDerWaalsContact C-N 3.26Å; V577-G579 PolarHBondContact O-N 2.82Å; G579-R581 PolarHBondContact O-N 2.89Å; G579-R582 PolarHBondContact O-N 2.76Å; G579-L583 WeakPolarHBondContact O-CB 3.17Å; G579-L583 PolarHBondContact O-N 2.81Å
580	F	97.3	Very high	92.3	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.018	27%	0.274	C	S	.	.	H	α-helix	trans	-61.9	-45.6	177.2	-83.3	-86.2	0	0	0	112.9	F515 F518 C544 I547 A548 L551 L576 V577 R582 L583 G584	F515-F580 HydrophobicContact CB-CE2 3.87Å; F515-F580 HydrophobicContact CB-CZ 3.81Å; F515-F580 HydrophobicContact CD1-CZ 4.02Å; F515-F580 HydrophobicContact CG-CE2 4.48Å; F515-F580 HydrophobicContact CG-CZ 4.33Å; F515-F580 WeakPolarHBondContact O-CZ 3.36Å; F518-F580 HydrophobicContact CB-CE1 4.39Å; F518-F580 HydrophobicContact CB-CZ 4.34Å; F518-F580 HydrophobicContact CD1-CD1 4.27Å; F518-F580 AromaticContact CD1-CE1 3.39Å; F518-F580 HydrophobicContact CD1-CE1 3.39Å; F518-F580 HydrophobicContact CD1-CZ 4.12Å; F518-F580 HydrophobicContact CE1-CD1 4.39Å; F518-F580 AromaticContact CE1-CE1 3.86Å; F518-F580 HydrophobicContact CE1-CE1 3.86Å; F518-F580 HydrophobicContact CG-CE1 4.06Å; F518-F580 HydrophobicContact CG-CZ 4.49Å; C544-F580 VanDerWaalsContact CB-O 3.31Å; C544-F580 WeakPolarHBondContact CB-O 3.46Å; I547-F580 HydrophobicContact CB-CD1 4.06Å; I547-F580 HydrophobicContact CB-CE1 4.14Å; I547-F580 HydrophobicContact CD1-CD1 4.21Å; I547-F580 HydrophobicContact CD1-CE1 3.74Å; I547-F580 HydrophobicContact CG2-CD1 3.81Å; I547-F580 HydrophobicContact CG2-CD2 4.27Å; I547-F580 HydrophobicContact CG2-CE1 3.62Å; I547-F580 HydrophobicContact CG2-CE2 4.14Å; I547-F580 HydrophobicContact CG2-CG 4.13Å; I547-F580 HydrophobicContact CG2-CZ 3.81Å; A548-F580 HydrophobicContact CB-CB 4.03Å; L551-F580 HydrophobicContact CD1-CD2 3.82Å; L551-F580 HydrophobicContact CD1-CE2 3.88Å; L576-F580 HydrophobicContact CB-CD2 4.35Å; L576-F580 HydrophobicContact CB-CE2 4.37Å; L576-F580 WeakPolarHBondContact O-CD2 3.43Å; L576-F580 PolarHBondContact O-N 3.5Å; V577-F580 PolarHBondContact O-N 3.23Å; F580-R582 VanDerWaalsContact C-N 3.29Å; F580-R582 PolarHBondContact O-N 3.27Å; F580-L583 PolarHBondContact O-N 3.22Å; F580-G584 PolarHBondContact O-N 3.17Å
581	R	97	Very high	93.9	Very high	117 Å²	117	46.7 Å²	46.7	44%	0.442	25%	0.251	S	S	.	.	H	α-helix	trans	-58.7	-44.1	177.6	-72.4	-179.5	177.1	168.9	0.7	111.4	M545 A548 V577 G579 T585	M545-R581 HydrophobicContact CE-CB 4.42Å; M545-R581 HydrophobicContact SD-CB 4.45Å; M545-R581 HydrophobicContact SD-CG 3.94Å; A548-R581 HydrophobicContact CB-CG 3.96Å; V577-R581 HydrophobicContact CG1-CG 4.44Å; V577-R581 WeakPolarHBondContact O-CG 3.33Å; V577-R581 PolarHBondContact O-N 2.63Å; G579-R581 PolarHBondContact O-N 2.89Å; R581-T585 VanDerWaalsContact O-CB 3.29Å; R581-T585 WeakPolarHBondContact O-CB 3.3Å; R581-T585 PolarHBondContact O-N 3.24Å; R581-T585 PolarHBondContact O-OG1 2.76Å; R581-T585 VanDerWaalsContact O-OG1 3.09Å
582	R	97.2	Very high	95.1	Very high	158 Å²	158	46.9 Å²	46.9	60%	0.596	25%	0.25	S	C	*	.	H	α-helix	trans	-62.8	-48.2	177.1	-172	-177.1	-53.9	171.6	4.6	111.2	P578 G579 F580 G584 T585 E586	P578-R582 VanDerWaalsContact O-CB 3.3Å; P578-R582 WeakPolarHBondContact O-CB 3.46Å; P578-R582 PolarHBondContact O-N 3.17Å; G579-R582 PolarHBondContact O-N 2.76Å; F580-R582 VanDerWaalsContact C-N 3.29Å; F580-R582 PolarHBondContact O-N 3.27Å; R582-G584 PolarHBondContact O-N 3.47Å; R582-T585 PolarHBondContact O-N 3.21Å; R582-E586 VanDerWaalsContact CD-OE1 3.29Å; R582-E586 WeakPolarHBondContact CD-OE1 3.5Å; R582-E586 HydrophobicContact CG-CG 4.06Å; R582-E586 WeakPolarHBondContact CG-OE1 3.22Å; R582-E586 WeakPolarHBondContact O-CB 3.31Å; R582-E586 WeakPolarHBondContact O-CG 3.47Å; R582-E586 PolarHBondContact O-N 2.86Å
583	L	96.2	Very high	95.6	Very high	22 Å²	22	52.2 Å²	52.2	12%	0.115	26%	0.264	C	S	.	.	H	α-helix	trans	-55.2	-51.2	-179.7	-178.6	66.6	0	0	0	111.9	F518 P523 G579 F580 C587	F518-L583 HydrophobicContact CE1-CD2 4.4Å; P523-L583 HydrophobicContact CB-CD1 4.22Å; P523-L583 HydrophobicContact CG-CD1 3.5Å; P523-L583 HydrophobicContact CG-CD2 3.92Å; P523-L583 HydrophobicContact CG-CG 4.18Å; G579-L583 WeakPolarHBondContact O-CB 3.17Å; G579-L583 PolarHBondContact O-N 2.81Å; F580-L583 PolarHBondContact O-N 3.22Å; L583-C587 WeakPolarHBondContact O-CB 3.45Å; L583-C587 PolarHBondContact O-N 2.86Å
584	G	95.9	Very high	95.8	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.8	-39.8	178.5	0	0	0	0	0	113.2	H541 F580 R582 F588	H541-G584 PolarHBondContact ND1-O 2.9Å; H541-G584 VanDerWaalsContact ND1-O 3.08Å; F580-G584 PolarHBondContact O-N 3.17Å; R582-G584 PolarHBondContact O-N 3.47Å; G584-F588 PolarHBondContact O-N 3.25Å
585	T	96.3	Very high	96	Very high	52 Å²	52	51.8 Å²	51.8	32%	0.319	27%	0.266	S	S	.	.	H	α-helix	trans	-70.1	-42.5	179.4	-69.1	0	0	0	0	112.3	M545 R581 R582 F588 L589	M545-T585 WeakPolarHBondContact CE-OG1 3.18Å; R581-T585 VanDerWaalsContact O-CB 3.29Å; R581-T585 WeakPolarHBondContact O-CB 3.3Å; R581-T585 PolarHBondContact O-N 3.24Å; R581-T585 PolarHBondContact O-OG1 2.76Å; R581-T585 VanDerWaalsContact O-OG1 3.09Å; R582-T585 PolarHBondContact O-N 3.21Å; T585-F588 PolarHBondContact O-N 2.7Å; T585-L589 HydrophobicContact CG2-CD1 3.68Å; T585-L589 HydrophobicContact CG2-CG 4.07Å; T585-L589 VanDerWaalsContact O-CB 3.31Å; T585-L589 WeakPolarHBondContact O-CB 3.28Å; T585-L589 VanDerWaalsContact O-CG 3.23Å; T585-L589 WeakPolarHBondContact O-CG 3.31Å; T585-L589 PolarHBondContact O-N 2.75Å
586	E	95.7	Very high	96.2	Very high	110 Å²	110	52.5 Å²	52.5	51%	0.514	27%	0.265	S	S	.	.	H	α-helix	trans	-63	-43.8	178.9	-76.1	178.1	179.4	0	0	111.7	R582 L589 A590	R582-E586 VanDerWaalsContact CD-OE1 3.29Å; R582-E586 WeakPolarHBondContact CD-OE1 3.5Å; R582-E586 HydrophobicContact CG-CG 4.06Å; R582-E586 WeakPolarHBondContact CG-OE1 3.22Å; R582-E586 WeakPolarHBondContact O-CB 3.31Å; R582-E586 WeakPolarHBondContact O-CG 3.47Å; R582-E586 PolarHBondContact O-N 2.86Å; E586-L589 PolarHBondContact O-N 2.57Å; E586-A590 WeakPolarHBondContact O-CB 2.79Å; E586-A590 PolarHBondContact O-N 3.28Å
587	C	95.7	Very high	96.3	Very high	26 Å²	26	53.4 Å²	53.4	18%	0.176	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-49.7	175.1	-176.5	0	0	0	0	111.5	L583 A590 Q591	L583-C587 WeakPolarHBondContact O-CB 3.45Å; L583-C587 PolarHBondContact O-N 2.86Å; C587-A590 WeakPolarHBondContact O-CB 3.28Å; C587-A590 PolarHBondContact O-N 2.83Å; C587-Q591 PolarHBondContact O-N 2.99Å
588	F	96.6	Very high	96.2	Very high	15 Å²	15	56 Å²	56	7%	0.066	29%	0.291	C	S	.	.	H	α-helix	trans	-67.5	-38.4	-179.6	-171.4	-116.3	0	0	0	112.6	A538 H541 G584 T585 A590 Q591 M592 W639 L643 I647 A651	A538-F588 HydrophobicContact CB-CD2 4.43Å; A538-F588 HydrophobicContact CB-CE2 4.13Å; H541-F588 HydrophobicContact CB-CB 4.03Å; H541-F588 HydrophobicContact CB-CG 4.43Å; G584-F588 PolarHBondContact O-N 3.25Å; T585-F588 PolarHBondContact O-N 2.7Å; F588-A590 VanDerWaalsContact C-N 3.32Å; F588-A590 PolarHBondContact O-N 3.28Å; F588-Q591 WeakPolarHBondContact O-CB 3.4Å; F588-Q591 PolarHBondContact O-N 3.35Å; F588-M592 HydrophobicContact CD1-CG 4.24Å; F588-M592 HydrophobicContact CE1-CG 3.99Å; F588-M592 HydrophobicContact CE1-SD 4.25Å; F588-M592 HydrophobicContact CZ-CG 4.27Å; F588-M592 HydrophobicContact CZ-SD 4.16Å; F588-M592 WeakPolarHBondContact O-CG 3.27Å; F588-M592 PolarHBondContact O-N 3.43Å; F588-W639 AromaticContact CE2-CE2 3.98Å; F588-W639 HydrophobicContact CE2-CH2 4.33Å; F588-W639 AromaticContact CE2-CZ2 3.83Å; F588-W639 HydrophobicContact CE2-CZ2 3.83Å; F588-W639 HydrophobicContact CZ-CH2 4.21Å; F588-W639 HydrophobicContact CZ-CZ2 4.17Å; F588-W639 HydrophobicContact CZ-CZ3 4.49Å; F588-L643 HydrophobicContact CE2-CD1 4.03Å; F588-L643 HydrophobicContact CZ-CD1 3.66Å; F588-I647 HydrophobicContact CE1-CG2 4.33Å; F588-A651 HydrophobicContact CE1-CB 4.16Å; F588-A651 HydrophobicContact CZ-CB 4.03Å
589	L	96.6	Very high	96.2	Very high	77 Å²	77	52.5 Å²	52.5	40%	0.403	27%	0.268	S	S	.	.	H	α-helix	trans	-65.3	-34.4	175.2	-73.9	177.2	0	0	0	112.3	T585 E586 Q591 M592 R593	T585-L589 HydrophobicContact CG2-CD1 3.68Å; T585-L589 HydrophobicContact CG2-CG 4.07Å; T585-L589 VanDerWaalsContact O-CB 3.31Å; T585-L589 WeakPolarHBondContact O-CB 3.28Å; T585-L589 VanDerWaalsContact O-CG 3.23Å; T585-L589 WeakPolarHBondContact O-CG 3.31Å; T585-L589 PolarHBondContact O-N 2.75Å; E586-L589 PolarHBondContact O-N 2.57Å; L589-Q591 VanDerWaalsContact C-N 3.32Å; L589-M592 PolarHBondContact O-N 3.49Å; L589-R593 WeakPolarHBondContact O-CG 3.45Å; L589-R593 PolarHBondContact O-N 3.04Å; L589-R593 PolarHBondContact O-NH1 3.05Å
590	A	96	Very high	96.1	Very high	50 Å²	50	53.8 Å²	53.8	41%	0.413	27%	0.268	S	S	.	.	H	α-helix	trans	-60.7	-44.7	171.8	0	0	0	0	0	110.8	E586 C587 F588 M592 R593 A594	E586-A590 WeakPolarHBondContact O-CB 2.79Å; E586-A590 PolarHBondContact O-N 3.28Å; C587-A590 WeakPolarHBondContact O-CB 3.28Å; C587-A590 PolarHBondContact O-N 2.83Å; F588-A590 VanDerWaalsContact C-N 3.32Å; F588-A590 PolarHBondContact O-N 3.28Å; A590-M592 PolarHBondContact O-N 3.48Å; A590-R593 PolarHBondContact O-N 2.91Å; A590-A594 PolarHBondContact O-N 3.45Å
591	Q	95.4	Very high	96	Very high	6 Å²	6	60.3 Å²	60.3	3%	0.028	30%	0.299	C	S	.	.	H	α-helix	trans	-62.6	-42.4	175.2	-170.4	61.4	17.2	0	0	112.6	Q531 P534 A537 C587 F588 L589 R593 A594 Q595	Q531-Q591 PolarHBondContact O-OE1 3.01Å; Q531-Q591 VanDerWaalsContact O-OE1 3.13Å; P534-Q591 HydrophobicContact CB-CG 4.2Å; P534-Q591 VanDerWaalsContact CG-NE2 3.33Å; A537-Q591 HydrophobicContact CB-CB 3.85Å; A537-Q591 HydrophobicContact CB-CG 4Å; C587-Q591 PolarHBondContact O-N 2.99Å; F588-Q591 WeakPolarHBondContact O-CB 3.4Å; F588-Q591 PolarHBondContact O-N 3.35Å; L589-Q591 VanDerWaalsContact C-N 3.32Å; Q591-R593 VanDerWaalsContact C-N 3.3Å; Q591-R593 PolarHBondContact O-N 2.98Å; Q591-A594 PolarHBondContact O-N 3.47Å; Q591-Q595 WeakPolarHBondContact O-CG 3.22Å; Q591-Q595 PolarHBondContact O-N 2.94Å
592	M	96.8	Very high	95.8	Very high	19 Å²	19	57.5 Å²	57.5	9%	0.094	29%	0.288	C	S	.	.	H	α-helix	trans	-59.5	-39.5	175.3	-74.1	-67.9	-61.8	0	0	112.3	F588 L589 A590 K596 W639 A651 T654 L655	F588-M592 HydrophobicContact CD1-CG 4.24Å; F588-M592 HydrophobicContact CE1-CG 3.99Å; F588-M592 HydrophobicContact CE1-SD 4.25Å; F588-M592 HydrophobicContact CZ-CG 4.27Å; F588-M592 HydrophobicContact CZ-SD 4.16Å; F588-M592 WeakPolarHBondContact O-CG 3.27Å; F588-M592 PolarHBondContact O-N 3.43Å; L589-M592 PolarHBondContact O-N 3.49Å; A590-M592 PolarHBondContact O-N 3.48Å; M592-K596 WeakPolarHBondContact O-CB 3.18Å; M592-K596 PolarHBondContact O-N 3.17Å; M592-W639 HydrophobicContact SD-CH2 3.52Å; M592-W639 VanDerWaalsContact SD-CH2 3.52Å; M592-W639 HydrophobicContact SD-CZ2 4.49Å; M592-W639 HydrophobicContact SD-CZ3 4Å; M592-A651 HydrophobicContact CE-CB 4.13Å; M592-A651 WeakPolarHBondContact CE-O 3.48Å; M592-A651 HydrophobicContact SD-CB 3.86Å; M592-T654 HydrophobicContact CE-CG2 4.22Å; M592-L655 HydrophobicContact CE-CD1 4.23Å; M592-L655 HydrophobicContact CE-CD2 3.91Å; M592-L655 HydrophobicContact CE-CG 3.7Å; M592-L655 HydrophobicContact SD-CD1 4.25Å; M592-L655 HydrophobicContact SD-CG 4.35Å
593	R	96.7	Very high	95.6	Very high	163 Å²	163	50.2 Å²	50.2	62%	0.615	26%	0.261	S	S	*	.	H	α-helix	trans	-66.6	-40.9	175.3	-70.4	179	-166.5	103.8	-5.7	112	L589 A590 Q591 K596 G597	L589-R593 WeakPolarHBondContact O-CG 3.45Å; L589-R593 PolarHBondContact O-N 3.04Å; L589-R593 PolarHBondContact O-NH1 3.05Å; A590-R593 PolarHBondContact O-N 2.91Å; Q591-R593 VanDerWaalsContact C-N 3.3Å; Q591-R593 PolarHBondContact O-N 2.98Å; R593-K596 WeakPolarHBondContact O-CB 3.33Å; R593-K596 PolarHBondContact O-N 3.07Å; R593-G597 PolarHBondContact O-N 3Å
594	A	95.7	Very high	95.3	Very high	51 Å²	51	53 Å²	53	42%	0.421	28%	0.282	S	S	.	.	H	α-helix	trans	-61.7	-48	175.8	0	0	0	0	0	111.2	A590 Q591 K596 G597 E598	A590-A594 PolarHBondContact O-N 3.45Å; Q591-A594 PolarHBondContact O-N 3.47Å; A594-K596 VanDerWaalsContact C-N 3.34Å; A594-K596 PolarHBondContact O-N 2.7Å; A594-G597 PolarHBondContact O-N 3.49Å; A594-E598 PolarHBondContact O-N 3.12Å
595	Q	95.8	Very high	94.9	Very high	11 Å²	11	55.6 Å²	55.6	5%	0.051	30%	0.301	C	S	.	.	H	α-helix	trans	-62.2	-40.3	175.9	-66.8	-57.1	-67.7	0	0	111.9	Q591 G597 E598 L599 L635 L655	Q591-Q595 WeakPolarHBondContact O-CG 3.22Å; Q591-Q595 PolarHBondContact O-N 2.94Å; Q595-G597 VanDerWaalsContact C-N 3.34Å; Q595-G597 PolarHBondContact O-N 3.4Å; Q595-E598 PolarHBondContact NE2-OE2 3.43Å; Q595-E598 VanDerWaalsContact NE2-OE2 3.11Å; Q595-E598 PolarHBondContact O-N 3.12Å; Q595-E598 PolarHBondContact OE1-OE2 2.98Å; Q595-L599 VanDerWaalsContact O-CG 3.32Å; Q595-L599 WeakPolarHBondContact O-CG 3.46Å; Q595-L599 PolarHBondContact O-N 2.91Å; Q595-L635 HydrophobicContact CB-CD2 4.3Å; Q595-L635 HydrophobicContact CG-CD1 4.45Å; Q595-L635 HydrophobicContact CG-CD2 3.93Å; Q595-L655 HydrophobicContact CB-CD1 4.32Å; Q595-L655 HydrophobicContact CB-CD2 4.04Å
596	K	96.3	Very high	94.3	Very high	99 Å²	99	53.2 Å²	53.2	43%	0.43	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-47.5	173.3	-168.8	-167.7	175.6	-178.5	0	111.8	M592 R593 A594 L599 L600 L655 T658	M592-K596 WeakPolarHBondContact O-CB 3.18Å; M592-K596 PolarHBondContact O-N 3.17Å; R593-K596 WeakPolarHBondContact O-CB 3.33Å; R593-K596 PolarHBondContact O-N 3.07Å; A594-K596 VanDerWaalsContact C-N 3.34Å; A594-K596 PolarHBondContact O-N 2.7Å; K596-L599 PolarHBondContact O-N 3.2Å; K596-L600 HydrophobicContact CG-CD1 4.46Å; K596-L600 WeakPolarHBondContact O-CG 3.46Å; K596-L600 PolarHBondContact O-N 2.92Å; K596-L600 VanDerWaalsContact O-N 3.15Å; K596-L655 HydrophobicContact CB-CD2 4.46Å; K596-T658 HydrophobicContact CD-CG2 4.24Å; K596-T658 HydrophobicContact CG-CG2 3.6Å
597	G	95.9	Very high	93.6	Very high	37 Å²	37	53.8 Å²	53.8	38%	0.381	28%	0.284	S	S	.	.	H	α-helix	trans	-60	-45.9	178	0	0	0	0	0	112.3	R593 A594 Q595 L599 L600 E601	R593-G597 PolarHBondContact O-N 3Å; A594-G597 PolarHBondContact O-N 3.49Å; Q595-G597 VanDerWaalsContact C-N 3.34Å; Q595-G597 PolarHBondContact O-N 3.4Å; G597-L599 VanDerWaalsContact C-N 3.34Å; G597-L599 PolarHBondContact O-N 2.75Å; G597-L600 PolarHBondContact O-N 2.92Å; G597-E601 WeakPolarHBondContact O-CB 3.46Å; G597-E601 PolarHBondContact O-N 2.82Å
598	E	94.4	Very high	93.1	Very high	58 Å²	58	56.6 Å²	56.6	27%	0.271	30%	0.297	S	S	.	.	H	α-helix	trans	-61.4	-38.4	178.6	-174.9	174.8	-169.7	0	0	112.8	A594 Q595 R602 Q631	A594-E598 PolarHBondContact O-N 3.12Å; Q595-E598 PolarHBondContact NE2-OE2 3.43Å; Q595-E598 VanDerWaalsContact NE2-OE2 3.11Å; Q595-E598 PolarHBondContact O-N 3.12Å; Q595-E598 PolarHBondContact OE1-OE2 2.98Å; E598-R602 VanDerWaalsContact O-CG 3.28Å; E598-R602 WeakPolarHBondContact O-CG 3.34Å; E598-R602 PolarHBondContact O-N 3.33Å; E598-R602 VanDerWaalsContact O-N 3.14Å; E598-R602 IonicContact OE1-CZ 3.58Å; E598-R602 IonicContact OE1-NE 2.73Å; E598-R602 IonicContact OE1-NH2 3.41Å; E598-R602 PolarHBondContact OE1-NH2 2.73Å; E598-Q631 PolarHBondContact OE2-NE2 2.7Å
599	L	95.6	Very high	92.6	Very high	2 Å²	2	56.1 Å²	56.1	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-67.1	-42.7	175.5	-62.5	177.6	0	0	0	112	Q595 K596 G597 R602 L603 V628 Q631 L632 L655	Q595-L599 VanDerWaalsContact O-CG 3.32Å; Q595-L599 WeakPolarHBondContact O-CG 3.46Å; Q595-L599 PolarHBondContact O-N 2.91Å; K596-L599 PolarHBondContact O-N 3.2Å; G597-L599 VanDerWaalsContact C-N 3.34Å; G597-L599 PolarHBondContact O-N 2.75Å; L599-R602 PolarHBondContact O-N 3.48Å; L599-L603 WeakPolarHBondContact O-CG 3.11Å; L599-L603 PolarHBondContact O-N 3.29Å; L599-V628 HydrophobicContact CD2-CG1 4.16Å; L599-Q631 HydrophobicContact CD2-CB 3.87Å; L599-Q631 HydrophobicContact CD2-CG 3.84Å; L599-L632 HydrophobicContact CD1-CD2 3.76Å; L599-L632 HydrophobicContact CD1-CG 4.4Å; L599-L632 HydrophobicContact CD2-CD2 4.38Å; L599-L632 HydrophobicContact CD2-CG 4.33Å; L599-L655 HydrophobicContact CD1-CB 3.93Å; L599-L655 HydrophobicContact CD1-CD2 4.15Å
600	L	95.3	Very high	92	Very high	52 Å²	52	54.6 Å²	54.6	27%	0.272	29%	0.29	S	S	.	.	H	α-helix	trans	-67.1	-40.5	178.7	-69.3	175.6	0	0	0	111.8	K596 G597 R602 L603 S604 T658 E662	K596-L600 HydrophobicContact CG-CD1 4.46Å; K596-L600 WeakPolarHBondContact O-CG 3.46Å; K596-L600 PolarHBondContact O-N 2.92Å; K596-L600 VanDerWaalsContact O-N 3.15Å; G597-L600 PolarHBondContact O-N 2.92Å; L600-R602 VanDerWaalsContact C-N 3.34Å; L600-R602 PolarHBondContact O-N 3.34Å; L600-L603 PolarHBondContact O-N 3.02Å; L600-S604 WeakPolarHBondContact O-CB 3.37Å; L600-S604 PolarHBondContact O-N 2.86Å; L600-T658 HydrophobicContact CD1-CG2 4.37Å; L600-T658 HydrophobicContact CD2-CG2 3.88Å; L600-T658 HydrophobicContact CG-CG2 4.06Å; L600-E662 HydrophobicContact CD2-CB 3.84Å; L600-E662 HydrophobicContact CD2-CG 3.76Å
601	E	94.5	Very high	91.5	Very high	141 Å²	141	57.1 Å²	57.1	66%	0.659	30%	0.297	S	S	*	.	H	α-helix	trans	-59.9	-45.2	175.5	-174.2	179.4	-178.4	0	0	111	G597 L603 S604	G597-E601 WeakPolarHBondContact O-CB 3.46Å; G597-E601 PolarHBondContact O-N 2.82Å; E601-L603 PolarHBondContact O-N 2.67Å; E601-S604 WeakPolarHBondContact O-CB 3.46Å; E601-S604 PolarHBondContact O-N 3.22Å; E601-S604 PolarHBondContact O-OG 2.93Å
602	R	93.1	Very high	91.1	Very high	58 Å²	58	56.9 Å²	56.9	22%	0.219	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-42.4	175.8	-69.2	172.7	-172.4	-164.5	7.5	112.3	E598 L599 L600 S604 S605 Q627 V628 Q631	E598-R602 VanDerWaalsContact O-CG 3.28Å; E598-R602 WeakPolarHBondContact O-CG 3.34Å; E598-R602 PolarHBondContact O-N 3.33Å; E598-R602 VanDerWaalsContact O-N 3.14Å; E598-R602 IonicContact OE1-CZ 3.58Å; E598-R602 IonicContact OE1-NE 2.73Å; E598-R602 IonicContact OE1-NH2 3.41Å; E598-R602 PolarHBondContact OE1-NH2 2.73Å; L599-R602 PolarHBondContact O-N 3.48Å; L600-R602 VanDerWaalsContact C-N 3.34Å; L600-R602 PolarHBondContact O-N 3.34Å; R602-S604 VanDerWaalsContact C-N 3.3Å; R602-S604 PolarHBondContact O-N 3.32Å; R602-S605 WeakPolarHBondContact O-CB 3.46Å; R602-S605 PolarHBondContact O-N 2.91Å; R602-S605 PolarHBondContact O-OG 3.39Å; R602-Q627 PolarHBondContact NH1-O 3.43Å; R602-V628 HydrophobicContact CB-CG2 3.96Å; R602-Q631 VanDerWaalsContact CZ-OE1 3.3Å
603	L	92.3	Very high	90.4	Very high	6 Å²	6	59.4 Å²	59.4	3%	0.031	31%	0.31	C	S	.	.	H	α-helix	trans	-65.5	-31.6	175.7	-76.1	175.3	0	0	0	112.8	L599 L600 E601 S605 A606 F609 V628 A659 E662 I663	L599-L603 WeakPolarHBondContact O-CG 3.11Å; L599-L603 PolarHBondContact O-N 3.29Å; L600-L603 PolarHBondContact O-N 3.02Å; E601-L603 PolarHBondContact O-N 2.67Å; L603-S605 PolarHBondContact O-N 2.9Å; L603-S605 VanDerWaalsContact O-N 3.16Å; L603-A606 WeakPolarHBondContact O-CB 3.38Å; L603-A606 PolarHBondContact O-N 3.36Å; L603-F609 HydrophobicContact CD2-CZ 4.43Å; L603-V628 HydrophobicContact CD1-CG2 4.5Å; L603-V628 HydrophobicContact CD2-CG2 3.75Å; L603-V628 HydrophobicContact CG-CG2 3.65Å; L603-A659 HydrophobicContact CD1-CB 4.07Å; L603-E662 HydrophobicContact CB-CG 4.48Å; L603-E662 HydrophobicContact CD1-CB 3.96Å; L603-E662 HydrophobicContact CD1-CG 4.09Å; L603-I663 HydrophobicContact CD2-CG1 4.36Å
604	S	90.1	Very high	90.1	Very high	79 Å²	79	55 Å²	55	55%	0.552	30%	0.299	S	S	*	.	H	α-helix	trans	-61.2	-25.6	178.6	79	0	0	0	0	113	L600 E601 R602 A606	L600-S604 WeakPolarHBondContact O-CB 3.37Å; L600-S604 PolarHBondContact O-N 2.86Å; E601-S604 WeakPolarHBondContact O-CB 3.46Å; E601-S604 PolarHBondContact O-N 3.22Å; E601-S604 PolarHBondContact O-OG 2.93Å; R602-S604 VanDerWaalsContact C-N 3.3Å; R602-S604 PolarHBondContact O-N 3.32Å; S604-A606 PolarHBondContact O-N 2.91Å
605	S	88.6	Confident	89.7	Confident	55 Å²	55	58.6 Å²	58.6	39%	0.385	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-15.7	174.8	73.7	0	0	0	0	113.8	R602 L603 R607 V620 A624	R602-S605 WeakPolarHBondContact O-CB 3.46Å; R602-S605 PolarHBondContact O-N 2.91Å; R602-S605 PolarHBondContact O-OG 3.39Å; L603-S605 PolarHBondContact O-N 2.9Å; L603-S605 VanDerWaalsContact O-N 3.16Å; S605-R607 PolarHBondContact O-N 3.46Å; S605-V620 WeakPolarHBondContact O-CG1 3.35Å; S605-A624 WeakPolarHBondContact OG-CB 3.14Å
606	A	83.4	Confident	89.4	Confident	2 Å²	2	63.5 Å²	63.5	2%	0.017	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	15.1	179.7	0	0	0	0	0	114.6	L603 S604 N608 F609 A621 A624	L603-A606 WeakPolarHBondContact O-CB 3.38Å; L603-A606 PolarHBondContact O-N 3.36Å; S604-A606 PolarHBondContact O-N 2.91Å; A606-N608 PolarHBondContact O-N 2.89Å; A606-N608 VanDerWaalsContact O-N 3.08Å; A606-F609 HydrophobicContact CB-CD1 4.22Å; A606-F609 HydrophobicContact CB-CE1 3.83Å; A606-F609 HydrophobicContact CB-CE2 4.27Å; A606-F609 HydrophobicContact CB-CZ 3.85Å; A606-F609 PolarHBondContact O-N 3.02Å; A606-A621 HydrophobicContact CB-CB 4.04Å; A606-A624 HydrophobicContact CB-CB 3.92Å
607	R	81.4	Confident	89.1	Confident	123 Å²	123	59.9 Å²	59.9	46%	0.464	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	47	41.4	178.7	-59.8	-176.8	-178.7	174.4	4.4	113.1	S605 F609 S610 E616 N617	S605-R607 PolarHBondContact O-N 3.46Å; R607-F609 PolarHBondContact O-N 3.34Å; R607-F609 VanDerWaalsContact O-N 3.09Å; R607-S610 PolarHBondContact O-N 2.66Å; R607-S610 PolarHBondContact O-OG 3.3Å; R607-E616 IonicContact CZ-OE1 3.52Å; R607-E616 IonicContact NH1-OE1 3.71Å; R607-E616 IonicContact NH2-OE1 2.7Å; R607-E616 PolarHBondContact NH2-OE1 3.49Å; R607-E616 VanDerWaalsContact NH2-OE1 3.14Å; R607-N617 WeakPolarHBondContact CD-OD1 3.48Å; R607-N617 PolarHBondContact NH1-OD1 3.22Å
608	N	84	Confident	88.9	Confident	84 Å²	84	60.4 Å²	60.4	45%	0.449	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	57.2	15.2	-176.6	-58.8	-49.6	0	0	0	116.1	A606 S610 K666	A606-N608 PolarHBondContact O-N 2.89Å; A606-N608 VanDerWaalsContact O-N 3.08Å; N608-S610 PolarHBondContact O-N 3.41Å; N608-K666 HydrophobicContact CB-CD 4.25Å; N608-K666 WeakPolarHBondContact OD1-CD 3.33Å; N608-K666 WeakPolarHBondContact OD1-CE 3.47Å; N608-K666 PolarHBondContact OD1-NZ 3.44Å
609	F	87	Confident	88.7	Confident	6 Å²	6	61.1 Å²	61.1	3%	0.026	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	59.2	29	-175.4	-51.3	-84.4	0	0	0	114.3	L603 A606 R607 M612 A621 V625 I663 K666 L681 L684	L603-F609 HydrophobicContact CD2-CZ 4.43Å; A606-F609 HydrophobicContact CB-CD1 4.22Å; A606-F609 HydrophobicContact CB-CE1 3.83Å; A606-F609 HydrophobicContact CB-CE2 4.27Å; A606-F609 HydrophobicContact CB-CZ 3.85Å; A606-F609 PolarHBondContact O-N 3.02Å; R607-F609 PolarHBondContact O-N 3.34Å; R607-F609 VanDerWaalsContact O-N 3.09Å; F609-M612 VanDerWaalsContact C-SD 3.6Å; F609-M612 HydrophobicContact CB-SD 4.12Å; F609-M612 VanDerWaalsContact O-CG 3.23Å; F609-M612 WeakPolarHBondContact O-CG 3Å; F609-A621 HydrophobicContact CD1-CB 3.98Å; F609-A621 HydrophobicContact CE1-CB 4.16Å; F609-V625 HydrophobicContact CE1-CG2 3.99Å; F609-V625 HydrophobicContact CZ-CG2 4.25Å; F609-I663 HydrophobicContact CE2-CG1 4.24Å; F609-I663 HydrophobicContact CZ-CG1 4.02Å; F609-K666 HydrophobicContact CD2-CB 3.69Å; F609-K666 HydrophobicContact CD2-CG 4.3Å; F609-K666 HydrophobicContact CE2-CB 4.14Å; F609-K666 HydrophobicContact CE2-CG 4.4Å; F609-L681 HydrophobicContact CB-CD2 3.76Å; F609-L681 HydrophobicContact CD1-CD2 4.46Å; F609-L681 HydrophobicContact CG-CD2 4.42Å; F609-L684 HydrophobicContact CD1-CD1 3.97Å; F609-L684 HydrophobicContact CE1-CD1 4.14Å
610	S	84.2	Confident	88.6	Confident	44 Å²	44	63 Å²	63	31%	0.308	33%	0.329	S	S	.	.			trans	-91	150.7	174.3	59.4	0	0	0	0	111.9	R607 N608	R607-S610 PolarHBondContact O-N 2.66Å; R607-S610 PolarHBondContact O-OG 3.3Å; N608-S610 PolarHBondContact O-N 3.41Å
611	N	84.9	Confident	88.5	Confident	104 Å²	104	60.5 Å²	60.5	56%	0.556	32%	0.316	S	S	*	.			trans	51.5	58.3	178.1	-57.1	-8.6	0	0	0	111.2	D613 N617	N611-D613 VanDerWaalsContact C-N 3.31Å; N611-D613 WeakPolarHBondContact CA-OD1 3.24Å; N611-N617 VanDerWaalsContact O-CB 3.26Å; N611-N617 WeakPolarHBondContact O-CB 3.49Å; N611-N617 PolarHBondContact O-ND2 2.84Å
612	M	87.1	Confident	88.5	Confident	1 Å²	1	54.2 Å²	54.2	1%	0.005	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-20.1	-175.2	-65.9	-60.1	-51.2	0	0	111.6	F609 D614 Y618 A621 D677 R680 L681 L684	F609-M612 VanDerWaalsContact C-SD 3.6Å; F609-M612 HydrophobicContact CB-SD 4.12Å; F609-M612 VanDerWaalsContact O-CG 3.23Å; F609-M612 WeakPolarHBondContact O-CG 3Å; M612-D614 PolarHBondContact O-N 3.46Å; M612-Y618 HydrophobicContact CE-CD2 3.56Å; M612-Y618 HydrophobicContact CE-CE2 4.49Å; M612-Y618 HydrophobicContact CE-CG 4.3Å; M612-A621 HydrophobicContact CE-CB 3.78Å; M612-A621 HydrophobicContact SD-CB 4.17Å; M612-D677 VanDerWaalsContact CA-OD1 3.28Å; M612-D677 WeakPolarHBondContact CA-OD1 3.26Å; M612-D677 HydrophobicContact CB-CB 4.28Å; M612-D677 WeakPolarHBondContact CB-OD1 3.42Å; M612-D677 PolarHBondContact N-OD1 3.29Å; M612-R680 HydrophobicContact CB-CB 4.18Å; M612-R680 WeakPolarHBondContact O-CD 3.35Å; M612-R680 PolarHBondContact O-NE 3.18Å; M612-R680 PolarHBondContact O-NH1 3.18Å; M612-L681 HydrophobicContact CG-CD2 3.83Å; M612-L681 HydrophobicContact CG-CG 4.12Å; M612-L681 HydrophobicContact SD-CD2 4.45Å; M612-L684 HydrophobicContact CE-CD1 3.57Å
613	D	82.5	Confident	88.5	Confident	72 Å²	72	57.6 Å²	57.6	39%	0.385	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-31.3	168.5	67.2	-35.4	0	0	0	113.9	N611 D677 R680	N611-D613 VanDerWaalsContact C-N 3.31Å; N611-D613 WeakPolarHBondContact CA-OD1 3.24Å; D613-D677 PolarHBondContact N-OD1 3.18Å; D613-R680 PolarHBondContact O-NH1 3.23Å; D613-R680 PolarHBondContact O-NH2 3.12Å
614	D	89.7	Confident	88.6	Confident	71 Å²	71	57.3 Å²	57.3	38%	0.38	30%	0.302	S	S	.	.	S	Bend	trans	-71	126.9	171	178.2	-97.7	0	0	0	112	M612 E616 N617 Y618 R680	M612-D614 PolarHBondContact O-N 3.46Å; D614-E616 VanDerWaalsContact C-N 3.32Å; D614-E616 PolarHBondContact O-N 3.32Å; D614-E616 WeakPolarHBondContact OD1-CA 3.36Å; D614-E616 VanDerWaalsContact OD1-CB 3.26Å; D614-E616 WeakPolarHBondContact OD1-CB 3.24Å; D614-E616 PolarHBondContact OD1-N 2.99Å; D614-N617 HydrophobicContact CB-CB 4.16Å; D614-N617 PolarHBondContact O-N 3.44Å; D614-N617 PolarHBondContact OD1-N 3.15Å; D614-Y618 PolarHBondContact O-N 3.47Å; D614-R680 VanDerWaalsContact C-NH1 3.32Å; D614-R680 PolarHBondContact O-NH1 2.96Å
615	E	88.1	Confident	88.9	Confident	125 Å²	125	53.8 Å²	53.8	58%	0.584	28%	0.277	S	S	*	.	H	α-helix	trans	-64.1	-33	-177.5	-73.8	-63.8	146.5	0	0	113.3	S619 R680	E615-S619 WeakPolarHBondContact O-CB 3.27Å; E615-S619 PolarHBondContact O-N 2.99Å; E615-R680 IonicContact OE1-CZ 2.78Å; E615-R680 VanDerWaalsContact OE1-CZ 3.27Å; E615-R680 IonicContact OE1-NH1 3.8Å; E615-R680 PolarHBondContact OE1-NH1 3.26Å; E615-R680 IonicContact OE1-NH2 2.76Å; E615-R680 PolarHBondContact OE1-NH2 3.04Å
616	E	89.9	Confident	89.2	Confident	115 Å²	115	58 Å²	58	54%	0.537	29%	0.285	S	S	.	.	H	α-helix	trans	-68.9	-48	177.8	-168.5	-168.3	135.2	0	0	110.1	R607 D614 Y618 S619 V620	R607-E616 IonicContact CZ-OE1 3.52Å; R607-E616 IonicContact NH1-OE1 3.71Å; R607-E616 IonicContact NH2-OE1 2.7Å; R607-E616 PolarHBondContact NH2-OE1 3.49Å; R607-E616 VanDerWaalsContact NH2-OE1 3.14Å; D614-E616 VanDerWaalsContact C-N 3.32Å; D614-E616 PolarHBondContact O-N 3.32Å; D614-E616 WeakPolarHBondContact OD1-CA 3.36Å; D614-E616 VanDerWaalsContact OD1-CB 3.26Å; D614-E616 WeakPolarHBondContact OD1-CB 3.24Å; D614-E616 PolarHBondContact OD1-N 2.99Å; E616-Y618 PolarHBondContact O-N 3.28Å; E616-S619 PolarHBondContact O-N 3.42Å; E616-V620 VanDerWaalsContact O-CG2 3.31Å; E616-V620 WeakPolarHBondContact O-CG2 3.33Å; E616-V620 PolarHBondContact O-N 2.67Å
617	N	89.4	Confident	89.7	Confident	22 Å²	22	61.4 Å²	61.4	12%	0.118	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-45.8	177.1	-70.2	-24.7	0	0	0	111.9	R607 N611 D614 S619 V620 A621	R607-N617 WeakPolarHBondContact CD-OD1 3.48Å; R607-N617 PolarHBondContact NH1-OD1 3.22Å; N611-N617 VanDerWaalsContact O-CB 3.26Å; N611-N617 WeakPolarHBondContact O-CB 3.49Å; N611-N617 PolarHBondContact O-ND2 2.84Å; D614-N617 HydrophobicContact CB-CB 4.16Å; D614-N617 PolarHBondContact O-N 3.44Å; D614-N617 PolarHBondContact OD1-N 3.15Å; N617-S619 PolarHBondContact O-N 2.98Å; N617-V620 PolarHBondContact O-N 3.23Å; N617-A621 WeakPolarHBondContact O-CB 3.34Å; N617-A621 PolarHBondContact O-N 3.28Å
618	Y	91.2	Very high	90.4	Very high	48 Å²	48	55.7 Å²	55.7	19%	0.188	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-43.9	176.4	180	-107.1	0	0	0	112.3	M612 D614 E616 V620 A621 S622 R680 S683 L684	M612-Y618 HydrophobicContact CE-CD2 3.56Å; M612-Y618 HydrophobicContact CE-CE2 4.49Å; M612-Y618 HydrophobicContact CE-CG 4.3Å; D614-Y618 PolarHBondContact O-N 3.47Å; E616-Y618 PolarHBondContact O-N 3.28Å; Y618-V620 PolarHBondContact O-N 3.29Å; Y618-A621 PolarHBondContact O-N 3Å; Y618-S622 WeakPolarHBondContact O-CB 3.49Å; Y618-S622 PolarHBondContact O-N 3.32Å; Y618-R680 HydrophobicContact CD2-CB 3.67Å; Y618-R680 HydrophobicContact CD2-CG 3.92Å; Y618-R680 HydrophobicContact CE2-CB 3.7Å; Y618-R680 HydrophobicContact CE2-CG 3.98Å; Y618-R680 HydrophobicContact CG-CG 4.5Å; Y618-S683 PolarHBondContact OH-OG 3.39Å; Y618-L684 HydrophobicContact CD2-CG 4.49Å; Y618-L684 HydrophobicContact CE2-CD1 4.43Å; Y618-L684 HydrophobicContact CE2-CD2 3.99Å; Y618-L684 HydrophobicContact CE2-CG 3.92Å
619	S	91.4	Very high	91	Very high	74 Å²	74	51.9 Å²	51.9	52%	0.517	26%	0.258	S	S	.	.	H	α-helix	trans	-60.4	-44.3	176.7	-177.8	0	0	0	0	111.9	E615 E616 N617 K623	E615-S619 WeakPolarHBondContact O-CB 3.27Å; E615-S619 PolarHBondContact O-N 2.99Å; E616-S619 PolarHBondContact O-N 3.42Å; N617-S619 PolarHBondContact O-N 2.98Å; S619-K623 VanDerWaalsContact O-CB 3.25Å; S619-K623 WeakPolarHBondContact O-CB 3.35Å; S619-K623 PolarHBondContact O-N 2.9Å
620	V	93.4	Very high	91.3	Very high	41 Å²	41	56.7 Å²	56.7	25%	0.248	28%	0.281	C	S	.	.	H	α-helix	trans	-63.9	-47.4	177.6	172	0	0	0	0	111.4	S605 E616 N617 Y618 K623 A624	S605-V620 WeakPolarHBondContact O-CG1 3.35Å; E616-V620 VanDerWaalsContact O-CG2 3.31Å; E616-V620 WeakPolarHBondContact O-CG2 3.33Å; E616-V620 PolarHBondContact O-N 2.67Å; N617-V620 PolarHBondContact O-N 3.23Å; Y618-V620 PolarHBondContact O-N 3.29Å; V620-K623 PolarHBondContact O-N 3.34Å; V620-A624 WeakPolarHBondContact O-CB 3.47Å; V620-A624 PolarHBondContact O-N 2.9Å
621	A	92.9	Very high	91.8	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.2	-42.4	178.3	0	0	0	0	0	112.4	A606 F609 M612 N617 Y618 K623 A624 V625 L684	A606-A621 HydrophobicContact CB-CB 4.04Å; F609-A621 HydrophobicContact CD1-CB 3.98Å; F609-A621 HydrophobicContact CE1-CB 4.16Å; M612-A621 HydrophobicContact CE-CB 3.78Å; M612-A621 HydrophobicContact SD-CB 4.17Å; N617-A621 WeakPolarHBondContact O-CB 3.34Å; N617-A621 PolarHBondContact O-N 3.28Å; Y618-A621 PolarHBondContact O-N 3Å; A621-K623 VanDerWaalsContact C-N 3.33Å; A621-K623 PolarHBondContact O-N 3.39Å; A621-A624 PolarHBondContact O-N 3.46Å; A621-V625 WeakPolarHBondContact O-CG2 3.29Å; A621-V625 PolarHBondContact O-N 3.09Å; A621-L684 HydrophobicContact CB-CD1 3.95Å
622	S	93.3	Very high	92.4	Very high	8 Å²	8	50.5 Å²	50.5	6%	0.056	24%	0.244	C	C	.	.	H	α-helix	trans	-60.1	-43.6	174.4	-171.2	0	0	0	0	111.6	Y618 V625 R626 L684	Y618-S622 WeakPolarHBondContact O-CB 3.49Å; Y618-S622 PolarHBondContact O-N 3.32Å; S622-V625 PolarHBondContact O-N 3.44Å; S622-R626 WeakPolarHBondContact O-CB 3.34Å; S622-R626 WeakPolarHBondContact O-CG 3.29Å; S622-R626 PolarHBondContact O-N 2.98Å; S622-L684 VanDerWaalsContact CA-CD2 3.45Å
623	K	93.6	Very high	92.7	Very high	129 Å²	129	53 Å²	53	56%	0.561	26%	0.255	S	S	*	.	H	α-helix	trans	-62.5	-44	175.1	-173.5	178.7	-179.7	-178.4	0	111.5	S619 V620 A621 R626 Q627	S619-K623 VanDerWaalsContact O-CB 3.25Å; S619-K623 WeakPolarHBondContact O-CB 3.35Å; S619-K623 PolarHBondContact O-N 2.9Å; V620-K623 PolarHBondContact O-N 3.34Å; A621-K623 VanDerWaalsContact C-N 3.33Å; A621-K623 PolarHBondContact O-N 3.39Å; K623-R626 PolarHBondContact O-N 3.16Å; K623-Q627 HydrophobicContact CG-CG 4.42Å; K623-Q627 WeakPolarHBondContact O-CB 3.44Å; K623-Q627 WeakPolarHBondContact O-CG 3.45Å; K623-Q627 PolarHBondContact O-N 3Å
624	A	94.9	Very high	93.3	Very high	1 Å²	1	56.2 Å²	56.2	1%	0.008	26%	0.261	C	S	.	.	H	α-helix	trans	-60.5	-48	177.8	0	0	0	0	0	111.9	S605 A606 V620 A621 R626 Q627 V628	S605-A624 WeakPolarHBondContact OG-CB 3.14Å; A606-A624 HydrophobicContact CB-CB 3.92Å; V620-A624 WeakPolarHBondContact O-CB 3.47Å; V620-A624 PolarHBondContact O-N 2.9Å; A621-A624 PolarHBondContact O-N 3.46Å; A624-R626 PolarHBondContact O-N 3.35Å; A624-Q627 PolarHBondContact O-N 2.64Å; A624-V628 VanDerWaalsContact O-CG2 3.26Å; A624-V628 WeakPolarHBondContact O-CG2 3.49Å; A624-V628 PolarHBondContact O-N 3.14Å
625	V	95.3	Very high	93.5	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.024	25%	0.245	C	C	.	.	H	α-helix	trans	-60.7	-46.7	177	170.9	0	0	0	0	111.3	F609 A621 S622 Q627 V628 L629 V688	F609-V625 HydrophobicContact CE1-CG2 3.99Å; F609-V625 HydrophobicContact CZ-CG2 4.25Å; A621-V625 WeakPolarHBondContact O-CG2 3.29Å; A621-V625 PolarHBondContact O-N 3.09Å; S622-V625 PolarHBondContact O-N 3.44Å; V625-Q627 VanDerWaalsContact C-N 3.34Å; V625-Q627 PolarHBondContact O-N 3.32Å; V625-V628 WeakPolarHBondContact O-CB 3.49Å; V625-V628 PolarHBondContact O-N 3.42Å; V625-L629 HydrophobicContact CG1-CD1 4.12Å; V625-L629 WeakPolarHBondContact O-CG 3.47Å; V625-L629 PolarHBondContact O-N 3.08Å; V625-V688 HydrophobicContact CG1-CG2 3.41Å; V625-V688 VanDerWaalsContact CG1-CG2 3.41Å
626	R	94.8	Very high	93.8	Very high	144 Å²	144	47.3 Å²	47.3	54%	0.543	22%	0.219	S	C	.	.	H	α-helix	trans	-63.4	-38.3	176.7	-73.6	178.3	-178	156.7	3.5	112.4	S622 K623 A624 V628 L629 H630	S622-R626 WeakPolarHBondContact O-CB 3.34Å; S622-R626 WeakPolarHBondContact O-CG 3.29Å; S622-R626 PolarHBondContact O-N 2.98Å; K623-R626 PolarHBondContact O-N 3.16Å; A624-R626 PolarHBondContact O-N 3.35Å; R626-V628 VanDerWaalsContact C-N 3.32Å; R626-V628 PolarHBondContact O-N 2.61Å; R626-L629 PolarHBondContact O-N 3.02Å; R626-H630 WeakPolarHBondContact O-CB 3.28Å; R626-H630 PolarHBondContact O-N 3.48Å
627	Q	94.5	Very high	93.9	Very high	73 Å²	73	47.2 Å²	47.2	34%	0.341	22%	0.221	S	C	.	.	H	α-helix	trans	-64.2	-36.3	176.4	-78.8	176.4	-10.4	0	0	112.7	R602 K623 A624 V625 Q631	R602-Q627 PolarHBondContact NH1-O 3.43Å; K623-Q627 HydrophobicContact CG-CG 4.42Å; K623-Q627 WeakPolarHBondContact O-CB 3.44Å; K623-Q627 WeakPolarHBondContact O-CG 3.45Å; K623-Q627 PolarHBondContact O-N 3Å; A624-Q627 PolarHBondContact O-N 2.64Å; V625-Q627 VanDerWaalsContact C-N 3.34Å; V625-Q627 PolarHBondContact O-N 3.32Å; Q627-Q631 PolarHBondContact O-N 2.69Å
628	V	96.4	Very high	94.1	Very high	4 Å²	4	48.6 Å²	48.6	2%	0.024	23%	0.229	C	C	.	.	H	α-helix	trans	-67	-49.7	175.5	167.3	0	0	0	0	110.4	L599 R602 L603 A624 V625 R626 H630 Q631 L632 A659	L599-V628 HydrophobicContact CD2-CG1 4.16Å; R602-V628 HydrophobicContact CB-CG2 3.96Å; L603-V628 HydrophobicContact CD1-CG2 4.5Å; L603-V628 HydrophobicContact CD2-CG2 3.75Å; L603-V628 HydrophobicContact CG-CG2 3.65Å; A624-V628 VanDerWaalsContact O-CG2 3.26Å; A624-V628 WeakPolarHBondContact O-CG2 3.49Å; A624-V628 PolarHBondContact O-N 3.14Å; V625-V628 WeakPolarHBondContact O-CB 3.49Å; V625-V628 PolarHBondContact O-N 3.42Å; R626-V628 VanDerWaalsContact C-N 3.32Å; R626-V628 PolarHBondContact O-N 2.61Å; V628-H630 VanDerWaalsContact C-N 3.31Å; V628-H630 PolarHBondContact O-N 3.02Å; V628-Q631 WeakPolarHBondContact O-CB 3.17Å; V628-Q631 PolarHBondContact O-N 3.37Å; V628-L632 HydrophobicContact CG1-CD1 4.43Å; V628-L632 WeakPolarHBondContact O-CG 3.14Å; V628-L632 PolarHBondContact O-N 2.92Å; V628-A659 HydrophobicContact CG1-CB 3.78Å
629	L	95.4	Very high	94.3	Very high	3 Å²	3	46.3 Å²	46.3	2%	0.016	22%	0.22	C	C	.	.	H	α-helix	trans	-60.7	-41.6	176.1	-69.3	168.1	0	0	0	111.8	V625 R626 Q631 L632 K633 T687 V688 E691	V625-L629 HydrophobicContact CG1-CD1 4.12Å; V625-L629 WeakPolarHBondContact O-CG 3.47Å; V625-L629 PolarHBondContact O-N 3.08Å; R626-L629 PolarHBondContact O-N 3.02Å; L629-Q631 VanDerWaalsContact C-N 3.34Å; L629-Q631 PolarHBondContact O-N 3.14Å; L629-L632 PolarHBondContact O-N 3.14Å; L629-K633 WeakPolarHBondContact O-CG 3.39Å; L629-K633 PolarHBondContact O-N 2.72Å; L629-T687 HydrophobicContact CD1-CG2 4.14Å; L629-V688 HydrophobicContact CD1-CG2 4.4Å; L629-E691 HydrophobicContact CD1-CB 3.93Å; L629-E691 HydrophobicContact CD2-CB 4.38Å
630	H	95.1	Very high	94.3	Very high	108 Å²	108	45 Å²	45	50%	0.5	21%	0.206	S	C	.	.	H	α-helix	trans	-63.1	-39.7	176.2	-174.6	72.3	0	0	0	112.1	R626 V628 K633 R634	R626-H630 WeakPolarHBondContact O-CB 3.28Å; R626-H630 PolarHBondContact O-N 3.48Å; V628-H630 VanDerWaalsContact C-N 3.31Å; V628-H630 PolarHBondContact O-N 3.02Å; H630-K633 PolarHBondContact O-N 3Å; H630-R634 VanDerWaalsContact NE2-CD 3.32Å; H630-R634 WeakPolarHBondContact NE2-CD 3.46Å; H630-R634 WeakPolarHBondContact O-CB 3.26Å; H630-R634 WeakPolarHBondContact O-CG 3.46Å; H630-R634 PolarHBondContact O-N 3.17Å
631	Q	94.3	Very high	94.1	Very high	17 Å²	17	44.7 Å²	44.7	8%	0.079	20%	0.203	C	C	.	.	H	α-helix	trans	-60.4	-47.9	173.2	-168.9	58.1	15.7	0	0	111.8	E598 L599 R602 Q627 V628 L629 K633 R634 L635	E598-Q631 PolarHBondContact OE2-NE2 2.7Å; L599-Q631 HydrophobicContact CD2-CB 3.87Å; L599-Q631 HydrophobicContact CD2-CG 3.84Å; R602-Q631 VanDerWaalsContact CZ-OE1 3.3Å; Q627-Q631 PolarHBondContact O-N 2.69Å; V628-Q631 WeakPolarHBondContact O-CB 3.17Å; V628-Q631 PolarHBondContact O-N 3.37Å; L629-Q631 VanDerWaalsContact C-N 3.34Å; L629-Q631 PolarHBondContact O-N 3.14Å; Q631-K633 VanDerWaalsContact C-N 3.32Å; Q631-K633 PolarHBondContact O-N 3.07Å; Q631-R634 PolarHBondContact O-N 2.91Å; Q631-L635 WeakPolarHBondContact O-CB 3.36Å; Q631-L635 PolarHBondContact O-N 3.09Å
632	L	96.3	Very high	94.1	Very high	1 Å²	1	44.9 Å²	44.9	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-43.7	-180	-71.2	174.2	0	0	0	110.7	L599 V628 L629 L635 G636 M652 L655 L656 V695	L599-L632 HydrophobicContact CD1-CD2 3.76Å; L599-L632 HydrophobicContact CD1-CG 4.4Å; L599-L632 HydrophobicContact CD2-CD2 4.38Å; L599-L632 HydrophobicContact CD2-CG 4.33Å; V628-L632 HydrophobicContact CG1-CD1 4.43Å; V628-L632 WeakPolarHBondContact O-CG 3.14Å; V628-L632 PolarHBondContact O-N 2.92Å; L629-L632 PolarHBondContact O-N 3.14Å; L632-L635 PolarHBondContact O-N 3.26Å; L632-G636 PolarHBondContact O-N 3.23Å; L632-M652 HydrophobicContact CB-CE 4.26Å; L632-M652 HydrophobicContact CD2-CE 4.18Å; L632-M652 WeakPolarHBondContact O-CE 3.28Å; L632-L655 HydrophobicContact CD2-CB 3.57Å; L632-L655 HydrophobicContact CD2-CD1 4.28Å; L632-L656 HydrophobicContact CD1-CB 4.36Å; L632-L656 HydrophobicContact CD1-CD1 3.94Å; L632-V695 HydrophobicContact CB-CG1 3.88Å; L632-V695 HydrophobicContact CB-CG2 3.92Å
633	K	94.7	Very high	94.2	Very high	54 Å²	54	44.9 Å²	44.9	24%	0.235	20%	0.204	C	C	.	.	H	α-helix	trans	-60.8	-46.4	174.5	-72.9	174.8	174.2	-179.9	0	111.7	L629 H630 Q631 G636 I637 E691 V695	L629-K633 WeakPolarHBondContact O-CG 3.39Å; L629-K633 PolarHBondContact O-N 2.72Å; H630-K633 PolarHBondContact O-N 3Å; Q631-K633 VanDerWaalsContact C-N 3.32Å; Q631-K633 PolarHBondContact O-N 3.07Å; K633-G636 PolarHBondContact O-N 2.61Å; K633-I637 WeakPolarHBondContact O-CG1 3.49Å; K633-I637 PolarHBondContact O-N 2.94Å; K633-E691 IonicContact NZ-OE2 3.18Å; K633-E691 PolarHBondContact NZ-OE2 3.2Å; K633-V695 HydrophobicContact CG-CG2 4.19Å
634	R	94.6	Very high	94.2	Very high	139 Å²	139	39.5 Å²	39.5	53%	0.525	18%	0.182	S	C	.	.	H	α-helix	trans	-60.7	-46.1	176.6	-76.9	-179	63.3	-161.3	1.3	112.4	H630 Q631 G636 I637 V638	H630-R634 VanDerWaalsContact NE2-CD 3.32Å; H630-R634 WeakPolarHBondContact NE2-CD 3.46Å; H630-R634 WeakPolarHBondContact O-CB 3.26Å; H630-R634 WeakPolarHBondContact O-CG 3.46Å; H630-R634 PolarHBondContact O-N 3.17Å; Q631-R634 PolarHBondContact O-N 2.91Å; R634-G636 VanDerWaalsContact C-N 3.3Å; R634-I637 PolarHBondContact O-N 3.42Å; R634-V638 WeakPolarHBondContact O-CG2 3.36Å; R634-V638 PolarHBondContact O-N 3.34Å; R634-V638 VanDerWaalsContact O-N 3.1Å
635	L	94.9	Very high	94.1	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-65.3	-38.3	178	-171.8	64	0	0	0	111.4	P534 Q595 Q631 L632 I637 V638 W639 L655	P534-L635 HydrophobicContact CB-CD1 3.63Å; P534-L635 HydrophobicContact CG-CD1 4.01Å; Q595-L635 HydrophobicContact CB-CD2 4.3Å; Q595-L635 HydrophobicContact CG-CD1 4.45Å; Q595-L635 HydrophobicContact CG-CD2 3.93Å; Q631-L635 WeakPolarHBondContact O-CB 3.36Å; Q631-L635 PolarHBondContact O-N 3.09Å; L632-L635 PolarHBondContact O-N 3.26Å; L635-I637 VanDerWaalsContact C-N 3.32Å; L635-I637 PolarHBondContact O-N 3.02Å; L635-V638 PolarHBondContact O-N 3.37Å; L635-V638 VanDerWaalsContact O-N 3.12Å; L635-W639 HydrophobicContact CD1-CD2 4.07Å; L635-W639 HydrophobicContact CD1-CE3 4.37Å; L635-W639 HydrophobicContact CD1-CH2 3.99Å; L635-W639 HydrophobicContact CD1-CZ2 3.65Å; L635-W639 HydrophobicContact CD1-CZ3 4.33Å; L635-W639 HydrophobicContact CD2-CE3 4.19Å; L635-W639 HydrophobicContact CD2-CH2 3.49Å; L635-W639 VanDerWaalsContact CD2-CH2 3.49Å; L635-W639 HydrophobicContact CD2-CZ2 4.05Å; L635-W639 HydrophobicContact CD2-CZ3 3.56Å; L635-W639 HydrophobicContact CG-CD2 3.99Å; L635-W639 HydrophobicContact CG-CE3 3.82Å; L635-W639 HydrophobicContact CG-CH2 3.81Å; L635-W639 HydrophobicContact CG-CZ2 3.98Å; L635-W639 HydrophobicContact CG-CZ3 3.72Å; L635-W639 PolarHBondContact O-N 3.13Å; L635-L655 HydrophobicContact CD2-CD1 3.39Å
636	G	93.6	Very high	93.9	Very high	3 Å²	3	46.5 Å²	46.5	3%	0.031	22%	0.22	C	C	.	.	H	α-helix	trans	-55.5	-45.5	171.7	0	0	0	0	0	111.9	L632 K633 R634 V638 W639 Q640 Y648	L632-G636 PolarHBondContact O-N 3.23Å; K633-G636 PolarHBondContact O-N 2.61Å; R634-G636 VanDerWaalsContact C-N 3.3Å; G636-V638 PolarHBondContact O-N 2.82Å; G636-W639 PolarHBondContact O-N 3.37Å; G636-Q640 WeakPolarHBondContact O-CB 3.27Å; G636-Q640 PolarHBondContact O-N 3.43Å; G636-Y648 WeakPolarHBondContact CA-OH 3.39Å; G636-Y648 VanDerWaalsContact O-CE2 3.28Å; G636-Y648 WeakPolarHBondContact O-CE2 3.23Å; G636-Y648 PolarHBondContact O-OH 3.47Å
637	I	92.9	Very high	93.9	Very high	113 Å²	113	42.5 Å²	42.5	58%	0.579	21%	0.209	S	C	*	.	H	α-helix	trans	-64.3	-39.7	175.5	-64.5	163.3	0	0	0	111.4	K633 R634 L635 W639 Q640	K633-I637 WeakPolarHBondContact O-CG1 3.49Å; K633-I637 PolarHBondContact O-N 2.94Å; R634-I637 PolarHBondContact O-N 3.42Å; L635-I637 VanDerWaalsContact C-N 3.32Å; L635-I637 PolarHBondContact O-N 3.02Å; I637-W639 VanDerWaalsContact C-N 3.34Å; I637-W639 PolarHBondContact O-N 2.98Å; I637-Q640 WeakPolarHBondContact O-CB 3.49Å; I637-Q640 PolarHBondContact O-N 3.43Å
638	V	93.7	Very high	94	Very high	50 Å²	50	39.2 Å²	39.2	30%	0.303	19%	0.194	S	C	.	.	H	α-helix	trans	-65.8	-35.8	-179.4	171.2	0	0	0	0	112.5	P534 Q535 R634 L635 G636	P534-V638 HydrophobicContact CB-CG1 4.44Å; Q535-V638 HydrophobicContact CB-CG1 3.56Å; Q535-V638 HydrophobicContact CG-CG1 4.02Å; R634-V638 WeakPolarHBondContact O-CG2 3.36Å; R634-V638 PolarHBondContact O-N 3.34Å; R634-V638 VanDerWaalsContact O-N 3.1Å; L635-V638 PolarHBondContact O-N 3.37Å; L635-V638 VanDerWaalsContact O-N 3.12Å; G636-V638 PolarHBondContact O-N 2.82Å
639	W	95.3	Very high	93.9	Very high	0 Å²	0	39 Å²	39	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-93	-14.5	179.5	-68.3	-21.3	0	0	0	114	P534 F588 M592 L635 G636 I637 V642 L643 Y648 A651 M652 L655	P534-W639 HydrophobicContact CB-CZ2 4.34Å; P534-W639 PolarHBondContact O-NE1 3.29Å; F588-W639 AromaticContact CE2-CE2 3.98Å; F588-W639 HydrophobicContact CE2-CH2 4.33Å; F588-W639 AromaticContact CE2-CZ2 3.83Å; F588-W639 HydrophobicContact CE2-CZ2 3.83Å; F588-W639 HydrophobicContact CZ-CH2 4.21Å; F588-W639 HydrophobicContact CZ-CZ2 4.17Å; F588-W639 HydrophobicContact CZ-CZ3 4.49Å; M592-W639 HydrophobicContact SD-CH2 3.52Å; M592-W639 VanDerWaalsContact SD-CH2 3.52Å; M592-W639 HydrophobicContact SD-CZ2 4.49Å; M592-W639 HydrophobicContact SD-CZ3 4Å; L635-W639 HydrophobicContact CD1-CD2 4.07Å; L635-W639 HydrophobicContact CD1-CE3 4.37Å; L635-W639 HydrophobicContact CD1-CH2 3.99Å; L635-W639 HydrophobicContact CD1-CZ2 3.65Å; L635-W639 HydrophobicContact CD1-CZ3 4.33Å; L635-W639 HydrophobicContact CD2-CE3 4.19Å; L635-W639 HydrophobicContact CD2-CH2 3.49Å; L635-W639 VanDerWaalsContact CD2-CH2 3.49Å; L635-W639 HydrophobicContact CD2-CZ2 4.05Å; L635-W639 HydrophobicContact CD2-CZ3 3.56Å; L635-W639 HydrophobicContact CG-CD2 3.99Å; L635-W639 HydrophobicContact CG-CE3 3.82Å; L635-W639 HydrophobicContact CG-CH2 3.81Å; L635-W639 HydrophobicContact CG-CZ2 3.98Å; L635-W639 HydrophobicContact CG-CZ3 3.72Å; L635-W639 PolarHBondContact O-N 3.13Å; G636-W639 PolarHBondContact O-N 3.37Å; I637-W639 VanDerWaalsContact C-N 3.34Å; I637-W639 PolarHBondContact O-N 2.98Å; W639-V642 PolarHBondContact O-N 3.15Å; W639-V642 VanDerWaalsContact O-N 3.12Å; W639-L643 HydrophobicContact CB-CD1 3.93Å; W639-L643 HydrophobicContact CB-CG 4.41Å; W639-L643 HydrophobicContact CD2-CD1 4.1Å; W639-L643 HydrophobicContact CE3-CD1 4.39Å; W639-L643 HydrophobicContact CG-CD1 3.91Å; W639-L643 PolarHBondContact O-N 3.46Å; W639-L643 VanDerWaalsContact O-N 3.16Å; W639-Y648 HydrophobicContact CB-CD2 3.83Å; W639-Y648 HydrophobicContact CB-CE2 3.92Å; W639-A651 HydrophobicContact CE3-CB 4.34Å; W639-A651 HydrophobicContact CZ3-CB 3.91Å; W639-M652 HydrophobicContact CE3-SD 3.56Å; W639-M652 VanDerWaalsContact CE3-SD 3.56Å; W639-M652 HydrophobicContact CZ3-SD 3.69Å; W639-L655 HydrophobicContact CH2-CD1 4.06Å; W639-L655 HydrophobicContact CZ3-CD1 3.93Å
640	Q	91.3	Very high	93.9	Very high	46 Å²	46	45.6 Å²	45.6	22%	0.215	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	137	172.8	-175.7	179.8	42.4	0	0	109.6	G636 I637 V642 A697 L699	G636-Q640 WeakPolarHBondContact O-CB 3.27Å; G636-Q640 PolarHBondContact O-N 3.43Å; I637-Q640 WeakPolarHBondContact O-CB 3.49Å; I637-Q640 PolarHBondContact O-N 3.43Å; Q640-V642 PolarHBondContact O-N 2.91Å; Q640-A697 WeakPolarHBondContact CG-O 3.34Å; Q640-A697 PolarHBondContact NE2-O 3.29Å; Q640-A697 VanDerWaalsContact NE2-O 3.11Å; Q640-L699 PolarHBondContact NE2-O 3.46Å
641	D	87.4	Confident	94	Very high	36 Å²	36	40.6 Å²	40.6	19%	0.193	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.2	1.7	-174.8	-159.9	52.5	0	0	0	115.6	K423 R477	K423-D641 WeakPolarHBondContact CE-OD1 3.42Å; K423-D641 IonicContact NZ-OD1 2.92Å; K423-D641 PolarHBondContact NZ-OD1 3.28Å; R477-D641 WeakPolarHBondContact CD-O 3.15Å; R477-D641 WeakPolarHBondContact CG-O 3.5Å; R477-D641 IonicContact CZ-OD2 2.73Å; R477-D641 PolarHBondContact NE-O 3.01Å; R477-D641 IonicContact NE-OD2 3.64Å; R477-D641 PolarHBondContact NE-OD2 3.4Å; R477-D641 IonicContact NH2-OD2 2.67Å; R477-D641 PolarHBondContact NH2-OD2 3.17Å
642	V	93.8	Very high	94.1	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.024	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-60.1	173.1	178.7	0	0	0	0	110.7	C476 R477 Q535 A538 I539 N542 W639 Q640	C476-V642 WeakPolarHBondContact CA-O 3.12Å; R477-V642 PolarHBondContact N-O 3.08Å; Q535-V642 HydrophobicContact CG-CG2 4.39Å; A538-V642 HydrophobicContact CB-CG1 3.92Å; I539-V642 HydrophobicContact CG1-CG1 3.79Å; N542-V642 PolarHBondContact ND2-O 2.78Å; W639-V642 PolarHBondContact O-N 3.15Å; W639-V642 VanDerWaalsContact O-N 3.12Å; Q640-V642 PolarHBondContact O-N 2.91Å
643	L	94.9	Very high	94.1	Very high	8 Å²	8	39.8 Å²	39.8	4%	0.042	20%	0.195	C	C	.	.	S	Bend	trans	-82	151.2	-174.9	-70.1	173.9	0	0	0	112	A538 F588 W639 I647	A538-L643 HydrophobicContact CB-CD1 4.37Å; A538-L643 HydrophobicContact CB-CD2 3.8Å; A538-L643 HydrophobicContact CB-CG 4Å; F588-L643 HydrophobicContact CE2-CD1 4.03Å; F588-L643 HydrophobicContact CZ-CD1 3.66Å; W639-L643 HydrophobicContact CB-CD1 3.93Å; W639-L643 HydrophobicContact CB-CG 4.41Å; W639-L643 HydrophobicContact CD2-CD1 4.1Å; W639-L643 HydrophobicContact CE3-CD1 4.39Å; W639-L643 HydrophobicContact CG-CD1 3.91Å; W639-L643 PolarHBondContact O-N 3.46Å; W639-L643 VanDerWaalsContact O-N 3.16Å; L643-I647 HydrophobicContact CD1-CG2 4.4Å; L643-I647 HydrophobicContact CD2-CG2 4.18Å
644	P	94.5	Very high	94.2	Very high	15 Å²	15	40.4 Å²	40.4	10%	0.097	20%	0.203	C	C	.	.			trans	-55.6	142.4	163.4	-23.6	33.3	0	0	0	111.5	P474 C476 N646 I647 Y648	P474-P644 HydrophobicContact CB-CB 4.05Å; P474-P644 HydrophobicContact CB-CG 4.43Å; P474-P644 HydrophobicContact CG-CB 3.92Å; P474-P644 HydrophobicContact CG-CG 3.9Å; C476-P644 HydrophobicContact CB-CG 4Å; P644-N646 VanDerWaalsContact C-N 3.3Å; P644-N646 PolarHBondContact O-N 3.35Å; P644-I647 HydrophobicContact CB-CB 4.43Å; P644-I647 HydrophobicContact CB-CG1 4.12Å; P644-I647 HydrophobicContact CG-CG1 4.25Å; P644-I647 PolarHBondContact O-N 2.93Å; P644-Y648 PolarHBondContact O-N 2.95Å
645	V	92.3	Very high	94.4	Very high	37 Å²	37	33.8 Å²	33.8	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-48.3	-49	-176.1	176.2	0	0	0	0	112.6	I647 Y648 C649 P698 L699 Y708	V645-I647 VanDerWaalsContact C-N 3.33Å; V645-I647 PolarHBondContact O-N 3.3Å; V645-Y648 WeakPolarHBondContact O-CB 3.45Å; V645-Y648 PolarHBondContact O-N 3.17Å; V645-C649 PolarHBondContact O-N 3.09Å; V645-C649 PolarHBondContact O-SG 3.11Å; V645-P698 HydrophobicContact CB-CB 4.43Å; V645-P698 HydrophobicContact CG1-CB 4.05Å; V645-P698 HydrophobicContact CG1-CG 3.98Å; V645-P698 HydrophobicContact CG2-CB 4.31Å; V645-L699 HydrophobicContact CG2-CD2 3.97Å; V645-Y708 HydrophobicContact CG1-CD1 4.31Å; V645-Y708 HydrophobicContact CG1-CE1 3.59Å; V645-Y708 HydrophobicContact CG1-CE2 4.26Å
646	N	91.3	Very high	94.5	Very high	116 Å²	116	33.6 Å²	33.6	62%	0.62	18%	0.177	S	C	*	.	H	α-helix	trans	-64.5	-37.2	-178.4	-65.7	-11.7	0	0	0	112.5	P644 K650	P644-N646 VanDerWaalsContact C-N 3.3Å; P644-N646 PolarHBondContact O-N 3.35Å; N646-K650 VanDerWaalsContact O-CB 3.28Å; N646-K650 WeakPolarHBondContact O-CB 3.5Å; N646-K650 PolarHBondContact O-N 2.81Å; N646-K650 VanDerWaalsContact O-N 3.11Å
647	I	94.6	Very high	94.7	Very high	60 Å²	60	34.9 Å²	34.9	31%	0.308	18%	0.183	S	C	.	.	H	α-helix	trans	-72.4	-41.4	178.8	-57.3	-59.4	0	0	0	110	F588 L643 P644 V645 K650 A651	F588-I647 HydrophobicContact CE1-CG2 4.33Å; L643-I647 HydrophobicContact CD1-CG2 4.4Å; L643-I647 HydrophobicContact CD2-CG2 4.18Å; P644-I647 HydrophobicContact CB-CB 4.43Å; P644-I647 HydrophobicContact CB-CG1 4.12Å; P644-I647 HydrophobicContact CG-CG1 4.25Å; P644-I647 PolarHBondContact O-N 2.93Å; V645-I647 VanDerWaalsContact C-N 3.33Å; V645-I647 PolarHBondContact O-N 3.3Å; I647-K650 PolarHBondContact O-N 2.89Å; I647-A651 VanDerWaalsContact O-CB 3.31Å; I647-A651 WeakPolarHBondContact O-CB 3.41Å; I647-A651 PolarHBondContact O-N 3.38Å
648	Y	96.3	Very high	94.9	Very high	3 Å²	3	30.2 Å²	30.2	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-57	-55.3	173.5	178.5	-84	0	0	0	111.7	G636 W639 P644 V645 K650 A651 M652 V695 P698	G636-Y648 WeakPolarHBondContact CA-OH 3.39Å; G636-Y648 VanDerWaalsContact O-CE2 3.28Å; G636-Y648 WeakPolarHBondContact O-CE2 3.23Å; G636-Y648 PolarHBondContact O-OH 3.47Å; W639-Y648 HydrophobicContact CB-CD2 3.83Å; W639-Y648 HydrophobicContact CB-CE2 3.92Å; P644-Y648 PolarHBondContact O-N 2.95Å; V645-Y648 WeakPolarHBondContact O-CB 3.45Å; V645-Y648 PolarHBondContact O-N 3.17Å; Y648-K650 VanDerWaalsContact C-N 3.3Å; Y648-K650 PolarHBondContact O-N 3.01Å; Y648-A651 PolarHBondContact O-N 3.27Å; Y648-A651 VanDerWaalsContact O-N 3.12Å; Y648-M652 HydrophobicContact CD1-CG 4.03Å; Y648-M652 HydrophobicContact CD2-CG 4.46Å; Y648-M652 HydrophobicContact CE1-CB 4.49Å; Y648-M652 HydrophobicContact CE1-CG 3.65Å; Y648-M652 HydrophobicContact CE2-CG 4.13Å; Y648-M652 HydrophobicContact CG-CG 4.42Å; Y648-M652 WeakPolarHBondContact O-CG 3.34Å; Y648-M652 PolarHBondContact O-N 2.94Å; Y648-V695 PolarHBondContact OH-O 3.3Å; Y648-P698 HydrophobicContact CD1-CB 3.58Å; Y648-P698 HydrophobicContact CD1-CG 4.35Å; Y648-P698 HydrophobicContact CE1-CB 4.03Å; Y648-P698 HydrophobicContact CG-CB 4Å
649	C	95.2	Very high	95	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-62.4	-39.4	-177.3	-69.3	0	0	0	0	111.6	V645 G653 F696 Y715	V645-C649 PolarHBondContact O-N 3.09Å; V645-C649 PolarHBondContact O-SG 3.11Å; C649-G653 PolarHBondContact O-N 3.45Å; C649-F696 HydrophobicContact CB-CD1 4.23Å; C649-F696 HydrophobicContact CB-CE1 4.43Å; C649-F696 WeakPolarHBondContact O-CE1 3.4Å; C649-Y715 HydrophobicContact CB-CD1 3.82Å; C649-Y715 HydrophobicContact CB-CD2 4.1Å; C649-Y715 HydrophobicContact CB-CE1 3.56Å; C649-Y715 HydrophobicContact CB-CE2 3.88Å; C649-Y715 HydrophobicContact CB-CG 4.08Å
650	K	95.3	Very high	95	Very high	141 Å²	141	28 Å²	28	61%	0.613	15%	0.147	S	C	*	.	H	α-helix	trans	-63.6	-42.2	174.4	-172.5	174.8	-177.6	176	0	112.3	N646 I647 Y648 T654	N646-K650 VanDerWaalsContact O-CB 3.28Å; N646-K650 WeakPolarHBondContact O-CB 3.5Å; N646-K650 PolarHBondContact O-N 2.81Å; N646-K650 VanDerWaalsContact O-N 3.11Å; I647-K650 PolarHBondContact O-N 2.89Å; Y648-K650 VanDerWaalsContact C-N 3.3Å; Y648-K650 PolarHBondContact O-N 3.01Å; K650-T654 WeakPolarHBondContact O-CB 3.29Å; K650-T654 PolarHBondContact O-N 3.29Å; K650-T654 PolarHBondContact O-OG1 2.82Å
651	A	96.5	Very high	95.2	Very high	4 Å²	4	27.8 Å²	27.8	3%	0.033	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-53.3	177.9	0	0	0	0	0	111.3	F588 M592 W639 I647 Y648 G653 T654 L655	F588-A651 HydrophobicContact CE1-CB 4.16Å; F588-A651 HydrophobicContact CZ-CB 4.03Å; M592-A651 HydrophobicContact CE-CB 4.13Å; M592-A651 WeakPolarHBondContact CE-O 3.48Å; M592-A651 HydrophobicContact SD-CB 3.86Å; W639-A651 HydrophobicContact CE3-CB 4.34Å; W639-A651 HydrophobicContact CZ3-CB 3.91Å; I647-A651 VanDerWaalsContact O-CB 3.31Å; I647-A651 WeakPolarHBondContact O-CB 3.41Å; I647-A651 PolarHBondContact O-N 3.38Å; Y648-A651 PolarHBondContact O-N 3.27Å; Y648-A651 VanDerWaalsContact O-N 3.12Å; A651-G653 VanDerWaalsContact C-N 3.33Å; A651-G653 PolarHBondContact O-N 3.43Å; A651-T654 PolarHBondContact O-N 3.32Å; A651-L655 PolarHBondContact O-N 3.35Å; A651-L655 VanDerWaalsContact O-N 3.12Å
652	M	96.9	Very high	95.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-40.6	179.3	-63.4	-44.1	-66.6	0	0	112	L632 W639 Y648 T654 L655 L656 V695 F696	L632-M652 HydrophobicContact CB-CE 4.26Å; L632-M652 HydrophobicContact CD2-CE 4.18Å; L632-M652 WeakPolarHBondContact O-CE 3.28Å; W639-M652 HydrophobicContact CE3-SD 3.56Å; W639-M652 VanDerWaalsContact CE3-SD 3.56Å; W639-M652 HydrophobicContact CZ3-SD 3.69Å; Y648-M652 HydrophobicContact CD1-CG 4.03Å; Y648-M652 HydrophobicContact CD2-CG 4.46Å; Y648-M652 HydrophobicContact CE1-CB 4.49Å; Y648-M652 HydrophobicContact CE1-CG 3.65Å; Y648-M652 HydrophobicContact CE2-CG 4.13Å; Y648-M652 HydrophobicContact CG-CG 4.42Å; Y648-M652 WeakPolarHBondContact O-CG 3.34Å; Y648-M652 PolarHBondContact O-N 2.94Å; M652-T654 PolarHBondContact O-N 2.96Å; M652-L655 PolarHBondContact O-N 3.43Å; M652-L656 WeakPolarHBondContact O-CB 3.49Å; M652-L656 PolarHBondContact O-N 3.07Å; M652-V695 HydrophobicContact CB-CG1 4.16Å; M652-V695 HydrophobicContact CE-CG1 3.13Å; M652-V695 HydrophobicContact CG-CG1 4.37Å; M652-F696 HydrophobicContact CB-CE1 4.46Å
653	G	96.5	Very high	95.6	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-63.6	-39.5	175.4	0	0	0	0	0	113.3	C649 A651 L655 N657 Y715	C649-G653 PolarHBondContact O-N 3.45Å; A651-G653 VanDerWaalsContact C-N 3.33Å; A651-G653 PolarHBondContact O-N 3.43Å; G653-L655 VanDerWaalsContact C-N 3.35Å; G653-L655 PolarHBondContact O-N 3.31Å; G653-N657 WeakPolarHBondContact O-CB 3.43Å; G653-N657 PolarHBondContact O-N 2.93Å; G653-Y715 CarbonylContact C-O 3.55Å
654	T	97.1	Very high	95.6	Very high	67 Å²	67	29.3 Å²	29.3	41%	0.411	16%	0.156	S	C	.	.	H	α-helix	trans	-63.5	-40.7	175.8	-58.6	0	0	0	0	112	M592 K650 A651 M652 T658	M592-T654 HydrophobicContact CE-CG2 4.22Å; K650-T654 WeakPolarHBondContact O-CB 3.29Å; K650-T654 PolarHBondContact O-N 3.29Å; K650-T654 PolarHBondContact O-OG1 2.82Å; A651-T654 PolarHBondContact O-N 3.32Å; M652-T654 PolarHBondContact O-N 2.96Å; T654-T658 PolarHBondContact O-N 3.37Å; T654-T658 VanDerWaalsContact O-N 3.07Å; T654-T658 PolarHBondContact O-OG1 2.95Å
655	L	97.6	Very high	95.5	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-71.5	-44.8	179	-66.5	174.5	0	0	0	111.9	M592 Q595 K596 L599 L632 L635 W639 A651 M652 G653 N657 T658 A659	M592-L655 HydrophobicContact CE-CD1 4.23Å; M592-L655 HydrophobicContact CE-CD2 3.91Å; M592-L655 HydrophobicContact CE-CG 3.7Å; M592-L655 HydrophobicContact SD-CD1 4.25Å; M592-L655 HydrophobicContact SD-CG 4.35Å; Q595-L655 HydrophobicContact CB-CD1 4.32Å; Q595-L655 HydrophobicContact CB-CD2 4.04Å; K596-L655 HydrophobicContact CB-CD2 4.46Å; L599-L655 HydrophobicContact CD1-CB 3.93Å; L599-L655 HydrophobicContact CD1-CD2 4.15Å; L632-L655 HydrophobicContact CD2-CB 3.57Å; L632-L655 HydrophobicContact CD2-CD1 4.28Å; L635-L655 HydrophobicContact CD2-CD1 3.39Å; W639-L655 HydrophobicContact CH2-CD1 4.06Å; W639-L655 HydrophobicContact CZ3-CD1 3.93Å; A651-L655 PolarHBondContact O-N 3.35Å; A651-L655 VanDerWaalsContact O-N 3.12Å; M652-L655 PolarHBondContact O-N 3.43Å; G653-L655 VanDerWaalsContact C-N 3.35Å; G653-L655 PolarHBondContact O-N 3.31Å; L655-N657 VanDerWaalsContact C-N 3.33Å; L655-N657 PolarHBondContact O-N 3.45Å; L655-T658 WeakPolarHBondContact O-CB 3.48Å; L655-T658 PolarHBondContact O-N 2.9Å; L655-T658 VanDerWaalsContact O-N 3.12Å; L655-A659 PolarHBondContact O-N 3.12Å
656	L	97.1	Very high	95.4	Very high	1 Å²	1	31.5 Å²	31.5	1%	0.005	17%	0.172	C	C	.	.	H	α-helix	trans	-62.4	-41.6	174.7	-178.6	59.6	0	0	0	111.4	L632 M652 T658 A659 I660 F696 V716 W719	L632-L656 HydrophobicContact CD1-CB 4.36Å; L632-L656 HydrophobicContact CD1-CD1 3.94Å; M652-L656 WeakPolarHBondContact O-CB 3.49Å; M652-L656 PolarHBondContact O-N 3.07Å; L656-T658 PolarHBondContact O-N 2.87Å; L656-A659 PolarHBondContact O-N 2.97Å; L656-I660 HydrophobicContact CD1-CD1 4.15Å; L656-I660 HydrophobicContact CD1-CG1 4.38Å; L656-I660 HydrophobicContact CG-CD1 3.92Å; L656-I660 WeakPolarHBondContact O-CG1 3.16Å; L656-I660 PolarHBondContact O-N 2.99Å; L656-F696 HydrophobicContact CD2-CE2 3.83Å; L656-V716 HydrophobicContact CB-CG2 4.41Å; L656-V716 HydrophobicContact CD2-CG2 4.13Å; L656-V716 HydrophobicContact CG-CG2 4.43Å; L656-W719 HydrophobicContact CD2-CZ3 4.19Å
657	N	97.3	Very high	95.4	Very high	30 Å²	30	26 Å²	26	16%	0.16	14%	0.142	C	C	.	.	H	α-helix	trans	-59.2	-36.7	174.1	-176.4	80.8	0	0	0	111.9	G653 L655 S661 V716 P717 K718	G653-N657 WeakPolarHBondContact O-CB 3.43Å; G653-N657 PolarHBondContact O-N 2.93Å; L655-N657 VanDerWaalsContact C-N 3.33Å; L655-N657 PolarHBondContact O-N 3.45Å; N657-S661 PolarHBondContact ND2-OG 2.85Å; N657-S661 VanDerWaalsContact O-CB 3.24Å; N657-S661 WeakPolarHBondContact O-CB 3.21Å; N657-S661 PolarHBondContact O-N 2.82Å; N657-S661 PolarHBondContact O-OG 2.97Å; N657-V716 HydrophobicContact CB-CG1 3.91Å; N657-P717 WeakPolarHBondContact OD1-CD 3.38Å; N657-K718 WeakPolarHBondContact OD1-CB 3.37Å; N657-K718 PolarHBondContact OD1-N 3.31Å
658	T	97.1	Very high	95.2	Very high	16 Å²	16	24.6 Å²	24.6	10%	0.098	14%	0.136	C	C	.	.	H	α-helix	trans	-61.9	-49.6	175.5	-60.7	0	0	0	0	110.7	K596 L600 T654 L655 L656 I660 S661 E662	K596-T658 HydrophobicContact CD-CG2 4.24Å; K596-T658 HydrophobicContact CG-CG2 3.6Å; L600-T658 HydrophobicContact CD1-CG2 4.37Å; L600-T658 HydrophobicContact CD2-CG2 3.88Å; L600-T658 HydrophobicContact CG-CG2 4.06Å; T654-T658 PolarHBondContact O-N 3.37Å; T654-T658 VanDerWaalsContact O-N 3.07Å; T654-T658 PolarHBondContact O-OG1 2.95Å; L655-T658 WeakPolarHBondContact O-CB 3.48Å; L655-T658 PolarHBondContact O-N 2.9Å; L655-T658 VanDerWaalsContact O-N 3.12Å; L656-T658 PolarHBondContact O-N 2.87Å; T658-I660 PolarHBondContact O-N 3.16Å; T658-S661 PolarHBondContact O-N 3.34Å; T658-E662 PolarHBondContact O-N 3.08Å
659	A	95.9	Very high	94.9	Very high	3 Å²	3	28 Å²	28	3%	0.025	17%	0.165	C	C	.	.	H	α-helix	trans	-60.4	-45.8	179.3	0	0	0	0	0	111.7	L603 V628 L655 L656 E662 I663	L603-A659 HydrophobicContact CD1-CB 4.07Å; V628-A659 HydrophobicContact CG1-CB 3.78Å; L655-A659 PolarHBondContact O-N 3.12Å; L656-A659 PolarHBondContact O-N 2.97Å; A659-E662 PolarHBondContact O-N 3.25Å; A659-I663 VanDerWaalsContact O-CG1 3.29Å; A659-I663 WeakPolarHBondContact O-CG1 3.45Å; A659-I663 PolarHBondContact O-N 3.04Å
660	I	96.3	Very high	94.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-63.1	-43.3	177.5	-72.4	172.7	0	0	0	111.6	L656 T658 E662 I663 I664 V688 V716 K718 W719 F722	L656-I660 HydrophobicContact CD1-CD1 4.15Å; L656-I660 HydrophobicContact CD1-CG1 4.38Å; L656-I660 HydrophobicContact CG-CD1 3.92Å; L656-I660 WeakPolarHBondContact O-CG1 3.16Å; L656-I660 PolarHBondContact O-N 2.99Å; T658-I660 PolarHBondContact O-N 3.16Å; I660-E662 VanDerWaalsContact C-N 3.29Å; I660-E662 PolarHBondContact O-N 3.38Å; I660-I663 PolarHBondContact O-N 3.38Å; I660-I664 HydrophobicContact CG2-CD1 3.73Å; I660-I664 HydrophobicContact CG2-CG1 4.28Å; I660-I664 VanDerWaalsContact O-CG1 3.27Å; I660-I664 WeakPolarHBondContact O-CG1 3.28Å; I660-I664 PolarHBondContact O-N 2.94Å; I660-V688 HydrophobicContact CG1-CG1 4.14Å; I660-V716 HydrophobicContact CD1-CG1 3.93Å; I660-K718 HydrophobicContact CG2-CB 3.93Å; I660-W719 HydrophobicContact CD1-CE3 3.53Å; I660-W719 HydrophobicContact CD1-CZ3 3.73Å; I660-F722 HydrophobicContact CD1-CD1 4.35Å; I660-F722 HydrophobicContact CG1-CD1 4.39Å; I660-F722 HydrophobicContact CG2-CB 3.58Å; I660-F722 HydrophobicContact CG2-CD1 4.35Å; I660-F722 HydrophobicContact CG2-CD2 3.88Å; I660-F722 HydrophobicContact CG2-CG 3.69Å
661	S	95.8	Very high	94.2	Very high	42 Å²	42	31.5 Å²	31.5	29%	0.294	18%	0.184	S	C	.	.	H	α-helix	trans	-61.6	-40.6	178.9	-59.4	0	0	0	0	111.5	N657 T658 G665 K718	N657-S661 PolarHBondContact ND2-OG 2.85Å; N657-S661 VanDerWaalsContact O-CB 3.24Å; N657-S661 WeakPolarHBondContact O-CB 3.21Å; N657-S661 PolarHBondContact O-N 2.82Å; N657-S661 PolarHBondContact O-OG 2.97Å; T658-S661 PolarHBondContact O-N 3.34Å; S661-G665 PolarHBondContact O-N 3.45Å; S661-K718 WeakPolarHBondContact OG-CG 3.45Å
662	E	94.8	Very high	93.7	Very high	61 Å²	61	37.5 Å²	37.5	29%	0.285	22%	0.216	S	C	.	.	H	α-helix	trans	-65.9	-45.4	176.6	-171.2	64.8	-161.5	0	0	111.2	L600 L603 T658 A659 I660 I664 G665 K666	L600-E662 HydrophobicContact CD2-CB 3.84Å; L600-E662 HydrophobicContact CD2-CG 3.76Å; L603-E662 HydrophobicContact CB-CG 4.48Å; L603-E662 HydrophobicContact CD1-CB 3.96Å; L603-E662 HydrophobicContact CD1-CG 4.09Å; T658-E662 PolarHBondContact O-N 3.08Å; A659-E662 PolarHBondContact O-N 3.25Å; I660-E662 VanDerWaalsContact C-N 3.29Å; I660-E662 PolarHBondContact O-N 3.38Å; E662-I664 PolarHBondContact O-N 3.47Å; E662-G665 PolarHBondContact O-N 2.88Å; E662-K666 VanDerWaalsContact O-CG 3.29Å; E662-K666 WeakPolarHBondContact O-CG 3.3Å; E662-K666 PolarHBondContact O-N 3.45Å; E662-K666 WeakPolarHBondContact OE1-CE 3.4Å; E662-K666 IonicContact OE1-NZ 3.81Å
663	I	94.3	Very high	93.4	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	22%	0.217	C	C	.	.	H	α-helix	trans	-60.9	-47.4	177.6	-66.6	166.2	0	0	0	110.9	L603 F609 A659 I660 G665 K666 I667 V688 F722	L603-I663 HydrophobicContact CD2-CG1 4.36Å; F609-I663 HydrophobicContact CE2-CG1 4.24Å; F609-I663 HydrophobicContact CZ-CG1 4.02Å; A659-I663 VanDerWaalsContact O-CG1 3.29Å; A659-I663 WeakPolarHBondContact O-CG1 3.45Å; A659-I663 PolarHBondContact O-N 3.04Å; I660-I663 PolarHBondContact O-N 3.38Å; I663-G665 VanDerWaalsContact C-N 3.34Å; I663-G665 PolarHBondContact O-N 2.99Å; I663-K666 PolarHBondContact O-N 3.45Å; I663-I667 HydrophobicContact CG2-CD1 3.64Å; I663-I667 HydrophobicContact CG2-CG1 4.39Å; I663-I667 WeakPolarHBondContact O-CG1 3.45Å; I663-I667 PolarHBondContact O-N 3.12Å; I663-V688 HydrophobicContact CD1-CG2 4.12Å; I663-F722 HydrophobicContact CB-CE2 4.49Å; I663-F722 HydrophobicContact CG2-CE2 3.89Å
664	I	93.8	Very high	93.1	Very high	12 Å²	12	40 Å²	40	6%	0.062	23%	0.233	C	C	.	.	H	α-helix	trans	-57.3	-50.2	174.8	-67.1	169.9	0	0	0	109.7	I660 E662 K666 I667 T668 K718 P721 F722 L725 F751	I660-I664 HydrophobicContact CG2-CD1 3.73Å; I660-I664 HydrophobicContact CG2-CG1 4.28Å; I660-I664 VanDerWaalsContact O-CG1 3.27Å; I660-I664 WeakPolarHBondContact O-CG1 3.28Å; I660-I664 PolarHBondContact O-N 2.94Å; E662-I664 PolarHBondContact O-N 3.47Å; I664-K666 VanDerWaalsContact C-N 3.3Å; I664-K666 PolarHBondContact O-N 2.95Å; I664-I667 PolarHBondContact O-N 3.28Å; I664-T668 HydrophobicContact CG2-CG2 3.99Å; I664-T668 WeakPolarHBondContact O-CB 3.09Å; I664-T668 VanDerWaalsContact O-CG2 3.26Å; I664-T668 WeakPolarHBondContact O-CG2 3.21Å; I664-T668 PolarHBondContact O-N 2.8Å; I664-T668 PolarHBondContact O-OG1 3.09Å; I664-K718 HydrophobicContact CD1-CB 4.16Å; I664-P721 HydrophobicContact CD1-CB 4.31Å; I664-F722 HydrophobicContact CD1-CB 3.99Å; I664-F722 HydrophobicContact CD1-CD2 4.23Å; I664-F722 HydrophobicContact CG1-CB 4.47Å; I664-F722 HydrophobicContact CG1-CD2 3.8Å; I664-L725 HydrophobicContact CB-CD2 4.32Å; I664-L725 HydrophobicContact CG1-CD2 3.96Å; I664-L725 HydrophobicContact CG2-CD2 4.42Å; I664-F751 HydrophobicContact CG2-CE1 3.83Å; I664-F751 HydrophobicContact CG2-CZ 4.24Å
665	G	92.4	Very high	92.6	Very high	36 Å²	36	42.3 Å²	42.3	37%	0.371	25%	0.247	S	C	.	.	H	α-helix	trans	-58.5	-39.7	-178.4	0	0	0	0	0	113.1	S661 E662 I663 T668 A669	S661-G665 PolarHBondContact O-N 3.45Å; E662-G665 PolarHBondContact O-N 2.88Å; I663-G665 VanDerWaalsContact C-N 3.34Å; I663-G665 PolarHBondContact O-N 2.99Å; G665-T668 PolarHBondContact O-OG1 3.02Å; G665-A669 VanDerWaalsContact O-CB 3.3Å; G665-A669 WeakPolarHBondContact O-CB 3.22Å; G665-A669 PolarHBondContact O-N 2.66Å
666	K	91.5	Very high	92.2	Very high	63 Å²	63	47.8 Å²	47.8	27%	0.274	27%	0.273	S	S	.	.	H	α-helix	trans	-72.2	-45.3	178.3	-65.2	-67.1	176.9	173.7	0	112.8	N608 F609 E662 I663 I664 A669	N608-K666 HydrophobicContact CB-CD 4.25Å; N608-K666 WeakPolarHBondContact OD1-CD 3.33Å; N608-K666 WeakPolarHBondContact OD1-CE 3.47Å; N608-K666 PolarHBondContact OD1-NZ 3.44Å; F609-K666 HydrophobicContact CD2-CB 3.69Å; F609-K666 HydrophobicContact CD2-CG 4.3Å; F609-K666 HydrophobicContact CE2-CB 4.14Å; F609-K666 HydrophobicContact CE2-CG 4.4Å; E662-K666 VanDerWaalsContact O-CG 3.29Å; E662-K666 WeakPolarHBondContact O-CG 3.3Å; E662-K666 PolarHBondContact O-N 3.45Å; E662-K666 WeakPolarHBondContact OE1-CE 3.4Å; E662-K666 IonicContact OE1-NZ 3.81Å; I663-K666 PolarHBondContact O-N 3.45Å; I664-K666 VanDerWaalsContact C-N 3.3Å; I664-K666 PolarHBondContact O-N 2.95Å; K666-A669 PolarHBondContact O-N 3.33Å
667	I	91.7	Very high	91.8	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-42.8	179.7	-66.4	173.3	0	0	0	110.9	I663 I664 A669 L670 L681 L725 L729	I663-I667 HydrophobicContact CG2-CD1 3.64Å; I663-I667 HydrophobicContact CG2-CG1 4.39Å; I663-I667 WeakPolarHBondContact O-CG1 3.45Å; I663-I667 PolarHBondContact O-N 3.12Å; I664-I667 PolarHBondContact O-N 3.28Å; I667-A669 PolarHBondContact O-N 3.25Å; I667-L670 WeakPolarHBondContact O-CB 3.47Å; I667-L670 PolarHBondContact O-N 2.9Å; I667-L681 HydrophobicContact CD1-CD2 4.22Å; I667-L681 HydrophobicContact CG1-CD2 4.14Å; I667-L681 HydrophobicContact CG2-CD1 4.38Å; I667-L725 HydrophobicContact CB-CD2 4.23Å; I667-L725 HydrophobicContact CD1-CD2 4.23Å; I667-L725 HydrophobicContact CG2-CD1 4.18Å; I667-L725 HydrophobicContact CG2-CD2 4.16Å; I667-L729 HydrophobicContact CG2-CD2 4.26Å
668	T	89.4	Confident	91.5	Very high	29 Å²	29	47.2 Å²	47.2	18%	0.178	27%	0.271	C	S	.	.	H	α-helix	trans	-69.1	-16.7	179	56.2	0	0	0	0	114	I664 G665 L725 F751 L759	I664-T668 HydrophobicContact CG2-CG2 3.99Å; I664-T668 WeakPolarHBondContact O-CB 3.09Å; I664-T668 VanDerWaalsContact O-CG2 3.26Å; I664-T668 WeakPolarHBondContact O-CG2 3.21Å; I664-T668 PolarHBondContact O-N 2.8Å; I664-T668 PolarHBondContact O-OG1 3.09Å; G665-T668 PolarHBondContact O-OG1 3.02Å; T668-L725 HydrophobicContact CG2-CD1 4.31Å; T668-F751 HydrophobicContact CG2-CE1 4.18Å; T668-L759 HydrophobicContact CG2-CD1 3.73Å; T668-L759 HydrophobicContact CG2-CD2 4.14Å; T668-L759 HydrophobicContact CG2-CG 4.22Å
669	A	90.5	Very high	91.2	Very high	75 Å²	75	50.8 Å²	50.8	62%	0.62	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-5.7	176.1	0	0	0	0	0	113.9	G665 K666 I667	G665-A669 VanDerWaalsContact O-CB 3.3Å; G665-A669 WeakPolarHBondContact O-CB 3.22Å; G665-A669 PolarHBondContact O-N 2.66Å; K666-A669 PolarHBondContact O-N 3.33Å; I667-A669 PolarHBondContact O-N 3.25Å
670	L	89.2	Confident	91.1	Very high	30 Å²	30	52.8 Å²	52.8	16%	0.157	30%	0.296	C	S	.	.			trans	-70.5	133.3	176.9	-62.6	173.5	0	0	0	110.3	I667 I673 L681 A762	I667-L670 WeakPolarHBondContact O-CB 3.47Å; I667-L670 PolarHBondContact O-N 2.9Å; L670-I673 HydrophobicContact CB-CD1 4.12Å; L670-I673 HydrophobicContact CB-CG1 3.89Å; L670-I673 HydrophobicContact CD1-CD1 4.13Å; L670-I673 HydrophobicContact CD1-CG1 4Å; L670-L681 HydrophobicContact CD1-CD1 4.03Å; L670-A762 WeakPolarHBondContact O-CB 3.28Å
671	E	86.1	Confident	90.9	Very high	184 Å²	184	52.9 Å²	52.9	86%	0.86	30%	0.296	S	S	*	.	S	Bend	trans	-80.8	-32.8	-178.8	-65.3	-173.1	170.6	0	0	113	A762	E671-A762 WeakPolarHBondContact O-CA 3.38Å; E671-A762 WeakPolarHBondContact O-CB 3.44Å
672	D	87	Confident	90.8	Very high	131 Å²	131	54.5 Å²	54.5	70%	0.701	30%	0.297	S	S	*	.			trans	-141.1	135.4	-179.5	-162.4	4	0	0	0	109.4
673	I	90.1	Very high	90.8	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.021	30%	0.298	C	S	.	.			trans	-134.5	108.3	-179.5	-59.8	172	0	0	0	106.6	L670 D677 L681 A762 L763	L670-I673 HydrophobicContact CB-CD1 4.12Å; L670-I673 HydrophobicContact CB-CG1 3.89Å; L670-I673 HydrophobicContact CD1-CD1 4.13Å; L670-I673 HydrophobicContact CD1-CG1 4Å; I673-D677 HydrophobicContact CG2-CB 3.88Å; I673-L681 HydrophobicContact CD1-CD1 4.49Å; I673-L681 HydrophobicContact CG2-CD1 4.13Å; I673-A762 HydrophobicContact CD1-CB 4.09Å; I673-A762 HydrophobicContact CG1-CB 4.09Å; I673-A762 PolarHBondContact N-O 3.41Å; I673-L763 HydrophobicContact CB-CD2 3.94Å; I673-L763 HydrophobicContact CD1-CD2 4.15Å; I673-L763 HydrophobicContact CD1-CG 4.45Å; I673-L763 HydrophobicContact CG2-CD2 3.73Å
674	S	89.3	Confident	90.8	Very high	47 Å²	47	53.7 Å²	53.7	33%	0.329	30%	0.298	S	S	.	.			trans	-66.5	165.9	174.3	73.5	0	0	0	0	111.3	E676 D677 G678	S674-E676 VanDerWaalsContact C-N 3.26Å; S674-E676 PolarHBondContact O-N 3.43Å; S674-D677 WeakPolarHBondContact CB-OD2 3.49Å; S674-D677 PolarHBondContact N-OD2 2.87Å; S674-D677 PolarHBondContact O-N 3.18Å; S674-D677 WeakPolarHBondContact OG-CB 3.45Å; S674-D677 PolarHBondContact OG-N 3.02Å; S674-D677 PolarHBondContact OG-OD2 3.41Å; S674-G678 PolarHBondContact O-N 2.83Å
675	T	87.5	Confident	90.8	Very high	116 Å²	116	53.2 Å²	53.2	71%	0.712	30%	0.296	S	S	*	.	H	α-helix	trans	-60.1	-39	175.2	46.8	0	0	0	0	112	G678 D679	T675-G678 PolarHBondContact O-N 3.24Å; T675-D679 PolarHBondContact O-N 3.04Å
676	E	88.9	Confident	91	Very high	116 Å²	116	56.2 Å²	56.2	54%	0.542	30%	0.298	S	S	.	.	H	α-helix	trans	-69.2	-39.6	178.1	-63.6	178.9	-172.5	0	0	111.6	S674 D679 R680	S674-E676 VanDerWaalsContact C-N 3.26Å; S674-E676 PolarHBondContact O-N 3.43Å; E676-D679 PolarHBondContact O-N 3.46Å; E676-R680 WeakPolarHBondContact O-CG 3.35Å; E676-R680 PolarHBondContact O-N 3.21Å; E676-R680 VanDerWaalsContact O-N 3.11Å
677	D	89.3	Confident	91.2	Very high	17 Å²	17	54.4 Å²	54.4	9%	0.091	29%	0.293	C	S	.	.	H	α-helix	trans	-61.5	-44.3	171.9	-66.6	-47.7	0	0	0	111.2	M612 D613 I673 S674 D679 R680 L681	M612-D677 VanDerWaalsContact CA-OD1 3.28Å; M612-D677 WeakPolarHBondContact CA-OD1 3.26Å; M612-D677 HydrophobicContact CB-CB 4.28Å; M612-D677 WeakPolarHBondContact CB-OD1 3.42Å; M612-D677 PolarHBondContact N-OD1 3.29Å; D613-D677 PolarHBondContact N-OD1 3.18Å; I673-D677 HydrophobicContact CG2-CB 3.88Å; S674-D677 WeakPolarHBondContact CB-OD2 3.49Å; S674-D677 PolarHBondContact N-OD2 2.87Å; S674-D677 PolarHBondContact O-N 3.18Å; S674-D677 WeakPolarHBondContact OG-CB 3.45Å; S674-D677 PolarHBondContact OG-N 3.02Å; S674-D677 PolarHBondContact OG-OD2 3.41Å; D677-D679 PolarHBondContact O-N 3.27Å; D677-R680 PolarHBondContact O-N 3.41Å; D677-L681 WeakPolarHBondContact O-CB 3.33Å; D677-L681 WeakPolarHBondContact O-CG 3.47Å; D677-L681 PolarHBondContact O-N 3.47Å
678	G	91	Very high	91.3	Very high	3 Å²	3	54.6 Å²	54.6	3%	0.031	29%	0.294	C	S	.	.	H	α-helix	trans	-57.9	-44.7	178	0	0	0	0	0	112.8	S674 T675 Y682	S674-G678 PolarHBondContact O-N 2.83Å; T675-G678 PolarHBondContact O-N 3.24Å; G678-Y682 VanDerWaalsContact O-CB 3.29Å; G678-Y682 WeakPolarHBondContact O-CB 3.39Å; G678-Y682 PolarHBondContact O-N 3.26Å
679	D	91.1	Very high	91.6	Very high	90 Å²	90	54.8 Å²	54.8	48%	0.481	29%	0.293	S	S	.	.	H	α-helix	trans	-63.8	-43.5	176.5	-73.3	-17.4	0	0	0	112.1	T675 E676 D677 Y682 S683 Q730	T675-D679 PolarHBondContact O-N 3.04Å; E676-D679 PolarHBondContact O-N 3.46Å; D677-D679 PolarHBondContact O-N 3.27Å; D679-Y682 PolarHBondContact O-N 2.86Å; D679-S683 PolarHBondContact O-N 3.1Å; D679-Q730 PolarHBondContact OD1-NE2 2.91Å; D679-Q730 PolarHBondContact OD1-OE1 3.49Å
680	R	92.1	Very high	91.7	Very high	46 Å²	46	55.8 Å²	55.8	17%	0.174	29%	0.288	C	S	.	.	H	α-helix	trans	-69.1	-42.3	178.5	-74.5	-175.6	-177.6	-164.6	12.6	112.3	M612 D613 D614 E615 Y618 E676 D677 Y682 S683 L684	M612-R680 HydrophobicContact CB-CB 4.18Å; M612-R680 WeakPolarHBondContact O-CD 3.35Å; M612-R680 PolarHBondContact O-NE 3.18Å; M612-R680 PolarHBondContact O-NH1 3.18Å; D613-R680 PolarHBondContact O-NH1 3.23Å; D613-R680 PolarHBondContact O-NH2 3.12Å; D614-R680 VanDerWaalsContact C-NH1 3.32Å; D614-R680 PolarHBondContact O-NH1 2.96Å; E615-R680 IonicContact OE1-CZ 2.78Å; E615-R680 VanDerWaalsContact OE1-CZ 3.27Å; E615-R680 IonicContact OE1-NH1 3.8Å; E615-R680 PolarHBondContact OE1-NH1 3.26Å; E615-R680 IonicContact OE1-NH2 2.76Å; E615-R680 PolarHBondContact OE1-NH2 3.04Å; Y618-R680 HydrophobicContact CD2-CB 3.67Å; Y618-R680 HydrophobicContact CD2-CG 3.92Å; Y618-R680 HydrophobicContact CE2-CB 3.7Å; Y618-R680 HydrophobicContact CE2-CG 3.98Å; Y618-R680 HydrophobicContact CG-CG 4.5Å; E676-R680 WeakPolarHBondContact O-CG 3.35Å; E676-R680 PolarHBondContact O-N 3.21Å; E676-R680 VanDerWaalsContact O-N 3.11Å; D677-R680 PolarHBondContact O-N 3.41Å; R680-Y682 VanDerWaalsContact C-N 3.32Å; R680-Y682 PolarHBondContact O-N 3.47Å; R680-S683 WeakPolarHBondContact O-CB 3.42Å; R680-S683 PolarHBondContact O-N 3.46Å; R680-L684 WeakPolarHBondContact O-CG 3.41Å; R680-L684 PolarHBondContact O-N 2.65Å
681	L	93.5	Very high	91.9	Very high	1 Å²	1	57 Å²	57	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-61.4	-41.6	173.3	-72	174.3	0	0	0	111.4	F609 M612 I667 L670 I673 D677 L684 C685 L729	F609-L681 HydrophobicContact CB-CD2 3.76Å; F609-L681 HydrophobicContact CD1-CD2 4.46Å; F609-L681 HydrophobicContact CG-CD2 4.42Å; M612-L681 HydrophobicContact CG-CD2 3.83Å; M612-L681 HydrophobicContact CG-CG 4.12Å; M612-L681 HydrophobicContact SD-CD2 4.45Å; I667-L681 HydrophobicContact CD1-CD2 4.22Å; I667-L681 HydrophobicContact CG1-CD2 4.14Å; I667-L681 HydrophobicContact CG2-CD1 4.38Å; L670-L681 HydrophobicContact CD1-CD1 4.03Å; I673-L681 HydrophobicContact CD1-CD1 4.49Å; I673-L681 HydrophobicContact CG2-CD1 4.13Å; D677-L681 WeakPolarHBondContact O-CB 3.33Å; D677-L681 WeakPolarHBondContact O-CG 3.47Å; D677-L681 PolarHBondContact O-N 3.47Å; L681-L684 PolarHBondContact O-N 3.44Å; L681-C685 PolarHBondContact O-N 3.48Å; L681-C685 PolarHBondContact O-SG 3.41Å; L681-L729 HydrophobicContact CB-CD1 3.87Å; L681-L729 HydrophobicContact CD1-CD2 4.41Å
682	Y	94.4	Very high	92.3	Very high	77 Å²	77	48.3 Å²	48.3	30%	0.302	25%	0.252	S	S	.	.	H	α-helix	trans	-61.2	-44.6	174.8	176	-100	0	0	0	111.6	G678 D679 R680 L684 C685 K686 M726 Q730	G678-Y682 VanDerWaalsContact O-CB 3.29Å; G678-Y682 WeakPolarHBondContact O-CB 3.39Å; G678-Y682 PolarHBondContact O-N 3.26Å; D679-Y682 PolarHBondContact O-N 2.86Å; R680-Y682 VanDerWaalsContact C-N 3.32Å; R680-Y682 PolarHBondContact O-N 3.47Å; Y682-L684 PolarHBondContact O-N 3.49Å; Y682-C685 PolarHBondContact O-N 3.31Å; Y682-K686 HydrophobicContact CE1-CD 4.29Å; Y682-K686 VanDerWaalsContact O-CB 3.29Å; Y682-K686 WeakPolarHBondContact O-CB 3.26Å; Y682-K686 PolarHBondContact O-N 3.33Å; Y682-M726 HydrophobicContact CD2-CB 4.15Å; Y682-M726 HydrophobicContact CD2-CE 4.03Å; Y682-M726 WeakPolarHBondContact CD2-O 3.39Å; Y682-M726 HydrophobicContact CE2-CB 4.15Å; Y682-M726 HydrophobicContact CE2-CE 3.65Å; Y682-Q730 HydrophobicContact CD1-CG 4.04Å; Y682-Q730 HydrophobicContact CD2-CG 3.5Å; Y682-Q730 VanDerWaalsContact CD2-CG 3.5Å; Y682-Q730 HydrophobicContact CE1-CG 4.4Å; Y682-Q730 HydrophobicContact CE2-CG 3.92Å; Y682-Q730 HydrophobicContact CG-CG 3.56Å
683	S	93.9	Very high	92.6	Very high	46 Å²	46	43.2 Å²	43.2	32%	0.322	23%	0.226	S	C	.	.	H	α-helix	trans	-58.4	-43.3	175.3	176	0	0	0	0	112.7	Y618 D679 R680 K686 T687	Y618-S683 PolarHBondContact OH-OG 3.39Å; D679-S683 PolarHBondContact O-N 3.1Å; R680-S683 WeakPolarHBondContact O-CB 3.42Å; R680-S683 PolarHBondContact O-N 3.46Å; S683-K686 PolarHBondContact O-N 2.9Å; S683-T687 PolarHBondContact O-N 3.03Å; S683-T687 PolarHBondContact O-OG1 2.97Å
684	L	94.1	Very high	92.7	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-62.9	-46.6	174.5	-68.1	-179.3	0	0	0	111.9	F609 M612 Y618 A621 S622 R680 L681 Y682 K686 T687 V688	F609-L684 HydrophobicContact CD1-CD1 3.97Å; F609-L684 HydrophobicContact CE1-CD1 4.14Å; M612-L684 HydrophobicContact CE-CD1 3.57Å; Y618-L684 HydrophobicContact CD2-CG 4.49Å; Y618-L684 HydrophobicContact CE2-CD1 4.43Å; Y618-L684 HydrophobicContact CE2-CD2 3.99Å; Y618-L684 HydrophobicContact CE2-CG 3.92Å; A621-L684 HydrophobicContact CB-CD1 3.95Å; S622-L684 VanDerWaalsContact CA-CD2 3.45Å; R680-L684 WeakPolarHBondContact O-CG 3.41Å; R680-L684 PolarHBondContact O-N 2.65Å; L681-L684 PolarHBondContact O-N 3.44Å; Y682-L684 PolarHBondContact O-N 3.49Å; L684-K686 VanDerWaalsContact C-N 3.31Å; L684-K686 PolarHBondContact O-N 2.75Å; L684-T687 WeakPolarHBondContact O-CB 3.23Å; L684-T687 PolarHBondContact O-N 2.97Å; L684-V688 PolarHBondContact O-N 2.86Å
685	C	94.9	Very high	92.8	Very high	2 Å²	2	45.5 Å²	45.5	1%	0.014	23%	0.232	C	C	.	.	H	α-helix	trans	-65.4	-37	179.2	-64.2	0	0	0	0	111.9	L681 Y682 T687 V688 M689 F722 M726	L681-C685 PolarHBondContact O-N 3.48Å; L681-C685 PolarHBondContact O-SG 3.41Å; Y682-C685 PolarHBondContact O-N 3.31Å; C685-T687 VanDerWaalsContact C-N 3.32Å; C685-T687 PolarHBondContact O-N 2.93Å; C685-V688 WeakPolarHBondContact O-CB 3.32Å; C685-V688 PolarHBondContact O-N 3.39Å; C685-V688 VanDerWaalsContact O-N 3.11Å; C685-M689 PolarHBondContact O-N 3.5Å; C685-F722 HydrophobicContact CB-CE1 4.35Å; C685-F722 HydrophobicContact CB-CE2 4.06Å; C685-F722 HydrophobicContact CB-CZ 3.61Å; C685-M726 HydrophobicContact CB-CE 4.19Å; C685-M726 HydrophobicContact CB-CG 3.34Å; C685-M726 HydrophobicContact CB-SD 3.56Å; C685-M726 VanDerWaalsContact CB-SD 3.56Å
686	K	95.1	Very high	93.1	Very high	98 Å²	98	40 Å²	40	43%	0.426	20%	0.198	S	C	.	.	H	α-helix	trans	-60.9	-41.2	174.4	-173.6	177.9	179.2	-175.9	0	111.8	Y682 S683 L684 V688 M689 D690 M726	Y682-K686 HydrophobicContact CE1-CD 4.29Å; Y682-K686 VanDerWaalsContact O-CB 3.29Å; Y682-K686 WeakPolarHBondContact O-CB 3.26Å; Y682-K686 PolarHBondContact O-N 3.33Å; S683-K686 PolarHBondContact O-N 2.9Å; L684-K686 VanDerWaalsContact C-N 3.31Å; L684-K686 PolarHBondContact O-N 2.75Å; K686-V688 VanDerWaalsContact C-N 3.28Å; K686-V688 PolarHBondContact O-N 3.29Å; K686-M689 PolarHBondContact O-N 2.95Å; K686-M689 VanDerWaalsContact O-N 3.13Å; K686-D690 WeakPolarHBondContact O-CB 3.48Å; K686-D690 VanDerWaalsContact O-CG 3.32Å; K686-D690 PolarHBondContact O-N 2.8Å; K686-M726 VanDerWaalsContact CA-CE 3.48Å; K686-M726 HydrophobicContact CB-CE 3.8Å; K686-M726 HydrophobicContact CG-CE 4.46Å
687	T	95.3	Very high	93.3	Very high	26 Å²	26	35.5 Å²	35.5	16%	0.16	18%	0.181	C	C	.	.	H	α-helix	trans	-57	-43.2	173.3	-54.8	0	0	0	0	111.3	L629 S683 L684 C685 E691	L629-T687 HydrophobicContact CD1-CG2 4.14Å; S683-T687 PolarHBondContact O-N 3.03Å; S683-T687 PolarHBondContact O-OG1 2.97Å; L684-T687 WeakPolarHBondContact O-CB 3.23Å; L684-T687 PolarHBondContact O-N 2.97Å; C685-T687 VanDerWaalsContact C-N 3.32Å; C685-T687 PolarHBondContact O-N 2.93Å; T687-E691 WeakPolarHBondContact O-CB 3.37Å; T687-E691 PolarHBondContact O-N 3.34Å
688	V	95.4	Very high	93.2	Very high	4 Å²	4	35.1 Å²	35.1	2%	0.024	18%	0.179	C	C	.	.	H	α-helix	trans	-67.7	-37.9	176.4	-179.7	0	0	0	0	112.1	V625 L629 I660 I663 L684 C685 K686 G692 F722	V625-V688 HydrophobicContact CG1-CG2 3.41Å; V625-V688 VanDerWaalsContact CG1-CG2 3.41Å; L629-V688 HydrophobicContact CD1-CG2 4.4Å; I660-V688 HydrophobicContact CG1-CG1 4.14Å; I663-V688 HydrophobicContact CD1-CG2 4.12Å; L684-V688 PolarHBondContact O-N 2.86Å; C685-V688 WeakPolarHBondContact O-CB 3.32Å; C685-V688 PolarHBondContact O-N 3.39Å; C685-V688 VanDerWaalsContact O-N 3.11Å; K686-V688 VanDerWaalsContact C-N 3.28Å; K686-V688 PolarHBondContact O-N 3.29Å; V688-G692 VanDerWaalsContact O-CA 3.22Å; V688-G692 WeakPolarHBondContact O-CA 3.28Å; V688-G692 PolarHBondContact O-N 3.33Å; V688-F722 HydrophobicContact CB-CE1 3.94Å; V688-F722 HydrophobicContact CB-CZ 3.98Å; V688-F722 HydrophobicContact CG1-CE1 3.86Å; V688-F722 HydrophobicContact CG1-CZ 4.09Å
689	M	94.2	Very high	93	Very high	33 Å²	33	37.4 Å²	37.4	16%	0.163	19%	0.191	C	C	.	.	H	α-helix	trans	-66.2	-39.8	176.7	-77.3	-59.4	-62.3	0	0	113.2	C685 K686 P693 W719 F722 M726	C685-M689 PolarHBondContact O-N 3.5Å; K686-M689 PolarHBondContact O-N 2.95Å; K686-M689 VanDerWaalsContact O-N 3.13Å; M689-P693 WeakPolarHBondContact O-CD 3.41Å; M689-P693 WeakPolarHBondContact O-CG 3.26Å; M689-W719 HydrophobicContact CE-CH2 3.97Å; M689-W719 HydrophobicContact CE-CZ2 3.34Å; M689-W719 HydrophobicContact SD-CD2 4.46Å; M689-W719 HydrophobicContact SD-CH2 3.66Å; M689-W719 HydrophobicContact SD-CZ2 3.63Å; M689-W719 HydrophobicContact SD-CZ3 4.13Å; M689-F722 HydrophobicContact CG-CD1 4.11Å; M689-F722 HydrophobicContact CG-CE1 3.84Å; M689-F722 HydrophobicContact SD-CD1 3.54Å; M689-F722 VanDerWaalsContact SD-CD1 3.54Å; M689-F722 HydrophobicContact SD-CE1 3.87Å; M689-M726 HydrophobicContact CB-SD 4.25Å; M689-M726 HydrophobicContact CG-CE 3.97Å; M689-M726 HydrophobicContact CG-SD 3.17Å; M689-M726 WeakPolarHBondContact CG-SD 3.46Å; M689-M726 HydrophobicContact SD-SD 4.29Å
690	D	93.3	Very high	92.6	Very high	97 Å²	97	36.9 Å²	36.9	52%	0.519	19%	0.194	S	C	.	.	H	α-helix	trans	-78	-38.6	-177	-67	-18.4	0	0	0	111.2	K686 Q694	K686-D690 WeakPolarHBondContact O-CB 3.48Å; K686-D690 VanDerWaalsContact O-CG 3.32Å; K686-D690 PolarHBondContact O-N 2.8Å; D690-Q694 PolarHBondContact O-NE2 3.4Å
691	E	94.2	Very high	92.1	Very high	56 Å²	56	39.6 Å²	39.6	26%	0.262	21%	0.209	S	C	.	.	H	α-helix	trans	-94.9	-24.8	-176.8	-66.5	-165.7	-139	0	0	114.7	L629 K633 T687 Q694	L629-E691 HydrophobicContact CD1-CB 3.93Å; L629-E691 HydrophobicContact CD2-CB 4.38Å; K633-E691 IonicContact NZ-OE2 3.18Å; K633-E691 PolarHBondContact NZ-OE2 3.2Å; T687-E691 WeakPolarHBondContact O-CB 3.37Å; T687-E691 PolarHBondContact O-N 3.34Å; E691-Q694 WeakPolarHBondContact O-CB 3.43Å; E691-Q694 PolarHBondContact O-N 2.95Å
692	G	93.1	Very high	91.4	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.246	C	C	.	.	S	Bend	trans	-57.2	-45.6	-178.7	0	0	0	0	0	114.1	V688 Q694 V695	V688-G692 VanDerWaalsContact O-CA 3.22Å; V688-G692 WeakPolarHBondContact O-CA 3.28Å; V688-G692 PolarHBondContact O-N 3.33Å; G692-Q694 PolarHBondContact O-N 2.99Å; G692-V695 VanDerWaalsContact O-CB 3.28Å; G692-V695 WeakPolarHBondContact O-CB 3.48Å; G692-V695 WeakPolarHBondContact O-CG2 3.2Å; G692-V695 PolarHBondContact O-N 2.93Å
693	P	94.1	Very high	90.6	Very high	24 Å²	24	48.2 Å²	48.2	16%	0.156	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-61.8	-30.9	177.8	-26.1	37.6	0	0	0	113.1	M689 V695 F696 Q709 V712 W719	M689-P693 WeakPolarHBondContact O-CD 3.41Å; M689-P693 WeakPolarHBondContact O-CG 3.26Å; P693-V695 PolarHBondContact O-N 3.25Å; P693-V695 VanDerWaalsContact O-N 3.07Å; P693-F696 PolarHBondContact O-N 3.02Å; P693-Q709 HydrophobicContact CB-CB 4.26Å; P693-Q709 WeakPolarHBondContact O-CG 3.25Å; P693-V712 HydrophobicContact CB-CG2 3.91Å; P693-V712 HydrophobicContact CG-CG2 4.29Å; P693-W719 HydrophobicContact CG-CH2 3.82Å; P693-W719 HydrophobicContact CG-CZ2 3.95Å
694	Q	92	Very high	90	Very high	97 Å²	97	51.6 Å²	51.6	45%	0.453	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-64.3	-16.9	-179.1	-55.6	174.1	2.4	0	0	112.9	D690 E691 G692 F696	D690-Q694 PolarHBondContact O-NE2 3.4Å; E691-Q694 WeakPolarHBondContact O-CB 3.43Å; E691-Q694 PolarHBondContact O-N 2.95Å; G692-Q694 PolarHBondContact O-N 2.99Å; Q694-F696 PolarHBondContact O-N 3.11Å
695	V	92.6	Very high	89.8	Confident	3 Å²	3	51.5 Å²	51.5	2%	0.018	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-68.3	-22.4	174.9	-178.7	0	0	0	0	111.7	L632 K633 Y648 M652 G692 P693 A697	L632-V695 HydrophobicContact CB-CG1 3.88Å; L632-V695 HydrophobicContact CB-CG2 3.92Å; K633-V695 HydrophobicContact CG-CG2 4.19Å; Y648-V695 PolarHBondContact OH-O 3.3Å; M652-V695 HydrophobicContact CB-CG1 4.16Å; M652-V695 HydrophobicContact CE-CG1 3.13Å; M652-V695 HydrophobicContact CG-CG1 4.37Å; G692-V695 VanDerWaalsContact O-CB 3.28Å; G692-V695 WeakPolarHBondContact O-CB 3.48Å; G692-V695 WeakPolarHBondContact O-CG2 3.2Å; G692-V695 PolarHBondContact O-N 2.93Å; P693-V695 PolarHBondContact O-N 3.25Å; P693-V695 VanDerWaalsContact O-N 3.07Å; V695-A697 PolarHBondContact O-N 3.35Å; V695-A697 VanDerWaalsContact O-N 3.08Å
696	F	93.8	Very high	89.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	30%	0.297	C	S	.	.			trans	-85.7	76.1	178.8	-65.9	-96.8	0	0	0	111	C649 M652 L656 P693 Q694 P698 Q709 V712 Y715 V716	C649-F696 HydrophobicContact CB-CD1 4.23Å; C649-F696 HydrophobicContact CB-CE1 4.43Å; C649-F696 WeakPolarHBondContact O-CE1 3.4Å; M652-F696 HydrophobicContact CB-CE1 4.46Å; L656-F696 HydrophobicContact CD2-CE2 3.83Å; P693-F696 PolarHBondContact O-N 3.02Å; Q694-F696 PolarHBondContact O-N 3.11Å; F696-P698 WeakPolarHBondContact O-CD 3.25Å; F696-Q709 HydrophobicContact CB-CG 4.47Å; F696-V712 HydrophobicContact CD2-CG2 3.69Å; F696-V712 HydrophobicContact CE2-CB 4.36Å; F696-V712 HydrophobicContact CE2-CG1 4Å; F696-V712 HydrophobicContact CE2-CG2 3.73Å; F696-V712 HydrophobicContact CG-CG2 4.37Å; F696-V712 HydrophobicContact CZ-CG1 4.4Å; F696-V712 HydrophobicContact CZ-CG2 4.43Å; F696-Y715 HydrophobicContact CD1-CD2 4.41Å; F696-Y715 AromaticContact CE1-CD2 3.99Å; F696-Y715 HydrophobicContact CE1-CD2 3.99Å; F696-Y715 HydrophobicContact CE1-CG 4.1Å; F696-V716 HydrophobicContact CE2-CG2 4.35Å; F696-V716 HydrophobicContact CZ-CG2 3.83Å
697	A	91.8	Very high	89.2	Confident	22 Å²	22	59 Å²	59	18%	0.182	30%	0.302	C	S	.	.			trans	-123.2	62.8	177.6	0	0	0	0	0	112.1	Q640 V695 L699	Q640-A697 WeakPolarHBondContact CG-O 3.34Å; Q640-A697 PolarHBondContact NE2-O 3.29Å; Q640-A697 VanDerWaalsContact NE2-O 3.11Å; V695-A697 PolarHBondContact O-N 3.35Å; V695-A697 VanDerWaalsContact O-N 3.08Å; A697-L699 VanDerWaalsContact C-N 3.26Å; A697-L699 PolarHBondContact O-N 2.97Å
698	P	87.3	Confident	88.9	Confident	8 Å²	8	59.7 Å²	59.7	5%	0.052	30%	0.302	C	S	.	.			trans	-65.4	-26.5	-175.2	25.8	-34.3	0	0	0	113.8	V645 Y648 F696 N705 Y708	V645-P698 HydrophobicContact CB-CB 4.43Å; V645-P698 HydrophobicContact CG1-CB 4.05Å; V645-P698 HydrophobicContact CG1-CG 3.98Å; V645-P698 HydrophobicContact CG2-CB 4.31Å; Y648-P698 HydrophobicContact CD1-CB 3.58Å; Y648-P698 HydrophobicContact CD1-CG 4.35Å; Y648-P698 HydrophobicContact CE1-CB 4.03Å; Y648-P698 HydrophobicContact CG-CB 4Å; F696-P698 WeakPolarHBondContact O-CD 3.25Å; P698-N705 WeakPolarHBondContact CD-OD1 3.42Å; P698-Y708 HydrophobicContact CG-CD2 3.39Å; P698-Y708 HydrophobicContact CG-CE2 3.69Å; P698-Y708 HydrophobicContact CG-CG 3.89Å
699	L	87.6	Confident	88.6	Confident	52 Å²	52	62.8 Å²	62.8	27%	0.272	32%	0.316	S	S	.	.	S	Bend	trans	-102.9	147	-178.4	-53.9	173.6	0	0	0	110.6	Q640 V645 A697 E701 K704 N705 Y708	Q640-L699 PolarHBondContact NE2-O 3.46Å; V645-L699 HydrophobicContact CG2-CD2 3.97Å; A697-L699 VanDerWaalsContact C-N 3.26Å; A697-L699 PolarHBondContact O-N 2.97Å; L699-E701 VanDerWaalsContact C-N 3.26Å; L699-E701 PolarHBondContact O-N 3.29Å; L699-K704 HydrophobicContact CD1-CB 3.63Å; L699-K704 HydrophobicContact CD1-CD 4.41Å; L699-N705 WeakPolarHBondContact CB-OD1 3.4Å; L699-N705 PolarHBondContact N-OD1 2.9Å; L699-N705 VanDerWaalsContact N-OD1 3.07Å; L699-N705 PolarHBondContact O-ND2 3.47Å; L699-Y708 HydrophobicContact CD1-CE2 4.01Å; L699-Y708 HydrophobicContact CG-CE2 4.37Å
700	S	81.1	Confident	88.4	Confident	79 Å²	79	68.4 Å²	68.4	55%	0.552	34%	0.342	S	S	*	.	S	Bend	trans	-67.6	-26	176.3	-50.5	0	0	0	0	113.1
701	E	83.1	Confident	88.2	Confident	103 Å²	103	66.4 Å²	66.4	48%	0.481	33%	0.33	S	S	.	.	S	Bend	trans	-84.9	109.6	174.4	-70.9	177.6	-142.3	0	0	110.6	L699 S703 K704	L699-E701 VanDerWaalsContact C-N 3.26Å; L699-E701 PolarHBondContact O-N 3.29Å; E701-S703 VanDerWaalsContact C-N 3.26Å; E701-S703 PolarHBondContact O-N 2.91Å; E701-K704 HydrophobicContact CB-CD 4.29Å; E701-K704 HydrophobicContact CB-CG 4.48Å; E701-K704 VanDerWaalsContact CD-NZ 3.28Å; E701-K704 PolarHBondContact O-N 3.32Å; E701-K704 IonicContact OE1-NZ 3.49Å; E701-K704 PolarHBondContact OE1-NZ 3.12Å; E701-K704 VanDerWaalsContact OE2-CD 3.29Å; E701-K704 WeakPolarHBondContact OE2-CD 3.26Å; E701-K704 WeakPolarHBondContact OE2-CE 3.31Å; E701-K704 IonicContact OE2-NZ 2.67Å; E701-K704 PolarHBondContact OE2-NZ 2.91Å
702	E	77.2	Confident	88.1	Confident	169 Å²	169	63.8 Å²	63.8	79%	0.79	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-59.3	-34	-176.9	-67.1	-175.5	168	0	0	113.7	K704 N705	E702-K704 PolarHBondContact O-N 2.7Å; E702-N705 PolarHBondContact O-N 3.29Å; E702-N705 VanDerWaalsContact O-N 3.08Å
703	S	77.7	Confident	88.1	Confident	90 Å²	90	66.1 Å²	66.1	63%	0.629	33%	0.333	S	S	*	.	G	3₁₀ helix	trans	-60.2	-30.2	-179.2	59.9	0	0	0	0	113.2	E701	E701-S703 VanDerWaalsContact C-N 3.26Å; E701-S703 PolarHBondContact O-N 2.91Å
704	K	83.1	Confident	88	Confident	116 Å²	116	70.1 Å²	70.1	50%	0.504	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-86.7	-8.7	-179.1	-66.9	177.2	176.7	155.7	0	113.2	L699 E701 E702	L699-K704 HydrophobicContact CD1-CB 3.63Å; L699-K704 HydrophobicContact CD1-CD 4.41Å; E701-K704 HydrophobicContact CB-CD 4.29Å; E701-K704 HydrophobicContact CB-CG 4.48Å; E701-K704 VanDerWaalsContact CD-NZ 3.28Å; E701-K704 PolarHBondContact O-N 3.32Å; E701-K704 IonicContact OE1-NZ 3.49Å; E701-K704 PolarHBondContact OE1-NZ 3.12Å; E701-K704 VanDerWaalsContact OE2-CD 3.29Å; E701-K704 WeakPolarHBondContact OE2-CD 3.26Å; E701-K704 WeakPolarHBondContact OE2-CE 3.31Å; E701-K704 IonicContact OE2-NZ 2.67Å; E701-K704 PolarHBondContact OE2-NZ 2.91Å; E702-K704 PolarHBondContact O-N 2.7Å
705	N	88.4	Confident	88	Confident	2 Å²	2	67.8 Å²	67.8	1%	0.011	34%	0.344	C	S	.	.			trans	-84.3	-15.7	-176.7	-71	-35.4	0	0	0	114.1	P698 L699 E702 K707 Y708 Q709	P698-N705 WeakPolarHBondContact CD-OD1 3.42Å; L699-N705 WeakPolarHBondContact CB-OD1 3.4Å; L699-N705 PolarHBondContact N-OD1 2.9Å; L699-N705 VanDerWaalsContact N-OD1 3.07Å; L699-N705 PolarHBondContact O-ND2 3.47Å; E702-N705 PolarHBondContact O-N 3.29Å; E702-N705 VanDerWaalsContact O-N 3.08Å; N705-K707 VanDerWaalsContact C-N 3.26Å; N705-K707 PolarHBondContact O-N 2.7Å; N705-K707 VanDerWaalsContact O-N 3.15Å; N705-Y708 PolarHBondContact O-N 3.24Å; N705-Q709 WeakPolarHBondContact O-CG 3.28Å; N705-Q709 PolarHBondContact O-N 3.35Å
706	K	87.7	Confident	88.2	Confident	136 Å²	136	67.7 Å²	67.7	59%	0.591	34%	0.343	S	S	*	.	H	α-helix	trans	-50.5	-43.6	-176.5	-72.4	-172.3	175.9	-175.9	0	113.5	Y708 Q709 E710	K706-Y708 VanDerWaalsContact C-N 3.3Å; K706-Y708 PolarHBondContact O-N 3.48Å; K706-Q709 PolarHBondContact O-N 2.98Å; K706-Q709 VanDerWaalsContact O-N 3.13Å; K706-E710 WeakPolarHBondContact O-CG 3.45Å; K706-E710 PolarHBondContact O-N 2.95Å; K706-E710 VanDerWaalsContact O-N 3.07Å
707	K	89.3	Confident	88.2	Confident	122 Å²	122	72.3 Å²	72.3	53%	0.53	37%	0.374	S	S	.	.	H	α-helix	trans	-53.7	-45.9	177.1	-179.9	-179.6	174.1	-178.9	0	112.3	N705 Q709 E710 E711	N705-K707 VanDerWaalsContact C-N 3.26Å; N705-K707 PolarHBondContact O-N 2.7Å; N705-K707 VanDerWaalsContact O-N 3.15Å; K707-Q709 VanDerWaalsContact C-N 3.33Å; K707-Q709 PolarHBondContact O-N 3.27Å; K707-E710 PolarHBondContact O-N 2.96Å; K707-E711 WeakPolarHBondContact CE-OE1 3.47Å; K707-E711 IonicContact NZ-OE1 2.69Å; K707-E711 WeakPolarHBondContact O-CG 3.35Å; K707-E711 PolarHBondContact O-N 3.22Å; K707-E711 VanDerWaalsContact O-N 3.09Å
708	Y	89.3	Confident	88.3	Confident	41 Å²	41	75.7 Å²	75.7	16%	0.161	38%	0.384	C	S	.	.	H	α-helix	trans	-73.5	-27.9	-177.5	-52	-65.1	0	0	0	112.7	V645 P698 L699 N705 K706 E710 E711	V645-Y708 HydrophobicContact CG1-CD1 4.31Å; V645-Y708 HydrophobicContact CG1-CE1 3.59Å; V645-Y708 HydrophobicContact CG1-CE2 4.26Å; P698-Y708 HydrophobicContact CG-CD2 3.39Å; P698-Y708 HydrophobicContact CG-CE2 3.69Å; P698-Y708 HydrophobicContact CG-CG 3.89Å; L699-Y708 HydrophobicContact CD1-CE2 4.01Å; L699-Y708 HydrophobicContact CG-CE2 4.37Å; N705-Y708 PolarHBondContact O-N 3.24Å; K706-Y708 VanDerWaalsContact C-N 3.3Å; K706-Y708 PolarHBondContact O-N 3.48Å; Y708-E710 VanDerWaalsContact C-N 3.32Å; Y708-E711 PolarHBondContact O-N 3.05Å
709	Q	90.4	Very high	88.7	Confident	68 Å²	68	76.2 Å²	76.2	32%	0.318	39%	0.385	S	S	.	.	H	α-helix	trans	-73.1	-26.5	174.8	-58.7	179.3	-13.7	0	0	112	P693 F696 N705 K706 K707 V712	P693-Q709 HydrophobicContact CB-CB 4.26Å; P693-Q709 WeakPolarHBondContact O-CG 3.25Å; F696-Q709 HydrophobicContact CB-CG 4.47Å; N705-Q709 WeakPolarHBondContact O-CG 3.28Å; N705-Q709 PolarHBondContact O-N 3.35Å; K706-Q709 PolarHBondContact O-N 2.98Å; K706-Q709 VanDerWaalsContact O-N 3.13Å; K707-Q709 VanDerWaalsContact C-N 3.33Å; K707-Q709 PolarHBondContact O-N 3.27Å; Q709-V712 WeakPolarHBondContact O-CG2 3.45Å
710	E	88.6	Confident	89	Confident	151 Å²	151	78.6 Å²	78.6	71%	0.706	40%	0.396	S	S	*	.	H	α-helix	trans	-80.9	-31.7	173.1	-68.9	169.7	-170.9	0	0	111.8	K706 K707 Y708 V712 P713	K706-E710 WeakPolarHBondContact O-CG 3.45Å; K706-E710 PolarHBondContact O-N 2.95Å; K706-E710 VanDerWaalsContact O-N 3.07Å; K707-E710 PolarHBondContact O-N 2.96Å; Y708-E710 VanDerWaalsContact C-N 3.32Å; E710-V712 VanDerWaalsContact C-N 3.26Å; E710-V712 PolarHBondContact O-N 3.45Å; E710-P713 WeakPolarHBondContact O-CD 3.46Å
711	E	90.6	Very high	89.6	Confident	56 Å²	56	75.7 Å²	75.7	26%	0.262	38%	0.375	S	S	.	.			trans	-81.2	10.9	179.5	-71.7	176.3	-175.9	0	0	114.6	K707 Y708 P713 V714 Y715	K707-E711 WeakPolarHBondContact CE-OE1 3.47Å; K707-E711 IonicContact NZ-OE1 2.69Å; K707-E711 WeakPolarHBondContact O-CG 3.35Å; K707-E711 PolarHBondContact O-N 3.22Å; K707-E711 VanDerWaalsContact O-N 3.09Å; Y708-E711 PolarHBondContact O-N 3.05Å; E711-P713 VanDerWaalsContact C-N 3.29Å; E711-P713 VanDerWaalsContact O-N 3.16Å; E711-V714 HydrophobicContact CB-CG2 4.29Å; E711-V714 VanDerWaalsContact O-CB 3.26Å; E711-V714 WeakPolarHBondContact O-CB 3.31Å; E711-V714 PolarHBondContact O-N 3.19Å; E711-Y715 HydrophobicContact CB-CE2 4.01Å; E711-Y715 WeakPolarHBondContact O-CD2 3.26Å
712	V	91.8	Very high	90.2	Very high	1 Å²	1	70.8 Å²	70.8	1%	0.006	35%	0.352	C	S	.	.	H	α-helix	trans	-48.1	-42.6	177.2	177	0	0	0	0	113.6	P693 F696 Q709 E710 V714 Y715 V716 W719	P693-V712 HydrophobicContact CB-CG2 3.91Å; P693-V712 HydrophobicContact CG-CG2 4.29Å; F696-V712 HydrophobicContact CD2-CG2 3.69Å; F696-V712 HydrophobicContact CE2-CB 4.36Å; F696-V712 HydrophobicContact CE2-CG1 4Å; F696-V712 HydrophobicContact CE2-CG2 3.73Å; F696-V712 HydrophobicContact CG-CG2 4.37Å; F696-V712 HydrophobicContact CZ-CG1 4.4Å; F696-V712 HydrophobicContact CZ-CG2 4.43Å; Q709-V712 WeakPolarHBondContact O-CG2 3.45Å; E710-V712 VanDerWaalsContact C-N 3.26Å; E710-V712 PolarHBondContact O-N 3.45Å; V712-V714 PolarHBondContact O-N 3.48Å; V712-V714 VanDerWaalsContact O-N 3.12Å; V712-Y715 PolarHBondContact O-N 3Å; V712-Y715 VanDerWaalsContact O-N 3.08Å; V712-V716 HydrophobicContact CG1-CB 4.14Å; V712-V716 HydrophobicContact CG1-CG2 3.76Å; V712-V716 WeakPolarHBondContact O-CB 3.44Å; V712-V716 PolarHBondContact O-N 3.49Å; V712-W719 HydrophobicContact CG1-CD2 3.57Å; V712-W719 HydrophobicContact CG1-CE3 3.59Å; V712-W719 HydrophobicContact CG1-CG 4.14Å; V712-W719 HydrophobicContact CG1-CH2 4.18Å; V712-W719 HydrophobicContact CG1-CZ2 4.13Å; V712-W719 HydrophobicContact CG1-CZ3 3.91Å
713	P	92	Very high	90.9	Very high	48 Å²	48	67 Å²	67	31%	0.312	33%	0.333	S	S	.	.	H	α-helix	trans	-60.7	-22.4	178.5	-20.3	31.1	0	0	0	114.5	E710 E711 W719 M720	E710-P713 WeakPolarHBondContact O-CD 3.46Å; E711-P713 VanDerWaalsContact C-N 3.29Å; E711-P713 VanDerWaalsContact O-N 3.16Å; P713-W719 HydrophobicContact CG-CG 4.47Å; P713-M720 HydrophobicContact CB-CE 3.93Å; P713-M720 HydrophobicContact CG-CE 3.89Å
714	V	92	Very high	91.7	Very high	109 Å²	109	63.6 Å²	63.6	66%	0.661	31%	0.307	S	S	*	.	H	α-helix	trans	-72.5	-37.8	177.2	-177.4	0	0	0	0	110.8	E711 V712	E711-V714 HydrophobicContact CB-CG2 4.29Å; E711-V714 VanDerWaalsContact O-CB 3.26Å; E711-V714 WeakPolarHBondContact O-CB 3.31Å; E711-V714 PolarHBondContact O-N 3.19Å; V712-V714 PolarHBondContact O-N 3.48Å; V712-V714 VanDerWaalsContact O-N 3.12Å
715	Y	92.5	Very high	92.2	Very high	47 Å²	47	58.1 Å²	58.1	18%	0.184	28%	0.284	C	S	.	.	H	α-helix	trans	-95.9	-17.2	-175.9	-56.3	-74.5	0	0	0	113.6	C649 G653 F696 E711 V712 P717	C649-Y715 HydrophobicContact CB-CD1 3.82Å; C649-Y715 HydrophobicContact CB-CD2 4.1Å; C649-Y715 HydrophobicContact CB-CE1 3.56Å; C649-Y715 HydrophobicContact CB-CE2 3.88Å; C649-Y715 HydrophobicContact CB-CG 4.08Å; G653-Y715 CarbonylContact C-O 3.55Å; F696-Y715 HydrophobicContact CD1-CD2 4.41Å; F696-Y715 AromaticContact CE1-CD2 3.99Å; F696-Y715 HydrophobicContact CE1-CD2 3.99Å; F696-Y715 HydrophobicContact CE1-CG 4.1Å; E711-Y715 HydrophobicContact CB-CE2 4.01Å; E711-Y715 WeakPolarHBondContact O-CD2 3.26Å; V712-Y715 PolarHBondContact O-N 3Å; V712-Y715 VanDerWaalsContact O-N 3.08Å; Y715-P717 WeakPolarHBondContact O-CD 3.41Å
716	V	95.9	Very high	92.4	Very high	1 Å²	1	58.7 Å²	58.7	1%	0.006	29%	0.286	C	S	.	.			trans	-121.3	91	-175.1	-174.9	0	0	0	0	109.9	L656 N657 I660 F696 V712 K718 W719	L656-V716 HydrophobicContact CB-CG2 4.41Å; L656-V716 HydrophobicContact CD2-CG2 4.13Å; L656-V716 HydrophobicContact CG-CG2 4.43Å; N657-V716 HydrophobicContact CB-CG1 3.91Å; I660-V716 HydrophobicContact CD1-CG1 3.93Å; F696-V716 HydrophobicContact CE2-CG2 4.35Å; F696-V716 HydrophobicContact CZ-CG2 3.83Å; V712-V716 HydrophobicContact CG1-CB 4.14Å; V712-V716 HydrophobicContact CG1-CG2 3.76Å; V712-V716 WeakPolarHBondContact O-CB 3.44Å; V712-V716 PolarHBondContact O-N 3.49Å; V716-K718 VanDerWaalsContact C-N 3.27Å; V716-K718 PolarHBondContact O-N 3.14Å; V716-W719 HydrophobicContact CB-CB 4.02Å; V716-W719 HydrophobicContact CG1-CB 3.94Å; V716-W719 HydrophobicContact CG1-CE3 4.18Å; V716-W719 WeakPolarHBondContact O-CB 3.46Å; V716-W719 PolarHBondContact O-N 3.06Å
717	P	93.9	Very high	92.6	Very high	98 Å²	98	55.4 Å²	55.4	64%	0.636	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-36	-176.1	-28.9	34.8	0	0	0	114.9	N657 Y715 W719	N657-P717 WeakPolarHBondContact OD1-CD 3.38Å; Y715-P717 WeakPolarHBondContact O-CD 3.41Å; P717-W719 VanDerWaalsContact C-N 3.29Å; P717-W719 PolarHBondContact O-N 3Å
718	K	94.6	Very high	92.7	Very high	92 Å²	92	49.8 Å²	49.8	40%	0.4	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	8.1	179.8	-67.4	-65.1	-169.1	172.9	0	114.3	N657 I660 S661 I664 V716 P721 F722	N657-K718 WeakPolarHBondContact OD1-CB 3.37Å; N657-K718 PolarHBondContact OD1-N 3.31Å; I660-K718 HydrophobicContact CG2-CB 3.93Å; S661-K718 WeakPolarHBondContact OG-CG 3.45Å; I664-K718 HydrophobicContact CD1-CB 4.16Å; V716-K718 VanDerWaalsContact C-N 3.27Å; V716-K718 PolarHBondContact O-N 3.14Å; K718-P721 HydrophobicContact CD-CB 4.39Å; K718-P721 HydrophobicContact CD-CG 4.18Å; K718-P721 WeakPolarHBondContact O-CD 3.43Å; K718-F722 VanDerWaalsContact O-CB 3.29Å; K718-F722 WeakPolarHBondContact O-CB 3.45Å; K718-F722 PolarHBondContact O-N 3.29Å
719	W	95.4	Very high	92.7	Very high	20 Å²	20	48.4 Å²	48.4	8%	0.076	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-48.5	-179.6	-171	-100.9	0	0	0	113.4	L656 I660 M689 P693 V712 P713 V716 P717 F722 K723	L656-W719 HydrophobicContact CD2-CZ3 4.19Å; I660-W719 HydrophobicContact CD1-CE3 3.53Å; I660-W719 HydrophobicContact CD1-CZ3 3.73Å; M689-W719 HydrophobicContact CE-CH2 3.97Å; M689-W719 HydrophobicContact CE-CZ2 3.34Å; M689-W719 HydrophobicContact SD-CD2 4.46Å; M689-W719 HydrophobicContact SD-CH2 3.66Å; M689-W719 HydrophobicContact SD-CZ2 3.63Å; M689-W719 HydrophobicContact SD-CZ3 4.13Å; P693-W719 HydrophobicContact CG-CH2 3.82Å; P693-W719 HydrophobicContact CG-CZ2 3.95Å; V712-W719 HydrophobicContact CG1-CD2 3.57Å; V712-W719 HydrophobicContact CG1-CE3 3.59Å; V712-W719 HydrophobicContact CG1-CG 4.14Å; V712-W719 HydrophobicContact CG1-CH2 4.18Å; V712-W719 HydrophobicContact CG1-CZ2 4.13Å; V712-W719 HydrophobicContact CG1-CZ3 3.91Å; P713-W719 HydrophobicContact CG-CG 4.47Å; V716-W719 HydrophobicContact CB-CB 4.02Å; V716-W719 HydrophobicContact CG1-CB 3.94Å; V716-W719 HydrophobicContact CG1-CE3 4.18Å; V716-W719 WeakPolarHBondContact O-CB 3.46Å; V716-W719 PolarHBondContact O-N 3.06Å; P717-W719 VanDerWaalsContact C-N 3.29Å; P717-W719 PolarHBondContact O-N 3Å; W719-F722 WeakPolarHBondContact O-CB 3.44Å; W719-F722 PolarHBondContact O-N 3.07Å; W719-K723 PolarHBondContact O-N 2.71Å
720	M	93.3	Very high	92.7	Very high	102 Å²	102	49.4 Å²	49.4	50%	0.502	25%	0.249	S	C	.	.	H	α-helix	trans	-66.9	-45.4	177.9	-63.8	-57.9	-170.2	0	0	112.1	P713 F722 K723 E724	P713-M720 HydrophobicContact CB-CE 3.93Å; P713-M720 HydrophobicContact CG-CE 3.89Å; M720-F722 VanDerWaalsContact C-N 3.26Å; M720-F722 PolarHBondContact O-N 3.11Å; M720-K723 WeakPolarHBondContact O-CB 3.36Å; M720-K723 PolarHBondContact O-N 3.25Å; M720-K723 VanDerWaalsContact O-N 3.14Å; M720-E724 PolarHBondContact O-N 3.31Å
721	P	93.8	Very high	92.7	Very high	17 Å²	17	42.8 Å²	42.8	11%	0.11	22%	0.221	C	C	.	.	H	α-helix	trans	-54.8	-38.6	170.7	-28.6	34.6	0	0	0	114.5	I664 K718 E724 L725 A750 F751	I664-P721 HydrophobicContact CD1-CB 4.31Å; K718-P721 HydrophobicContact CD-CB 4.39Å; K718-P721 HydrophobicContact CD-CG 4.18Å; K718-P721 WeakPolarHBondContact O-CD 3.43Å; P721-E724 PolarHBondContact O-N 3.41Å; P721-L725 PolarHBondContact O-N 3.08Å; P721-A750 HydrophobicContact CB-CB 4.11Å; P721-A750 HydrophobicContact CG-CB 4.19Å; P721-F751 HydrophobicContact CB-CE2 4.35Å; P721-F751 HydrophobicContact CB-CZ 4.2Å; P721-F751 VanDerWaalsContact O-CE2 3.28Å; P721-F751 WeakPolarHBondContact O-CE2 3.33Å; P721-F751 WeakPolarHBondContact O-CZ 3.46Å
722	F	95.6	Very high	92.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-64.3	-42.3	176.4	-171.2	-122.6	0	0	0	112.5	I660 I663 I664 C685 V688 M689 K718 W719 M720 E724 L725 M726	I660-F722 HydrophobicContact CD1-CD1 4.35Å; I660-F722 HydrophobicContact CG1-CD1 4.39Å; I660-F722 HydrophobicContact CG2-CB 3.58Å; I660-F722 HydrophobicContact CG2-CD1 4.35Å; I660-F722 HydrophobicContact CG2-CD2 3.88Å; I660-F722 HydrophobicContact CG2-CG 3.69Å; I663-F722 HydrophobicContact CB-CE2 4.49Å; I663-F722 HydrophobicContact CG2-CE2 3.89Å; I664-F722 HydrophobicContact CD1-CB 3.99Å; I664-F722 HydrophobicContact CD1-CD2 4.23Å; I664-F722 HydrophobicContact CG1-CB 4.47Å; I664-F722 HydrophobicContact CG1-CD2 3.8Å; C685-F722 HydrophobicContact CB-CE1 4.35Å; C685-F722 HydrophobicContact CB-CE2 4.06Å; C685-F722 HydrophobicContact CB-CZ 3.61Å; V688-F722 HydrophobicContact CB-CE1 3.94Å; V688-F722 HydrophobicContact CB-CZ 3.98Å; V688-F722 HydrophobicContact CG1-CE1 3.86Å; V688-F722 HydrophobicContact CG1-CZ 4.09Å; M689-F722 HydrophobicContact CG-CD1 4.11Å; M689-F722 HydrophobicContact CG-CE1 3.84Å; M689-F722 HydrophobicContact SD-CD1 3.54Å; M689-F722 VanDerWaalsContact SD-CD1 3.54Å; M689-F722 HydrophobicContact SD-CE1 3.87Å; K718-F722 VanDerWaalsContact O-CB 3.29Å; K718-F722 WeakPolarHBondContact O-CB 3.45Å; K718-F722 PolarHBondContact O-N 3.29Å; W719-F722 WeakPolarHBondContact O-CB 3.44Å; W719-F722 PolarHBondContact O-N 3.07Å; M720-F722 VanDerWaalsContact C-N 3.26Å; M720-F722 PolarHBondContact O-N 3.11Å; F722-E724 VanDerWaalsContact C-N 3.34Å; F722-E724 PolarHBondContact O-N 3.08Å; F722-L725 WeakPolarHBondContact O-CB 3.44Å; F722-L725 PolarHBondContact O-N 2.8Å; F722-M726 HydrophobicContact CE1-SD 4.18Å; F722-M726 PolarHBondContact O-N 3.2Å
723	K	93.7	Very high	92.3	Very high	89 Å²	89	43.8 Å²	43.8	39%	0.387	23%	0.232	S	C	.	.	H	α-helix	trans	-62.8	-40.5	175.6	-171.3	177.6	-179.9	-179.6	0	111.9	W719 M720 M726 M727	W719-K723 PolarHBondContact O-N 2.71Å; M720-K723 WeakPolarHBondContact O-CB 3.36Å; M720-K723 PolarHBondContact O-N 3.25Å; M720-K723 VanDerWaalsContact O-N 3.14Å; K723-M726 PolarHBondContact O-N 3.43Å; K723-M727 HydrophobicContact CD-CE 4.27Å; K723-M727 HydrophobicContact CG-CE 3.89Å; K723-M727 HydrophobicContact CG-SD 4.38Å; K723-M727 WeakPolarHBondContact O-CG 3.48Å; K723-M727 PolarHBondContact O-N 3.05Å
724	E	93.1	Very high	92	Very high	20 Å²	20	48.4 Å²	48.4	9%	0.093	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-41.3	174.3	-68	-57.2	129.8	0	0	112.1	M720 P721 F722 M726 M727 M728 R739 L747 A750 F751	M720-E724 PolarHBondContact O-N 3.31Å; P721-E724 PolarHBondContact O-N 3.41Å; F722-E724 VanDerWaalsContact C-N 3.34Å; F722-E724 PolarHBondContact O-N 3.08Å; E724-M726 VanDerWaalsContact C-N 3.35Å; E724-M726 PolarHBondContact O-N 3.12Å; E724-M727 PolarHBondContact O-N 3.38Å; E724-M728 WeakPolarHBondContact O-CG 3.3Å; E724-M728 PolarHBondContact O-N 3.05Å; E724-R739 IonicContact OE1-CZ 3.5Å; E724-R739 IonicContact OE1-NH2 3.27Å; E724-R739 PolarHBondContact OE1-NH2 3.13Å; E724-R739 IonicContact OE2-CZ 3.97Å; E724-R739 IonicContact OE2-NE 2.75Å; E724-R739 PolarHBondContact OE2-NE 2.91Å; E724-R739 IonicContact OE2-NH2 2.82Å; E724-R739 PolarHBondContact OE2-NH2 3.37Å; E724-L747 HydrophobicContact CB-CD1 4.32Å; E724-A750 HydrophobicContact CB-CB 4.12Å; E724-A750 HydrophobicContact CG-CB 3.91Å; E724-F751 HydrophobicContact CB-CE2 4.1Å
725	L	93.8	Very high	91.8	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.239	C	C	.	.	H	α-helix	trans	-58.6	-46.3	175.7	179.2	64.4	0	0	0	111.5	I664 I667 T668 P721 F722 M727 M728 L729 F751 L759	I664-L725 HydrophobicContact CB-CD2 4.32Å; I664-L725 HydrophobicContact CG1-CD2 3.96Å; I664-L725 HydrophobicContact CG2-CD2 4.42Å; I667-L725 HydrophobicContact CB-CD2 4.23Å; I667-L725 HydrophobicContact CD1-CD2 4.23Å; I667-L725 HydrophobicContact CG2-CD1 4.18Å; I667-L725 HydrophobicContact CG2-CD2 4.16Å; T668-L725 HydrophobicContact CG2-CD1 4.31Å; P721-L725 PolarHBondContact O-N 3.08Å; F722-L725 WeakPolarHBondContact O-CB 3.44Å; F722-L725 PolarHBondContact O-N 2.8Å; L725-M727 VanDerWaalsContact C-N 3.29Å; L725-M727 PolarHBondContact O-N 3.28Å; L725-M728 WeakPolarHBondContact O-CB 3.45Å; L725-M728 PolarHBondContact O-N 3.23Å; L725-M728 VanDerWaalsContact O-N 3.12Å; L725-L729 WeakPolarHBondContact O-CG 3.13Å; L725-L729 PolarHBondContact O-N 3.49Å; L725-F751 HydrophobicContact CB-CE2 4.34Å; L725-F751 HydrophobicContact CB-CZ 3.98Å; L725-L759 HydrophobicContact CD1-CD1 4.1Å; L725-L759 HydrophobicContact CD1-CD2 4.14Å
726	M	93.9	Very high	91.6	Very high	14 Å²	14	45.8 Å²	45.8	7%	0.069	23%	0.231	C	C	.	.	H	α-helix	trans	-58.7	-41.9	176.8	-77.2	-177.1	61.6	0	0	112.9	Y682 C685 K686 M689 F722 K723 E724 M728 L729	Y682-M726 HydrophobicContact CD2-CB 4.15Å; Y682-M726 HydrophobicContact CD2-CE 4.03Å; Y682-M726 WeakPolarHBondContact CD2-O 3.39Å; Y682-M726 HydrophobicContact CE2-CB 4.15Å; Y682-M726 HydrophobicContact CE2-CE 3.65Å; C685-M726 HydrophobicContact CB-CE 4.19Å; C685-M726 HydrophobicContact CB-CG 3.34Å; C685-M726 HydrophobicContact CB-SD 3.56Å; C685-M726 VanDerWaalsContact CB-SD 3.56Å; K686-M726 VanDerWaalsContact CA-CE 3.48Å; K686-M726 HydrophobicContact CB-CE 3.8Å; K686-M726 HydrophobicContact CG-CE 4.46Å; M689-M726 HydrophobicContact CB-SD 4.25Å; M689-M726 HydrophobicContact CG-CE 3.97Å; M689-M726 HydrophobicContact CG-SD 3.17Å; M689-M726 WeakPolarHBondContact CG-SD 3.46Å; M689-M726 HydrophobicContact SD-SD 4.29Å; F722-M726 HydrophobicContact CE1-SD 4.18Å; F722-M726 PolarHBondContact O-N 3.2Å; K723-M726 PolarHBondContact O-N 3.43Å; E724-M726 VanDerWaalsContact C-N 3.35Å; E724-M726 PolarHBondContact O-N 3.12Å; M726-M728 VanDerWaalsContact C-N 3.31Å; M726-L729 PolarHBondContact O-N 3.42Å
727	M	91	Very high	91	Very high	66 Å²	66	47.1 Å²	47.1	33%	0.325	25%	0.245	S	C	.	.	H	α-helix	trans	-65.4	-38.5	177.2	-69.9	166	173.3	0	0	110.6	K723 E724 L725 Q730 A731 R739	K723-M727 HydrophobicContact CD-CE 4.27Å; K723-M727 HydrophobicContact CG-CE 3.89Å; K723-M727 HydrophobicContact CG-SD 4.38Å; K723-M727 WeakPolarHBondContact O-CG 3.48Å; K723-M727 PolarHBondContact O-N 3.05Å; E724-M727 PolarHBondContact O-N 3.38Å; L725-M727 VanDerWaalsContact C-N 3.29Å; L725-M727 PolarHBondContact O-N 3.28Å; M727-Q730 PolarHBondContact O-N 3.15Å; M727-A731 WeakPolarHBondContact O-CB 3.48Å; M727-A731 PolarHBondContact O-N 3.18Å; M727-R739 PolarHBondContact SD-NH1 3.35Å; M727-R739 PolarHBondContact SD-NH2 3.29Å
728	M	90.5	Very high	90.7	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.02	24%	0.242	C	C	.	.	H	α-helix	trans	-64.9	-37.3	176.5	-71.1	-136.8	-58.2	0	0	114.1	E724 L725 M726 Q730 A731 I736 L747 L759	E724-M728 WeakPolarHBondContact O-CG 3.3Å; E724-M728 PolarHBondContact O-N 3.05Å; L725-M728 WeakPolarHBondContact O-CB 3.45Å; L725-M728 PolarHBondContact O-N 3.23Å; L725-M728 VanDerWaalsContact O-N 3.12Å; M726-M728 VanDerWaalsContact C-N 3.31Å; M728-Q730 PolarHBondContact O-N 3.24Å; M728-Q730 VanDerWaalsContact O-N 3.08Å; M728-A731 PolarHBondContact O-N 3.01Å; M728-I736 HydrophobicContact SD-CG1 4.41Å; M728-I736 HydrophobicContact SD-CG2 4.09Å; M728-L747 HydrophobicContact CE-CD1 4.15Å; M728-L747 HydrophobicContact CG-CD1 3.82Å; M728-L747 HydrophobicContact CG-CD2 4.48Å; M728-L747 HydrophobicContact SD-CD1 3.49Å; M728-L747 WeakPolarHBondContact SD-CD1 3.2Å; M728-L747 HydrophobicContact SD-CD2 3.59Å; M728-L747 VanDerWaalsContact SD-CD2 3.59Å; M728-L747 HydrophobicContact SD-CG 4.17Å; M728-L759 HydrophobicContact CE-CB 3.75Å; M728-L759 HydrophobicContact CE-CD1 3.25Å; M728-L759 HydrophobicContact CE-CG 4.06Å
729	L	90.3	Very high	90.4	Very high	12 Å²	12	46.5 Å²	46.5	6%	0.063	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-17.9	178	-69.8	174	0	0	0	113.3	I667 L681 L725 M726 L763	I667-L729 HydrophobicContact CG2-CD2 4.26Å; L681-L729 HydrophobicContact CB-CD1 3.87Å; L681-L729 HydrophobicContact CD1-CD2 4.41Å; L725-L729 WeakPolarHBondContact O-CG 3.13Å; L725-L729 PolarHBondContact O-N 3.49Å; M726-L729 PolarHBondContact O-N 3.42Å; L729-L763 HydrophobicContact CD2-CD2 4.06Å
730	Q	89.8	Confident	90.1	Very high	89 Å²	89	46 Å²	46	42%	0.416	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-120.4	-6.7	-177	-66.1	-69.3	-57.9	0	0	113.3	D679 Y682 M727 M728	D679-Q730 PolarHBondContact OD1-NE2 2.91Å; D679-Q730 PolarHBondContact OD1-OE1 3.49Å; Y682-Q730 HydrophobicContact CD1-CG 4.04Å; Y682-Q730 HydrophobicContact CD2-CG 3.5Å; Y682-Q730 VanDerWaalsContact CD2-CG 3.5Å; Y682-Q730 HydrophobicContact CE1-CG 4.4Å; Y682-Q730 HydrophobicContact CE2-CG 3.92Å; Y682-Q730 HydrophobicContact CG-CG 3.56Å; M727-Q730 PolarHBondContact O-N 3.15Å; M728-Q730 PolarHBondContact O-N 3.24Å; M728-Q730 VanDerWaalsContact O-N 3.08Å
731	A	89.2	Confident	89.8	Confident	13 Å²	13	43.3 Å²	43.3	11%	0.107	23%	0.228	C	C	.	.			trans	-83.9	150.5	-172.1	0	0	0	0	0	112.3	M727 M728 E735 I736 F764	M727-A731 WeakPolarHBondContact O-CB 3.48Å; M727-A731 PolarHBondContact O-N 3.18Å; M728-A731 PolarHBondContact O-N 3.01Å; A731-E735 WeakPolarHBondContact CA-OE2 3.17Å; A731-E735 HydrophobicContact CB-CB 4.08Å; A731-I736 HydrophobicContact CB-CD1 4.37Å; A731-I736 HydrophobicContact CB-CG1 3.81Å; A731-F764 WeakPolarHBondContact O-CZ 3.41Å
732	S	88.6	Confident	89.2	Confident	48 Å²	48	49 Å²	49	34%	0.336	26%	0.257	S	S	.	.			trans	-74.7	158.8	168	71.8	0	0	0	0	111.9	Q734 E735 I736	S732-Q734 PolarHBondContact O-N 3.11Å; S732-Q734 VanDerWaalsContact O-N 3.13Å; S732-E735 WeakPolarHBondContact CB-OE1 3.47Å; S732-E735 PolarHBondContact N-OE2 2.93Å; S732-E735 PolarHBondContact O-N 3.28Å; S732-E735 VanDerWaalsContact O-N 3.08Å; S732-E735 WeakPolarHBondContact OG-CG 3.49Å; S732-E735 PolarHBondContact OG-N 3.35Å; S732-E735 PolarHBondContact OG-OE1 3.24Å; S732-I736 WeakPolarHBondContact O-CG1 3.22Å; S732-I736 PolarHBondContact O-N 3.45Å
733	L	86.1	Confident	88.6	Confident	30 Å²	30	50.8 Å²	50.8	16%	0.157	28%	0.276	C	S	.	.	H	α-helix	trans	-58.2	-29.4	178.6	-162.8	79.2	0	0	0	112.8	G737 I760 F764 R769 R770 A773	L733-G737 PolarHBondContact O-N 3.32Å; L733-I760 HydrophobicContact CD1-CG2 3.75Å; L733-F764 HydrophobicContact CB-CD1 4.46Å; L733-F764 HydrophobicContact CB-CE1 4.1Å; L733-F764 HydrophobicContact CB-CZ 4.2Å; L733-F764 HydrophobicContact CD1-CD1 4.27Å; L733-F764 HydrophobicContact CD1-CD2 3.65Å; L733-F764 HydrophobicContact CD1-CE1 4.42Å; L733-F764 HydrophobicContact CD1-CE2 3.83Å; L733-F764 HydrophobicContact CD1-CG 3.89Å; L733-F764 HydrophobicContact CD1-CZ 4.2Å; L733-R769 VanDerWaalsContact CD2-C 3.47Å; L733-R769 HydrophobicContact CD2-CB 4.16Å; L733-R769 VanDerWaalsContact CD2-O 3.3Å; L733-R769 WeakPolarHBondContact CD2-O 3.47Å; L733-R770 HydrophobicContact CD2-CB 4.48Å; L733-A773 HydrophobicContact CD1-CB 4.01Å; L733-A773 HydrophobicContact CD2-CB 3.64Å; L733-A773 HydrophobicContact CG-CB 3.67Å
734	Q	85.8	Confident	88.1	Confident	145 Å²	145	55.8 Å²	55.8	68%	0.678	30%	0.297	S	S	*	.	H	α-helix	trans	-70.3	-48.8	174.9	-178.3	174.8	-9.3	0	0	111.2	S732 I736 G737 D738	S732-Q734 PolarHBondContact O-N 3.11Å; S732-Q734 VanDerWaalsContact O-N 3.13Å; Q734-I736 VanDerWaalsContact C-N 3.28Å; Q734-I736 PolarHBondContact O-N 3.23Å; Q734-G737 WeakPolarHBondContact O-CA 3.34Å; Q734-G737 PolarHBondContact O-N 3.45Å; Q734-D738 PolarHBondContact O-N 2.91Å
735	E	88.1	Confident	87.8	Confident	98 Å²	98	55.2 Å²	55.2	46%	0.458	30%	0.297	S	S	.	.	H	α-helix	trans	-59.3	-39	176.9	-72.6	154.3	-134.9	0	0	112.1	A731 S732 G737 D738 R739	A731-E735 WeakPolarHBondContact CA-OE2 3.17Å; A731-E735 HydrophobicContact CB-CB 4.08Å; S732-E735 WeakPolarHBondContact CB-OE1 3.47Å; S732-E735 PolarHBondContact N-OE2 2.93Å; S732-E735 PolarHBondContact O-N 3.28Å; S732-E735 VanDerWaalsContact O-N 3.08Å; S732-E735 WeakPolarHBondContact OG-CG 3.49Å; S732-E735 PolarHBondContact OG-N 3.35Å; S732-E735 PolarHBondContact OG-OE1 3.24Å; E735-G737 VanDerWaalsContact C-N 3.32Å; E735-G737 PolarHBondContact O-N 3.47Å; E735-D738 PolarHBondContact O-N 2.93Å; E735-R739 WeakPolarHBondContact O-CB 3.28Å; E735-R739 VanDerWaalsContact O-CG 3.29Å; E735-R739 WeakPolarHBondContact O-CG 3.48Å; E735-R739 PolarHBondContact O-N 3.43Å
736	I	87.4	Confident	87.4	Confident	3 Å²	3	58.5 Å²	58.5	2%	0.015	32%	0.318	C	S	.	.	H	α-helix	trans	-62.4	-42.2	175.1	-65.3	170.6	0	0	0	110.6	M728 A731 S732 Q734 R739 W740 L747 I760 F764	M728-I736 HydrophobicContact SD-CG1 4.41Å; M728-I736 HydrophobicContact SD-CG2 4.09Å; A731-I736 HydrophobicContact CB-CD1 4.37Å; A731-I736 HydrophobicContact CB-CG1 3.81Å; S732-I736 WeakPolarHBondContact O-CG1 3.22Å; S732-I736 PolarHBondContact O-N 3.45Å; Q734-I736 VanDerWaalsContact C-N 3.28Å; Q734-I736 PolarHBondContact O-N 3.23Å; I736-R739 PolarHBondContact O-N 2.88Å; I736-W740 WeakPolarHBondContact O-CB 3.19Å; I736-W740 PolarHBondContact O-N 2.81Å; I736-L747 HydrophobicContact CG2-CD2 3.95Å; I736-I760 HydrophobicContact CG2-CD1 3.86Å; I736-I760 HydrophobicContact CG2-CG1 4.14Å; I736-F764 HydrophobicContact CD1-CE2 3.52Å; I736-F764 HydrophobicContact CD1-CZ 3.82Å
737	G	84.1	Confident	87.1	Confident	28 Å²	28	57.8 Å²	57.8	29%	0.289	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-43.3	174.4	0	0	0	0	0	112.9	L733 Q734 E735 W740 A741	L733-G737 PolarHBondContact O-N 3.32Å; Q734-G737 WeakPolarHBondContact O-CA 3.34Å; Q734-G737 PolarHBondContact O-N 3.45Å; E735-G737 VanDerWaalsContact C-N 3.32Å; E735-G737 PolarHBondContact O-N 3.47Å; G737-W740 WeakPolarHBondContact O-CB 3.47Å; G737-W740 PolarHBondContact O-N 3.27Å; G737-A741 PolarHBondContact O-N 3.03Å; G737-A741 VanDerWaalsContact O-N 3.11Å
738	D	86.8	Confident	86.9	Confident	108 Å²	108	55.9 Å²	55.9	58%	0.578	31%	0.309	S	S	*	.	H	α-helix	trans	-66.5	-38.7	179.2	-66.3	-20.6	0	0	0	111.6	Q734 E735 A741	Q734-D738 PolarHBondContact O-N 2.91Å; E735-D738 PolarHBondContact O-N 2.93Å; D738-A741 WeakPolarHBondContact O-CB 3.35Å; D738-A741 PolarHBondContact O-N 3.27Å
739	R	87.6	Confident	86.7	Confident	69 Å²	69	60.1 Å²	60.1	26%	0.26	35%	0.345	S	S	.	.	H	α-helix	trans	-74.1	-23.8	175.3	-68.7	-175.7	82.3	111.1	11.9	114	E724 M727 E735 I736 G745 P746 L747	E724-R739 IonicContact OE1-CZ 3.5Å; E724-R739 IonicContact OE1-NH2 3.27Å; E724-R739 PolarHBondContact OE1-NH2 3.13Å; E724-R739 IonicContact OE2-CZ 3.97Å; E724-R739 IonicContact OE2-NE 2.75Å; E724-R739 PolarHBondContact OE2-NE 2.91Å; E724-R739 IonicContact OE2-NH2 2.82Å; E724-R739 PolarHBondContact OE2-NH2 3.37Å; M727-R739 PolarHBondContact SD-NH1 3.35Å; M727-R739 PolarHBondContact SD-NH2 3.29Å; E735-R739 WeakPolarHBondContact O-CB 3.28Å; E735-R739 VanDerWaalsContact O-CG 3.29Å; E735-R739 WeakPolarHBondContact O-CG 3.48Å; E735-R739 PolarHBondContact O-N 3.43Å; I736-R739 PolarHBondContact O-N 2.88Å; R739-G745 CarbonylContact O-C 3.39Å; R739-G745 VanDerWaalsContact O-CA 3.25Å; R739-G745 WeakPolarHBondContact O-CA 3.37Å; R739-P746 VanDerWaalsContact O-CD 3.31Å; R739-P746 WeakPolarHBondContact O-CD 3.41Å; R739-L747 HydrophobicContact CB-CB 4.19Å; R739-L747 WeakPolarHBondContact O-CB 3.47Å; R739-L747 PolarHBondContact O-N 3.47Å
740	W	88.9	Confident	86.6	Confident	11 Å²	11	60.4 Å²	60.4	4%	0.042	35%	0.349	C	S	.	.	H	α-helix	trans	-70.3	-39.5	170.1	179.4	-102.1	0	0	0	111.1	I736 G737 D742 G743 K744 G745 L747 A748 V756 I777	I736-W740 WeakPolarHBondContact O-CB 3.19Å; I736-W740 PolarHBondContact O-N 2.81Å; G737-W740 WeakPolarHBondContact O-CB 3.47Å; G737-W740 PolarHBondContact O-N 3.27Å; W740-D742 PolarHBondContact O-N 3.4Å; W740-G743 VanDerWaalsContact NE1-N 3.17Å; W740-G743 PolarHBondContact O-N 2.97Å; W740-K744 PolarHBondContact O-N 2.82Å; W740-G745 PolarHBondContact O-N 3.45Å; W740-L747 HydrophobicContact CB-CD2 4.49Å; W740-L747 HydrophobicContact CE3-CD2 4.43Å; W740-L747 HydrophobicContact CE3-CG 4.43Å; W740-A748 HydrophobicContact CD2-CB 4.22Å; W740-A748 HydrophobicContact CE3-CB 3.79Å; W740-A748 HydrophobicContact CH2-CB 4.02Å; W740-A748 HydrophobicContact CZ2-CB 4.43Å; W740-A748 HydrophobicContact CZ3-CB 3.69Å; W740-V756 HydrophobicContact CE3-CG1 4.38Å; W740-V756 HydrophobicContact CE3-CG2 4.13Å; W740-V756 HydrophobicContact CZ3-CB 4.32Å; W740-V756 HydrophobicContact CZ3-CG2 3.82Å; W740-I777 HydrophobicContact CB-CG1 4.48Å; W740-I777 HydrophobicContact CD2-CB 4.47Å; W740-I777 HydrophobicContact CD2-CG1 4.09Å; W740-I777 HydrophobicContact CD2-CG2 4Å; W740-I777 HydrophobicContact CE3-CG2 4.24Å; W740-I777 HydrophobicContact CG-CG1 3.9Å; W740-I777 HydrophobicContact CH2-CG2 4.02Å; W740-I777 HydrophobicContact CZ2-CG2 3.75Å; W740-I777 HydrophobicContact CZ3-CG2 4.25Å
741	A	87.4	Confident	86.5	Confident	45 Å²	45	56.7 Å²	56.7	37%	0.372	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	42.9	56.4	177.5	0	0	0	0	0	113	G737 D738 G743 K744	G737-A741 PolarHBondContact O-N 3.03Å; G737-A741 VanDerWaalsContact O-N 3.11Å; D738-A741 WeakPolarHBondContact O-CB 3.35Å; D738-A741 PolarHBondContact O-N 3.27Å; A741-G743 PolarHBondContact O-N 2.84Å; A741-G743 VanDerWaalsContact O-N 3.14Å; A741-K744 PolarHBondContact O-N 3.07Å
742	D	82.4	Confident	86.6	Confident	136 Å²	136	58.3 Å²	58.3	73%	0.727	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	50.8	37.4	-179	-60.8	-33.4	0	0	0	114.4	W740	W740-D742 PolarHBondContact O-N 3.4Å
743	G	81.4	Confident	86.6	Confident	38 Å²	38	57 Å²	57	39%	0.392	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	85.4	7.4	177.7	0	0	0	0	0	114.5	W740 A741 A748	W740-G743 VanDerWaalsContact NE1-N 3.17Å; W740-G743 PolarHBondContact O-N 2.97Å; A741-G743 PolarHBondContact O-N 2.84Å; A741-G743 VanDerWaalsContact O-N 3.14Å; G743-A748 VanDerWaalsContact C-CB 3.42Å; G743-A748 WeakPolarHBondContact O-CB 3.47Å
744	K	83.9	Confident	86.7	Confident	194 Å²	194	59.5 Å²	59.5	84%	0.843	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.6	-4.6	178.6	-62.6	180	-178.4	175.6	0	113.7	W740 A741	W740-K744 PolarHBondContact O-N 2.82Å; A741-K744 PolarHBondContact O-N 3.07Å
745	G	86.8	Confident	86.9	Confident	8 Å²	8	56.4 Å²	56.4	8%	0.082	34%	0.338	C	S	.	.	S	Bend	trans	-81.8	171.3	-178.2	0	0	0	0	0	113.7	R739 W740 L747 A748 A749	R739-G745 CarbonylContact O-C 3.39Å; R739-G745 VanDerWaalsContact O-CA 3.25Å; R739-G745 WeakPolarHBondContact O-CA 3.37Å; W740-G745 PolarHBondContact O-N 3.45Å; G745-L747 PolarHBondContact O-N 3.46Å; G745-L747 VanDerWaalsContact O-N 3.17Å; G745-A748 PolarHBondContact O-N 2.69Å; G745-A748 VanDerWaalsContact O-N 3.09Å; G745-A749 PolarHBondContact O-N 3.36Å
746	P	85.9	Confident	87	Confident	69 Å²	69	51.8 Å²	51.8	45%	0.448	32%	0.317	S	S	.	.	H	α-helix	trans	-58	-30.8	-178.6	24.2	-35.2	0	0	0	112.8	R739 A749 A750	R739-P746 VanDerWaalsContact O-CD 3.31Å; R739-P746 WeakPolarHBondContact O-CD 3.41Å; P746-A749 PolarHBondContact O-N 2.8Å; P746-A750 PolarHBondContact O-N 3.5Å
747	L	86.9	Confident	87.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.6	-39	178.4	-175.1	64.6	0	0	0	112.3	E724 M728 I736 R739 W740 G745 A749 A750 F751 V756	E724-L747 HydrophobicContact CB-CD1 4.32Å; M728-L747 HydrophobicContact CE-CD1 4.15Å; M728-L747 HydrophobicContact CG-CD1 3.82Å; M728-L747 HydrophobicContact CG-CD2 4.48Å; M728-L747 HydrophobicContact SD-CD1 3.49Å; M728-L747 WeakPolarHBondContact SD-CD1 3.2Å; M728-L747 HydrophobicContact SD-CD2 3.59Å; M728-L747 VanDerWaalsContact SD-CD2 3.59Å; M728-L747 HydrophobicContact SD-CG 4.17Å; I736-L747 HydrophobicContact CG2-CD2 3.95Å; R739-L747 HydrophobicContact CB-CB 4.19Å; R739-L747 WeakPolarHBondContact O-CB 3.47Å; R739-L747 PolarHBondContact O-N 3.47Å; W740-L747 HydrophobicContact CB-CD2 4.49Å; W740-L747 HydrophobicContact CE3-CD2 4.43Å; W740-L747 HydrophobicContact CE3-CG 4.43Å; G745-L747 PolarHBondContact O-N 3.46Å; G745-L747 VanDerWaalsContact O-N 3.17Å; L747-A749 VanDerWaalsContact C-N 3.29Å; L747-A749 PolarHBondContact O-N 2.83Å; L747-A750 PolarHBondContact O-N 2.91Å; L747-A750 VanDerWaalsContact O-N 3.15Å; L747-F751 HydrophobicContact CD1-CD2 3.92Å; L747-F751 PolarHBondContact O-N 3.21Å; L747-V756 HydrophobicContact CD1-CG2 4.38Å; L747-V756 HydrophobicContact CD2-CG1 3.87Å; L747-V756 HydrophobicContact CD2-CG2 4.24Å; L747-V756 HydrophobicContact CG-CG2 4.03Å
748	A	87.3	Confident	87.4	Confident	25 Å²	25	54.3 Å²	54.3	21%	0.207	33%	0.327	C	S	.	.	H	α-helix	trans	-70.7	-25.7	178	0	0	0	0	0	112.7	W740 G743 G745 A750	W740-A748 HydrophobicContact CD2-CB 4.22Å; W740-A748 HydrophobicContact CE3-CB 3.79Å; W740-A748 HydrophobicContact CH2-CB 4.02Å; W740-A748 HydrophobicContact CZ2-CB 4.43Å; W740-A748 HydrophobicContact CZ3-CB 3.69Å; G743-A748 VanDerWaalsContact C-CB 3.42Å; G743-A748 WeakPolarHBondContact O-CB 3.47Å; G745-A748 PolarHBondContact O-N 2.69Å; G745-A748 VanDerWaalsContact O-N 3.09Å; A748-A750 VanDerWaalsContact C-N 3.33Å
749	A	87.3	Confident	87.5	Confident	93 Å²	93	49.3 Å²	49.3	77%	0.769	30%	0.3	S	S	*	.	H	α-helix	trans	-74.2	-25.2	171.4	0	0	0	0	0	112.7	G745 P746 L747	G745-A749 PolarHBondContact O-N 3.36Å; P746-A749 PolarHBondContact O-N 2.8Å; L747-A749 VanDerWaalsContact C-N 3.29Å; L747-A749 PolarHBondContact O-N 2.83Å
750	A	86.8	Confident	87.6	Confident	18 Å²	18	46 Å²	46	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-93.4	-36.6	-175.7	0	0	0	0	0	114.1	P721 E724 P746 L747 A748	P721-A750 HydrophobicContact CB-CB 4.11Å; P721-A750 HydrophobicContact CG-CB 4.19Å; E724-A750 HydrophobicContact CB-CB 4.12Å; E724-A750 HydrophobicContact CG-CB 3.91Å; P746-A750 PolarHBondContact O-N 3.5Å; L747-A750 PolarHBondContact O-N 2.91Å; L747-A750 VanDerWaalsContact O-N 3.15Å; A748-A750 VanDerWaalsContact C-N 3.33Å
751	F	88.1	Confident	87.7	Confident	12 Å²	12	51.6 Å²	51.6	5%	0.053	31%	0.309	C	S	.	.	S	Bend	trans	-135.7	151.1	-173	-66.1	-82.2	0	0	0	112	I664 T668 P721 E724 L725 L747 E755 V756	I664-F751 HydrophobicContact CG2-CE1 3.83Å; I664-F751 HydrophobicContact CG2-CZ 4.24Å; T668-F751 HydrophobicContact CG2-CE1 4.18Å; P721-F751 HydrophobicContact CB-CE2 4.35Å; P721-F751 HydrophobicContact CB-CZ 4.2Å; P721-F751 VanDerWaalsContact O-CE2 3.28Å; P721-F751 WeakPolarHBondContact O-CE2 3.33Å; P721-F751 WeakPolarHBondContact O-CZ 3.46Å; E724-F751 HydrophobicContact CB-CE2 4.1Å; L725-F751 HydrophobicContact CB-CE2 4.34Å; L725-F751 HydrophobicContact CB-CZ 3.98Å; L747-F751 HydrophobicContact CD1-CD2 3.92Å; L747-F751 PolarHBondContact O-N 3.21Å; F751-E755 HydrophobicContact CB-CB 4.34Å; F751-E755 HydrophobicContact CD1-CB 4.35Å; F751-V756 HydrophobicContact CB-CG2 3.63Å
752	S	90.5	Very high	87.8	Confident	46 Å²	46	49.5 Å²	49.5	32%	0.322	29%	0.292	S	S	.	.			trans	-71.2	154.9	172.5	65.6	0	0	0	0	112.1	S754 E755 V756	S752-S754 PolarHBondContact O-N 2.87Å; S752-S754 PolarHBondContact OG-OG 3.03Å; S752-E755 WeakPolarHBondContact CB-OE2 3.42Å; S752-E755 PolarHBondContact N-OE2 2.97Å; S752-E755 PolarHBondContact O-N 2.75Å; S752-E755 WeakPolarHBondContact OG-CB 3.43Å; S752-E755 VanDerWaalsContact OG-CD 3.24Å; S752-E755 VanDerWaalsContact OG-CG 3.22Å; S752-E755 WeakPolarHBondContact OG-CG 3.2Å; S752-E755 PolarHBondContact OG-N 3.39Å; S752-E755 PolarHBondContact OG-OE2 2.9Å; S752-V756 WeakPolarHBondContact O-CG2 3.35Å; S752-V756 PolarHBondContact O-N 3.09Å
753	S	88.6	Confident	88.1	Confident	22 Å²	22	44.5 Å²	44.5	15%	0.154	27%	0.265	C	S	.	.	H	α-helix	trans	-52.2	-37.4	173.2	166.4	0	0	0	0	112.6	K757 K778	S753-K757 WeakPolarHBondContact O-CB 2.84Å; S753-K757 WeakPolarHBondContact O-CD 3.21Å; S753-K757 WeakPolarHBondContact O-CG 3.45Å; S753-K757 PolarHBondContact O-N 3.3Å; S753-K757 PolarHBondContact OG-NZ 2.99Å; S753-K778 WeakPolarHBondContact CB-O 2.98Å; S753-K778 WeakPolarHBondContact CB-OXT 3.29Å; S753-K778 PolarHBondContact OG-O 3.18Å; S753-K778 PolarHBondContact OG-OXT 3.24Å
754	S	88.8	Confident	88.5	Confident	82 Å²	82	45.2 Å²	45.2	57%	0.573	26%	0.257	S	S	*	.	H	α-helix	trans	-64.8	-45.4	175.3	37.1	0	0	0	0	113.4	S752 K757 A758	S752-S754 PolarHBondContact O-N 2.87Å; S752-S754 PolarHBondContact OG-OG 3.03Å; S754-K757 PolarHBondContact O-N 3.07Å; S754-A758 WeakPolarHBondContact O-CB 3.36Å; S754-A758 PolarHBondContact O-N 3.02Å
755	E	89.8	Confident	88.6	Confident	80 Å²	80	44 Å²	44	37%	0.374	26%	0.255	S	S	.	.	H	α-helix	trans	-67.3	-43.4	179.8	-72.2	162.6	136.8	0	0	111	F751 S752 K757 A758 L759	F751-E755 HydrophobicContact CB-CB 4.34Å; F751-E755 HydrophobicContact CD1-CB 4.35Å; S752-E755 WeakPolarHBondContact CB-OE2 3.42Å; S752-E755 PolarHBondContact N-OE2 2.97Å; S752-E755 PolarHBondContact O-N 2.75Å; S752-E755 WeakPolarHBondContact OG-CB 3.43Å; S752-E755 VanDerWaalsContact OG-CD 3.24Å; S752-E755 VanDerWaalsContact OG-CG 3.22Å; S752-E755 WeakPolarHBondContact OG-CG 3.2Å; S752-E755 PolarHBondContact OG-N 3.39Å; S752-E755 PolarHBondContact OG-OE2 2.9Å; E755-K757 VanDerWaalsContact C-N 3.35Å; E755-K757 PolarHBondContact O-N 3.48Å; E755-A758 PolarHBondContact O-N 2.96Å; E755-L759 WeakPolarHBondContact O-CG 3.34Å; E755-L759 PolarHBondContact O-N 3.08Å
756	V	90.1	Very high	88.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-63.4	-42.4	176.7	-179.9	0	0	0	0	110.8	W740 L747 F751 S752 L759 I760 I777	W740-V756 HydrophobicContact CE3-CG1 4.38Å; W740-V756 HydrophobicContact CE3-CG2 4.13Å; W740-V756 HydrophobicContact CZ3-CB 4.32Å; W740-V756 HydrophobicContact CZ3-CG2 3.82Å; L747-V756 HydrophobicContact CD1-CG2 4.38Å; L747-V756 HydrophobicContact CD2-CG1 3.87Å; L747-V756 HydrophobicContact CD2-CG2 4.24Å; L747-V756 HydrophobicContact CG-CG2 4.03Å; F751-V756 HydrophobicContact CB-CG2 3.63Å; S752-V756 WeakPolarHBondContact O-CG2 3.35Å; S752-V756 PolarHBondContact O-N 3.09Å; V756-L759 PolarHBondContact O-N 3.13Å; V756-I760 HydrophobicContact CG1-CD1 3.97Å; V756-I760 HydrophobicContact CG1-CG1 4.49Å; V756-I760 WeakPolarHBondContact O-CG1 3.36Å; V756-I760 PolarHBondContact O-N 3.4Å; V756-I777 HydrophobicContact CB-CG2 4.47Å; V756-I777 HydrophobicContact CG1-CD1 3.91Å; V756-I777 HydrophobicContact CG1-CG2 4.41Å
757	K	89.9	Confident	88.7	Confident	44 Å²	44	50.2 Å²	50.2	19%	0.191	29%	0.285	C	S	.	.	H	α-helix	trans	-59.6	-47.6	173.6	-77.1	169.8	178.5	152.3	0	111.1	S753 S754 E755 L759 I760 R761 L774 I777	S753-K757 WeakPolarHBondContact O-CB 2.84Å; S753-K757 WeakPolarHBondContact O-CD 3.21Å; S753-K757 WeakPolarHBondContact O-CG 3.45Å; S753-K757 PolarHBondContact O-N 3.3Å; S753-K757 PolarHBondContact OG-NZ 2.99Å; S754-K757 PolarHBondContact O-N 3.07Å; E755-K757 VanDerWaalsContact C-N 3.35Å; E755-K757 PolarHBondContact O-N 3.48Å; K757-L759 VanDerWaalsContact C-N 3.35Å; K757-L759 PolarHBondContact O-N 3.13Å; K757-I760 PolarHBondContact O-N 3.24Å; K757-R761 VanDerWaalsContact O-CG 3.24Å; K757-R761 WeakPolarHBondContact O-CG 3.49Å; K757-R761 PolarHBondContact O-N 3.3Å; K757-L774 HydrophobicContact CB-CD2 3.94Å; K757-L774 WeakPolarHBondContact CE-O 3.34Å; K757-L774 HydrophobicContact CG-CD2 3.8Å; K757-I777 WeakPolarHBondContact CE-O 3.34Å; K757-I777 HydrophobicContact CG-CG2 4.11Å; K757-I777 PolarHBondContact NZ-O 3.2Å
758	A	89.6	Confident	88.6	Confident	40 Å²	40	58.9 Å²	58.9	33%	0.331	33%	0.325	S	S	.	.	H	α-helix	trans	-58.1	-46.5	178.6	0	0	0	0	0	111.7	S754 E755 I760 R761 A762	S754-A758 WeakPolarHBondContact O-CB 3.36Å; S754-A758 PolarHBondContact O-N 3.02Å; E755-A758 PolarHBondContact O-N 2.96Å; A758-I760 PolarHBondContact O-N 3.08Å; A758-R761 WeakPolarHBondContact O-CA 3.29Å; A758-R761 WeakPolarHBondContact O-CB 3.49Å; A758-R761 PolarHBondContact O-N 3.02Å; A758-A762 PolarHBondContact O-N 3.15Å
759	L	89.6	Confident	88.4	Confident	3 Å²	3	67.8 Å²	67.8	2%	0.016	35%	0.353	C	S	.	.	H	α-helix	trans	-62.4	-42.1	176.8	-77.5	162.1	0	0	0	113.1	T668 L725 M728 E755 V756 K757 R761 A762 L763	T668-L759 HydrophobicContact CG2-CD1 3.73Å; T668-L759 HydrophobicContact CG2-CD2 4.14Å; T668-L759 HydrophobicContact CG2-CG 4.22Å; L725-L759 HydrophobicContact CD1-CD1 4.1Å; L725-L759 HydrophobicContact CD1-CD2 4.14Å; M728-L759 HydrophobicContact CE-CB 3.75Å; M728-L759 HydrophobicContact CE-CD1 3.25Å; M728-L759 HydrophobicContact CE-CG 4.06Å; E755-L759 WeakPolarHBondContact O-CG 3.34Å; E755-L759 PolarHBondContact O-N 3.08Å; V756-L759 PolarHBondContact O-N 3.13Å; K757-L759 VanDerWaalsContact C-N 3.35Å; K757-L759 PolarHBondContact O-N 3.13Å; L759-R761 PolarHBondContact O-N 3.07Å; L759-A762 PolarHBondContact O-N 2.84Å; L759-L763 WeakPolarHBondContact O-CB 3.21Å; L759-L763 WeakPolarHBondContact O-CG 2.89Å; L759-L763 PolarHBondContact O-N 2.89Å
760	I	90.4	Very high	88.5	Confident	1 Å²	1	65 Å²	65	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-62.9	-35.3	173.3	-69.7	168.3	0	0	0	110.8	L733 I736 V756 K757 A758 A762 F764 R770 L774 I777	L733-I760 HydrophobicContact CD1-CG2 3.75Å; I736-I760 HydrophobicContact CG2-CD1 3.86Å; I736-I760 HydrophobicContact CG2-CG1 4.14Å; V756-I760 HydrophobicContact CG1-CD1 3.97Å; V756-I760 HydrophobicContact CG1-CG1 4.49Å; V756-I760 WeakPolarHBondContact O-CG1 3.36Å; V756-I760 PolarHBondContact O-N 3.4Å; K757-I760 PolarHBondContact O-N 3.24Å; A758-I760 PolarHBondContact O-N 3.08Å; I760-A762 VanDerWaalsContact C-N 3.3Å; I760-F764 HydrophobicContact CG2-CD2 4.16Å; I760-F764 PolarHBondContact O-N 2.76Å; I760-R770 HydrophobicContact CG2-CG 4.06Å; I760-L774 HydrophobicContact CB-CD2 3.93Å; I760-L774 HydrophobicContact CD1-CD2 4.34Å; I760-L774 HydrophobicContact CG2-CD2 3.73Å; I760-L774 HydrophobicContact CG2-CG 4.06Å; I760-I777 HydrophobicContact CD1-CD1 3.13Å
761	R	90.3	Very high	88.5	Confident	127 Å²	127	66.7 Å²	66.7	48%	0.479	34%	0.337	S	S	.	.	H	α-helix	trans	-66.5	-34.9	176.6	-67.5	-163.6	-171.5	96.2	-1.4	112.5	K757 A758 L759 R770 L774	K757-R761 VanDerWaalsContact O-CG 3.24Å; K757-R761 WeakPolarHBondContact O-CG 3.49Å; K757-R761 PolarHBondContact O-N 3.3Å; A758-R761 WeakPolarHBondContact O-CA 3.29Å; A758-R761 WeakPolarHBondContact O-CB 3.49Å; A758-R761 PolarHBondContact O-N 3.02Å; L759-R761 PolarHBondContact O-N 3.07Å; R761-R770 VanDerWaalsContact CA-CZ 3.48Å; R761-R770 PolarHBondContact O-NH1 3.33Å; R761-R770 PolarHBondContact O-NH2 3.49Å; R761-L774 HydrophobicContact CG-CD1 4.28Å
762	A	88.9	Confident	88.3	Confident	1 Å²	1	68.7 Å²	68.7	1%	0.008	36%	0.356	C	S	.	.	H	α-helix	trans	-77.6	-38.1	178.6	0	0	0	0	0	113	L670 E671 I673 A758 L759 I760	L670-A762 WeakPolarHBondContact O-CB 3.28Å; E671-A762 WeakPolarHBondContact O-CA 3.38Å; E671-A762 WeakPolarHBondContact O-CB 3.44Å; I673-A762 HydrophobicContact CD1-CB 4.09Å; I673-A762 HydrophobicContact CG1-CB 4.09Å; I673-A762 PolarHBondContact N-O 3.41Å; A758-A762 PolarHBondContact O-N 3.15Å; L759-A762 PolarHBondContact O-N 2.84Å; I760-A762 VanDerWaalsContact C-N 3.3Å
763	L	89.6	Confident	88	Confident	32 Å²	32	67.2 Å²	67.2	17%	0.168	35%	0.347	C	S	.	.	H	α-helix	trans	-84.9	-23.2	-174.3	-71.7	166.5	0	0	0	115.1	I673 L729 L759	I673-L763 HydrophobicContact CB-CD2 3.94Å; I673-L763 HydrophobicContact CD1-CD2 4.15Å; I673-L763 HydrophobicContact CD1-CG 4.45Å; I673-L763 HydrophobicContact CG2-CD2 3.73Å; L729-L763 HydrophobicContact CD2-CD2 4.06Å; L759-L763 WeakPolarHBondContact O-CB 3.21Å; L759-L763 WeakPolarHBondContact O-CG 2.89Å; L759-L763 PolarHBondContact O-N 2.89Å
764	F	89.2	Confident	88	Confident	53 Å²	53	67.5 Å²	67.5	23%	0.232	35%	0.346	C	S	.	.	S	Bend	trans	-126.9	137.6	-172.2	-61.9	-85.5	0	0	0	112	A731 L733 I736 I760 R770	A731-F764 WeakPolarHBondContact O-CZ 3.41Å; L733-F764 HydrophobicContact CB-CD1 4.46Å; L733-F764 HydrophobicContact CB-CE1 4.1Å; L733-F764 HydrophobicContact CB-CZ 4.2Å; L733-F764 HydrophobicContact CD1-CD1 4.27Å; L733-F764 HydrophobicContact CD1-CD2 3.65Å; L733-F764 HydrophobicContact CD1-CE1 4.42Å; L733-F764 HydrophobicContact CD1-CE2 3.83Å; L733-F764 HydrophobicContact CD1-CG 3.89Å; L733-F764 HydrophobicContact CD1-CZ 4.2Å; I736-F764 HydrophobicContact CD1-CE2 3.52Å; I736-F764 HydrophobicContact CD1-CZ 3.82Å; I760-F764 HydrophobicContact CG2-CD2 4.16Å; I760-F764 PolarHBondContact O-N 2.76Å; F764-R770 VanDerWaalsContact O-CD 3.28Å; F764-R770 WeakPolarHBondContact O-CD 3.33Å; F764-R770 PolarHBondContact O-NH1 3.19Å
765	Q	85.6	Confident	87.8	Confident	169 Å²	169	66.8 Å²	66.8	79%	0.79	35%	0.345	S	S	*	.			trans	-61.1	154.9	173	-66.4	-175.8	-5.7	0	0	112.7	T767 R770	Q765-T767 PolarHBondContact O-N 3.18Å; Q765-R770 VanDerWaalsContact O-CD 3.22Å; Q765-R770 WeakPolarHBondContact O-CD 3.15Å
766	N	85.6	Confident	87.4	Confident	139 Å²	139	70.1 Å²	70.1	74%	0.743	36%	0.358	S	S	*	.	S	Bend	trans	-67.8	103.1	-179.7	-169.7	16.9	0	0	0	111.1
767	T	90.1	Very high	87.2	Confident	68 Å²	68	70.2 Å²	70.2	42%	0.417	36%	0.359	S	S	.	.			trans	-135.5	160.1	-178.5	57.7	0	0	0	0	110.5	Q765 R769 R770 A771	Q765-T767 PolarHBondContact O-N 3.18Å; T767-R769 PolarHBondContact O-N 3Å; T767-R770 WeakPolarHBondContact O-CB 3.33Å; T767-R770 PolarHBondContact O-N 3.3Å; T767-R770 VanDerWaalsContact O-N 3.08Å; T767-R770 PolarHBondContact OG1-N 2.9Å; T767-A771 PolarHBondContact O-N 2.75Å
768	E	84.4	Confident	86.5	Confident	182 Å²	182	78.1 Å²	78.1	85%	0.85	39%	0.394	S	S	*	.	H	α-helix	trans	-57.6	-35.5	174.8	-67.4	-175	170.5	0	0	112.2	A771 A772	E768-A771 PolarHBondContact O-N 2.79Å; E768-A772 WeakPolarHBondContact O-CB 3.35Å; E768-A772 PolarHBondContact O-N 3.06Å
769	R	83.8	Confident	86.3	Confident	211 Å²	211	80.1 Å²	80.1	80%	0.796	40%	0.397	S	S	*	.	H	α-helix	trans	-62.8	-44.7	174.8	-68	-176.4	178.2	-177	-0.6	111.8	L733 T767 A772 A773	L733-R769 VanDerWaalsContact CD2-C 3.47Å; L733-R769 HydrophobicContact CD2-CB 4.16Å; L733-R769 VanDerWaalsContact CD2-O 3.3Å; L733-R769 WeakPolarHBondContact CD2-O 3.47Å; T767-R769 PolarHBondContact O-N 3Å; R769-A772 PolarHBondContact O-N 2.73Å; R769-A773 PolarHBondContact O-N 3.11Å
770	R	88.9	Confident	86.1	Confident	34 Å²	34	84.1 Å²	84.1	13%	0.128	42%	0.417	C	S	.	.	H	α-helix	trans	-60.5	-46	173.6	175.8	179.5	155.8	-167.8	-7.1	111.4	L733 I760 R761 F764 Q765 T767 A772 A773 L774	L733-R770 HydrophobicContact CD2-CB 4.48Å; I760-R770 HydrophobicContact CG2-CG 4.06Å; R761-R770 VanDerWaalsContact CA-CZ 3.48Å; R761-R770 PolarHBondContact O-NH1 3.33Å; R761-R770 PolarHBondContact O-NH2 3.49Å; F764-R770 VanDerWaalsContact O-CD 3.28Å; F764-R770 WeakPolarHBondContact O-CD 3.33Å; F764-R770 PolarHBondContact O-NH1 3.19Å; Q765-R770 VanDerWaalsContact O-CD 3.22Å; Q765-R770 WeakPolarHBondContact O-CD 3.15Å; T767-R770 WeakPolarHBondContact O-CB 3.33Å; T767-R770 PolarHBondContact O-N 3.3Å; T767-R770 VanDerWaalsContact O-N 3.08Å; T767-R770 PolarHBondContact OG1-N 2.9Å; R770-A772 VanDerWaalsContact C-N 3.32Å; R770-A772 PolarHBondContact O-N 3.02Å; R770-A773 PolarHBondContact O-N 2.96Å; R770-L774 HydrophobicContact CG-CD1 3.9Å; R770-L774 HydrophobicContact CG-CG 4.32Å; R770-L774 WeakPolarHBondContact O-CB 3.07Å; R770-L774 VanDerWaalsContact O-CG 3.3Å; R770-L774 WeakPolarHBondContact O-CG 3.29Å; R770-L774 PolarHBondContact O-N 3.45Å
771	A	86.6	Confident	85.9	Confident	54 Å²	54	88.7 Å²	88.7	45%	0.446	44%	0.44	S	S	.	.	H	α-helix	trans	-60.3	-42.1	177.8	0	0	0	0	0	112	T767 E768 L774 A775	T767-A771 PolarHBondContact O-N 2.75Å; E768-A771 PolarHBondContact O-N 2.79Å; A771-L774 PolarHBondContact O-N 3.42Å; A771-A775 WeakPolarHBondContact O-CB 3.29Å; A771-A775 PolarHBondContact O-N 3.44Å
772	A	84.5	Confident	85.6	Confident	55 Å²	55	86.5 Å²	86.5	46%	0.455	44%	0.437	S	S	.	.	H	α-helix	trans	-64.3	-41.2	176.1	0	0	0	0	0	112.8	E768 R769 R770 A775 K776	E768-A772 WeakPolarHBondContact O-CB 3.35Å; E768-A772 PolarHBondContact O-N 3.06Å; R769-A772 PolarHBondContact O-N 2.73Å; R770-A772 VanDerWaalsContact C-N 3.32Å; R770-A772 PolarHBondContact O-N 3.02Å; A772-A775 PolarHBondContact O-N 3.07Å; A772-K776 WeakPolarHBondContact O-CG 3.48Å; A772-K776 PolarHBondContact O-N 3Å
773	A	83.6	Confident	85.4	Confident	15 Å²	15	91.8 Å²	91.8	12%	0.124	46%	0.464	C	S	.	.	H	α-helix	trans	-66.8	-43.2	175.9	0	0	0	0	0	112.2	L733 R769 R770 A775 K776 I777	L733-A773 HydrophobicContact CD1-CB 4.01Å; L733-A773 HydrophobicContact CD2-CB 3.64Å; L733-A773 HydrophobicContact CG-CB 3.67Å; R769-A773 PolarHBondContact O-N 3.11Å; R770-A773 PolarHBondContact O-N 2.96Å; A773-A775 PolarHBondContact O-N 3Å; A773-K776 PolarHBondContact O-N 2.67Å; A773-K776 VanDerWaalsContact O-N 3.13Å; A773-I777 PolarHBondContact O-N 3.2Å
774	L	88.1	Confident	85.2	Confident	28 Å²	28	95.8 Å²	95.8	15%	0.147	48%	0.484	C	S	.	.	H	α-helix	trans	-61.6	-32.1	176	-71.4	172.1	0	0	0	112.7	K757 I760 R761 R770 A771	K757-L774 HydrophobicContact CB-CD2 3.94Å; K757-L774 WeakPolarHBondContact CE-O 3.34Å; K757-L774 HydrophobicContact CG-CD2 3.8Å; I760-L774 HydrophobicContact CB-CD2 3.93Å; I760-L774 HydrophobicContact CD1-CD2 4.34Å; I760-L774 HydrophobicContact CG2-CD2 3.73Å; I760-L774 HydrophobicContact CG2-CG 4.06Å; R761-L774 HydrophobicContact CG-CD1 4.28Å; R770-L774 HydrophobicContact CG-CD1 3.9Å; R770-L774 HydrophobicContact CG-CG 4.32Å; R770-L774 WeakPolarHBondContact O-CB 3.07Å; R770-L774 VanDerWaalsContact O-CG 3.3Å; R770-L774 WeakPolarHBondContact O-CG 3.29Å; R770-L774 PolarHBondContact O-N 3.45Å; A771-L774 PolarHBondContact O-N 3.42Å
775	A	84.7	Confident	84.9	Confident	67 Å²	67	98.9 Å²	98.9	55%	0.554	50%	0.502	S	S	*	.	H	α-helix	trans	-72.1	-27.3	176.8	0	0	0	0	0	113.5	A771 A772 A773	A771-A775 WeakPolarHBondContact O-CB 3.29Å; A771-A775 PolarHBondContact O-N 3.44Å; A772-A775 PolarHBondContact O-N 3.07Å; A773-A775 PolarHBondContact O-N 3Å
776	K	82.6	Confident	84.8	Confident	149 Å²	149	93.5 Å²	93.5	65%	0.648	48%	0.48	S	S	*	.	H	α-helix	trans	-77.4	-25.4	176.6	-70.4	-179.7	178	-173.1	0	112.8	A772 A773 K778	A772-K776 WeakPolarHBondContact O-CG 3.48Å; A772-K776 PolarHBondContact O-N 3Å; A773-K776 PolarHBondContact O-N 2.67Å; A773-K776 VanDerWaalsContact O-N 3.13Å; K776-K778 PolarHBondContact O-N 2.69Å
777	I	84.8	Confident	84.7	Confident	3 Å²	3	89.7 Å²	89.7	2%	0.015	46%	0.458	C	S	.	.			trans	-85.4	108.6	177.2	-63.1	163.8	0	0	0	107.4	W740 V756 K757 I760 A773	W740-I777 HydrophobicContact CB-CG1 4.48Å; W740-I777 HydrophobicContact CD2-CB 4.47Å; W740-I777 HydrophobicContact CD2-CG1 4.09Å; W740-I777 HydrophobicContact CD2-CG2 4Å; W740-I777 HydrophobicContact CE3-CG2 4.24Å; W740-I777 HydrophobicContact CG-CG1 3.9Å; W740-I777 HydrophobicContact CH2-CG2 4.02Å; W740-I777 HydrophobicContact CZ2-CG2 3.75Å; W740-I777 HydrophobicContact CZ3-CG2 4.25Å; V756-I777 HydrophobicContact CB-CG2 4.47Å; V756-I777 HydrophobicContact CG1-CD1 3.91Å; V756-I777 HydrophobicContact CG1-CG2 4.41Å; K757-I777 WeakPolarHBondContact CE-O 3.34Å; K757-I777 HydrophobicContact CG-CG2 4.11Å; K757-I777 PolarHBondContact NZ-O 3.2Å; I760-I777 HydrophobicContact CD1-CD1 3.13Å; A773-I777 PolarHBondContact O-N 3.2Å
778	K	74.8	Confident	84.2	Confident	210 Å²	210	91.6 Å²	91.6	91%	0.913	46%	0.461	S	S	*	.			trans	-109.1	0	-179.1	-77.4	-172.1	178.7	178	0	111.6	S753 K776	S753-K778 WeakPolarHBondContact CB-O 2.98Å; S753-K778 WeakPolarHBondContact CB-OXT 3.29Å; S753-K778 PolarHBondContact OG-O 3.18Å; S753-K778 PolarHBondContact OG-OXT 3.24Å; K776-K778 PolarHBondContact O-N 2.69Å

Retrieved 778 of 778 residues in 2509 ms (Link to these results)

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