A0A096NAC8_PAPAN Loading...

TBC1 domain family member 25

Acts as a GTPase-activating protein specific for RAB33B. Involved in the regulation of autophagosome maturation, the process in which autophagosomes fuse with endosomes and lysosomes.

AlphaFold DB , UniProt , Accession A0A096NAC8, Species PAPAN (Papio anubis, Olive baboon), Gene TBC1D25, Length 688 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	39.8	Very low	33.7	Very low	239 Å²	239	126.6 Å²	126.6	100%	1.177	84%	0.835	S	S	*	*				0	110	0	-60.2	165.3	-173.7	0	0	104.9
2	A	31.3	Very low	33.4	Very low	93 Å²	93	122.6 Å²	122.6	77%	0.769	83%	0.833	S	S	*	*			cis	65.7	120.7	45	0	0	0	0	0	110.1
3	T	32.9	Very low	33.4	Very low	128 Å²	128	123.6 Å²	123.6	79%	0.785	84%	0.842	S	S	*	*			cis	-150	155.8	13.4	50	0	0	0	0	113.1
4	A	34.2	Very low	33.2	Very low	90 Å²	90	119.9 Å²	119.9	74%	0.744	84%	0.835	S	S	*	*				44.9	153.9	129.3	0	0	0	0	0	121.6
5	S	34	Very low	33.3	Very low	121 Å²	121	118.4 Å²	118.4	85%	0.846	83%	0.832	S	S	*	*			cis	178.5	160.8	-11.4	49.2	0	0	0	0	109.4
6	G	30.8	Very low	33.7	Very low	78 Å²	78	118.3 Å²	118.3	80%	0.804	83%	0.828	S	S	*	*			trans	145.1	150.8	154.2	0	0	0	0	0	114.8
7	A	32.7	Very low	34	Very low	96 Å²	96	118.5 Å²	118.5	79%	0.793	83%	0.826	S	S	*	*			trans	-147.9	-176.8	-173.3	0	0	0	0	0	112.9
8	S	32.3	Very low	34.3	Very low	102 Å²	102	119.1 Å²	119.1	71%	0.713	83%	0.827	S	S	*	*			trans	67.5	110.9	166.7	51.2	0	0	0	0	119.2
9	D	33.8	Very low	34.2	Very low	156 Å²	156	116.7 Å²	116.7	83%	0.834	82%	0.823	S	S	*	*				41.7	132.5	123	-48.4	-26.1	0	0	0	121.4
10	L	33.2	Very low	34.1	Very low	174 Å²	174	118.5 Å²	118.5	91%	0.911	83%	0.828	S	S	*	*				-161.3	133.5	126.3	-110.1	168.9	0	0	0	111.2
11	S	35.5	Very low	33.9	Very low	116 Å²	116	116.7 Å²	116.7	81%	0.811	83%	0.828	S	S	*	*			trans	-89.4	131.6	173.1	55.7	0	0	0	0	111.1
12	G	30.7	Very low	33.8	Very low	78 Å²	78	109.9 Å²	109.9	80%	0.804	81%	0.81	S	S	*	*			trans	-150.4	119.5	179.3	0	0	0	0	0	113.1
13	S	32.5	Very low	33.9	Very low	136 Å²	136	115 Å²	115	95%	0.951	82%	0.818	S	S	*	*			trans	-78.7	130.1	178	167.2	0	0	0	0	111.8
14	G	30.8	Very low	34.1	Very low	72 Å²	72	114.1 Å²	114.1	74%	0.742	82%	0.823	S	S	*	*			trans	-148.6	124.8	170.3	0	0	0	0	0	111.2
15	A	35.2	Very low	34.3	Very low	97 Å²	97	114.8 Å²	114.8	80%	0.802	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-88.9	147.8	-175.5	0	0	0	0	0	112.7
16	P	39.3	Very low	34.4	Very low	117 Å²	117	114 Å²	114	76%	0.76	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-79.9	161	174	33.5	-35.2	0	0	0	112.9
17	P	38.8	Very low	34.5	Very low	122 Å²	122	115.2 Å²	115.2	79%	0.792	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-74.3	164.7	179.7	-14.4	31	0	0	0	113.9
18	P	40.4	Very low	34.6	Very low	129 Å²	129	115.2 Å²	115.2	84%	0.838	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-90.1	152.5	-171.1	35.2	-35.8	0	0	0	115
19	G	31.3	Very low	34.9	Very low	73 Å²	73	119.3 Å²	119.3	75%	0.753	84%	0.84	S	S	*	*			trans	93.1	69.1	130.3	0	0	0	0	0	119.6
20	V	32.5	Very low	35.2	Very low	152 Å²	152	121.2 Å²	121.2	92%	0.921	84%	0.844	S	S	*	*			trans	-126.1	79.7	143.3	-172.4	0	0	0	0	108.3
21	G	30.2	Very low	35.8	Very low	82 Å²	82	118.2 Å²	118.2	85%	0.845	83%	0.825	S	S	*	*			trans	-90.1	105.7	-174.3	0	0	0	0	0	112.9
22	A	38	Very low	36.4	Very low	96 Å²	96	120.5 Å²	120.5	79%	0.793	82%	0.823	S	S	*	*			trans	-153.7	16	171.1	0	0	0	0	0	115.7
23	Q	31.8	Very low	37.7	Very low	201 Å²	201	121 Å²	121	94%	0.939	80%	0.801	S	S	*	*			trans	-154	86.7	176.5	-112.4	163.1	10.3	0	0	111.9
24	A	37.9	Very low	39.2	Very low	108 Å²	108	122.6 Å²	122.6	89%	0.893	79%	0.794	S	S	*	*			trans	-145.1	52.1	178.8	0	0	0	0	0	111.5
25	A	39.3	Very low	41.2	Very low	105 Å²	105	123.5 Å²	123.5	87%	0.868	78%	0.784	S	S	*	*	S	Bend	trans	-157.2	37.4	-178.5	0	0	0	0	0	113.7
26	A	35.8	Very low	43.5	Very low	104 Å²	104	119.4 Å²	119.4	86%	0.86	75%	0.749	S	S	*	*			trans	-156.4	51.1	178.4	0	0	0	0	0	113.1
27	A	33.6	Very low	45.7	Very low	104 Å²	104	122.3 Å²	122.3	86%	0.86	75%	0.745	S	S	*	*			trans	-131.8	59.7	168.3	0	0	0	0	0	108.7
28	A	34.8	Very low	48.1	Very low	96 Å²	96	116.6 Å²	116.6	79%	0.793	71%	0.708	S	S	*	*			trans	-78.2	143.2	168.4	0	0	0	0	0	108.7	E30	A28-E30 PolarHBondContact O-N 2.74Å
29	E	37.1	Very low	50.4	Low	187 Å²	187	116.1 Å²	116.1	87%	0.874	69%	0.689	S	S	*	*			trans	-62.4	129.6	-174.7	-63.9	149.9	131.3	0	0	111.1	E31	E29-E31 PolarHBondContact O-N 3.34Å
30	E	41.3	Very low	53.3	Low	197 Å²	197	112.8 Å²	112.8	92%	0.921	65%	0.654	S	S	*	*			trans	-72.5	76.5	164	-73.4	-169.2	126.3	0	0	108.9	A28 E32	A28-E30 PolarHBondContact O-N 2.74Å; E30-E32 PolarHBondContact O-N 3.26Å; E30-E32 VanDerWaalsContact O-N 3.14Å
31	E	44.5	Very low	56.1	Low	110 Å²	110	108.7 Å²	108.7	51%	0.514	62%	0.624	S	S	.	*			trans	-60.9	109.3	170.9	-175.4	-164.6	-143.7	0	0	109	E29 R33 K115	E29-E31 PolarHBondContact O-N 3.34Å; E31-R33 VanDerWaalsContact O-CG 3.27Å; E31-R33 WeakPolarHBondContact O-CG 3.32Å; E31-R33 PolarHBondContact O-N 2.79Å; E31-K115 IonicContact OE1-NZ 3.82Å; E31-K115 PolarHBondContact OE1-NZ 2.76Å; E31-K115 WeakPolarHBondContact OE2-CE 3.46Å; E31-K115 IonicContact OE2-NZ 2.76Å; E31-K115 PolarHBondContact OE2-NZ 2.65Å
32	E	49	Very low	59	Low	165 Å²	165	106.1 Å²	106.1	77%	0.771	59%	0.59	S	S	*	*			trans	-58.1	105.4	179.9	-109.9	-177.9	146.5	0	0	110.9	E30 E34	E30-E32 PolarHBondContact O-N 3.26Å; E30-E32 VanDerWaalsContact O-N 3.14Å; E32-E34 PolarHBondContact O-N 3.23Å; E32-E34 VanDerWaalsContact O-N 3.16Å
33	R	57.4	Low	61.1	Low	87 Å²	87	102.5 Å²	102.5	33%	0.328	56%	0.559	S	S	.	*			trans	-87.8	82.5	-174.7	-60.6	-165.5	-172.9	174.8	9.5	111.5	E31 V35 F110 A111	E31-R33 VanDerWaalsContact O-CG 3.27Å; E31-R33 WeakPolarHBondContact O-CG 3.32Å; E31-R33 PolarHBondContact O-N 2.79Å; R33-V35 PolarHBondContact O-N 2.91Å; R33-V35 VanDerWaalsContact O-N 3.1Å; R33-F110 PolarHBondContact NH1-O 3.41Å; R33-A111 PolarHBondContact NH2-O 3.32Å; R33-A111 VanDerWaalsContact NH2-O 3.1Å
34	E	63.9	Low	63.5	Low	171 Å²	171	95.8 Å²	95.8	80%	0.799	53%	0.527	S	S	*	.	S	Bend	trans	-45.5	-43.3	178.2	-64.9	-175.1	128.9	0	0	113.6	E32	E32-E34 PolarHBondContact O-N 3.23Å; E32-E34 VanDerWaalsContact O-N 3.16Å
35	V	73.8	Confident	64.8	Low	90 Å²	90	94.2 Å²	94.2	55%	0.545	51%	0.51	S	S	.	.			trans	-149.8	133.6	179.8	-173.9	0	0	0	0	111.9	R33 A55	R33-V35 PolarHBondContact O-N 2.91Å; R33-V35 VanDerWaalsContact O-N 3.1Å; V35-A55 HydrophobicContact CG1-CB 3.57Å
36	V	82.6	Confident	65.9	Low	12 Å²	12	98.3 Å²	98.3	7%	0.073	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	128	167.9	173.2	0	0	0	0	110.7	A55 V56 P58 F110 L118	V36-A55 WeakPolarHBondContact O-CA 3.16Å; V36-V56 HydrophobicContact CB-CG2 4.44Å; V36-V56 PolarHBondContact N-O 3.5Å; V36-V56 PolarHBondContact O-N 3.38Å; V36-P58 HydrophobicContact CB-CG 4.21Å; V36-P58 HydrophobicContact CG2-CG 3.53Å; V36-F110 HydrophobicContact CB-CD1 4.26Å; V36-F110 HydrophobicContact CB-CE1 4.4Å; V36-F110 HydrophobicContact CG1-CD1 4.05Å; V36-F110 HydrophobicContact CG1-CE1 4.31Å; V36-F110 HydrophobicContact CG2-CD1 4.31Å; V36-L118 HydrophobicContact CG1-CB 4.02Å
37	R	85.3	Confident	67.6	Low	178 Å²	178	98.6 Å²	98.6	67%	0.672	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.6	134.2	170.8	-67.1	179.8	179.1	178.1	0.1	110.2	Y117 L118	R37-Y117 CarbonylContact O-C 3.43Å; R37-Y117 VanDerWaalsContact O-CA 3.26Å; R37-Y117 WeakPolarHBondContact O-CA 3.44Å; R37-Y117 WeakPolarHBondContact O-CB 3.44Å; R37-L118 PolarHBondContact O-N 2.89Å
38	V	89.6	Confident	69.5	Low	1 Å²	1	99 Å²	99	1%	0.006	49%	0.488	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.3	-178.7	-172.4	0	0	0	0	109.4	V40 S53 F54 V56 L118 L120	V38-V40 HydrophobicContact CG1-CG2 3.85Å; V38-S53 VanDerWaalsContact O-CA 3.3Å; V38-S53 WeakPolarHBondContact O-CA 3.35Å; V38-F54 HydrophobicContact CB-CD2 4.04Å; V38-F54 HydrophobicContact CB-CE2 3.78Å; V38-F54 HydrophobicContact CB-CZ 4.22Å; V38-F54 HydrophobicContact CG1-CE2 4.01Å; V38-F54 HydrophobicContact CG1-CZ 4.01Å; V38-F54 HydrophobicContact CG2-CD2 4.39Å; V38-F54 HydrophobicContact CG2-CE2 4.08Å; V38-F54 PolarHBondContact N-O 3.02Å; V38-F54 PolarHBondContact O-N 3.04Å; V38-V56 HydrophobicContact CG2-CG1 4.17Å; V38-V56 HydrophobicContact CG2-CG2 3.67Å; V38-L118 CarbonylContact C-O 3.57Å; V38-L118 WeakPolarHBondContact CA-O 3.38Å; V38-L118 HydrophobicContact CG2-CD2 4.47Å; V38-L120 HydrophobicContact CG1-CD1 3.63Å; V38-L120 HydrophobicContact CG1-CG 3.84Å
39	R	88.7	Confident	71.8	Confident	119 Å²	119	97 Å²	97	45%	0.449	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	131.2	168.5	-73.3	-167.4	158.5	173.4	-7	109	Y117 L118 Q119 L120	R39-Y117 HydrophobicContact CB-CD2 4.07Å; R39-Y117 HydrophobicContact CB-CG 4.44Å; R39-Y117 HydrophobicContact CG-CD1 4.27Å; R39-Y117 HydrophobicContact CG-CD2 3.94Å; R39-Y117 HydrophobicContact CG-CE2 4.43Å; R39-Y117 HydrophobicContact CG-CG 3.86Å; R39-Y117 PolarHBondContact NH1-OH 2.91Å; R39-L118 PolarHBondContact N-O 2.86Å; R39-Q119 CarbonylContact O-C 3.53Å; R39-Q119 WeakPolarHBondContact O-CA 3.32Å; R39-L120 PolarHBondContact O-N 2.89Å
40	V	92.9	Very high	74.2	Confident	3 Å²	3	90.8 Å²	90.8	2%	0.018	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	132	-177.5	-167.8	0	0	0	0	110.6	V38 F51 R52 F54 L70 F74 L120 V122	V38-V40 HydrophobicContact CG1-CG2 3.85Å; V40-F51 WeakPolarHBondContact O-CA 3.45Å; V40-R52 PolarHBondContact N-O 2.81Å; V40-R52 PolarHBondContact O-N 3.37Å; V40-R52 VanDerWaalsContact O-N 3.07Å; V40-F54 HydrophobicContact CG2-CE1 3.54Å; V40-F54 HydrophobicContact CG2-CZ 3.8Å; V40-L70 HydrophobicContact CB-CD2 4.3Å; V40-L70 HydrophobicContact CG1-CD2 3.77Å; V40-L70 HydrophobicContact CG2-CD2 3.8Å; V40-F74 HydrophobicContact CB-CE2 3.71Å; V40-F74 HydrophobicContact CB-CZ 3.81Å; V40-F74 HydrophobicContact CG1-CE2 3.56Å; V40-F74 HydrophobicContact CG1-CZ 3.87Å; V40-F74 HydrophobicContact CG2-CE2 4.46Å; V40-L120 WeakPolarHBondContact CA-O 3.3Å; V40-L120 HydrophobicContact CB-CB 4.5Å; V40-L120 HydrophobicContact CG1-CB 4.16Å; V40-L120 HydrophobicContact CG2-CB 4.17Å; V40-L120 HydrophobicContact CG2-CD1 4.34Å; V40-V122 HydrophobicContact CG1-CB 4.49Å; V40-V122 HydrophobicContact CG1-CG2 3.79Å
41	K	90.7	Very high	76.3	Confident	67 Å²	67	88 Å²	88	29%	0.291	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	112.4	169.4	-177.6	-175.9	179.1	-175.4	0	109.8	P49 F51 L120 R121 V122	K41-P49 HydrophobicContact CD-CB 4.29Å; K41-P49 HydrophobicContact CG-CB 3.98Å; K41-F51 HydrophobicContact CB-CD1 4.01Å; K41-F51 HydrophobicContact CB-CE1 3.79Å; K41-F51 HydrophobicContact CD-CE1 3.83Å; K41-F51 HydrophobicContact CD-CZ 3.88Å; K41-F51 HydrophobicContact CG-CD1 4.16Å; K41-F51 HydrophobicContact CG-CE1 3.63Å; K41-F51 HydrophobicContact CG-CZ 3.87Å; K41-L120 PolarHBondContact N-O 2.96Å; K41-R121 CarbonylContact O-C 3.53Å; K41-R121 VanDerWaalsContact O-CA 3.32Å; K41-R121 WeakPolarHBondContact O-CA 3.21Å; K41-V122 PolarHBondContact O-N 2.84Å
42	K	90.4	Very high	78.3	Confident	27 Å²	27	87.4 Å²	87.4	12%	0.117	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	130.4	168.8	162.5	179.1	161.6	-164.6	0	109.3	P49 E50 F74 L76 V122 I124	K42-P49 CarbonylContact O-C 3.57Å; K42-P49 WeakPolarHBondContact O-CA 3.47Å; K42-P49 WeakPolarHBondContact O-CB 3.43Å; K42-E50 HydrophobicContact CB-CB 4.19Å; K42-E50 HydrophobicContact CD-CB 4.22Å; K42-E50 WeakPolarHBondContact CD-OE2 3.45Å; K42-E50 WeakPolarHBondContact CE-OE2 3.22Å; K42-E50 HydrophobicContact CG-CB 4.42Å; K42-E50 PolarHBondContact N-O 3.32Å; K42-E50 IonicContact NZ-OE2 2.94Å; K42-E50 PolarHBondContact NZ-OE2 3.23Å; K42-E50 PolarHBondContact O-N 3.31Å; K42-E50 VanDerWaalsContact O-N 3.09Å; K42-F74 HydrophobicContact CB-CD1 3.8Å; K42-F74 HydrophobicContact CB-CE1 3.66Å; K42-F74 HydrophobicContact CB-CG 4.33Å; K42-F74 HydrophobicContact CB-CZ 4.1Å; K42-F74 HydrophobicContact CD-CB 3.9Å; K42-F74 HydrophobicContact CD-CD1 3.54Å; K42-F74 HydrophobicContact CD-CE1 4.24Å; K42-F74 HydrophobicContact CD-CG 3.91Å; K42-F74 HydrophobicContact CG-CD1 4.35Å; K42-F74 PolarHBondContact NZ-O 2.96Å; K42-L76 HydrophobicContact CD-CD2 4.3Å; K42-V122 CarbonylContact C-O 3.59Å; K42-V122 WeakPolarHBondContact CA-O 3.31Å; K42-I124 HydrophobicContact CD-CD1 3.98Å; K42-I124 HydrophobicContact CG-CD1 3.99Å
43	C	83.7	Confident	80	Confident	21 Å²	21	83.5 Å²	83.5	14%	0.142	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	129.3	175.5	-65.5	0	0	0	0	108.2	V122 D123 I124	C43-V122 PolarHBondContact N-O 2.99Å; C43-D123 VanDerWaalsContact CB-OD1 3.29Å; C43-D123 WeakPolarHBondContact CB-OD1 3.28Å; C43-I124 PolarHBondContact O-N 3.21Å
44	E	81.9	Confident	81.4	Confident	59 Å²	59	81.4 Å²	81.4	28%	0.276	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	135.3	177.6	-172.3	157.8	-152.5	0	0	106.9	F46 L47 K79 I124	E44-F46 PolarHBondContact O-N 3.36Å; E44-L47 HydrophobicContact CB-CB 4.49Å; E44-L47 HydrophobicContact CG-CD1 4.47Å; E44-L47 PolarHBondContact O-N 2.9Å; E44-K79 IonicContact OE1-NZ 3.94Å; E44-I124 HydrophobicContact CB-CB 4.28Å; E44-I124 HydrophobicContact CB-CD1 4.33Å; E44-I124 HydrophobicContact CG-CB 4.14Å; E44-I124 HydrophobicContact CG-CD1 4.4Å; E44-I124 HydrophobicContact CG-CG2 4.26Å
45	S	65.4	Low	82.3	Confident	75 Å²	75	76 Å²	76	52%	0.524	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-20.2	-150.6	-57.7	0	0	0	0	117.5
46	F	60.7	Low	82.9	Confident	192 Å²	192	72.1 Å²	72.1	84%	0.842	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131	10.1	-177.3	-54.3	-73.2	0	0	0	113.7	E44	E44-F46 PolarHBondContact O-N 3.36Å
47	L	72.5	Confident	82.8	Confident	109 Å²	109	73.8 Å²	73.8	57%	0.571	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116	149.7	-177.9	-67.6	179.8	0	0	0	112	E44	E44-L47 HydrophobicContact CB-CB 4.49Å; E44-L47 HydrophobicContact CG-CD1 4.47Å; E44-L47 PolarHBondContact O-N 2.9Å
48	P	74	Confident	82.7	Confident	112 Å²	112	67.1 Å²	67.1	73%	0.727	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-61.4	141.2	172.8	27.1	-34.6	0	0	0	110.3	E50	P48-E50 PolarHBondContact O-N 2.97Å
49	P	82.6	Confident	82.1	Confident	55 Å²	55	74 Å²	74	36%	0.357	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	129.1	-172.6	26.1	-34.1	0	0	0	112	K41 K42 F51	K41-P49 HydrophobicContact CD-CB 4.29Å; K41-P49 HydrophobicContact CG-CB 3.98Å; K42-P49 CarbonylContact O-C 3.57Å; K42-P49 WeakPolarHBondContact O-CA 3.47Å; K42-P49 WeakPolarHBondContact O-CB 3.43Å; P49-F51 HydrophobicContact CB-CE2 4.19Å; P49-F51 HydrophobicContact CB-CZ 4.5Å; P49-F51 HydrophobicContact CG-CE2 4.05Å; P49-F51 HydrophobicContact CG-CZ 4.42Å; P49-F51 VanDerWaalsContact O-CD2 3.3Å; P49-F51 WeakPolarHBondContact O-CD2 3.16Å; P49-F51 WeakPolarHBondContact O-CE2 3.43Å
50	E	86.9	Confident	81.4	Confident	57 Å²	57	74.3 Å²	74.3	27%	0.266	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	135.4	-179.4	-166.2	-171.5	163	0	0	110.2	K42 P48 R52 F74	K42-E50 HydrophobicContact CB-CB 4.19Å; K42-E50 HydrophobicContact CD-CB 4.22Å; K42-E50 WeakPolarHBondContact CD-OE2 3.45Å; K42-E50 WeakPolarHBondContact CE-OE2 3.22Å; K42-E50 HydrophobicContact CG-CB 4.42Å; K42-E50 PolarHBondContact N-O 3.32Å; K42-E50 IonicContact NZ-OE2 2.94Å; K42-E50 PolarHBondContact NZ-OE2 3.23Å; K42-E50 PolarHBondContact O-N 3.31Å; K42-E50 VanDerWaalsContact O-N 3.09Å; P48-E50 PolarHBondContact O-N 2.97Å; E50-R52 IonicContact OE1-CZ 2.7Å; E50-R52 IonicContact OE1-NE 3.85Å; E50-R52 PolarHBondContact OE1-NE 3.18Å; E50-R52 IonicContact OE1-NH2 3.84Å; E50-R52 PolarHBondContact OE1-NH2 3.49Å; E50-F74 HydrophobicContact CB-CD1 4.36Å; E50-F74 HydrophobicContact CB-CE1 4.13Å; E50-F74 HydrophobicContact CG-CD1 4.12Å; E50-F74 HydrophobicContact CG-CE1 4Å
51	F	86.6	Confident	81.1	Confident	138 Å²	138	74.8 Å²	74.8	61%	0.605	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.8	127.3	-177.9	-66	-93.5	0	0	0	111	V40 K41 P49	V40-F51 WeakPolarHBondContact O-CA 3.45Å; K41-F51 HydrophobicContact CB-CD1 4.01Å; K41-F51 HydrophobicContact CB-CE1 3.79Å; K41-F51 HydrophobicContact CD-CE1 3.83Å; K41-F51 HydrophobicContact CD-CZ 3.88Å; K41-F51 HydrophobicContact CG-CD1 4.16Å; K41-F51 HydrophobicContact CG-CE1 3.63Å; K41-F51 HydrophobicContact CG-CZ 3.87Å; P49-F51 HydrophobicContact CB-CE2 4.19Å; P49-F51 HydrophobicContact CB-CZ 4.5Å; P49-F51 HydrophobicContact CG-CE2 4.05Å; P49-F51 HydrophobicContact CG-CZ 4.42Å; P49-F51 VanDerWaalsContact O-CD2 3.3Å; P49-F51 WeakPolarHBondContact O-CD2 3.16Å; P49-F51 WeakPolarHBondContact O-CE2 3.43Å
52	R	85.8	Confident	80.9	Confident	97 Å²	97	73.6 Å²	73.6	37%	0.366	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	157.1	171.4	-64.5	-173.2	-174.8	-150.2	8	110.6	V40 E50 A73 F74 D75	V40-R52 PolarHBondContact N-O 2.81Å; V40-R52 PolarHBondContact O-N 3.37Å; V40-R52 VanDerWaalsContact O-N 3.07Å; E50-R52 IonicContact OE1-CZ 2.7Å; E50-R52 IonicContact OE1-NE 3.85Å; E50-R52 PolarHBondContact OE1-NE 3.18Å; E50-R52 IonicContact OE1-NH2 3.84Å; E50-R52 PolarHBondContact OE1-NH2 3.49Å; R52-A73 WeakPolarHBondContact CD-O 3.4Å; R52-A73 PolarHBondContact NE-O 2.68Å; R52-A73 PolarHBondContact NH1-O 3.24Å; R52-F74 HydrophobicContact CB-CE1 3.93Å; R52-F74 HydrophobicContact CB-CE2 4.26Å; R52-F74 HydrophobicContact CB-CZ 3.68Å; R52-F74 HydrophobicContact CG-CD1 4.18Å; R52-F74 HydrophobicContact CG-CE1 3.66Å; R52-F74 HydrophobicContact CG-CZ 3.97Å; R52-D75 IonicContact NH1-OD2 2.7Å; R52-D75 IonicContact NH2-OD2 2.68Å
53	S	83.8	Confident	80.7	Confident	83 Å²	83	73 Å²	73	58%	0.58	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-136.6	136.5	-178.3	-60.2	0	0	0	0	109.7	V38	V38-S53 VanDerWaalsContact O-CA 3.3Å; V38-S53 WeakPolarHBondContact O-CA 3.35Å
54	F	87.4	Confident	80.6	Confident	43 Å²	43	76.5 Å²	76.5	19%	0.189	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	-174.3	176.5	52	-96.1	0	0	0	109.6	V38 V40 V56 L66 I69 L70 A73	V38-F54 HydrophobicContact CB-CD2 4.04Å; V38-F54 HydrophobicContact CB-CE2 3.78Å; V38-F54 HydrophobicContact CB-CZ 4.22Å; V38-F54 HydrophobicContact CG1-CE2 4.01Å; V38-F54 HydrophobicContact CG1-CZ 4.01Å; V38-F54 HydrophobicContact CG2-CD2 4.39Å; V38-F54 HydrophobicContact CG2-CE2 4.08Å; V38-F54 PolarHBondContact N-O 3.02Å; V38-F54 PolarHBondContact O-N 3.04Å; V40-F54 HydrophobicContact CG2-CE1 3.54Å; V40-F54 HydrophobicContact CG2-CZ 3.8Å; F54-V56 HydrophobicContact CD2-CG1 3.7Å; F54-V56 HydrophobicContact CE2-CG1 3.67Å; F54-L66 HydrophobicContact CE2-CD1 4.1Å; F54-L66 HydrophobicContact CZ-CD1 4.1Å; F54-I69 HydrophobicContact CD1-CG2 4.32Å; F54-I69 HydrophobicContact CD2-CG2 3.91Å; F54-I69 HydrophobicContact CE1-CG2 4.04Å; F54-I69 HydrophobicContact CE2-CG2 3.62Å; F54-I69 HydrophobicContact CG-CG2 4.26Å; F54-I69 HydrophobicContact CZ-CG2 3.69Å; F54-L70 HydrophobicContact CE1-CD2 4.16Å; F54-L70 HydrophobicContact CZ-CD2 4.04Å; F54-A73 HydrophobicContact CE1-CB 4.43Å
55	A	83.3	Confident	80.7	Confident	59 Å²	59	76.7 Å²	76.7	49%	0.488	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	144.3	178.8	0	0	0	0	0	109.4	V35 V36	V35-A55 HydrophobicContact CG1-CB 3.57Å; V36-A55 WeakPolarHBondContact O-CA 3.16Å
56	V	85.4	Confident	81.7	Confident	7 Å²	7	73.2 Å²	73.2	4%	0.042	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	146.9	-177	-57	0	0	0	0	110.1	V36 V38 F54 T61 I69 F110	V36-V56 HydrophobicContact CB-CG2 4.44Å; V36-V56 PolarHBondContact N-O 3.5Å; V36-V56 PolarHBondContact O-N 3.38Å; V38-V56 HydrophobicContact CG2-CG1 4.17Å; V38-V56 HydrophobicContact CG2-CG2 3.67Å; F54-V56 HydrophobicContact CD2-CG1 3.7Å; F54-V56 HydrophobicContact CE2-CG1 3.67Å; V56-T61 HydrophobicContact CB-CG2 4.17Å; V56-T61 HydrophobicContact CG1-CG2 4.32Å; V56-I69 HydrophobicContact CG1-CD1 4.27Å; V56-F110 HydrophobicContact CG2-CE1 3.5Å; V56-F110 VanDerWaalsContact CG2-CE1 3.5Å; V56-F110 HydrophobicContact CG2-CZ 3.64Å
57	D	82.2	Confident	82.9	Confident	48 Å²	48	66.2 Å²	66.2	26%	0.257	36%	0.361	S	S	.	.			trans	-88.2	118.5	169.3	168.2	4.6	0	0	0	108.6	Q59 I60 T61	D57-Q59 PolarHBondContact O-N 3.12Å; D57-Q59 WeakPolarHBondContact OD1-CB 3.2Å; D57-Q59 PolarHBondContact OD1-N 2.79Å; D57-I60 HydrophobicContact CB-CD1 4.13Å; D57-I60 HydrophobicContact CB-CG1 3.86Å; D57-I60 PolarHBondContact O-N 2.86Å; D57-T61 VanDerWaalsContact O-CB 3.26Å; D57-T61 WeakPolarHBondContact O-CB 3.31Å; D57-T61 PolarHBondContact O-N 2.9Å; D57-T61 PolarHBondContact O-OG1 2.94Å
58	P	82.7	Confident	83.1	Confident	38 Å²	38	66 Å²	66	25%	0.247	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.3	178.9	-24	35.6	0	0	0	114.9	V36 F110	V36-P58 HydrophobicContact CB-CG 4.21Å; V36-P58 HydrophobicContact CG2-CG 3.53Å; P58-F110 HydrophobicContact CB-CD2 3.82Å; P58-F110 HydrophobicContact CB-CE2 4.06Å; P58-F110 HydrophobicContact CB-CG 4.15Å; P58-F110 HydrophobicContact CG-CD1 4.45Å; P58-F110 HydrophobicContact CG-CD2 4.45Å; P58-F110 HydrophobicContact CG-CG 4.34Å
59	Q	76.6	Confident	83.5	Confident	145 Å²	145	63.3 Å²	63.3	68%	0.678	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-24.7	-176.6	-56.1	-168.3	10.1	0	0	112.9	D57	D57-Q59 PolarHBondContact O-N 3.12Å; D57-Q59 WeakPolarHBondContact OD1-CB 3.2Å; D57-Q59 PolarHBondContact OD1-N 2.79Å
60	I	74.8	Confident	83.6	Confident	125 Å²	125	60.7 Å²	60.7	64%	0.641	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.4	-6.8	-175.2	67.9	178.1	0	0	0	114.4	D57 S62	D57-I60 HydrophobicContact CB-CD1 4.13Å; D57-I60 HydrophobicContact CB-CG1 3.86Å; D57-I60 PolarHBondContact O-N 2.86Å; I60-S62 PolarHBondContact O-N 3.12Å
61	T	84.8	Confident	83.3	Confident	14 Å²	14	59.5 Å²	59.5	9%	0.086	31%	0.313	C	S	.	.			trans	-95.4	95	-175.6	-54.2	0	0	0	0	111.3	V56 D57 V65 L66 L106 F110	V56-T61 HydrophobicContact CB-CG2 4.17Å; V56-T61 HydrophobicContact CG1-CG2 4.32Å; D57-T61 VanDerWaalsContact O-CB 3.26Å; D57-T61 WeakPolarHBondContact O-CB 3.31Å; D57-T61 PolarHBondContact O-N 2.9Å; D57-T61 PolarHBondContact O-OG1 2.94Å; T61-V65 HydrophobicContact CG2-CG1 4.24Å; T61-L66 HydrophobicContact CG2-CB 4.22Å; T61-L106 VanDerWaalsContact O-CD2 3.23Å; T61-L106 WeakPolarHBondContact O-CD2 3.3Å; T61-F110 HydrophobicContact CG2-CZ 4.41Å
62	S	87.8	Confident	82.9	Confident	41 Å²	41	62.9 Å²	62.9	29%	0.287	32%	0.322	S	S	.	.			trans	-76.2	170.7	166.5	71.2	0	0	0	0	112.4	I60 D64 V65 L66 D103 L106	I60-S62 PolarHBondContact O-N 3.12Å; S62-D64 VanDerWaalsContact C-N 3.34Å; S62-D64 PolarHBondContact O-N 3.44Å; S62-V65 PolarHBondContact O-N 3.25Å; S62-V65 WeakPolarHBondContact OG-CG2 3.31Å; S62-V65 PolarHBondContact OG-N 3.22Å; S62-L66 WeakPolarHBondContact O-CB 3.29Å; S62-L66 PolarHBondContact O-N 3.06Å; S62-D103 VanDerWaalsContact CA-OD1 3.31Å; S62-D103 WeakPolarHBondContact CA-OD1 3.45Å; S62-D103 VanDerWaalsContact CB-OD1 3.32Å; S62-D103 WeakPolarHBondContact CB-OD1 3.49Å; S62-L106 VanDerWaalsContact C-CD2 3.46Å
63	L	86.5	Confident	82.7	Confident	14 Å²	14	59.1 Å²	59.1	7%	0.073	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-39	175.6	178	51.2	0	0	0	112.3	L66 Q67 I84 L100 D103 L106	L63-L66 PolarHBondContact O-N 3.39Å; L63-Q67 HydrophobicContact CD1-CG 4.29Å; L63-Q67 WeakPolarHBondContact O-CB 3.5Å; L63-Q67 WeakPolarHBondContact O-CG 3.33Å; L63-Q67 PolarHBondContact O-N 2.84Å; L63-I84 HydrophobicContact CD1-CD1 4.1Å; L63-L100 HydrophobicContact CD1-CD2 3.54Å; L63-L100 HydrophobicContact CD2-CD2 3.85Å; L63-L100 HydrophobicContact CG-CD2 4.23Å; L63-D103 PolarHBondContact N-OD1 3.1Å; L63-L106 HydrophobicContact CB-CD2 4.39Å
64	D	81.6	Confident	82.7	Confident	96 Å²	96	55.3 Å²	55.3	51%	0.513	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-42.4	174.1	-75	-43.8	0	0	0	111.7	S62 L66 Q67 H68	S62-D64 VanDerWaalsContact C-N 3.34Å; S62-D64 PolarHBondContact O-N 3.44Å; D64-L66 VanDerWaalsContact C-N 3.35Å; D64-Q67 PolarHBondContact O-N 3.14Å; D64-H68 PolarHBondContact O-CD2 3.42Å; D64-H68 VanDerWaalsContact O-CD2 3.28Å; D64-H68 PolarHBondContact O-N 3.36Å
65	V	83	Confident	82.3	Confident	63 Å²	63	58.8 Å²	58.8	38%	0.382	31%	0.306	S	S	.	.	H	α-helix	trans	-62.8	-43.6	175.1	173.8	0	0	0	0	110.3	T61 S62 H68 I69	T61-V65 HydrophobicContact CG2-CG1 4.24Å; S62-V65 PolarHBondContact O-N 3.25Å; S62-V65 WeakPolarHBondContact OG-CG2 3.31Å; S62-V65 PolarHBondContact OG-N 3.22Å; V65-H68 PolarHBondContact O-N 3.31Å; V65-I69 HydrophobicContact CG1-CD1 3.91Å; V65-I69 VanDerWaalsContact O-CG1 3.3Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 3.3Å
66	L	86.1	Confident	82	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	29%	0.285	C	S	.	.	H	α-helix	trans	-63.2	-41.9	175.8	-178.6	61.1	0	0	0	112.2	F54 T61 S62 L63 D64 I69 L70 L100 L106 L120	F54-L66 HydrophobicContact CE2-CD1 4.1Å; F54-L66 HydrophobicContact CZ-CD1 4.1Å; T61-L66 HydrophobicContact CG2-CB 4.22Å; S62-L66 WeakPolarHBondContact O-CB 3.29Å; S62-L66 PolarHBondContact O-N 3.06Å; L63-L66 PolarHBondContact O-N 3.39Å; D64-L66 VanDerWaalsContact C-N 3.35Å; L66-I69 PolarHBondContact O-N 3.37Å; L66-L70 HydrophobicContact CD1-CD1 4.46Å; L66-L70 HydrophobicContact CD1-CG 4.37Å; L66-L70 HydrophobicContact CG-CD1 4.15Å; L66-L70 HydrophobicContact CG-CG 4.5Å; L66-L70 WeakPolarHBondContact O-CB 3.25Å; L66-L70 VanDerWaalsContact O-CG 3.24Å; L66-L70 WeakPolarHBondContact O-CG 3.14Å; L66-L70 PolarHBondContact O-N 2.78Å; L66-L100 HydrophobicContact CD2-CD1 4.26Å; L66-L106 HydrophobicContact CD2-CD1 3.68Å; L66-L106 HydrophobicContact CD2-CD2 4.35Å; L66-L120 HydrophobicContact CD1-CD1 4.2Å; L66-L120 HydrophobicContact CD2-CD1 4.01Å
67	Q	85.8	Confident	80.6	Confident	45 Å²	45	61 Å²	61	21%	0.21	32%	0.317	C	S	.	.	H	α-helix	trans	-59.6	-45.4	173.2	-78.3	178.7	35.5	0	0	111.4	L63 D64 I69 L70 I71 I84	L63-Q67 HydrophobicContact CD1-CG 4.29Å; L63-Q67 WeakPolarHBondContact O-CB 3.5Å; L63-Q67 WeakPolarHBondContact O-CG 3.33Å; L63-Q67 PolarHBondContact O-N 2.84Å; D64-Q67 PolarHBondContact O-N 3.14Å; Q67-I69 PolarHBondContact O-N 3.36Å; Q67-L70 PolarHBondContact O-N 2.9Å; Q67-I71 WeakPolarHBondContact O-CB 3.43Å; Q67-I71 VanDerWaalsContact O-CG1 3.28Å; Q67-I71 WeakPolarHBondContact O-CG1 3.4Å; Q67-I71 PolarHBondContact O-N 3.1Å; Q67-I84 HydrophobicContact CG-CD1 3.73Å
68	H	78.3	Confident	79.3	Confident	105 Å²	105	62.2 Å²	62.2	49%	0.486	34%	0.341	S	S	.	.	H	α-helix	trans	-64.3	-37.9	176.3	-86.3	-74.5	0	0	0	112.8	D64 V65 R72	D64-H68 PolarHBondContact O-CD2 3.42Å; D64-H68 VanDerWaalsContact O-CD2 3.28Å; D64-H68 PolarHBondContact O-N 3.36Å; V65-H68 PolarHBondContact O-N 3.31Å; H68-R72 WeakPolarHBondContact O-CG 3.41Å; H68-R72 PolarHBondContact O-N 3.39Å; H68-R72 VanDerWaalsContact O-N 3.12Å
69	I	81.8	Confident	78.1	Confident	54 Å²	54	65 Å²	65	28%	0.277	35%	0.349	S	S	.	.	H	α-helix	trans	-63	-45.5	171.8	-68.6	164.8	0	0	0	110.3	F54 V56 V65 L66 Q67 R72 A73	F54-I69 HydrophobicContact CD1-CG2 4.32Å; F54-I69 HydrophobicContact CD2-CG2 3.91Å; F54-I69 HydrophobicContact CE1-CG2 4.04Å; F54-I69 HydrophobicContact CE2-CG2 3.62Å; F54-I69 HydrophobicContact CG-CG2 4.26Å; F54-I69 HydrophobicContact CZ-CG2 3.69Å; V56-I69 HydrophobicContact CG1-CD1 4.27Å; V65-I69 HydrophobicContact CG1-CD1 3.91Å; V65-I69 VanDerWaalsContact O-CG1 3.3Å; V65-I69 WeakPolarHBondContact O-CG1 3.48Å; V65-I69 PolarHBondContact O-N 3.3Å; L66-I69 PolarHBondContact O-N 3.37Å; Q67-I69 PolarHBondContact O-N 3.36Å; I69-R72 PolarHBondContact O-N 3.39Å; I69-A73 WeakPolarHBondContact O-CA 3.18Å; I69-A73 WeakPolarHBondContact O-CB 3.47Å; I69-A73 PolarHBondContact O-N 2.67Å
70	L	85.3	Confident	77.1	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-64.1	-42	179.2	-72.2	171.4	0	0	0	112.9	V40 F54 L66 Q67 A73 F74 F82 I84 V122	V40-L70 HydrophobicContact CB-CD2 4.3Å; V40-L70 HydrophobicContact CG1-CD2 3.77Å; V40-L70 HydrophobicContact CG2-CD2 3.8Å; F54-L70 HydrophobicContact CE1-CD2 4.16Å; F54-L70 HydrophobicContact CZ-CD2 4.04Å; L66-L70 HydrophobicContact CD1-CD1 4.46Å; L66-L70 HydrophobicContact CD1-CG 4.37Å; L66-L70 HydrophobicContact CG-CD1 4.15Å; L66-L70 HydrophobicContact CG-CG 4.5Å; L66-L70 WeakPolarHBondContact O-CB 3.25Å; L66-L70 VanDerWaalsContact O-CG 3.24Å; L66-L70 WeakPolarHBondContact O-CG 3.14Å; L66-L70 PolarHBondContact O-N 2.78Å; Q67-L70 PolarHBondContact O-N 2.9Å; L70-A73 PolarHBondContact O-N 3.49Å; L70-F74 HydrophobicContact CD2-CD2 4.4Å; L70-F74 HydrophobicContact CD2-CE2 4.18Å; L70-F74 PolarHBondContact O-N 2.81Å; L70-F82 HydrophobicContact CB-CE2 4.39Å; L70-F82 HydrophobicContact CB-CZ 4.34Å; L70-F82 HydrophobicContact CD1-CE2 4.25Å; L70-I84 HydrophobicContact CD1-CD1 3.59Å; L70-I84 HydrophobicContact CD1-CG1 3.98Å; L70-I84 HydrophobicContact CD1-CG2 4.49Å; L70-V122 HydrophobicContact CD1-CG2 4Å; L70-V122 HydrophobicContact CD2-CG2 4.07Å
71	I	80	Confident	76.6	Confident	32 Å²	32	64.8 Å²	64.8	16%	0.164	35%	0.348	C	S	.	.	H	α-helix	trans	-60.3	-46.9	176.2	-73	163.7	0	0	0	110.8	Q67 D75 L76 F82	Q67-I71 WeakPolarHBondContact O-CB 3.43Å; Q67-I71 VanDerWaalsContact O-CG1 3.28Å; Q67-I71 WeakPolarHBondContact O-CG1 3.4Å; Q67-I71 PolarHBondContact O-N 3.1Å; I71-D75 PolarHBondContact O-N 2.73Å; I71-D75 VanDerWaalsContact O-N 3.13Å; I71-L76 HydrophobicContact CG1-CB 4.36Å; I71-L76 HydrophobicContact CG2-CB 4.47Å; I71-L76 PolarHBondContact O-N 3.41Å; I71-F82 HydrophobicContact CD1-CE1 4.12Å; I71-F82 HydrophobicContact CD1-CZ 4.4Å; I71-F82 HydrophobicContact CG1-CE1 3.67Å; I71-F82 HydrophobicContact CG1-CZ 3.91Å
72	R	79.1	Confident	76.6	Confident	209 Å²	209	65.3 Å²	65.3	79%	0.789	35%	0.349	S	S	*	.	H	α-helix	trans	-72.9	-27	176.5	-68.1	-175.7	70.3	-179.9	3.4	113.3	H68 I69	H68-R72 WeakPolarHBondContact O-CG 3.41Å; H68-R72 PolarHBondContact O-N 3.39Å; H68-R72 VanDerWaalsContact O-N 3.12Å; I69-R72 PolarHBondContact O-N 3.39Å
73	A	81.6	Confident	76.5	Confident	18 Å²	18	64.7 Å²	64.7	15%	0.149	35%	0.349	C	S	.	.	H	α-helix	trans	-73.7	-38.6	178.8	0	0	0	0	0	111.3	R52 F54 I69 L70	R52-A73 WeakPolarHBondContact CD-O 3.4Å; R52-A73 PolarHBondContact NE-O 2.68Å; R52-A73 PolarHBondContact NH1-O 3.24Å; F54-A73 HydrophobicContact CE1-CB 4.43Å; I69-A73 WeakPolarHBondContact O-CA 3.18Å; I69-A73 WeakPolarHBondContact O-CB 3.47Å; I69-A73 PolarHBondContact O-N 2.67Å; L70-A73 PolarHBondContact O-N 3.49Å
74	F	83.6	Confident	76.8	Confident	3 Å²	3	64.6 Å²	64.6	1%	0.013	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	15.2	-173.3	-71.6	-79.2	0	0	0	114.7	V40 K42 E50 R52 L70 L76	V40-F74 HydrophobicContact CB-CE2 3.71Å; V40-F74 HydrophobicContact CB-CZ 3.81Å; V40-F74 HydrophobicContact CG1-CE2 3.56Å; V40-F74 HydrophobicContact CG1-CZ 3.87Å; V40-F74 HydrophobicContact CG2-CE2 4.46Å; K42-F74 HydrophobicContact CB-CD1 3.8Å; K42-F74 HydrophobicContact CB-CE1 3.66Å; K42-F74 HydrophobicContact CB-CG 4.33Å; K42-F74 HydrophobicContact CB-CZ 4.1Å; K42-F74 HydrophobicContact CD-CB 3.9Å; K42-F74 HydrophobicContact CD-CD1 3.54Å; K42-F74 HydrophobicContact CD-CE1 4.24Å; K42-F74 HydrophobicContact CD-CG 3.91Å; K42-F74 HydrophobicContact CG-CD1 4.35Å; K42-F74 PolarHBondContact NZ-O 2.96Å; E50-F74 HydrophobicContact CB-CD1 4.36Å; E50-F74 HydrophobicContact CB-CE1 4.13Å; E50-F74 HydrophobicContact CG-CD1 4.12Å; E50-F74 HydrophobicContact CG-CE1 4Å; R52-F74 HydrophobicContact CB-CE1 3.93Å; R52-F74 HydrophobicContact CB-CE2 4.26Å; R52-F74 HydrophobicContact CB-CZ 3.68Å; R52-F74 HydrophobicContact CG-CD1 4.18Å; R52-F74 HydrophobicContact CG-CE1 3.66Å; R52-F74 HydrophobicContact CG-CZ 3.97Å; L70-F74 HydrophobicContact CD2-CD2 4.4Å; L70-F74 HydrophobicContact CD2-CE2 4.18Å; L70-F74 PolarHBondContact O-N 2.81Å; F74-L76 VanDerWaalsContact C-N 3.28Å; F74-L76 HydrophobicContact CB-CD1 4.23Å; F74-L76 HydrophobicContact CB-CD2 3.84Å; F74-L76 HydrophobicContact CB-CG 3.8Å; F74-L76 WeakPolarHBondContact O-CD2 3.5Å; F74-L76 PolarHBondContact O-N 3.11Å
75	D	78.3	Confident	77.3	Confident	117 Å²	117	60.8 Å²	60.8	63%	0.626	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	41.4	178.2	-57.8	-61.9	0	0	0	113.2	R52 I71 S77	R52-D75 IonicContact NH1-OD2 2.7Å; R52-D75 IonicContact NH2-OD2 2.68Å; I71-D75 PolarHBondContact O-N 2.73Å; I71-D75 VanDerWaalsContact O-N 3.13Å; D75-S77 VanDerWaalsContact C-N 3.32Å; D75-S77 PolarHBondContact O-N 2.81Å
76	L	76.5	Confident	77.7	Confident	9 Å²	9	58.4 Å²	58.4	5%	0.047	31%	0.314	C	S	.	.			trans	-79.3	74	-172.9	-54.3	-179.4	0	0	0	111.7	K42 I71 F74 G78 K79 F82 I124	K42-L76 HydrophobicContact CD-CD2 4.3Å; I71-L76 HydrophobicContact CG1-CB 4.36Å; I71-L76 HydrophobicContact CG2-CB 4.47Å; I71-L76 PolarHBondContact O-N 3.41Å; F74-L76 VanDerWaalsContact C-N 3.28Å; F74-L76 HydrophobicContact CB-CD1 4.23Å; F74-L76 HydrophobicContact CB-CD2 3.84Å; F74-L76 HydrophobicContact CB-CG 3.8Å; F74-L76 WeakPolarHBondContact O-CD2 3.5Å; F74-L76 PolarHBondContact O-N 3.11Å; L76-G78 PolarHBondContact O-N 3.29Å; L76-K79 PolarHBondContact O-N 2.76Å; L76-F82 HydrophobicContact CD1-CD1 3.97Å; L76-F82 HydrophobicContact CD1-CE1 3.86Å; L76-F82 HydrophobicContact CD1-CG 4.42Å; L76-F82 HydrophobicContact CD1-CZ 4.19Å; L76-I124 HydrophobicContact CD2-CD1 3.65Å
77	S	55.7	Low	77.8	Confident	102 Å²	102	60.4 Å²	60.4	71%	0.713	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.5	90.9	-175	52.8	0	0	0	0	115.3	D75 K79	D75-S77 VanDerWaalsContact C-N 3.32Å; D75-S77 PolarHBondContact O-N 2.81Å; S77-K79 PolarHBondContact O-N 2.7Å
78	G	55.3	Low	77.8	Confident	75 Å²	75	58.6 Å²	58.6	77%	0.773	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.6	-7.1	177.2	0	0	0	0	0	116.3	L76 K80	L76-G78 PolarHBondContact O-N 3.29Å; G78-K80 PolarHBondContact O-N 3.11Å
79	K	57.5	Low	77.9	Confident	96 Å²	96	61 Å²	61	42%	0.417	32%	0.322	S	S	.	.			trans	-73.2	98.1	-177.3	-66	-175.5	-177.3	-179.3	0	110.4	E44 L76 S77 N81 F82	E44-K79 IonicContact OE1-NZ 3.94Å; L76-K79 PolarHBondContact O-N 2.76Å; S77-K79 PolarHBondContact O-N 2.7Å; K79-N81 VanDerWaalsContact C-N 3.29Å; K79-F82 WeakPolarHBondContact O-CD1 3.29Å; K79-F82 VanDerWaalsContact O-CE1 3.27Å; K79-F82 WeakPolarHBondContact O-CE1 3.27Å
80	K	56	Low	77.6	Confident	126 Å²	126	61.1 Å²	61.1	55%	0.548	32%	0.324	S	S	.	.			trans	-76.6	-14	164.2	-71.7	-159	172.6	-158.3	0	113.6	G78 F82	G78-K80 PolarHBondContact O-N 3.11Å; K80-F82 VanDerWaalsContact C-N 3.34Å; K80-F82 PolarHBondContact O-N 3.25Å; K80-F82 VanDerWaalsContact O-N 3.07Å
81	N	64.6	Low	77.1	Confident	140 Å²	140	73.4 Å²	73.4	75%	0.749	37%	0.37	S	S	*	.			trans	-88.2	61.2	-172.5	-64.3	-0.5	0	0	0	112.7	K79	K79-N81 VanDerWaalsContact C-N 3.29Å
82	F	84.6	Confident	76.7	Confident	25 Å²	25	79.3 Å²	79.3	11%	0.11	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.5	170.2	59.7	-92.1	0	0	0	111.3	L70 I71 L76 K79 K80 I84 V122 D123 I124	L70-F82 HydrophobicContact CB-CE2 4.39Å; L70-F82 HydrophobicContact CB-CZ 4.34Å; L70-F82 HydrophobicContact CD1-CE2 4.25Å; I71-F82 HydrophobicContact CD1-CE1 4.12Å; I71-F82 HydrophobicContact CD1-CZ 4.4Å; I71-F82 HydrophobicContact CG1-CE1 3.67Å; I71-F82 HydrophobicContact CG1-CZ 3.91Å; L76-F82 HydrophobicContact CD1-CD1 3.97Å; L76-F82 HydrophobicContact CD1-CE1 3.86Å; L76-F82 HydrophobicContact CD1-CG 4.42Å; L76-F82 HydrophobicContact CD1-CZ 4.19Å; K79-F82 WeakPolarHBondContact O-CD1 3.29Å; K79-F82 VanDerWaalsContact O-CE1 3.27Å; K79-F82 WeakPolarHBondContact O-CE1 3.27Å; K80-F82 VanDerWaalsContact C-N 3.34Å; K80-F82 PolarHBondContact O-N 3.25Å; K80-F82 VanDerWaalsContact O-N 3.07Å; F82-I84 HydrophobicContact CD2-CG1 3.93Å; F82-I84 HydrophobicContact CE2-CD1 3.88Å; F82-I84 HydrophobicContact CE2-CG1 3.7Å; F82-V122 HydrophobicContact CB-CG1 4.21Å; F82-V122 HydrophobicContact CD2-CG1 3.67Å; F82-V122 HydrophobicContact CD2-CG2 4.45Å; F82-V122 HydrophobicContact CE2-CG1 4.31Å; F82-V122 HydrophobicContact CG-CG1 4.12Å; F82-D123 WeakPolarHBondContact CA-O 3.5Å; F82-I124 HydrophobicContact CB-CG1 4.47Å
83	G	85.9	Confident	76.4	Confident	28 Å²	28	71.7 Å²	71.7	29%	0.289	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	141.8	173	0	0	0	0	0	111.2	V122 D123	G83-V122 CarbonylContact O-C 3.59Å; G83-V122 VanDerWaalsContact O-CA 3.31Å; G83-V122 WeakPolarHBondContact O-CA 3.22Å; G83-D123 PolarHBondContact N-O 2.75Å; G83-D123 PolarHBondContact O-N 2.71Å
84	I	92.1	Very high	76.1	Confident	12 Å²	12	77.3 Å²	77.3	6%	0.062	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	134	167.7	-55.6	170.5	0	0	0	108.2	L63 Q67 L70 F82 L100 R121	L63-I84 HydrophobicContact CD1-CD1 4.1Å; Q67-I84 HydrophobicContact CG-CD1 3.73Å; L70-I84 HydrophobicContact CD1-CD1 3.59Å; L70-I84 HydrophobicContact CD1-CG1 3.98Å; L70-I84 HydrophobicContact CD1-CG2 4.49Å; F82-I84 HydrophobicContact CD2-CG1 3.93Å; F82-I84 HydrophobicContact CE2-CD1 3.88Å; F82-I84 HydrophobicContact CE2-CG1 3.7Å; I84-L100 HydrophobicContact CB-CB 4.31Å; I84-L100 HydrophobicContact CG2-CB 3.99Å; I84-L100 HydrophobicContact CG2-CD1 4.02Å; I84-L100 PolarHBondContact O-N 3.4Å; I84-R121 WeakPolarHBondContact CA-O 3.43Å
85	S	92.6	Very high	76.1	Confident	16 Å²	16	82.4 Å²	82.4	11%	0.112	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	148.8	170.8	-57.9	0	0	0	0	110.8	L98 L120 R121	S85-L98 CarbonylContact C-O 3.49Å; S85-L98 WeakPolarHBondContact CA-O 3.42Å; S85-L98 VanDerWaalsContact CB-O 3.26Å; S85-L98 WeakPolarHBondContact CB-O 3.12Å; S85-L120 CarbonylContact O-C 3.54Å; S85-L120 WeakPolarHBondContact O-CA 3.41Å; S85-R121 PolarHBondContact N-O 3.45Å; S85-R121 PolarHBondContact O-N 3.2Å
86	Y	92.2	Very high	76.4	Confident	13 Å²	13	79.3 Å²	79.3	5%	0.051	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	151	173.9	69.8	-83.1	0	0	0	111.5	G88 Y97 L98 L100 D105 A109 Q119	Y86-G88 PolarHBondContact O-N 3.42Å; Y86-Y97 CarbonylContact O-C 3.58Å; Y86-Y97 WeakPolarHBondContact O-CA 3.48Å; Y86-L98 HydrophobicContact CD1-CB 4.18Å; Y86-L98 WeakPolarHBondContact CD1-O 3.28Å; Y86-L98 HydrophobicContact CE1-CB 3.78Å; Y86-L98 HydrophobicContact CE2-CB 4.37Å; Y86-L98 HydrophobicContact CE2-CD1 4.04Å; Y86-L98 PolarHBondContact N-O 3.45Å; Y86-L98 PolarHBondContact O-N 2.73Å; Y86-L100 HydrophobicContact CD1-CB 4.21Å; Y86-L100 HydrophobicContact CD1-CD1 4.47Å; Y86-L100 HydrophobicContact CD1-CG 4.27Å; Y86-D105 HydrophobicContact CE1-CB 4.48Å; Y86-A109 HydrophobicContact CD1-CB 3.79Å; Y86-A109 HydrophobicContact CD2-CB 3.53Å; Y86-A109 HydrophobicContact CE1-CB 4.09Å; Y86-A109 HydrophobicContact CE2-CB 3.84Å; Y86-A109 HydrophobicContact CG-CB 3.49Å; Y86-A109 VanDerWaalsContact CG-CB 3.49Å; Y86-Q119 WeakPolarHBondContact CA-O 3.43Å
87	L	87.7	Confident	76.9	Confident	44 Å²	44	82.3 Å²	82.3	23%	0.23	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	108.9	174	-170.3	66.9	0	0	0	109.3	E95 Y97 Q119	L87-E95 HydrophobicContact CD1-CB 4.07Å; L87-E95 HydrophobicContact CG-CB 4.46Å; L87-Y97 HydrophobicContact CB-CD1 4.45Å; L87-Y97 HydrophobicContact CB-CE1 4.12Å; L87-Y97 HydrophobicContact CD1-CD2 4.13Å; L87-Y97 HydrophobicContact CD1-CE1 4.39Å; L87-Y97 HydrophobicContact CD1-CE2 3.97Å; L87-Y97 HydrophobicContact CD1-CG 4.43Å; L87-Q119 HydrophobicContact CB-CB 4.07Å; L87-Q119 HydrophobicContact CB-CG 4.5Å; L87-Q119 HydrophobicContact CD2-CB 4.4Å; L87-Q119 PolarHBondContact N-O 2.88Å
88	G	84.7	Confident	78.4	Confident	7 Å²	7	80.5 Å²	80.5	7%	0.072	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	-172.4	173.7	0	0	0	0	0	111.8	Y86 E95 V96	Y86-G88 PolarHBondContact O-N 3.42Å; G88-E95 WeakPolarHBondContact O-CA 3.42Å; G88-V96 PolarHBondContact N-O 3.17Å; G88-V96 PolarHBondContact O-N 3.24Å
89	R	80.9	Confident	80	Confident	154 Å²	154	80.4 Å²	80.4	58%	0.581	40%	0.401	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-116.7	138.9	170.6	-70.5	-178.4	-179	157.1	4.3	110.6	Q94 E95	R89-Q94 WeakPolarHBondContact CA-O 3.49Å; R89-E95 HydrophobicContact CG-CG 4.22Å; R89-E95 IonicContact CZ-OE1 2.7Å; R89-E95 IonicContact NE-OE1 3.69Å; R89-E95 PolarHBondContact NE-OE1 2.79Å; R89-E95 IonicContact NH2-OE1 3.41Å; R89-E95 PolarHBondContact NH2-OE1 3.2Å
90	D	75.6	Confident	81.5	Confident	58 Å²	58	76.2 Å²	76.2	31%	0.31	38%	0.383	S	S	.	.			trans	-82	-176.1	177.5	90.2	-30.6	0	0	0	112.3	L92 G93 Q94 V96	D90-L92 PolarHBondContact O-N 3.11Å; D90-L92 WeakPolarHBondContact OD1-CA 3.29Å; D90-L92 WeakPolarHBondContact OD1-CB 3.28Å; D90-L92 PolarHBondContact OD1-N 2.99Å; D90-G93 PolarHBondContact O-N 3.36Å; D90-G93 VanDerWaalsContact O-N 3.09Å; D90-G93 PolarHBondContact OD1-N 3.18Å; D90-Q94 PolarHBondContact N-O 3.39Å; D90-Q94 PolarHBondContact OD1-N 3.1Å; D90-V96 HydrophobicContact CB-CG2 4.12Å
91	R	74.3	Confident	82.7	Confident	258 Å²	258	76.9 Å²	76.9	97%	0.974	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-8.5	179.4	-63.3	-173.6	-178.8	-166	0.2	114.2
92	L	72.9	Confident	83.8	Confident	155 Å²	155	72.3 Å²	72.3	81%	0.812	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.9	0.6	175.2	-57	175.3	0	0	0	111.7	D90 Q94	D90-L92 PolarHBondContact O-N 3.11Å; D90-L92 WeakPolarHBondContact OD1-CA 3.29Å; D90-L92 WeakPolarHBondContact OD1-CB 3.28Å; D90-L92 PolarHBondContact OD1-N 2.99Å; L92-Q94 VanDerWaalsContact C-N 3.33Å
93	G	71.2	Confident	83.7	Confident	49 Å²	49	75 Å²	75	51%	0.505	39%	0.386	S	S	.	.	S	Bend	trans	81.5	7	-178.2	0	0	0	0	0	114.5	D90	D90-G93 PolarHBondContact O-N 3.36Å; D90-G93 VanDerWaalsContact O-N 3.09Å; D90-G93 PolarHBondContact OD1-N 3.18Å
94	Q	77	Confident	83.7	Confident	137 Å²	137	83 Å²	83	64%	0.64	41%	0.408	S	S	*	.			trans	-82.4	142.9	-179.4	-167.4	164.2	67.8	0	0	110.7	R89 D90 L92 V96	R89-Q94 WeakPolarHBondContact CA-O 3.49Å; D90-Q94 PolarHBondContact N-O 3.39Å; D90-Q94 PolarHBondContact OD1-N 3.1Å; L92-Q94 VanDerWaalsContact C-N 3.33Å; Q94-V96 PolarHBondContact O-N 3.41Å
95	E	81.9	Confident	83.5	Confident	109 Å²	109	84.3 Å²	84.3	51%	0.509	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	120.1	-177.1	-58.8	-165.6	156.1	0	0	111.1	L87 G88 R89	L87-E95 HydrophobicContact CD1-CB 4.07Å; L87-E95 HydrophobicContact CG-CB 4.46Å; G88-E95 WeakPolarHBondContact O-CA 3.42Å; R89-E95 HydrophobicContact CG-CG 4.22Å; R89-E95 IonicContact CZ-OE1 2.7Å; R89-E95 IonicContact NE-OE1 3.69Å; R89-E95 PolarHBondContact NE-OE1 2.79Å; R89-E95 IonicContact NH2-OE1 3.41Å; R89-E95 PolarHBondContact NH2-OE1 3.2Å
96	V	86	Confident	83.3	Confident	52 Å²	52	83.6 Å²	83.6	32%	0.315	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	141.5	-171.3	178.3	0	0	0	0	109.7	G88 D90 Q94 L98	G88-V96 PolarHBondContact N-O 3.17Å; G88-V96 PolarHBondContact O-N 3.24Å; D90-V96 HydrophobicContact CB-CG2 4.12Å; Q94-V96 PolarHBondContact O-N 3.41Å; V96-L98 HydrophobicContact CG1-CD2 4.3Å; V96-L98 PolarHBondContact O-N 2.68Å
97	Y	87.2	Confident	82.9	Confident	73 Å²	73	86.3 Å²	86.3	29%	0.286	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	116	172.1	-78.7	-81.4	0	0	0	110.7	Y86 L87 Q119 R121	Y86-Y97 CarbonylContact O-C 3.58Å; Y86-Y97 WeakPolarHBondContact O-CA 3.48Å; L87-Y97 HydrophobicContact CB-CD1 4.45Å; L87-Y97 HydrophobicContact CB-CE1 4.12Å; L87-Y97 HydrophobicContact CD1-CD2 4.13Å; L87-Y97 HydrophobicContact CD1-CE1 4.39Å; L87-Y97 HydrophobicContact CD1-CE2 3.97Å; L87-Y97 HydrophobicContact CD1-CG 4.43Å; Y97-Q119 PolarHBondContact OH-NE2 2.91Å; Y97-R121 HydrophobicContact CD1-CB 3.71Å; Y97-R121 HydrophobicContact CE1-CB 3.49Å; Y97-R121 VanDerWaalsContact CE1-CB 3.49Å
98	L	86.3	Confident	82.8	Confident	63 Å²	63	86.3 Å²	86.3	33%	0.33	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	131.5	178.1	-58	178.6	0	0	0	109.6	S85 Y86 V96	S85-L98 CarbonylContact C-O 3.49Å; S85-L98 WeakPolarHBondContact CA-O 3.42Å; S85-L98 VanDerWaalsContact CB-O 3.26Å; S85-L98 WeakPolarHBondContact CB-O 3.12Å; Y86-L98 HydrophobicContact CD1-CB 4.18Å; Y86-L98 WeakPolarHBondContact CD1-O 3.28Å; Y86-L98 HydrophobicContact CE1-CB 3.78Å; Y86-L98 HydrophobicContact CE2-CB 4.37Å; Y86-L98 HydrophobicContact CE2-CD1 4.04Å; Y86-L98 PolarHBondContact N-O 3.45Å; Y86-L98 PolarHBondContact O-N 2.73Å; V96-L98 HydrophobicContact CG1-CD2 4.3Å; V96-L98 PolarHBondContact O-N 2.68Å
99	S	88.9	Confident	83	Confident	74 Å²	74	86 Å²	86	52%	0.517	43%	0.429	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	139.1	177.6	-55.2	0	0	0	0	111.2
100	L	87.9	Confident	83.3	Confident	7 Å²	7	79.3 Å²	79.3	4%	0.037	40%	0.404	C	S	.	.			trans	-109.7	103.1	179.3	-158.4	177.9	0	0	0	108.2	L63 L66 I84 Y86 D105 L106 L120	L63-L100 HydrophobicContact CD1-CD2 3.54Å; L63-L100 HydrophobicContact CD2-CD2 3.85Å; L63-L100 HydrophobicContact CG-CD2 4.23Å; L66-L100 HydrophobicContact CD2-CD1 4.26Å; I84-L100 HydrophobicContact CB-CB 4.31Å; I84-L100 HydrophobicContact CG2-CB 3.99Å; I84-L100 HydrophobicContact CG2-CD1 4.02Å; I84-L100 PolarHBondContact O-N 3.4Å; Y86-L100 HydrophobicContact CD1-CB 4.21Å; Y86-L100 HydrophobicContact CD1-CD1 4.47Å; Y86-L100 HydrophobicContact CD1-CG 4.27Å; L100-D105 HydrophobicContact CD2-CB 4.14Å; L100-D105 HydrophobicContact CG-CB 4.12Å; L100-L106 HydrophobicContact CD1-CD1 4.11Å; L100-L106 HydrophobicContact CD2-CB 4.1Å; L100-L120 HydrophobicContact CD1-CD2 4.32Å
101	L	81.9	Confident	83.6	Confident	141 Å²	141	79.7 Å²	79.7	74%	0.738	42%	0.415	S	S	*	.			trans	-117.5	-13.8	-168.3	-58.4	177.7	0	0	0	113.4	D105	L101-D105 WeakPolarHBondContact CA-OD2 3.16Å; L101-D105 PolarHBondContact N-OD2 3.06Å
102	S	87.9	Confident	83.7	Confident	44 Å²	44	71.2 Å²	71.2	31%	0.308	39%	0.393	S	S	.	.	S	Bend	trans	-149.1	165.3	-176.1	66.6	0	0	0	0	112.6	W104 D105 L106	S102-W104 PolarHBondContact O-N 3.47Å; S102-W104 PolarHBondContact OG-N 2.9Å; S102-D105 PolarHBondContact N-OD2 3.28Å; S102-D105 WeakPolarHBondContact O-CB 3.35Å; S102-D105 PolarHBondContact O-N 3.15Å; S102-D105 VanDerWaalsContact O-N 3.09Å; S102-D105 PolarHBondContact OG-N 3.35Å; S102-D105 PolarHBondContact OG-OD2 3.28Å; S102-L106 PolarHBondContact O-N 2.89Å
103	D	83	Confident	83.8	Confident	80 Å²	80	64.5 Å²	64.5	43%	0.428	36%	0.359	S	S	.	.	H	α-helix	trans	-62.1	-23	171.1	-63.3	-63.7	0	0	0	113.2	S62 L63 L106 S107	S62-D103 VanDerWaalsContact CA-OD1 3.31Å; S62-D103 WeakPolarHBondContact CA-OD1 3.45Å; S62-D103 VanDerWaalsContact CB-OD1 3.32Å; S62-D103 WeakPolarHBondContact CB-OD1 3.49Å; L63-D103 PolarHBondContact N-OD1 3.1Å; D103-L106 PolarHBondContact O-N 3.42Å; D103-S107 WeakPolarHBondContact O-CB 3.35Å; D103-S107 PolarHBondContact O-N 2.97Å; D103-S107 PolarHBondContact O-OG 3.19Å
104	W	85.6	Confident	83.2	Confident	198 Å²	198	65.8 Å²	65.8	75%	0.75	36%	0.36	S	S	*	.	H	α-helix	trans	-69.7	-40.8	172.2	-179.2	-92.6	0	0	0	111.6	S102 L106 S107 T108	S102-W104 PolarHBondContact O-N 3.47Å; S102-W104 PolarHBondContact OG-N 2.9Å; W104-L106 VanDerWaalsContact C-N 3.34Å; W104-S107 PolarHBondContact O-N 2.84Å; W104-T108 WeakPolarHBondContact O-CB 3.45Å; W104-T108 PolarHBondContact O-N 2.66Å; W104-T108 PolarHBondContact O-OG1 3.38Å
105	D	86.8	Confident	82.3	Confident	38 Å²	38	66 Å²	66	20%	0.203	36%	0.359	C	S	.	.	H	α-helix	trans	-66.6	-38.5	173.6	-53	-53.2	0	0	0	110.9	Y86 L100 L101 S102 T108 A109	Y86-D105 HydrophobicContact CE1-CB 4.48Å; L100-D105 HydrophobicContact CD2-CB 4.14Å; L100-D105 HydrophobicContact CG-CB 4.12Å; L101-D105 WeakPolarHBondContact CA-OD2 3.16Å; L101-D105 PolarHBondContact N-OD2 3.06Å; S102-D105 PolarHBondContact N-OD2 3.28Å; S102-D105 WeakPolarHBondContact O-CB 3.35Å; S102-D105 PolarHBondContact O-N 3.15Å; S102-D105 VanDerWaalsContact O-N 3.09Å; S102-D105 PolarHBondContact OG-N 3.35Å; S102-D105 PolarHBondContact OG-OD2 3.28Å; D105-T108 PolarHBondContact O-N 2.87Å; D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.23Å; D105-A109 PolarHBondContact O-N 3.13Å
106	L	89	Confident	81.3	Confident	2 Å²	2	65.3 Å²	65.3	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-63.6	-45.7	174.6	-176.7	52.9	0	0	0	112.2	T61 S62 L63 L66 L100 S102 D103 W104 T108 A109 F110	T61-L106 VanDerWaalsContact O-CD2 3.23Å; T61-L106 WeakPolarHBondContact O-CD2 3.3Å; S62-L106 VanDerWaalsContact C-CD2 3.46Å; L63-L106 HydrophobicContact CB-CD2 4.39Å; L66-L106 HydrophobicContact CD2-CD1 3.68Å; L66-L106 HydrophobicContact CD2-CD2 4.35Å; L100-L106 HydrophobicContact CD1-CD1 4.11Å; L100-L106 HydrophobicContact CD2-CB 4.1Å; S102-L106 PolarHBondContact O-N 2.89Å; D103-L106 PolarHBondContact O-N 3.42Å; W104-L106 VanDerWaalsContact C-N 3.34Å; L106-T108 VanDerWaalsContact C-N 3.3Å; L106-T108 PolarHBondContact O-N 2.96Å; L106-A109 WeakPolarHBondContact O-CB 3.31Å; L106-A109 PolarHBondContact O-N 3.27Å; L106-F110 HydrophobicContact CD1-CD2 4.16Å; L106-F110 HydrophobicContact CD1-CE1 4.19Å; L106-F110 HydrophobicContact CD1-CE2 3.65Å; L106-F110 HydrophobicContact CD1-CZ 3.66Å; L106-F110 HydrophobicContact CD2-CE2 4.15Å; L106-F110 HydrophobicContact CG-CD2 4.06Å; L106-F110 HydrophobicContact CG-CE2 3.58Å; L106-F110 HydrophobicContact CG-CZ 4.09Å; L106-F110 WeakPolarHBondContact O-CD2 3.34Å; L106-F110 PolarHBondContact O-N 3.32Å
107	S	84.4	Confident	81	Confident	70 Å²	70	66.7 Å²	66.7	49%	0.49	36%	0.364	S	S	.	.	H	α-helix	trans	-59.9	-42.6	174.9	-58.3	0	0	0	0	111.2	D103 W104 F110 A111	D103-S107 WeakPolarHBondContact O-CB 3.35Å; D103-S107 PolarHBondContact O-N 2.97Å; D103-S107 PolarHBondContact O-OG 3.19Å; W104-S107 PolarHBondContact O-N 2.84Å; S107-F110 PolarHBondContact O-N 2.94Å; S107-A111 WeakPolarHBondContact O-CB 3.24Å; S107-A111 PolarHBondContact O-N 3.43Å
108	T	85.8	Confident	81	Confident	44 Å²	44	63.3 Å²	63.3	27%	0.27	35%	0.351	S	S	.	.	H	α-helix	trans	-64.4	-41.8	175.1	-56.7	0	0	0	0	111.4	W104 D105 L106 A111 T112	W104-T108 WeakPolarHBondContact O-CB 3.45Å; W104-T108 PolarHBondContact O-N 2.66Å; W104-T108 PolarHBondContact O-OG1 3.38Å; D105-T108 PolarHBondContact O-N 2.87Å; L106-T108 VanDerWaalsContact C-N 3.3Å; L106-T108 PolarHBondContact O-N 2.96Å; T108-A111 PolarHBondContact O-N 3Å; T108-T112 HydrophobicContact CG2-CG2 4.22Å; T108-T112 WeakPolarHBondContact O-CB 3.49Å; T108-T112 WeakPolarHBondContact O-CG2 3.23Å; T108-T112 PolarHBondContact O-N 2.96Å; T108-T112 PolarHBondContact O-OG1 3.38Å
109	A	88.7	Confident	81.1	Confident	0 Å²	0	63 Å²	63	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-63.3	-42.3	176.4	0	0	0	0	0	111.9	Y86 D105 L106 A113 L118	Y86-A109 HydrophobicContact CD1-CB 3.79Å; Y86-A109 HydrophobicContact CD2-CB 3.53Å; Y86-A109 HydrophobicContact CE1-CB 4.09Å; Y86-A109 HydrophobicContact CE2-CB 3.84Å; Y86-A109 HydrophobicContact CG-CB 3.49Å; Y86-A109 VanDerWaalsContact CG-CB 3.49Å; D105-A109 VanDerWaalsContact O-CB 3.29Å; D105-A109 WeakPolarHBondContact O-CB 3.23Å; D105-A109 PolarHBondContact O-N 3.13Å; L106-A109 WeakPolarHBondContact O-CB 3.31Å; L106-A109 PolarHBondContact O-N 3.27Å; A109-A113 WeakPolarHBondContact O-CB 3.43Å; A109-A113 PolarHBondContact O-N 2.97Å; A109-A113 VanDerWaalsContact O-N 3.09Å; A109-L118 HydrophobicContact CB-CD1 4.09Å; A109-L118 HydrophobicContact CB-CD2 4.42Å
110	F	87	Confident	81.3	Confident	14 Å²	14	59.5 Å²	59.5	6%	0.061	32%	0.323	C	S	.	.	H	α-helix	trans	-62.1	-51.1	172.2	-70.8	-43.1	0	0	0	111.5	R33 V36 V56 P58 T61 L106 S107 T112 A113 L118	R33-F110 PolarHBondContact NH1-O 3.41Å; V36-F110 HydrophobicContact CB-CD1 4.26Å; V36-F110 HydrophobicContact CB-CE1 4.4Å; V36-F110 HydrophobicContact CG1-CD1 4.05Å; V36-F110 HydrophobicContact CG1-CE1 4.31Å; V36-F110 HydrophobicContact CG2-CD1 4.31Å; V56-F110 HydrophobicContact CG2-CE1 3.5Å; V56-F110 VanDerWaalsContact CG2-CE1 3.5Å; V56-F110 HydrophobicContact CG2-CZ 3.64Å; P58-F110 HydrophobicContact CB-CD2 3.82Å; P58-F110 HydrophobicContact CB-CE2 4.06Å; P58-F110 HydrophobicContact CB-CG 4.15Å; P58-F110 HydrophobicContact CG-CD1 4.45Å; P58-F110 HydrophobicContact CG-CD2 4.45Å; P58-F110 HydrophobicContact CG-CG 4.34Å; T61-F110 HydrophobicContact CG2-CZ 4.41Å; L106-F110 HydrophobicContact CD1-CD2 4.16Å; L106-F110 HydrophobicContact CD1-CE1 4.19Å; L106-F110 HydrophobicContact CD1-CE2 3.65Å; L106-F110 HydrophobicContact CD1-CZ 3.66Å; L106-F110 HydrophobicContact CD2-CE2 4.15Å; L106-F110 HydrophobicContact CG-CD2 4.06Å; L106-F110 HydrophobicContact CG-CE2 3.58Å; L106-F110 HydrophobicContact CG-CZ 4.09Å; L106-F110 WeakPolarHBondContact O-CD2 3.34Å; L106-F110 PolarHBondContact O-N 3.32Å; S107-F110 PolarHBondContact O-N 2.94Å; F110-T112 PolarHBondContact O-N 3.35Å; F110-A113 PolarHBondContact O-N 3.38Å; F110-L118 HydrophobicContact CD1-CD2 3.8Å; F110-L118 HydrophobicContact CE1-CD2 3.87Å
111	A	81.1	Confident	81.5	Confident	65 Å²	65	63.3 Å²	63.3	54%	0.537	34%	0.337	S	S	.	.	H	α-helix	trans	-57.3	-48.4	-179.3	0	0	0	0	0	112.3	R33 S107 T108 A113	R33-A111 PolarHBondContact NH2-O 3.32Å; R33-A111 VanDerWaalsContact NH2-O 3.1Å; S107-A111 WeakPolarHBondContact O-CB 3.24Å; S107-A111 PolarHBondContact O-N 3.43Å; T108-A111 PolarHBondContact O-N 3Å; A111-A113 PolarHBondContact O-N 3.41Å
112	T	76.6	Confident	81.9	Confident	81 Å²	81	56.6 Å²	56.6	50%	0.497	30%	0.302	S	S	.	.	H	α-helix	trans	-79	-10.6	-175.9	58	0	0	0	0	115.1	T108 F110 S114	T108-T112 HydrophobicContact CG2-CG2 4.22Å; T108-T112 WeakPolarHBondContact O-CB 3.49Å; T108-T112 WeakPolarHBondContact O-CG2 3.23Å; T108-T112 PolarHBondContact O-N 2.96Å; T108-T112 PolarHBondContact O-OG1 3.38Å; F110-T112 PolarHBondContact O-N 3.35Å; T112-S114 PolarHBondContact O-N 2.93Å
113	A	74.9	Confident	81.8	Confident	13 Å²	13	56.6 Å²	56.6	11%	0.107	30%	0.299	C	S	.	.			trans	-63.3	98	176.1	0	0	0	0	0	112	A109 F110 A111 K115 L118	A109-A113 WeakPolarHBondContact O-CB 3.43Å; A109-A113 PolarHBondContact O-N 2.97Å; A109-A113 VanDerWaalsContact O-N 3.09Å; F110-A113 PolarHBondContact O-N 3.38Å; A111-A113 PolarHBondContact O-N 3.41Å; A113-K115 PolarHBondContact O-N 2.86Å; A113-L118 HydrophobicContact CB-CB 3.9Å; A113-L118 HydrophobicContact CB-CD1 4.19Å
114	S	59.6	Low	81.8	Confident	76 Å²	76	53.3 Å²	53.3	53%	0.531	28%	0.281	S	S	.	.			trans	-63.1	119.1	169.9	55.3	0	0	0	0	110	T112	T112-S114 PolarHBondContact O-N 2.93Å
115	K	57.3	Low	80.8	Confident	142 Å²	142	53.2 Å²	53.2	62%	0.617	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.5	138.6	179.8	-65.7	178.2	-177.2	175.7	0	110.7	E31 A113	E31-K115 IonicContact OE1-NZ 3.82Å; E31-K115 PolarHBondContact OE1-NZ 2.76Å; E31-K115 WeakPolarHBondContact OE2-CE 3.46Å; E31-K115 IonicContact OE2-NZ 2.76Å; E31-K115 PolarHBondContact OE2-NZ 2.65Å; A113-K115 PolarHBondContact O-N 2.86Å
116	P	62.3	Low	79.3	Confident	94 Å²	94	55.3 Å²	55.3	61%	0.61	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	cis	-109.1	6.5	26.5	38	-32.5	0	0	0	116.8
117	Y	78.1	Confident	77.1	Confident	81 Å²	81	60.7 Å²	60.7	32%	0.318	33%	0.334	S	S	.	.			trans	-154.3	148.6	175.5	52.9	-100.1	0	0	0	113.7	R37 R39 Q119	R37-Y117 CarbonylContact O-C 3.43Å; R37-Y117 VanDerWaalsContact O-CA 3.26Å; R37-Y117 WeakPolarHBondContact O-CA 3.44Å; R37-Y117 WeakPolarHBondContact O-CB 3.44Å; R39-Y117 HydrophobicContact CB-CD2 4.07Å; R39-Y117 HydrophobicContact CB-CG 4.44Å; R39-Y117 HydrophobicContact CG-CD1 4.27Å; R39-Y117 HydrophobicContact CG-CD2 3.94Å; R39-Y117 HydrophobicContact CG-CE2 4.43Å; R39-Y117 HydrophobicContact CG-CG 3.86Å; R39-Y117 PolarHBondContact NH1-OH 2.91Å; Y117-Q119 HydrophobicContact CD2-CB 4.22Å; Y117-Q119 HydrophobicContact CE2-CB 4.21Å
118	L	88.1	Confident	74.8	Confident	3 Å²	3	66.1 Å²	66.1	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	130.8	160.3	171.2	58.1	0	0	0	108.9	V36 R37 V38 R39 A109 F110 A113 L120	V36-L118 HydrophobicContact CG1-CB 4.02Å; R37-L118 PolarHBondContact O-N 2.89Å; V38-L118 CarbonylContact C-O 3.57Å; V38-L118 WeakPolarHBondContact CA-O 3.38Å; V38-L118 HydrophobicContact CG2-CD2 4.47Å; R39-L118 PolarHBondContact N-O 2.86Å; A109-L118 HydrophobicContact CB-CD1 4.09Å; A109-L118 HydrophobicContact CB-CD2 4.42Å; F110-L118 HydrophobicContact CD1-CD2 3.8Å; F110-L118 HydrophobicContact CE1-CD2 3.87Å; A113-L118 HydrophobicContact CB-CB 3.9Å; A113-L118 HydrophobicContact CB-CD1 4.19Å; L118-L120 HydrophobicContact CD1-CD2 4.14Å; L118-L120 HydrophobicContact CD2-CD2 4.12Å; L118-L120 HydrophobicContact CG-CD2 4.01Å; L118-L120 HydrophobicContact CG-CG 4.31Å
119	Q	89.1	Confident	72	Confident	56 Å²	56	72.1 Å²	72.1	26%	0.262	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	118.2	176.7	-174.1	163.5	-63	0	0	111	R39 Y86 L87 Y97 Y117	R39-Q119 CarbonylContact O-C 3.53Å; R39-Q119 WeakPolarHBondContact O-CA 3.32Å; Y86-Q119 WeakPolarHBondContact CA-O 3.43Å; L87-Q119 HydrophobicContact CB-CB 4.07Å; L87-Q119 HydrophobicContact CB-CG 4.5Å; L87-Q119 HydrophobicContact CD2-CB 4.4Å; L87-Q119 PolarHBondContact N-O 2.88Å; Y97-Q119 PolarHBondContact OH-NE2 2.91Å; Y117-Q119 HydrophobicContact CD2-CB 4.22Å; Y117-Q119 HydrophobicContact CE2-CB 4.21Å
120	L	92.4	Very high	69.1	Low	0 Å²	0	77.5 Å²	77.5	0%	0	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	155.9	175.7	-57.1	-177.9	0	0	0	111.6	V38 R39 V40 K41 L66 S85 L100 L118	V38-L120 HydrophobicContact CG1-CD1 3.63Å; V38-L120 HydrophobicContact CG1-CG 3.84Å; R39-L120 PolarHBondContact O-N 2.89Å; V40-L120 WeakPolarHBondContact CA-O 3.3Å; V40-L120 HydrophobicContact CB-CB 4.5Å; V40-L120 HydrophobicContact CG1-CB 4.16Å; V40-L120 HydrophobicContact CG2-CB 4.17Å; V40-L120 HydrophobicContact CG2-CD1 4.34Å; K41-L120 PolarHBondContact N-O 2.96Å; L66-L120 HydrophobicContact CD1-CD1 4.2Å; L66-L120 HydrophobicContact CD2-CD1 4.01Å; S85-L120 CarbonylContact O-C 3.54Å; S85-L120 WeakPolarHBondContact O-CA 3.41Å; L100-L120 HydrophobicContact CD1-CD2 4.32Å; L118-L120 HydrophobicContact CD1-CD2 4.14Å; L118-L120 HydrophobicContact CD2-CD2 4.12Å; L118-L120 HydrophobicContact CG-CD2 4.01Å; L118-L120 HydrophobicContact CG-CG 4.31Å
121	R	91	Very high	66.7	Low	87 Å²	87	82.2 Å²	82.2	33%	0.328	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	137.6	168.8	176.5	176.8	171.4	171.9	-4.4	108.7	K41 I84 S85 Y97 D123	K41-R121 CarbonylContact O-C 3.53Å; K41-R121 VanDerWaalsContact O-CA 3.32Å; K41-R121 WeakPolarHBondContact O-CA 3.21Å; I84-R121 WeakPolarHBondContact CA-O 3.43Å; S85-R121 PolarHBondContact N-O 3.45Å; S85-R121 PolarHBondContact O-N 3.2Å; Y97-R121 HydrophobicContact CD1-CB 3.71Å; Y97-R121 HydrophobicContact CE1-CB 3.49Å; Y97-R121 VanDerWaalsContact CE1-CB 3.49Å; R121-D123 WeakPolarHBondContact CD-OD2 3.48Å; R121-D123 WeakPolarHBondContact CG-OD2 3.44Å; R121-D123 IonicContact CZ-OD1 3.65Å; R121-D123 VanDerWaalsContact CZ-OD1 3.23Å; R121-D123 IonicContact CZ-OD2 3.76Å; R121-D123 IonicContact NE-OD1 2.78Å; R121-D123 PolarHBondContact NE-OD1 3.37Å; R121-D123 IonicContact NE-OD2 2.69Å; R121-D123 PolarHBondContact NE-OD2 3.09Å; R121-D123 IonicContact NH2-OD1 3.16Å; R121-D123 PolarHBondContact NH2-OD1 3.04Å; R121-D123 IonicContact NH2-OD2 3.84Å
122	V	91.3	Very high	64	Low	0 Å²	0	86 Å²	86	0%	0	46%	0.462	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	120.4	172.8	167.8	0	0	0	0	107.8	V40 K41 K42 C43 L70 F82 G83 I124	V40-V122 HydrophobicContact CG1-CB 4.49Å; V40-V122 HydrophobicContact CG1-CG2 3.79Å; K41-V122 PolarHBondContact O-N 2.84Å; K42-V122 CarbonylContact C-O 3.59Å; K42-V122 WeakPolarHBondContact CA-O 3.31Å; C43-V122 PolarHBondContact N-O 2.99Å; L70-V122 HydrophobicContact CD1-CG2 4Å; L70-V122 HydrophobicContact CD2-CG2 4.07Å; F82-V122 HydrophobicContact CB-CG1 4.21Å; F82-V122 HydrophobicContact CD2-CG1 3.67Å; F82-V122 HydrophobicContact CD2-CG2 4.45Å; F82-V122 HydrophobicContact CE2-CG1 4.31Å; F82-V122 HydrophobicContact CG-CG1 4.12Å; G83-V122 CarbonylContact O-C 3.59Å; G83-V122 VanDerWaalsContact O-CA 3.31Å; G83-V122 WeakPolarHBondContact O-CA 3.22Å; V122-I124 HydrophobicContact CG1-CG1 4.38Å
123	D	86.3	Confident	61.6	Low	45 Å²	45	88.8 Å²	88.8	24%	0.241	47%	0.473	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	111.3	178	-71.8	-69.8	0	0	0	110.1	C43 F82 G83 R121	C43-D123 VanDerWaalsContact CB-OD1 3.29Å; C43-D123 WeakPolarHBondContact CB-OD1 3.28Å; F82-D123 WeakPolarHBondContact CA-O 3.5Å; G83-D123 PolarHBondContact N-O 2.75Å; G83-D123 PolarHBondContact O-N 2.71Å; R121-D123 WeakPolarHBondContact CD-OD2 3.48Å; R121-D123 WeakPolarHBondContact CG-OD2 3.44Å; R121-D123 IonicContact CZ-OD1 3.65Å; R121-D123 VanDerWaalsContact CZ-OD1 3.23Å; R121-D123 IonicContact CZ-OD2 3.76Å; R121-D123 IonicContact NE-OD1 2.78Å; R121-D123 PolarHBondContact NE-OD1 3.37Å; R121-D123 IonicContact NE-OD2 2.69Å; R121-D123 PolarHBondContact NE-OD2 3.09Å; R121-D123 IonicContact NH2-OD1 3.16Å; R121-D123 PolarHBondContact NH2-OD1 3.04Å; R121-D123 IonicContact NH2-OD2 3.84Å
124	I	82.3	Confident	59.4	Low	11 Å²	11	96.1 Å²	96.1	6%	0.056	51%	0.505	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	119.1	177.3	-59.2	175.8	0	0	0	108.2	K42 C43 E44 L76 F82 V122	K42-I124 HydrophobicContact CD-CD1 3.98Å; K42-I124 HydrophobicContact CG-CD1 3.99Å; C43-I124 PolarHBondContact O-N 3.21Å; E44-I124 HydrophobicContact CB-CB 4.28Å; E44-I124 HydrophobicContact CB-CD1 4.33Å; E44-I124 HydrophobicContact CG-CB 4.14Å; E44-I124 HydrophobicContact CG-CD1 4.4Å; E44-I124 HydrophobicContact CG-CG2 4.26Å; L76-I124 HydrophobicContact CD2-CD1 3.65Å; F82-I124 HydrophobicContact CB-CG1 4.47Å; V122-I124 HydrophobicContact CG1-CG1 4.38Å
125	R	64.6	Low	57.8	Low	196 Å²	196	99.2 Å²	99.2	74%	0.74	52%	0.516	S	S	*	.	P	Polyproline II helix	trans	-77.1	132	171.8	-63.3	-174.9	-177.2	-175.8	1.7	109.2
126	P	54.8	Low	56.5	Low	81 Å²	81	103.8 Å²	103.8	53%	0.526	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-63.1	144	165.1	28.8	-33.3	0	0	0	109.1	E128	P126-E128 PolarHBondContact O-N 2.74Å
127	S	43.4	Very low	54.8	Low	116 Å²	116	105.8 Å²	105.8	81%	0.811	54%	0.535	S	S	*	.			trans	-79.6	104.1	170.9	48.8	0	0	0	0	108.9	D129	S127-D129 PolarHBondContact O-N 3.4Å
128	E	35.7	Very low	52.3	Low	184 Å²	184	108.8 Å²	108.8	86%	0.86	56%	0.555	S	S	*	*			trans	-71.9	92.6	170.6	-68.1	-176.8	149.6	0	0	109.9	P126	P126-E128 PolarHBondContact O-N 2.74Å
129	D	28.6	Very low	49.1	Very low	169 Å²	169	115.9 Å²	115.9	90%	0.904	59%	0.592	S	S	*	*			trans	-159	102.1	150.6	-105.8	-32.5	0	0	0	109.7	S127	S127-D129 PolarHBondContact O-N 3.4Å
130	S	26.8	Very low	46.3	Very low	114 Å²	114	118.4 Å²	118.4	80%	0.797	62%	0.616	S	S	*	*			trans	-162.6	135.5	175.3	-160.6	0	0	0	0	106.3
131	P	35.7	Very low	43.3	Very low	112 Å²	112	123.9 Å²	123.9	73%	0.727	65%	0.651	S	S	*	*				-141.7	-168.3	73.4	36.9	-15.7	0	0	0	111.7
132	L	25.1	Very low	40.2	Very low	144 Å²	144	128.5 Å²	128.5	75%	0.754	67%	0.673	S	S	*	*			cis	-143.7	160.5	13.1	-93.1	175.4	0	0	0	110
133	L	26.2	Very low	37.2	Very low	140 Å²	140	135.8 Å²	135.8	73%	0.733	71%	0.712	S	S	*	*			trans	69.2	140.1	158	-64.3	149	0	0	0	116.6
134	E	28.1	Very low	34.3	Very low	167 Å²	167	140.8 Å²	140.8	78%	0.78	74%	0.744	S	S	*	*			cis	-145.8	154.9	2.5	-154.9	155.7	-136.3	0	0	111.1
135	D	26.9	Very low	31.7	Very low	142 Å²	142	148.4 Å²	148.4	76%	0.759	78%	0.783	S	S	*	*			trans	-82.5	174.9	-172.5	-65.6	-67.9	0	0	0	114.9
136	W	29.5	Very low	29.7	Very low	238 Å²	238	142 Å²	142	90%	0.902	78%	0.779	S	S	*	*			trans	137.1	60.1	145.5	-69.4	110.2	0	0	0	116.7
137	D	26.3	Very low	28.3	Very low	136 Å²	136	143.5 Å²	143.5	73%	0.727	79%	0.791	S	S	*	*				26.5	147.7	124.5	-125.8	-10.4	0	0	0	123.7
138	I	25.8	Very low	27.3	Very low	143 Å²	143	144.3 Å²	144.3	73%	0.733	79%	0.786	S	S	*	*			trans	70.8	128.8	156.7	-64.5	156.5	0	0	0	115.9
139	I	21.8	Very low	26.9	Very low	153 Å²	153	141.2 Å²	141.2	79%	0.785	78%	0.779	S	S	*	*			cis	-130.8	149.2	32.4	-58.3	169.7	0	0	0	112.6
140	S	29.6	Very low	26.7	Very low	109 Å²	109	140.5 Å²	140.5	76%	0.762	78%	0.775	S	S	*	*			trans	-119.7	141	156.1	-177.2	0	0	0	0	108.6
141	P	28.9	Very low	26.8	Very low	114 Å²	114	142.6 Å²	142.6	74%	0.74	78%	0.776	S	S	*	*				-148.1	162	101.6	39.7	-24.5	0	0	0	115.6
142	K	27.1	Very low	26.2	Very low	185 Å²	185	141.1 Å²	141.1	80%	0.804	77%	0.773	S	S	*	*			trans	-79.4	141.2	150.3	-67.1	177.3	177.9	177.8	0	108.7
143	D	28.4	Very low	26.2	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	78%	0.776	S	S	*	*				166.5	101.3	128.4	-85.8	-9.5	0	0	0	112.1
144	V	25.3	Very low	26.2	Very low	150 Å²	150	145.9 Å²	145.9	91%	0.909	79%	0.785	S	S	*	*			trans	-141.5	142.9	145.9	-177.8	0	0	0	0	107.8
145	I	26.3	Very low	26.1	Very low	170 Å²	170	148.7 Å²	148.7	87%	0.872	79%	0.788	S	S	*	*			trans	-102.6	145.3	-172.1	-64.7	157.6	0	0	0	110.7
146	G	23	Very low	26.1	Very low	63 Å²	63	146.7 Å²	146.7	65%	0.649	79%	0.785	S	S	*	*			trans	127.8	141.2	147.4	0	0	0	0	0	117.6
147	S	25.3	Very low	25.8	Very low	111 Å²	111	139.8 Å²	139.8	78%	0.776	77%	0.774	S	S	*	*			trans	30.7	146.4	139.6	-70.9	0	0	0	0	121.7
148	D	24.1	Very low	25.8	Very low	134 Å²	134	141.4 Å²	141.4	72%	0.717	78%	0.781	S	S	*	*			cis	-145.7	153	10.4	-103.8	-31.1	0	0	0	109
149	V	26.2	Very low	25.7	Very low	118 Å²	118	139.7 Å²	139.7	72%	0.715	78%	0.778	S	S	*	*				54	141.8	87.2	-173.7	0	0	0	0	114.3
150	L	25.1	Very low	25.9	Very low	154 Å²	154	139 Å²	139	81%	0.806	78%	0.78	S	S	*	*			trans	82.8	135.3	-170	-50.9	-178.1	0	0	0	113.7
151	L	27.5	Very low	25.6	Very low	159 Å²	159	138.6 Å²	138.6	83%	0.832	78%	0.784	S	S	*	*			cis	-140	154.6	1.8	-121.9	167.3	0	0	0	110.9
152	A	24.5	Very low	25.3	Very low	80 Å²	80	137.9 Å²	137.9	66%	0.661	79%	0.788	S	S	*	*			trans	-94	-176.3	174.2	0	0	0	0	0	111.6
153	E	24.2	Very low	25.4	Very low	175 Å²	175	136.9 Å²	136.9	82%	0.818	79%	0.79	S	S	*	*			trans	71.7	97.4	165.3	-51.8	-157.7	116.1	0	0	118.4
154	K	25.6	Very low	25.4	Very low	210 Å²	210	135.7 Å²	135.7	91%	0.913	79%	0.791	S	S	*	*				-143.9	105.4	104.9	-117.4	177	178.7	175.3	0	113.3
155	R	27	Very low	25.4	Very low	225 Å²	225	137.4 Å²	137.4	85%	0.849	79%	0.786	S	S	*	*			trans	-68.7	166.7	143.7	-64	177.7	166.5	126.7	-7.7	106.9
156	S	26.3	Very low	25.5	Very low	100 Å²	100	134.6 Å²	134.6	70%	0.699	78%	0.777	S	S	*	*			cis	-163.6	141.7	30.4	53.1	0	0	0	0	112.3
157	S	24	Very low	25.6	Very low	94 Å²	94	140.1 Å²	140.1	66%	0.657	79%	0.786	S	S	*	*			trans	16.3	146.1	138.9	62.9	0	0	0	0	121.6
158	L	25.8	Very low	25.7	Very low	169 Å²	169	139.1 Å²	139.1	89%	0.885	78%	0.779	S	S	*	*				-143.3	168.6	116.2	-109	171.2	0	0	0	110.4
159	T	24.1	Very low	26.2	Very low	108 Å²	108	140.9 Å²	140.9	66%	0.663	79%	0.787	S	S	*	*			trans	-137.8	161.5	-156.1	52.9	0	0	0	0	114.1
160	T	24.8	Very low	26.3	Very low	137 Å²	137	142.6 Å²	142.6	84%	0.84	79%	0.791	S	S	*	*			trans	78.7	113	153.9	-47.7	0	0	0	0	118.7
161	A	23.4	Very low	26.7	Very low	102 Å²	102	139.6 Å²	139.6	84%	0.843	78%	0.779	S	S	*	*			trans	-152.5	157.7	140	0	0	0	0	0	108.9
162	A	23.4	Very low	27.1	Very low	98 Å²	98	139.4 Å²	139.4	81%	0.81	77%	0.774	S	S	*	*			trans	-102	166.8	-176	0	0	0	0	0	113.1
163	L	29.2	Very low	27.7	Very low	164 Å²	164	139.2 Å²	139.2	86%	0.859	76%	0.764	S	S	*	*			trans	-62.4	154.9	172.5	-61.3	171.4	0	0	0	111.5
164	P	28	Very low	27.9	Very low	128 Å²	128	132.6 Å²	132.6	83%	0.831	74%	0.743	S	S	*	*				-129.9	167.9	94.7	38.4	-32	0	0	0	114.5
165	F	25.8	Very low	28.3	Very low	187 Å²	187	131.1 Å²	131.1	82%	0.82	73%	0.732	S	S	*	*			trans	-96.2	125.5	-175.9	169	-93.5	0	0	0	111.9
166	T	27.4	Very low	28.8	Very low	110 Å²	110	122.2 Å²	122.2	68%	0.675	70%	0.703	S	S	*	*			trans	171.2	157.8	137.3	29.8	0	0	0	0	111.3
167	Q	26.3	Very low	29.4	Very low	180 Å²	180	119.5 Å²	119.5	84%	0.841	68%	0.68	S	S	*	*			trans	60.9	95.6	171	-50.8	-57.2	-2.1	0	0	119
168	S	26.8	Very low	30	Very low	90 Å²	90	118.2 Å²	118.2	63%	0.629	67%	0.671	S	S	*	*				176.1	101.1	113.6	-174	0	0	0	0	111	L170	S168-L170 PolarHBondContact O-N 2.67Å
169	I	35.2	Very low	30.4	Very low	171 Å²	171	116 Å²	116	88%	0.877	65%	0.654	S	S	*	*			trans	-91.9	92	171.6	-59.6	172	0	0	0	108
170	L	28.2	Very low	31.3	Very low	153 Å²	153	113.4 Å²	113.4	80%	0.801	64%	0.638	S	S	*	*	S	Bend	trans	-166.4	-32.8	159	-137.8	70.4	0	0	0	114.6	S168 Q172	S168-L170 PolarHBondContact O-N 2.67Å; L170-Q172 VanDerWaalsContact C-N 3.32Å; L170-Q172 PolarHBondContact O-N 3.07Å
171	T	32.1	Very low	31.9	Very low	91 Å²	91	111.2 Å²	111.2	56%	0.558	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	6.1	-162.3	55	0	0	0	0	116.3
172	Q	36.1	Very low	32.6	Very low	155 Å²	155	112.7 Å²	112.7	72%	0.724	61%	0.608	S	S	*	*	H	α-helix	trans	-89.8	-24.5	-170.8	-154.8	159.2	-16.1	0	0	113.7	L170	L170-Q172 VanDerWaalsContact C-N 3.32Å; L170-Q172 PolarHBondContact O-N 3.07Å
173	V	37.2	Very low	33.4	Very low	76 Å²	76	111.9 Å²	111.9	46%	0.461	59%	0.592	S	S	.	*	H	α-helix	trans	-75.8	-39.5	-176.3	-175.9	0	0	0	0	112.7	R175 T176 L177	V173-R175 VanDerWaalsContact C-N 3.31Å; V173-R175 PolarHBondContact O-N 3.43Å; V173-T176 PolarHBondContact O-N 2.87Å; V173-T176 PolarHBondContact O-OG1 3.15Å; V173-L177 HydrophobicContact CG1-CD1 4.43Å; V173-L177 PolarHBondContact O-N 3.39Å; V173-L177 VanDerWaalsContact O-N 3.14Å
174	G	28.9	Very low	33.8	Very low	36 Å²	36	105 Å²	105	37%	0.371	56%	0.556	S	S	.	*	H	α-helix	trans	-60.4	-41.3	177.4	0	0	0	0	0	112.1	T176 L177 S178	G174-T176 PolarHBondContact O-N 3.36Å; G174-L177 PolarHBondContact O-N 3.09Å; G174-S178 PolarHBondContact O-N 2.82Å; G174-S178 PolarHBondContact O-OG 3.21Å
175	R	33.4	Very low	34	Very low	179 Å²	179	102.9 Å²	102.9	68%	0.675	55%	0.545	S	S	*	.	H	α-helix	trans	-70.2	-28.5	-177.7	-66.6	179.7	178.7	166.1	2.1	114	V173 K179	V173-R175 VanDerWaalsContact C-N 3.31Å; V173-R175 PolarHBondContact O-N 3.43Å; R175-K179 WeakPolarHBondContact O-CG 3.38Å; R175-K179 PolarHBondContact O-N 3.28Å
176	T	39.3	Very low	34	Very low	38 Å²	38	104.6 Å²	104.6	23%	0.233	55%	0.546	C	S	.	.	H	α-helix	trans	-78.4	-40.3	174.6	56.1	0	0	0	0	110.7	V173 G174 K179 V180 E218	V173-T176 PolarHBondContact O-N 2.87Å; V173-T176 PolarHBondContact O-OG1 3.15Å; G174-T176 PolarHBondContact O-N 3.36Å; T176-K179 PolarHBondContact O-N 2.97Å; T176-V180 WeakPolarHBondContact O-CG2 3.41Å; T176-V180 PolarHBondContact O-N 2.88Å; T176-E218 VanDerWaalsContact CG2-OE1 3.23Å; T176-E218 WeakPolarHBondContact CG2-OE1 3.23Å
177	L	37.5	Very low	34.2	Very low	44 Å²	44	103.6 Å²	103.6	23%	0.23	54%	0.543	C	S	.	.	H	α-helix	trans	-58.1	-51	169.4	-92.2	165.7	0	0	0	112	V173 G174 K179 V180 Q181 L671	V173-L177 HydrophobicContact CG1-CD1 4.43Å; V173-L177 PolarHBondContact O-N 3.39Å; V173-L177 VanDerWaalsContact O-N 3.14Å; G174-L177 PolarHBondContact O-N 3.09Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.45Å; L177-V180 PolarHBondContact O-N 2.76Å; L177-V180 VanDerWaalsContact O-N 3.12Å; L177-Q181 VanDerWaalsContact O-CB 3.28Å; L177-Q181 WeakPolarHBondContact O-CB 3.4Å; L177-Q181 PolarHBondContact O-N 3.2Å; L177-L671 HydrophobicContact CD2-CD2 4.13Å
178	S	36.8	Very low	34.7	Very low	66 Å²	66	101.2 Å²	101.2	46%	0.462	53%	0.527	S	S	.	.	H	α-helix	trans	-60	-37.5	178.4	-54	0	0	0	0	112.8	G174 Q182	G174-S178 PolarHBondContact O-N 2.82Å; G174-S178 PolarHBondContact O-OG 3.21Å; S178-Q182 WeakPolarHBondContact O-CB 3.48Å; S178-Q182 PolarHBondContact O-N 3.39Å
179	K	35.3	Very low	35	Very low	124 Å²	124	99.8 Å²	99.8	54%	0.539	53%	0.527	S	S	.	.	H	α-helix	trans	-66.9	-43.5	173.9	-79.3	176.8	179.4	-178.6	0	112.2	R175 T176 L177 Q182 V183	R175-K179 WeakPolarHBondContact O-CG 3.38Å; R175-K179 PolarHBondContact O-N 3.28Å; T176-K179 PolarHBondContact O-N 2.97Å; L177-K179 VanDerWaalsContact C-N 3.31Å; L177-K179 PolarHBondContact O-N 3.45Å; K179-Q182 PolarHBondContact O-N 2.89Å; K179-V183 WeakPolarHBondContact O-CB 3.38Å; K179-V183 VanDerWaalsContact O-CG2 3.32Å; K179-V183 WeakPolarHBondContact O-CG2 3.28Å; K179-V183 PolarHBondContact O-N 3.2Å
180	V	41.6	Very low	34.6	Very low	52 Å²	52	100.8 Å²	100.8	32%	0.315	53%	0.528	S	S	.	.	H	α-helix	trans	-63.3	-44.6	176.5	168.5	0	0	0	0	110.3	T176 L177 V183 L184	T176-V180 WeakPolarHBondContact O-CG2 3.41Å; T176-V180 PolarHBondContact O-N 2.88Å; L177-V180 PolarHBondContact O-N 2.76Å; L177-V180 VanDerWaalsContact O-N 3.12Å; V180-V183 PolarHBondContact O-N 3.4Å; V180-L184 HydrophobicContact CG1-CD1 3.74Å; V180-L184 HydrophobicContact CG1-CG 4.24Å; V180-L184 VanDerWaalsContact O-CB 3.31Å; V180-L184 WeakPolarHBondContact O-CB 3.47Å; V180-L184 WeakPolarHBondContact O-CG 3.29Å; V180-L184 PolarHBondContact O-N 2.69Å
181	Q	39	Very low	35	Very low	92 Å²	92	100.5 Å²	100.5	43%	0.43	53%	0.527	S	S	.	.	H	α-helix	trans	-59.8	-44.9	174.5	-169.4	-177.4	15	0	0	111.8	L177 V183 L184 S185	L177-Q181 VanDerWaalsContact O-CB 3.28Å; L177-Q181 WeakPolarHBondContact O-CB 3.4Å; L177-Q181 PolarHBondContact O-N 3.2Å; Q181-V183 PolarHBondContact O-N 3.03Å; Q181-L184 PolarHBondContact O-N 2.78Å; Q181-S185 WeakPolarHBondContact O-CB 3.45Å; Q181-S185 PolarHBondContact O-N 3.37Å
182	Q	37.3	Very low	35.3	Very low	133 Å²	133	102.7 Å²	102.7	62%	0.621	54%	0.54	S	S	*	.	H	α-helix	trans	-68.9	-31.7	178.4	-168.7	170.6	52	0	0	112.9	S178 K179	S178-Q182 WeakPolarHBondContact O-CB 3.48Å; S178-Q182 PolarHBondContact O-N 3.39Å; K179-Q182 PolarHBondContact O-N 2.89Å
183	V	39	Very low	35.2	Very low	80 Å²	80	103.8 Å²	103.8	49%	0.485	54%	0.543	S	S	.	.	H	α-helix	trans	-81.2	-32.5	174	174.5	0	0	0	0	112.2	K179 V180 Q181 S185 W186 L222	K179-V183 WeakPolarHBondContact O-CB 3.38Å; K179-V183 VanDerWaalsContact O-CG2 3.32Å; K179-V183 WeakPolarHBondContact O-CG2 3.28Å; K179-V183 PolarHBondContact O-N 3.2Å; V180-V183 PolarHBondContact O-N 3.4Å; Q181-V183 PolarHBondContact O-N 3.03Å; V183-S185 VanDerWaalsContact C-N 3.32Å; V183-W186 PolarHBondContact O-N 3.35Å; V183-L222 HydrophobicContact CB-CD2 4.4Å; V183-L222 HydrophobicContact CG1-CD2 3.81Å
184	L	37.6	Very low	35.6	Very low	20 Å²	20	105.9 Å²	105.9	11%	0.105	56%	0.557	C	S	.	*	H	α-helix	trans	-65.4	-36.8	170	-74.3	170.1	0	0	0	111.2	V180 Q181 W186 L671	V180-L184 HydrophobicContact CG1-CD1 3.74Å; V180-L184 HydrophobicContact CG1-CG 4.24Å; V180-L184 VanDerWaalsContact O-CB 3.31Å; V180-L184 WeakPolarHBondContact O-CB 3.47Å; V180-L184 WeakPolarHBondContact O-CG 3.29Å; V180-L184 PolarHBondContact O-N 2.69Å; Q181-L184 PolarHBondContact O-N 2.78Å; L184-W186 PolarHBondContact O-N 3.02Å; L184-L671 HydrophobicContact CD1-CD1 3.9Å
185	S	32.1	Very low	36.9	Very low	84 Å²	84	107.1 Å²	107.1	59%	0.587	55%	0.553	S	S	*	*	G	3₁₀ helix	trans	-60.7	-23.1	173.5	170.6	0	0	0	0	113.6	Q181 V183 S187	Q181-S185 WeakPolarHBondContact O-CB 3.45Å; Q181-S185 PolarHBondContact O-N 3.37Å; V183-S185 VanDerWaalsContact C-N 3.32Å; S185-S187 VanDerWaalsContact C-N 3.34Å; S185-S187 PolarHBondContact O-N 3.28Å
186	W	27.4	Very low	38.7	Very low	223 Å²	223	104 Å²	104	85%	0.845	54%	0.544	S	S	*	.	G	3₁₀ helix	trans	-80.2	1.1	-173.9	-88.7	39.9	0	0	0	115.9	V183 L184	V183-W186 PolarHBondContact O-N 3.35Å; L184-W186 PolarHBondContact O-N 3.02Å
187	S	31.3	Very low	40.9	Very low	88 Å²	88	106.5 Å²	106.5	62%	0.615	56%	0.561	S	S	*	*	G	3₁₀ helix	trans	-157.7	64.1	168.6	72.3	0	0	0	0	114.9	S185	S185-S187 VanDerWaalsContact C-N 3.34Å; S185-S187 PolarHBondContact O-N 3.28Å
188	Y	35.5	Very low	43.5	Very low	130 Å²	130	107 Å²	107	51%	0.51	57%	0.567	S	S	.	*	S	Bend	trans	-118.6	5.4	163.1	-92	-79.1	0	0	0	114.2	A668	Y188-A668 HydrophobicContact CE2-CB 3.88Å
189	G	33.2	Very low	46.3	Very low	60 Å²	60	103.8 Å²	103.8	62%	0.619	55%	0.545	S	S	*	.	S	Bend	trans	-116.1	151.3	156.8	0	0	0	0	0	109.5
190	E	28.7	Very low	49.1	Very low	193 Å²	193	99.9 Å²	99.9	90%	0.902	53%	0.533	S	S	*	.	S	Bend	trans	66.6	127.4	-173.4	-55.1	-168.4	159	0	0	116.1
191	D	34.9	Very low	51.5	Low	147 Å²	147	101.2 Å²	101.2	79%	0.786	54%	0.538	S	S	*	.			trans	6	113.6	175.6	-62.9	-38.8	0	0	0	119.4	K193	D191-K193 VanDerWaalsContact C-N 3.27Å; D191-K193 PolarHBondContact O-N 3.15Å
192	V	38.1	Very low	54.1	Low	136 Å²	136	100.4 Å²	100.4	82%	0.824	55%	0.547	S	S	*	.			trans	-64.5	83.8	171	-175.2	0	0	0	0	110.5
193	K	34.4	Very low	56.8	Low	179 Å²	179	96.9 Å²	96.9	78%	0.778	53%	0.531	S	S	*	.			trans	-55.1	143.3	169.5	-77.1	169	-179.3	160.6	0	109.4	D191	D191-K193 VanDerWaalsContact C-N 3.27Å; D191-K193 PolarHBondContact O-N 3.15Å
194	P	46.3	Very low	59.5	Low	119 Å²	119	93.4 Å²	93.4	77%	0.773	51%	0.509	S	S	*	.			trans	-53.8	160.2	179.9	-26.8	35.2	0	0	0	112.7	K196	P194-K196 PolarHBondContact O-N 3.01Å
195	F	55.3	Low	62.1	Low	62 Å²	62	97.5 Å²	97.5	27%	0.272	53%	0.528	S	S	.	.			trans	-33.6	125.3	174.8	-83.7	-108.5	0	0	0	111.4	L660	F195-L660 HydrophobicContact CE1-CB 4.22Å; F195-L660 HydrophobicContact CE1-CD1 3.9Å; F195-L660 HydrophobicContact CZ-CB 4Å; F195-L660 HydrophobicContact CZ-CD1 4.35Å
196	K	71.1	Confident	65.1	Low	114 Å²	114	97.3 Å²	97.3	50%	0.496	52%	0.523	S	S	.	.	P	Polyproline II helix	trans	-47.3	135.3	166	-70	-172.5	-180	178.1	0	107.4	P194 H226 G227	P194-K196 PolarHBondContact O-N 3.01Å; K196-H226 HydrophobicContact CB-CB 4.46Å; K196-H226 HydrophobicContact CD-CB 4.08Å; K196-H226 HydrophobicContact CG-CB 4.42Å; K196-G227 WeakPolarHBondContact O-CA 3.37Å
197	P	86.1	Confident	68.3	Low	91 Å²	91	87.6 Å²	87.6	59%	0.591	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-56.8	159.3	-178.6	23.5	-33.4	0	0	0	110.1	L199 R223	P197-L199 PolarHBondContact O-N 3.11Å; P197-R223 VanDerWaalsContact O-CZ 3.25Å; P197-R223 PolarHBondContact O-NH1 3.24Å; P197-R223 PolarHBondContact O-NH2 3.42Å
198	P	93	Very high	71.3	Confident	53 Å²	53	84.8 Å²	84.8	34%	0.344	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-49.9	143.4	169.8	-23.3	33.7	0	0	0	110.6	S200 R223 G228 E230	P198-S200 PolarHBondContact O-N 3.16Å; P198-R223 PolarHBondContact O-NH2 2.88Å; P198-G228 WeakPolarHBondContact CA-O 3.42Å; P198-E230 HydrophobicContact CB-CB 4.43Å
199	L	94.9	Very high	73.9	Confident	0 Å²	0	81.3 Å²	81.3	0%	0	46%	0.455	C	S	.	.	B	Isolated β-bridge	trans	-56.7	122.4	174	174.5	70.9	0	0	0	108.7	P197 E203 F204 Y207 L220 R223 I224 G228 E230 L233 V237	P197-L199 PolarHBondContact O-N 3.11Å; L199-E203 HydrophobicContact CD1-CB 3.91Å; L199-E203 HydrophobicContact CD1-CG 3.74Å; L199-F204 HydrophobicContact CD1-CB 4.39Å; L199-F204 HydrophobicContact CD2-CB 4.16Å; L199-F204 HydrophobicContact CD2-CD2 4.15Å; L199-F204 HydrophobicContact CG-CB 4.23Å; L199-Y207 HydrophobicContact CD1-CE2 4.23Å; L199-L220 HydrophobicContact CD2-CD1 3.5Å; L199-L220 VanDerWaalsContact CD2-CD1 3.5Å; L199-R223 HydrophobicContact CD1-CG 3.97Å; L199-I224 HydrophobicContact CD2-CD1 4.21Å; L199-I224 HydrophobicContact CD2-CG1 3.97Å; L199-G228 PolarHBondContact N-O 3.36Å; L199-E230 WeakPolarHBondContact O-CB 3.44Å; L199-E230 PolarHBondContact O-N 2.77Å; L199-L233 HydrophobicContact CD2-CD1 4.49Å; L199-L233 HydrophobicContact CG-CD1 4.23Å; L199-L233 WeakPolarHBondContact O-CD1 3.25Å; L199-V237 HydrophobicContact CD2-CG2 4.34Å
200	S	94.6	Very high	76.7	Confident	42 Å²	42	87 Å²	87	29%	0.294	47%	0.465	S	S	.	.	P	Polyproline II helix	trans	-95.9	162.6	-179.8	68.2	0	0	0	0	112	P198 A202 E203 F204 E230 L233	P198-S200 PolarHBondContact O-N 3.16Å; S200-A202 PolarHBondContact O-N 2.68Å; S200-E203 PolarHBondContact O-N 2.93Å; S200-E203 VanDerWaalsContact O-N 3.15Å; S200-F204 PolarHBondContact O-N 3.43Å; S200-E230 WeakPolarHBondContact CA-OE2 3.34Å; S200-L233 VanDerWaalsContact C-CD1 3.43Å
201	D	92.5	Very high	79.6	Confident	79 Å²	79	81.9 Å²	81.9	42%	0.422	44%	0.441	S	S	.	.	H	α-helix	trans	-55.7	-46.9	-179.5	-176.6	77.9	0	0	0	113.2	E203 F204 H205 L233	D201-E203 VanDerWaalsContact C-N 3.3Å; D201-E203 PolarHBondContact O-N 2.87Å; D201-F204 PolarHBondContact O-N 3.3Å; D201-H205 PolarHBondContact O-N 3.46Å; D201-H205 VanDerWaalsContact O-N 3.09Å; D201-H205 PolarHBondContact O-ND1 3.02Å; D201-H205 IonicContact OD1-CE1 3.14Å; D201-H205 PolarHBondContact OD1-CE1 3.06Å; D201-H205 IonicContact OD1-ND1 2.75Å; D201-H205 IonicContact OD2-CE1 2.66Å; D201-H205 PolarHBondContact OD2-CE1 2.89Å; D201-H205 IonicContact OD2-ND1 2.71Å; D201-H205 PolarHBondContact OD2-ND1 2.93Å; D201-L233 HydrophobicContact CB-CD2 4.35Å; D201-L233 HydrophobicContact CB-CG 4.39Å
202	A	92.3	Very high	82.2	Confident	76 Å²	76	75.6 Å²	75.6	63%	0.628	41%	0.411	S	S	*	.	H	α-helix	trans	-63.5	-34.3	178.6	0	0	0	0	0	112.9	S200	S200-A202 PolarHBondContact O-N 2.68Å
203	E	94.3	Very high	84.8	Confident	59 Å²	59	71.5 Å²	71.5	28%	0.276	38%	0.383	S	S	.	.	H	α-helix	trans	-75.5	-40.4	176.3	-172.4	178.8	-168	0	0	111.4	L199 S200 D201 H205 T206 Y207 R223	L199-E203 HydrophobicContact CD1-CB 3.91Å; L199-E203 HydrophobicContact CD1-CG 3.74Å; S200-E203 PolarHBondContact O-N 2.93Å; S200-E203 VanDerWaalsContact O-N 3.15Å; D201-E203 VanDerWaalsContact C-N 3.3Å; D201-E203 PolarHBondContact O-N 2.87Å; E203-H205 VanDerWaalsContact C-N 3.29Å; E203-H205 PolarHBondContact O-N 2.99Å; E203-T206 WeakPolarHBondContact O-CB 3.36Å; E203-T206 PolarHBondContact O-N 3.25Å; E203-T206 PolarHBondContact O-OG1 3.47Å; E203-Y207 HydrophobicContact CG-CE2 4.37Å; E203-Y207 WeakPolarHBondContact O-CD2 3.25Å; E203-R223 WeakPolarHBondContact OE1-CD 3.33Å; E203-R223 IonicContact OE1-CZ 2.68Å; E203-R223 IonicContact OE1-NE 3.03Å; E203-R223 PolarHBondContact OE1-NE 3.42Å; E203-R223 IonicContact OE1-NH2 3.25Å; E203-R223 IonicContact OE2-CZ 3.68Å; E203-R223 VanDerWaalsContact OE2-CZ 3.25Å; E203-R223 IonicContact OE2-NE 3.17Å; E203-R223 PolarHBondContact OE2-NE 3.09Å; E203-R223 VanDerWaalsContact OE2-NE 3.11Å; E203-R223 IonicContact OE2-NH2 3.98Å; E203-R223 PolarHBondContact OE2-NH2 3.38Å
204	F	95	Very high	87.5	Confident	7 Å²	7	64.6 Å²	64.6	3%	0.031	35%	0.354	C	S	.	.	H	α-helix	trans	-58.3	-40.7	176.3	174.4	-115	0	0	0	112.1	L199 S200 D201 T206 Y207 L208 L220 L233 V236 V237 Y240	L199-F204 HydrophobicContact CD1-CB 4.39Å; L199-F204 HydrophobicContact CD2-CB 4.16Å; L199-F204 HydrophobicContact CD2-CD2 4.15Å; L199-F204 HydrophobicContact CG-CB 4.23Å; S200-F204 PolarHBondContact O-N 3.43Å; D201-F204 PolarHBondContact O-N 3.3Å; F204-T206 PolarHBondContact O-N 2.78Å; F204-T206 VanDerWaalsContact O-N 3.15Å; F204-Y207 WeakPolarHBondContact O-CB 3.45Å; F204-Y207 PolarHBondContact O-N 3.26Å; F204-L208 HydrophobicContact CE1-CD1 4.02Å; F204-L208 HydrophobicContact CE2-CD2 4.47Å; F204-L208 HydrophobicContact CZ-CD1 4.32Å; F204-L208 HydrophobicContact CZ-CD2 4.1Å; F204-L208 HydrophobicContact CZ-CG 4.49Å; F204-L220 HydrophobicContact CD2-CD1 3.97Å; F204-L220 HydrophobicContact CD2-CD2 4.35Å; F204-L220 HydrophobicContact CE2-CD1 4.37Å; F204-L220 HydrophobicContact CE2-CD2 3.92Å; F204-L233 HydrophobicContact CB-CD1 3.72Å; F204-L233 HydrophobicContact CB-CD2 4.44Å; F204-L233 HydrophobicContact CD1-CD2 3.94Å; F204-L233 HydrophobicContact CG-CD1 4.28Å; F204-L233 HydrophobicContact CG-CD2 4.37Å; F204-V236 HydrophobicContact CE1-CG1 3.85Å; F204-V236 HydrophobicContact CZ-CG1 4.06Å; F204-V237 HydrophobicContact CD2-CG2 4.06Å; F204-V237 HydrophobicContact CE2-CG2 4.14Å; F204-V237 HydrophobicContact CG-CG2 4.34Å; F204-V237 HydrophobicContact CZ-CG2 4.49Å; F204-Y240 HydrophobicContact CE2-CE2 4.36Å; F204-Y240 HydrophobicContact CZ-CD2 4.47Å; F204-Y240 AromaticContact CZ-CE2 3.82Å; F204-Y240 HydrophobicContact CZ-CE2 3.82Å
205	H	93.6	Very high	89.7	Confident	105 Å²	105	62.1 Å²	62.1	49%	0.486	34%	0.339	S	S	.	.	H	α-helix	trans	-57.9	-26.7	175	-78.8	91.5	0	0	0	113.5	D201 E203 Y207 L208	D201-H205 PolarHBondContact O-N 3.46Å; D201-H205 VanDerWaalsContact O-N 3.09Å; D201-H205 PolarHBondContact O-ND1 3.02Å; D201-H205 IonicContact OD1-CE1 3.14Å; D201-H205 PolarHBondContact OD1-CE1 3.06Å; D201-H205 IonicContact OD1-ND1 2.75Å; D201-H205 IonicContact OD2-CE1 2.66Å; D201-H205 PolarHBondContact OD2-CE1 2.89Å; D201-H205 IonicContact OD2-ND1 2.71Å; D201-H205 PolarHBondContact OD2-ND1 2.93Å; E203-H205 VanDerWaalsContact C-N 3.29Å; E203-H205 PolarHBondContact O-N 2.99Å; H205-Y207 PolarHBondContact O-N 3.36Å; H205-L208 PolarHBondContact O-N 3.16Å; H205-L208 VanDerWaalsContact O-N 3.11Å
206	T	95.3	Very high	91.4	Very high	81 Å²	81	63.2 Å²	63.2	50%	0.497	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-16.2	176.6	75.4	0	0	0	0	114	E203 F204 L208 R216	E203-T206 WeakPolarHBondContact O-CB 3.36Å; E203-T206 PolarHBondContact O-N 3.25Å; E203-T206 PolarHBondContact O-OG1 3.47Å; F204-T206 PolarHBondContact O-N 2.78Å; F204-T206 VanDerWaalsContact O-N 3.15Å; T206-L208 VanDerWaalsContact C-N 3.35Å; T206-R216 PolarHBondContact O-NH2 3.41Å
207	Y	94	Very high	92.4	Very high	18 Å²	18	59.5 Å²	59.5	7%	0.071	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-11	174.2	-66.2	-87.9	0	0	0	112.1	L199 E203 F204 H205 S215 R216 E219 L220 R223	L199-Y207 HydrophobicContact CD1-CE2 4.23Å; E203-Y207 HydrophobicContact CG-CE2 4.37Å; E203-Y207 WeakPolarHBondContact O-CD2 3.25Å; F204-Y207 WeakPolarHBondContact O-CB 3.45Å; F204-Y207 PolarHBondContact O-N 3.26Å; H205-Y207 PolarHBondContact O-N 3.36Å; Y207-S215 WeakPolarHBondContact O-CB 3.49Å; Y207-S215 PolarHBondContact O-N 2.89Å; Y207-S215 PolarHBondContact O-OG 3.25Å; Y207-R216 HydrophobicContact CD1-CB 4.11Å; Y207-E219 HydrophobicContact CE1-CB 3.82Å; Y207-L220 HydrophobicContact CD1-CB 3.74Å; Y207-L220 HydrophobicContact CD1-CD1 4.5Å; Y207-L220 HydrophobicContact CD2-CD1 3.99Å; Y207-L220 HydrophobicContact CE1-CB 4.04Å; Y207-L220 HydrophobicContact CE2-CD1 4.24Å; Y207-L220 HydrophobicContact CG-CB 4.11Å; Y207-L220 HydrophobicContact CG-CD1 4.13Å; Y207-R223 VanDerWaalsContact OH-CB 3.29Å; Y207-R223 WeakPolarHBondContact OH-CB 3.46Å; Y207-R223 WeakPolarHBondContact OH-CG 3.49Å
208	L	93.3	Very high	92.7	Very high	30 Å²	30	59 Å²	59	16%	0.157	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-97.3	149.5	-179.4	-52.3	-175.7	0	0	0	111.5	F204 H205 T206 Q213 L214	F204-L208 HydrophobicContact CE1-CD1 4.02Å; F204-L208 HydrophobicContact CE2-CD2 4.47Å; F204-L208 HydrophobicContact CZ-CD1 4.32Å; F204-L208 HydrophobicContact CZ-CD2 4.1Å; F204-L208 HydrophobicContact CZ-CG 4.49Å; H205-L208 PolarHBondContact O-N 3.16Å; H205-L208 VanDerWaalsContact O-N 3.11Å; T206-L208 VanDerWaalsContact C-N 3.35Å; L208-Q213 CarbonylContact C-O 3.57Å; L208-Q213 VanDerWaalsContact CA-O 3.25Å; L208-Q213 WeakPolarHBondContact CA-O 3.24Å; L208-L214 HydrophobicContact CD2-CB 4.33Å; L208-L214 HydrophobicContact CD2-CD1 4.32Å
209	N	91.5	Very high	92.6	Very high	57 Å²	57	61 Å²	61	31%	0.305	32%	0.324	S	S	.	.			trans	-88.4	-175.9	167	70	1.7	0	0	0	111.8	E211 G212 Q213	N209-E211 VanDerWaalsContact C-N 3.28Å; N209-E211 PolarHBondContact ND2-OE2 3.3Å; N209-E211 PolarHBondContact O-N 3.14Å; N209-E211 PolarHBondContact OD1-N 3.2Å; N209-E211 PolarHBondContact OD1-OE2 3Å; N209-E211 VanDerWaalsContact OD1-OE2 3.14Å; N209-G212 WeakPolarHBondContact O-CA 3.41Å; N209-G212 PolarHBondContact O-N 3.03Å; N209-G212 PolarHBondContact OD1-N 3.36Å; N209-Q213 PolarHBondContact N-O 3.41Å; N209-Q213 PolarHBondContact ND2-OE1 2.79Å; N209-Q213 WeakPolarHBondContact OD1-CA 3.42Å; N209-Q213 WeakPolarHBondContact OD1-CB 3.12Å; N209-Q213 PolarHBondContact OD1-N 3.39Å; N209-Q213 PolarHBondContact OD1-O 2.77Å
210	H	90.8	Very high	92.6	Very high	179 Å²	179	61.2 Å²	61.2	83%	0.829	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.6	-175	66.1	-28.3	0	0	0	115	G212	H210-G212 VanDerWaalsContact C-N 3.28Å
211	E	90.1	Very high	92.7	Very high	85 Å²	85	60 Å²	60	40%	0.397	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-1.5	168.8	-51.1	88.1	159.2	0	0	112.5	N209 Q213 T250 G251	N209-E211 VanDerWaalsContact C-N 3.28Å; N209-E211 PolarHBondContact ND2-OE2 3.3Å; N209-E211 PolarHBondContact O-N 3.14Å; N209-E211 PolarHBondContact OD1-N 3.2Å; N209-E211 PolarHBondContact OD1-OE2 3Å; N209-E211 VanDerWaalsContact OD1-OE2 3.14Å; E211-Q213 VanDerWaalsContact C-N 3.33Å; E211-Q213 HydrophobicContact CB-CG 4.23Å; E211-Q213 PolarHBondContact O-N 3.41Å; E211-T250 HydrophobicContact CB-CG2 3.76Å; E211-T250 WeakPolarHBondContact O-CB 3.38Å; E211-G251 PolarHBondContact O-N 2.88Å
212	G	89.8	Confident	92.6	Very high	15 Å²	15	58.1 Å²	58.1	16%	0.155	30%	0.304	C	S	.	.			trans	76.4	11.3	-178	0	0	0	0	0	114.6	N209 H210 R254	N209-G212 WeakPolarHBondContact O-CA 3.41Å; N209-G212 PolarHBondContact O-N 3.03Å; N209-G212 PolarHBondContact OD1-N 3.36Å; H210-G212 VanDerWaalsContact C-N 3.28Å; G212-R254 PolarHBondContact O-NH1 3.25Å; G212-R254 PolarHBondContact O-NH2 3.04Å
213	Q	91.9	Very high	92.6	Very high	51 Å²	51	55.3 Å²	55.3	24%	0.238	28%	0.277	C	S	.	.			trans	-69.9	147.7	173.8	-55.8	165.1	-44.1	0	0	110.2	L208 N209 E211 S215 G248 T250	L208-Q213 CarbonylContact C-O 3.57Å; L208-Q213 VanDerWaalsContact CA-O 3.25Å; L208-Q213 WeakPolarHBondContact CA-O 3.24Å; N209-Q213 PolarHBondContact N-O 3.41Å; N209-Q213 PolarHBondContact ND2-OE1 2.79Å; N209-Q213 WeakPolarHBondContact OD1-CA 3.42Å; N209-Q213 WeakPolarHBondContact OD1-CB 3.12Å; N209-Q213 PolarHBondContact OD1-N 3.39Å; N209-Q213 PolarHBondContact OD1-O 2.77Å; E211-Q213 VanDerWaalsContact C-N 3.33Å; E211-Q213 HydrophobicContact CB-CG 4.23Å; E211-Q213 PolarHBondContact O-N 3.41Å; Q213-S215 PolarHBondContact O-N 3.02Å; Q213-G248 WeakPolarHBondContact CG-O 3.42Å; Q213-G248 PolarHBondContact NE2-O 2.86Å; Q213-T250 HydrophobicContact CG-CG2 3.88Å
214	L	92.1	Very high	92.7	Very high	34 Å²	34	52.6 Å²	52.6	18%	0.178	26%	0.264	C	S	.	.	B	Isolated β-bridge	trans	-79.9	114.1	179	176.7	58.1	0	0	0	110.6	L208 P217 L220 Y240	L208-L214 HydrophobicContact CD2-CB 4.33Å; L208-L214 HydrophobicContact CD2-CD1 4.32Å; L214-P217 HydrophobicContact CD2-CB 3.84Å; L214-P217 HydrophobicContact CG-CB 4.18Å; L214-L220 HydrophobicContact CD1-CB 4.48Å; L214-L220 HydrophobicContact CD1-CD2 3.7Å; L214-L220 HydrophobicContact CD2-CD2 3.9Å; L214-L220 HydrophobicContact CG-CD2 4.5Å; L214-Y240 HydrophobicContact CB-CE1 3.89Å; L214-Y240 HydrophobicContact CD2-CD1 3.45Å; L214-Y240 VanDerWaalsContact CD2-CD1 3.45Å; L214-Y240 HydrophobicContact CD2-CE1 3.69Å; L214-Y240 HydrophobicContact CD2-CG 4.12Å; L214-Y240 HydrophobicContact CG-CE1 4.42Å
215	S	91.3	Very high	92.8	Very high	66 Å²	66	53 Å²	53	46%	0.462	27%	0.265	S	S	.	.	S	Bend	trans	-88.8	-28.6	-173.1	64.2	0	0	0	0	115.2	Y207 Q213	Y207-S215 WeakPolarHBondContact O-CB 3.49Å; Y207-S215 PolarHBondContact O-N 2.89Å; Y207-S215 PolarHBondContact O-OG 3.25Å; Q213-S215 PolarHBondContact O-N 3.02Å
216	R	92.4	Very high	92.6	Very high	85 Å²	85	50.1 Å²	50.1	32%	0.321	25%	0.252	S	S	.	.			trans	-137.3	66.3	-170.4	-66.4	179.2	-65.4	135.2	-3.3	111	T206 Y207 E218 E219 L220	T206-R216 PolarHBondContact O-NH2 3.41Å; Y207-R216 HydrophobicContact CD1-CB 4.11Å; R216-E218 PolarHBondContact O-N 3.1Å; R216-E219 HydrophobicContact CB-CB 4.22Å; R216-E219 HydrophobicContact CB-CG 4.46Å; R216-E219 WeakPolarHBondContact CD-OE1 3.43Å; R216-E219 IonicContact CZ-OE2 2.73Å; R216-E219 IonicContact NE-OE2 2.76Å; R216-E219 IonicContact NH1-OE2 3.15Å; R216-E219 PolarHBondContact NH1-OE2 3.36Å; R216-E219 PolarHBondContact O-N 3.07Å; R216-L220 PolarHBondContact O-N 2.75Å
217	P	92.2	Very high	92.3	Very high	36 Å²	36	46.3 Å²	46.3	23%	0.234	23%	0.229	C	C	.	.	H	α-helix	trans	-65.4	-36	-172	25.7	-34.7	0	0	0	113.8	L214 R221 P436	L214-P217 HydrophobicContact CD2-CB 3.84Å; L214-P217 HydrophobicContact CG-CB 4.18Å; P217-R221 WeakPolarHBondContact O-CG 3.4Å; P217-R221 PolarHBondContact O-N 2.99Å; P217-P436 HydrophobicContact CB-CB 4.25Å; P217-P436 HydrophobicContact CB-CG 3.98Å; P217-P436 HydrophobicContact CG-CG 4.32Å
218	E	90.9	Very high	92.4	Very high	80 Å²	80	45.4 Å²	45.4	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-62.4	-48.7	175.6	-66.2	170.7	-161	0	0	111.7	T176 R216 L220 R221 L222 P436	T176-E218 VanDerWaalsContact CG2-OE1 3.23Å; T176-E218 WeakPolarHBondContact CG2-OE1 3.23Å; R216-E218 PolarHBondContact O-N 3.1Å; E218-L220 VanDerWaalsContact C-N 3.34Å; E218-L220 PolarHBondContact O-N 3.33Å; E218-R221 PolarHBondContact O-N 3.13Å; E218-L222 PolarHBondContact O-N 2.88Å; E218-P436 HydrophobicContact CG-CG 4.01Å
219	E	92.8	Very high	92.5	Very high	97 Å²	97	44.2 Å²	44.2	45%	0.453	22%	0.219	S	C	.	.	H	α-helix	trans	-67.6	-34.4	180	-64	174.1	-135.9	0	0	112.2	Y207 R216 R223	Y207-E219 HydrophobicContact CE1-CB 3.82Å; R216-E219 HydrophobicContact CB-CB 4.22Å; R216-E219 HydrophobicContact CB-CG 4.46Å; R216-E219 WeakPolarHBondContact CD-OE1 3.43Å; R216-E219 IonicContact CZ-OE2 2.73Å; R216-E219 IonicContact NE-OE2 2.76Å; R216-E219 IonicContact NH1-OE2 3.15Å; R216-E219 PolarHBondContact NH1-OE2 3.36Å; R216-E219 PolarHBondContact O-N 3.07Å; E219-R223 VanDerWaalsContact O-CB 3.27Å; E219-R223 WeakPolarHBondContact O-CB 3.29Å; E219-R223 PolarHBondContact O-N 2.82Å
220	L	94.5	Very high	92.7	Very high	4 Å²	4	44.9 Å²	44.9	2%	0.021	22%	0.221	C	C	.	.	H	α-helix	trans	-62.5	-47.4	172.1	175.1	62.8	0	0	0	110.7	L199 F204 Y207 L214 R216 E218 R223 I224	L199-L220 HydrophobicContact CD2-CD1 3.5Å; L199-L220 VanDerWaalsContact CD2-CD1 3.5Å; F204-L220 HydrophobicContact CD2-CD1 3.97Å; F204-L220 HydrophobicContact CD2-CD2 4.35Å; F204-L220 HydrophobicContact CE2-CD1 4.37Å; F204-L220 HydrophobicContact CE2-CD2 3.92Å; Y207-L220 HydrophobicContact CD1-CB 3.74Å; Y207-L220 HydrophobicContact CD1-CD1 4.5Å; Y207-L220 HydrophobicContact CD2-CD1 3.99Å; Y207-L220 HydrophobicContact CE1-CB 4.04Å; Y207-L220 HydrophobicContact CE2-CD1 4.24Å; Y207-L220 HydrophobicContact CG-CB 4.11Å; Y207-L220 HydrophobicContact CG-CD1 4.13Å; L214-L220 HydrophobicContact CD1-CB 4.48Å; L214-L220 HydrophobicContact CD1-CD2 3.7Å; L214-L220 HydrophobicContact CD2-CD2 3.9Å; L214-L220 HydrophobicContact CG-CD2 4.5Å; R216-L220 PolarHBondContact O-N 2.75Å; E218-L220 VanDerWaalsContact C-N 3.34Å; E218-L220 PolarHBondContact O-N 3.33Å; L220-R223 PolarHBondContact O-N 2.99Å; L220-I224 HydrophobicContact CD1-CD1 3.96Å; L220-I224 HydrophobicContact CD1-CG1 4.42Å; L220-I224 HydrophobicContact CG-CD1 3.99Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 2.91Å
221	R	95.1	Very high	93	Very high	16 Å²	16	40.5 Å²	40.5	6%	0.06	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-47.3	176.1	-79	-178.7	172.5	-103.2	-8.1	111.2	P217 E218 R223 I224 Y225 Y240 L241 N243 W431 S432 L434 P435	P217-R221 WeakPolarHBondContact O-CG 3.4Å; P217-R221 PolarHBondContact O-N 2.99Å; E218-R221 PolarHBondContact O-N 3.13Å; R221-R223 VanDerWaalsContact C-N 3.32Å; R221-R223 PolarHBondContact O-N 3.29Å; R221-I224 PolarHBondContact O-N 2.9Å; R221-I224 VanDerWaalsContact O-N 3.16Å; R221-Y225 WeakPolarHBondContact O-CB 3.35Å; R221-Y225 PolarHBondContact O-N 3.06Å; R221-Y240 PolarHBondContact NH2-O 3.5Å; R221-L241 HydrophobicContact CG-CD2 4.28Å; R221-L241 PolarHBondContact NH2-O 3.36Å; R221-N243 PolarHBondContact NH2-OD1 3.22Å; R221-W431 PolarHBondContact NH1-O 2.78Å; R221-S432 WeakPolarHBondContact O-CB 3.36Å; R221-L434 WeakPolarHBondContact CD-O 3.29Å; R221-L434 PolarHBondContact NH1-O 3.24Å; R221-P435 PolarHBondContact NH1-O 3.21Å
222	L	91	Very high	93.2	Very high	39 Å²	39	39.9 Å²	39.9	20%	0.204	21%	0.213	C	C	.	.	H	α-helix	trans	-60.7	-39	176.2	-174.2	60.5	0	0	0	112.5	V183 E218 I224 Y225 H226	V183-L222 HydrophobicContact CB-CD2 4.4Å; V183-L222 HydrophobicContact CG1-CD2 3.81Å; E218-L222 PolarHBondContact O-N 2.88Å; L222-I224 VanDerWaalsContact C-N 3.34Å; L222-I224 PolarHBondContact O-N 3.41Å; L222-Y225 HydrophobicContact CD1-CD1 4.22Å; L222-Y225 WeakPolarHBondContact O-CB 3.38Å; L222-Y225 PolarHBondContact O-N 3.18Å; L222-H226 PolarHBondContact O-CD2 3.19Å; L222-H226 PolarHBondContact O-N 2.8Å
223	R	93.6	Very high	93.5	Very high	18 Å²	18	39.4 Å²	39.4	7%	0.068	21%	0.207	C	C	.	.	H	α-helix	trans	-63.6	-38	176	174.7	57.6	-173.8	89.7	2.2	112.9	P197 P198 L199 E203 Y207 E219 L220 R221 G227	P197-R223 VanDerWaalsContact O-CZ 3.25Å; P197-R223 PolarHBondContact O-NH1 3.24Å; P197-R223 PolarHBondContact O-NH2 3.42Å; P198-R223 PolarHBondContact O-NH2 2.88Å; L199-R223 HydrophobicContact CD1-CG 3.97Å; E203-R223 WeakPolarHBondContact OE1-CD 3.33Å; E203-R223 IonicContact OE1-CZ 2.68Å; E203-R223 IonicContact OE1-NE 3.03Å; E203-R223 PolarHBondContact OE1-NE 3.42Å; E203-R223 IonicContact OE1-NH2 3.25Å; E203-R223 IonicContact OE2-CZ 3.68Å; E203-R223 VanDerWaalsContact OE2-CZ 3.25Å; E203-R223 IonicContact OE2-NE 3.17Å; E203-R223 PolarHBondContact OE2-NE 3.09Å; E203-R223 VanDerWaalsContact OE2-NE 3.11Å; E203-R223 IonicContact OE2-NH2 3.98Å; E203-R223 PolarHBondContact OE2-NH2 3.38Å; Y207-R223 VanDerWaalsContact OH-CB 3.29Å; Y207-R223 WeakPolarHBondContact OH-CB 3.46Å; Y207-R223 WeakPolarHBondContact OH-CG 3.49Å; E219-R223 VanDerWaalsContact O-CB 3.27Å; E219-R223 WeakPolarHBondContact O-CB 3.29Å; E219-R223 PolarHBondContact O-N 2.82Å; L220-R223 PolarHBondContact O-N 2.99Å; R221-R223 VanDerWaalsContact C-N 3.32Å; R221-R223 PolarHBondContact O-N 3.29Å; R223-G227 PolarHBondContact O-N 3.17Å
224	I	96.2	Very high	93.7	Very high	1 Å²	1	37.9 Å²	37.9	1%	0.005	20%	0.199	C	C	.	.	H	α-helix	trans	-71.3	-41.7	173.9	-64.2	164	0	0	0	110.3	L199 L220 R221 L222 H226 G227 G228 V229 V237 L241 E428	L199-I224 HydrophobicContact CD2-CD1 4.21Å; L199-I224 HydrophobicContact CD2-CG1 3.97Å; L220-I224 HydrophobicContact CD1-CD1 3.96Å; L220-I224 HydrophobicContact CD1-CG1 4.42Å; L220-I224 HydrophobicContact CG-CD1 3.99Å; L220-I224 VanDerWaalsContact O-CG1 3.29Å; L220-I224 WeakPolarHBondContact O-CG1 3.47Å; L220-I224 PolarHBondContact O-N 2.91Å; R221-I224 PolarHBondContact O-N 2.9Å; R221-I224 VanDerWaalsContact O-N 3.16Å; L222-I224 VanDerWaalsContact C-N 3.34Å; L222-I224 PolarHBondContact O-N 3.41Å; I224-H226 PolarHBondContact O-N 3.42Å; I224-H226 VanDerWaalsContact O-N 3.17Å; I224-G227 PolarHBondContact O-N 2.94Å; I224-G227 VanDerWaalsContact O-N 3.11Å; I224-G228 PolarHBondContact O-N 3.11Å; I224-V229 HydrophobicContact CD1-CG2 4.28Å; I224-V229 HydrophobicContact CG1-CG2 4.12Å; I224-V229 HydrophobicContact CG2-CG2 3.83Å; I224-V237 HydrophobicContact CD1-CG1 3.43Å; I224-V237 VanDerWaalsContact CD1-CG1 3.43Å; I224-V237 HydrophobicContact CG1-CG1 4.47Å; I224-L241 HydrophobicContact CD1-CD1 4.46Å; I224-L241 HydrophobicContact CD1-CD2 3.9Å; I224-L241 HydrophobicContact CD1-CG 4.38Å; I224-L241 HydrophobicContact CG2-CD1 4.25Å; I224-L241 HydrophobicContact CG2-CD2 4.48Å; I224-E428 HydrophobicContact CG2-CB 4.25Å
225	Y	95.4	Very high	93.9	Very high	15 Å²	15	40.5 Å²	40.5	6%	0.059	21%	0.209	C	C	.	.	H	α-helix	trans	-55.5	-37	179.1	174.2	-105.8	0	0	0	112.9	R221 L222 V429 S432 F617 R664 F667	R221-Y225 WeakPolarHBondContact O-CB 3.35Å; R221-Y225 PolarHBondContact O-N 3.06Å; L222-Y225 HydrophobicContact CD1-CD1 4.22Å; L222-Y225 WeakPolarHBondContact O-CB 3.38Å; L222-Y225 PolarHBondContact O-N 3.18Å; Y225-V429 HydrophobicContact CD2-CG1 3.66Å; Y225-V429 HydrophobicContact CE2-CG1 4.03Å; Y225-V429 HydrophobicContact CG-CG1 4.49Å; Y225-V429 WeakPolarHBondContact O-CG1 3.37Å; Y225-S432 WeakPolarHBondContact CA-OG 3.26Å; Y225-S432 WeakPolarHBondContact CB-OG 3.23Å; Y225-S432 PolarHBondContact N-OG 3.47Å; Y225-S432 VanDerWaalsContact N-OG 3.1Å; Y225-F617 HydrophobicContact CE2-CD1 4.18Å; Y225-F617 HydrophobicContact CE2-CD2 4.01Å; Y225-F617 AromaticContact CE2-CE1 3.94Å; Y225-F617 HydrophobicContact CE2-CE1 3.94Å; Y225-F617 AromaticContact CE2-CE2 3.76Å; Y225-F617 HydrophobicContact CE2-CE2 3.76Å; Y225-F617 HydrophobicContact CE2-CG 4.22Å; Y225-F617 AromaticContact CE2-CZ 3.73Å; Y225-F617 HydrophobicContact CE2-CZ 3.73Å; Y225-F617 AromaticContact CZ-CE2 3.96Å; Y225-F617 VanDerWaalsContact OH-CE2 3.28Å; Y225-F617 WeakPolarHBondContact OH-CE2 3.34Å; Y225-R664 HydrophobicContact CE1-CG 4.21Å; Y225-R664 HydrophobicContact CE2-CG 4.46Å; Y225-R664 VanDerWaalsContact O-CZ 3.28Å; Y225-R664 PolarHBondContact O-NE 3.22Å; Y225-R664 PolarHBondContact O-NH2 3.16Å; Y225-R664 WeakPolarHBondContact OH-CG 3.29Å; Y225-F667 WeakPolarHBondContact OH-CD1 3.43Å
226	H	90.6	Very high	94.1	Very high	46 Å²	46	40.2 Å²	40.2	21%	0.213	20%	0.204	C	C	.	.	H	α-helix	trans	-79.5	-40.6	174.5	-68.1	-72	0	0	0	114	K196 L222 I224 R664	K196-H226 HydrophobicContact CB-CB 4.46Å; K196-H226 HydrophobicContact CD-CB 4.08Å; K196-H226 HydrophobicContact CG-CB 4.42Å; L222-H226 PolarHBondContact O-CD2 3.19Å; L222-H226 PolarHBondContact O-N 2.8Å; I224-H226 PolarHBondContact O-N 3.42Å; I224-H226 VanDerWaalsContact O-N 3.17Å; H226-R664 PolarHBondContact O-NH1 3.45Å; H226-R664 PolarHBondContact O-NH2 2.79Å
227	G	88.6	Confident	94.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-111.2	-22.6	-167.5	0	0	0	0	0	118.2	K196 R223 I224 R425	K196-G227 WeakPolarHBondContact O-CA 3.37Å; R223-G227 PolarHBondContact O-N 3.17Å; I224-G227 PolarHBondContact O-N 2.94Å; I224-G227 VanDerWaalsContact O-N 3.11Å; G227-R425 PolarHBondContact O-NE 2.74Å; G227-R425 PolarHBondContact O-NH2 2.76Å
228	G	95.4	Very high	94.6	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	18%	0.178	C	C	.	.			trans	74	-170.4	-162	0	0	0	0	0	112.6	P198 L199 I224	P198-G228 WeakPolarHBondContact CA-O 3.42Å; L199-G228 PolarHBondContact N-O 3.36Å; I224-G228 PolarHBondContact O-N 3.11Å
229	V	96.6	Very high	94.9	Very high	4 Å²	4	32.2 Å²	32.2	2%	0.024	17%	0.166	C	C	.	.	B	Isolated β-bridge	trans	-116.8	143.4	-176.7	-168.5	0	0	0	0	110.6	I224 L233 R234 V237 E428	I224-V229 HydrophobicContact CD1-CG2 4.28Å; I224-V229 HydrophobicContact CG1-CG2 4.12Å; I224-V229 HydrophobicContact CG2-CG2 3.83Å; V229-L233 HydrophobicContact CG1-CB 3.6Å; V229-L233 HydrophobicContact CG1-CD1 4.47Å; V229-R234 HydrophobicContact CB-CG 4.49Å; V229-R234 HydrophobicContact CG1-CG 4.47Å; V229-V237 HydrophobicContact CG1-CB 3.92Å; V229-V237 HydrophobicContact CG1-CG1 4.11Å; V229-V237 HydrophobicContact CG1-CG2 3.98Å; V229-V237 HydrophobicContact CG2-CB 4.41Å; V229-V237 HydrophobicContact CG2-CG1 3.77Å; V229-E428 HydrophobicContact CB-CG 4.39Å; V229-E428 HydrophobicContact CG2-CB 4.39Å; V229-E428 HydrophobicContact CG2-CG 3.88Å; V229-E428 PolarHBondContact N-OE2 3.42Å
230	E	95.9	Very high	95.1	Very high	72 Å²	72	28.9 Å²	28.9	34%	0.336	15%	0.149	S	C	.	.			trans	-61	137.1	169.8	-168.5	-170.2	134.8	0	0	110.3	P198 L199 S200 S232 L233 R234	P198-E230 HydrophobicContact CB-CB 4.43Å; L199-E230 WeakPolarHBondContact O-CB 3.44Å; L199-E230 PolarHBondContact O-N 2.77Å; S200-E230 WeakPolarHBondContact CA-OE2 3.34Å; E230-S232 WeakPolarHBondContact CG-OG 3.27Å; E230-S232 PolarHBondContact O-N 3.3Å; E230-S232 PolarHBondContact OE1-OG 3.21Å; E230-L233 PolarHBondContact O-N 3.43Å; E230-R234 PolarHBondContact O-N 3.3Å
231	P	95.5	Very high	95.2	Very high	86 Å²	86	28.9 Å²	28.9	56%	0.558	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-53.2	-33.5	-175.8	-30.8	36.6	0	0	0	115.2
232	S	94.4	Very high	95.3	Very high	72 Å²	72	28.2 Å²	28.2	50%	0.503	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-42.3	175.2	56.9	0	0	0	0	113	E230	E230-S232 WeakPolarHBondContact CG-OG 3.27Å; E230-S232 PolarHBondContact O-N 3.3Å; E230-S232 PolarHBondContact OE1-OG 3.21Å
233	L	96.1	Very high	95.6	Very high	6 Å²	6	28 Å²	28	3%	0.031	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-17.8	-176.2	-91.5	-173.4	0	0	0	114	L199 S200 D201 F204 V229 E230 K235 V236 V237	L199-L233 HydrophobicContact CD2-CD1 4.49Å; L199-L233 HydrophobicContact CG-CD1 4.23Å; L199-L233 WeakPolarHBondContact O-CD1 3.25Å; S200-L233 VanDerWaalsContact C-CD1 3.43Å; D201-L233 HydrophobicContact CB-CD2 4.35Å; D201-L233 HydrophobicContact CB-CG 4.39Å; F204-L233 HydrophobicContact CB-CD1 3.72Å; F204-L233 HydrophobicContact CB-CD2 4.44Å; F204-L233 HydrophobicContact CD1-CD2 3.94Å; F204-L233 HydrophobicContact CG-CD1 4.28Å; F204-L233 HydrophobicContact CG-CD2 4.37Å; V229-L233 HydrophobicContact CG1-CB 3.6Å; V229-L233 HydrophobicContact CG1-CD1 4.47Å; E230-L233 PolarHBondContact O-N 3.43Å; L233-K235 VanDerWaalsContact C-N 3.26Å; L233-K235 PolarHBondContact O-N 3.08Å; L233-K235 VanDerWaalsContact O-N 3.17Å; L233-V236 PolarHBondContact O-N 2.9Å; L233-V237 HydrophobicContact CB-CG2 3.98Å; L233-V237 HydrophobicContact CD1-CG2 4.17Å; L233-V237 HydrophobicContact CD2-CG2 4.35Å; L233-V237 HydrophobicContact CG-CG2 4.43Å; L233-V237 PolarHBondContact O-N 3.43Å
234	R	97.8	Very high	95.7	Very high	19 Å²	19	27.2 Å²	27.2	7%	0.072	14%	0.143	C	C	.	.	H	α-helix	trans	-51.3	-43.6	-174.8	-66.7	-179.9	169.4	150.3	-4.2	112.6	V229 E230 V236 V237 W238 V344 D421 L424 E428	V229-R234 HydrophobicContact CB-CG 4.49Å; V229-R234 HydrophobicContact CG1-CG 4.47Å; E230-R234 PolarHBondContact O-N 3.3Å; R234-V236 PolarHBondContact O-N 3.32Å; R234-V237 PolarHBondContact O-N 2.9Å; R234-W238 HydrophobicContact CB-CG 4.42Å; R234-W238 WeakPolarHBondContact O-CB 3.4Å; R234-W238 PolarHBondContact O-N 2.85Å; R234-V344 HydrophobicContact CB-CG1 3.59Å; R234-V344 HydrophobicContact CB-CG2 4.32Å; R234-D421 IonicContact NH1-OD1 3.21Å; R234-D421 PolarHBondContact NH1-OD1 3.46Å; R234-L424 VanDerWaalsContact NH1-CD1 3.29Å; R234-E428 WeakPolarHBondContact CD-OE1 3.48Å; R234-E428 WeakPolarHBondContact CG-OE1 3.34Å; R234-E428 IonicContact CZ-OE1 4Å; R234-E428 IonicContact NE-OE1 3.36Å; R234-E428 PolarHBondContact NE-OE1 2.86Å; R234-E428 IonicContact NH2-OE1 3.28Å
235	K	96.1	Very high	95.7	Very high	88 Å²	88	28 Å²	28	38%	0.383	15%	0.146	S	C	.	.	H	α-helix	trans	-53.9	-26.2	176.5	-81.4	179.7	175	-178.2	0	114.2	L233 R239 V344 D346	L233-K235 VanDerWaalsContact C-N 3.26Å; L233-K235 PolarHBondContact O-N 3.08Å; L233-K235 VanDerWaalsContact O-N 3.17Å; K235-R239 PolarHBondContact O-NE 3.3Å; K235-V344 WeakPolarHBondContact CE-O 3.21Å; K235-V344 WeakPolarHBondContact CG-O 3.21Å; K235-D346 IonicContact NZ-OD2 3.35Å; K235-D346 PolarHBondContact NZ-OD2 3.15Å
236	V	95.4	Very high	95.6	Very high	60 Å²	60	28 Å²	28	36%	0.364	15%	0.147	S	C	.	.	H	α-helix	trans	-100.9	-55.3	177.9	-179.3	0	0	0	0	111	F204 L233 R234 W238 R239 Y240	F204-V236 HydrophobicContact CE1-CG1 3.85Å; F204-V236 HydrophobicContact CZ-CG1 4.06Å; L233-V236 PolarHBondContact O-N 2.9Å; R234-V236 PolarHBondContact O-N 3.32Å; V236-W238 PolarHBondContact O-N 2.93Å; V236-R239 WeakPolarHBondContact O-CB 3.43Å; V236-R239 PolarHBondContact O-N 3.39Å; V236-Y240 HydrophobicContact CG1-CE2 4.29Å
237	V	97.3	Very high	95.6	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-66.8	-36.6	-169.6	175.4	0	0	0	0	112.5	L199 F204 I224 V229 L233 R234 R239 Y240 L241	L199-V237 HydrophobicContact CD2-CG2 4.34Å; F204-V237 HydrophobicContact CD2-CG2 4.06Å; F204-V237 HydrophobicContact CE2-CG2 4.14Å; F204-V237 HydrophobicContact CG-CG2 4.34Å; F204-V237 HydrophobicContact CZ-CG2 4.49Å; I224-V237 HydrophobicContact CD1-CG1 3.43Å; I224-V237 VanDerWaalsContact CD1-CG1 3.43Å; I224-V237 HydrophobicContact CG1-CG1 4.47Å; V229-V237 HydrophobicContact CG1-CB 3.92Å; V229-V237 HydrophobicContact CG1-CG1 4.11Å; V229-V237 HydrophobicContact CG1-CG2 3.98Å; V229-V237 HydrophobicContact CG2-CB 4.41Å; V229-V237 HydrophobicContact CG2-CG1 3.77Å; L233-V237 HydrophobicContact CB-CG2 3.98Å; L233-V237 HydrophobicContact CD1-CG2 4.17Å; L233-V237 HydrophobicContact CD2-CG2 4.35Å; L233-V237 HydrophobicContact CG-CG2 4.43Å; L233-V237 PolarHBondContact O-N 3.43Å; R234-V237 PolarHBondContact O-N 2.9Å; V237-R239 PolarHBondContact O-N 2.87Å; V237-R239 VanDerWaalsContact O-N 3.12Å; V237-Y240 PolarHBondContact O-N 3.47Å; V237-L241 HydrophobicContact CG1-CD1 4.42Å; V237-L241 HydrophobicContact CG1-CG 4.44Å; V237-L241 PolarHBondContact O-N 3.03Å
238	W	98.3	Very high	95.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-59.6	-27.6	179.6	-77.9	29.2	0	0	0	112.7	R234 V236 Y240 L241 L242 P340 I341 V344 M345 L424 E428 W431	R234-W238 HydrophobicContact CB-CG 4.42Å; R234-W238 WeakPolarHBondContact O-CB 3.4Å; R234-W238 PolarHBondContact O-N 2.85Å; V236-W238 PolarHBondContact O-N 2.93Å; W238-Y240 VanDerWaalsContact C-N 3.28Å; W238-Y240 PolarHBondContact O-N 3.1Å; W238-L241 PolarHBondContact O-N 3.14Å; W238-L242 WeakPolarHBondContact O-CB 3.26Å; W238-L242 VanDerWaalsContact O-CG 3.32Å; W238-L242 WeakPolarHBondContact O-CG 3.29Å; W238-L242 PolarHBondContact O-N 2.91Å; W238-P340 HydrophobicContact CH2-CB 4.26Å; W238-P340 HydrophobicContact CZ3-CB 4.44Å; W238-I341 HydrophobicContact CE3-CG1 4.43Å; W238-I341 HydrophobicContact CZ3-CG1 4.07Å; W238-V344 HydrophobicContact CD2-CB 4.41Å; W238-V344 HydrophobicContact CD2-CG1 3.91Å; W238-V344 HydrophobicContact CD2-CG2 4.3Å; W238-V344 HydrophobicContact CE3-CB 3.97Å; W238-V344 HydrophobicContact CE3-CG1 3.87Å; W238-V344 HydrophobicContact CE3-CG2 4.05Å; W238-V344 HydrophobicContact CG-CG1 4.3Å; W238-V344 HydrophobicContact CH2-CG2 3.84Å; W238-V344 HydrophobicContact CZ2-CG2 4.02Å; W238-V344 HydrophobicContact CZ3-CB 4.07Å; W238-V344 HydrophobicContact CZ3-CG1 4.46Å; W238-V344 HydrophobicContact CZ3-CG2 3.81Å; W238-M345 HydrophobicContact CB-CE 3.68Å; W238-L424 HydrophobicContact CH2-CB 4.38Å; W238-L424 HydrophobicContact CH2-CD2 3.51Å; W238-L424 HydrophobicContact CH2-CG 4.5Å; W238-L424 HydrophobicContact CZ2-CB 4.02Å; W238-L424 HydrophobicContact CZ2-CD2 3.98Å; W238-L424 HydrophobicContact CZ3-CD2 4.47Å; W238-E428 HydrophobicContact CZ2-CG 4.14Å; W238-E428 VanDerWaalsContact NE1-CG 3.27Å; W238-E428 PolarHBondContact NE1-OE1 3.41Å; W238-W431 HydrophobicContact CD2-CH2 4.39Å; W238-W431 AromaticContact CD2-CZ3 3.7Å; W238-W431 HydrophobicContact CD2-CZ3 3.7Å; W238-W431 AromaticContact CE3-CH2 3.83Å; W238-W431 HydrophobicContact CE3-CH2 3.83Å; W238-W431 AromaticContact CE3-CZ3 3.55Å; W238-W431 HydrophobicContact CE3-CZ3 3.55Å; W238-W431 HydrophobicContact CG-CZ3 4.26Å; W238-W431 AromaticContact CH2-CH2 3.83Å; W238-W431 HydrophobicContact CH2-CH2 3.83Å; W238-W431 AromaticContact CH2-CZ3 3.99Å; W238-W431 HydrophobicContact CH2-CZ3 3.99Å; W238-W431 HydrophobicContact CZ2-CH2 4.44Å; W238-W431 HydrophobicContact CZ2-CZ3 4.2Å; W238-W431 AromaticContact CZ3-CH2 3.52Å; W238-W431 HydrophobicContact CZ3-CH2 3.52Å; W238-W431 AromaticContact CZ3-CZ3 3.71Å; W238-W431 HydrophobicContact CZ3-CZ3 3.71Å
239	R	97.4	Very high	95.4	Very high	34 Å²	34	35.3 Å²	35.3	13%	0.128	20%	0.199	C	C	.	.	H	α-helix	trans	-67.4	-27.9	177.4	-59.5	-177.7	-174.7	169.9	0.2	112.6	K235 V236 V237 N243 V244 Y245 M345	K235-R239 PolarHBondContact O-NE 3.3Å; V236-R239 WeakPolarHBondContact O-CB 3.43Å; V236-R239 PolarHBondContact O-N 3.39Å; V237-R239 PolarHBondContact O-N 2.87Å; V237-R239 VanDerWaalsContact O-N 3.12Å; R239-N243 PolarHBondContact O-N 3.5Å; R239-V244 HydrophobicContact CB-CB 4.05Å; R239-V244 HydrophobicContact CB-CG1 4.43Å; R239-V244 HydrophobicContact CB-CG2 4.43Å; R239-V244 WeakPolarHBondContact O-CB 3.47Å; R239-V244 PolarHBondContact O-N 3.03Å; R239-Y245 HydrophobicContact CB-CD2 3.9Å; R239-Y245 HydrophobicContact CB-CE2 3.43Å; R239-Y245 VanDerWaalsContact CB-CE2 3.43Å; R239-Y245 VanDerWaalsContact CD-OH 3.28Å; R239-Y245 WeakPolarHBondContact CD-OH 3.43Å; R239-Y245 HydrophobicContact CG-CE2 4.22Å; R239-Y245 PolarHBondContact NH1-OH 3.02Å; R239-Y245 VanDerWaalsContact NH1-OH 3.16Å; R239-M345 HydrophobicContact CG-CE 3.78Å; R239-M345 HydrophobicContact CG-SD 4.26Å; R239-M345 PolarHBondContact NE-SD 2.84Å
240	Y	96.1	Very high	95.3	Very high	27 Å²	27	36.5 Å²	36.5	11%	0.106	21%	0.207	C	C	.	.	H	α-helix	trans	-82.1	-35.5	172.2	-62.1	-84.3	0	0	0	112.3	F204 L214 R221 V236 V237 W238 L242 N243 Y245 R254	F204-Y240 HydrophobicContact CE2-CE2 4.36Å; F204-Y240 HydrophobicContact CZ-CD2 4.47Å; F204-Y240 AromaticContact CZ-CE2 3.82Å; F204-Y240 HydrophobicContact CZ-CE2 3.82Å; L214-Y240 HydrophobicContact CB-CE1 3.89Å; L214-Y240 HydrophobicContact CD2-CD1 3.45Å; L214-Y240 VanDerWaalsContact CD2-CD1 3.45Å; L214-Y240 HydrophobicContact CD2-CE1 3.69Å; L214-Y240 HydrophobicContact CD2-CG 4.12Å; L214-Y240 HydrophobicContact CG-CE1 4.42Å; R221-Y240 PolarHBondContact NH2-O 3.5Å; V236-Y240 HydrophobicContact CG1-CE2 4.29Å; V237-Y240 PolarHBondContact O-N 3.47Å; W238-Y240 VanDerWaalsContact C-N 3.28Å; W238-Y240 PolarHBondContact O-N 3.1Å; Y240-L242 VanDerWaalsContact C-N 3.29Å; Y240-L242 PolarHBondContact O-N 3.02Å; Y240-N243 PolarHBondContact O-N 3.47Å; Y240-N243 PolarHBondContact O-OD1 3.05Å; Y240-Y245 HydrophobicContact CD1-CD2 4.34Å; Y240-Y245 HydrophobicContact CE1-CD2 4.19Å; Y240-R254 PolarHBondContact OH-NE 2.93Å; Y240-R254 VanDerWaalsContact OH-NE 3.07Å; Y240-R254 PolarHBondContact OH-NH1 3.13Å; Y240-R254 PolarHBondContact OH-NH2 2.9Å; Y240-R254 VanDerWaalsContact OH-NH2 3.11Å
241	L	97	Very high	95	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	20%	0.203	C	C	.	.	H	α-helix	trans	-65.7	-34	174.7	-64.7	179.5	0	0	0	112.3	R221 I224 V237 W238 E428 W431	R221-L241 HydrophobicContact CG-CD2 4.28Å; R221-L241 PolarHBondContact NH2-O 3.36Å; I224-L241 HydrophobicContact CD1-CD1 4.46Å; I224-L241 HydrophobicContact CD1-CD2 3.9Å; I224-L241 HydrophobicContact CD1-CG 4.38Å; I224-L241 HydrophobicContact CG2-CD1 4.25Å; I224-L241 HydrophobicContact CG2-CD2 4.48Å; V237-L241 HydrophobicContact CG1-CD1 4.42Å; V237-L241 HydrophobicContact CG1-CG 4.44Å; V237-L241 PolarHBondContact O-N 3.03Å; W238-L241 PolarHBondContact O-N 3.14Å; L241-E428 HydrophobicContact CD1-CB 4.46Å; L241-E428 HydrophobicContact CD1-CG 4.4Å; L241-W431 HydrophobicContact CB-CB 4.13Å; L241-W431 HydrophobicContact CB-CE3 4.19Å; L241-W431 HydrophobicContact CD1-CE3 4.43Å
242	L	97.3	Very high	94.9	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.01	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	13.2	178.5	-60.2	-177.6	0	0	0	113.9	W238 Y240 V244 I341 C354 I358 W431	W238-L242 WeakPolarHBondContact O-CB 3.26Å; W238-L242 VanDerWaalsContact O-CG 3.32Å; W238-L242 WeakPolarHBondContact O-CG 3.29Å; W238-L242 PolarHBondContact O-N 2.91Å; Y240-L242 VanDerWaalsContact C-N 3.29Å; Y240-L242 PolarHBondContact O-N 3.02Å; L242-V244 VanDerWaalsContact C-N 3.3Å; L242-V244 HydrophobicContact CB-CG2 4.24Å; L242-V244 PolarHBondContact O-N 2.88Å; L242-I341 HydrophobicContact CD1-CD1 3.89Å; L242-I341 HydrophobicContact CD1-CG1 4.24Å; L242-C354 HydrophobicContact CD1-CB 3.97Å; L242-I358 HydrophobicContact CD2-CB 3.99Å; L242-I358 HydrophobicContact CD2-CD1 4.46Å; L242-I358 HydrophobicContact CD2-CG1 4.49Å; L242-W431 HydrophobicContact CD1-CE3 4.5Å; L242-W431 HydrophobicContact CD1-CH2 4.13Å; L242-W431 HydrophobicContact CD1-CZ3 3.88Å; L242-W431 HydrophobicContact CD2-CD2 3.73Å; L242-W431 HydrophobicContact CD2-CE3 3.53Å; L242-W431 HydrophobicContact CD2-CG 4.38Å; L242-W431 HydrophobicContact CD2-CH2 4Å; L242-W431 HydrophobicContact CD2-CZ2 4.19Å; L242-W431 HydrophobicContact CD2-CZ3 3.68Å; L242-W431 HydrophobicContact CG-CE3 3.96Å; L242-W431 HydrophobicContact CG-CH2 4.41Å; L242-W431 HydrophobicContact CG-CZ3 3.84Å
243	N	95.9	Very high	95	Very high	35 Å²	35	40.4 Å²	40.4	19%	0.187	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.5	46	175.6	-59	-21.8	0	0	0	113.7	R221 R239 Y240 D437 P439	R221-N243 PolarHBondContact NH2-OD1 3.22Å; R239-N243 PolarHBondContact O-N 3.5Å; Y240-N243 PolarHBondContact O-N 3.47Å; Y240-N243 PolarHBondContact O-OD1 3.05Å; N243-D437 WeakPolarHBondContact CB-O 3.41Å; N243-D437 WeakPolarHBondContact ND2-CB 3.38Å; N243-D437 PolarHBondContact ND2-N 3.26Å; N243-D437 PolarHBondContact ND2-O 3.32Å; N243-P439 WeakPolarHBondContact O-CD 3.48Å
244	V	96.9	Very high	95	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	21%	0.211	C	C	.	.			trans	-79.8	-28.6	-178.2	167.9	0	0	0	0	112.6	R239 L242 Y257 M258 V353 C354 V443	R239-V244 HydrophobicContact CB-CB 4.05Å; R239-V244 HydrophobicContact CB-CG1 4.43Å; R239-V244 HydrophobicContact CB-CG2 4.43Å; R239-V244 WeakPolarHBondContact O-CB 3.47Å; R239-V244 PolarHBondContact O-N 3.03Å; L242-V244 VanDerWaalsContact C-N 3.3Å; L242-V244 HydrophobicContact CB-CG2 4.24Å; L242-V244 PolarHBondContact O-N 2.88Å; V244-Y257 HydrophobicContact CG1-CE1 4.23Å; V244-Y257 WeakPolarHBondContact O-CE1 3.43Å; V244-Y257 PolarHBondContact O-OH 3.35Å; V244-M258 HydrophobicContact CG1-CE 4.27Å; V244-M258 HydrophobicContact CG1-SD 3.59Å; V244-M258 VanDerWaalsContact CG1-SD 3.59Å; V244-V353 HydrophobicContact CG1-CG1 3.68Å; V244-C354 HydrophobicContact CG2-CB 4.38Å; V244-V443 WeakPolarHBondContact O-CG2 3.42Å
245	Y	95.8	Very high	94.8	Very high	19 Å²	19	46.9 Å²	46.9	8%	0.075	24%	0.24	C	C	.	.	S	Bend	trans	-103.2	129.6	-175.9	-65.9	-58.3	0	0	0	111	R239 Y240 L249 R254 Y257 M258	R239-Y245 HydrophobicContact CB-CD2 3.9Å; R239-Y245 HydrophobicContact CB-CE2 3.43Å; R239-Y245 VanDerWaalsContact CB-CE2 3.43Å; R239-Y245 VanDerWaalsContact CD-OH 3.28Å; R239-Y245 WeakPolarHBondContact CD-OH 3.43Å; R239-Y245 HydrophobicContact CG-CE2 4.22Å; R239-Y245 PolarHBondContact NH1-OH 3.02Å; R239-Y245 VanDerWaalsContact NH1-OH 3.16Å; Y240-Y245 HydrophobicContact CD1-CD2 4.34Å; Y240-Y245 HydrophobicContact CE1-CD2 4.19Å; Y245-L249 HydrophobicContact CD1-CD1 4.45Å; Y245-R254 HydrophobicContact CD1-CB 4.01Å; Y245-R254 HydrophobicContact CD1-CG 3.65Å; Y245-R254 HydrophobicContact CD2-CG 4.38Å; Y245-R254 HydrophobicContact CE1-CB 3.53Å; Y245-R254 HydrophobicContact CE1-CG 3.72Å; Y245-R254 HydrophobicContact CE2-CG 4.43Å; Y245-R254 HydrophobicContact CG-CG 3.99Å; Y245-Y257 AromaticContact CD1-CD1 3.81Å; Y245-Y257 HydrophobicContact CD1-CD1 3.81Å; Y245-Y257 HydrophobicContact CD1-CE1 4.04Å; Y245-Y257 AromaticContact CE1-CD1 3.87Å; Y245-Y257 HydrophobicContact CE1-CD1 3.87Å; Y245-Y257 HydrophobicContact CE1-CE1 4.37Å; Y245-M258 HydrophobicContact CE1-CG 3.76Å; Y245-M258 HydrophobicContact CE1-SD 3.84Å; Y245-M258 WeakPolarHBondContact OH-CG 3.3Å
246	P	94.3	Very high	94.9	Very high	13 Å²	13	46.6 Å²	46.6	8%	0.084	24%	0.243	C	C	.	.	P	Polyproline II helix	trans	-54.5	153.5	159.3	-24.4	33.4	0	0	0	112	L249 Y257 P439 H441	P246-L249 HydrophobicContact CB-CD1 4.41Å; P246-L249 HydrophobicContact CB-CG 4.33Å; P246-L249 HydrophobicContact CG-CD1 4.28Å; P246-Y257 HydrophobicContact CG-CE2 4.17Å; P246-P439 VanDerWaalsContact CA-O 3.3Å; P246-P439 WeakPolarHBondContact CA-O 3.48Å; P246-P439 WeakPolarHBondContact CB-O 3.37Å; P246-P439 HydrophobicContact CG-CG 4.31Å; P246-H441 WeakPolarHBondContact CG-O 3.38Å
247	D	89.3	Confident	95	Very high	115 Å²	115	44.4 Å²	44.4	62%	0.615	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.8	153.6	178	-99.1	-19.2	0	0	0	112.4	L249 P438	D247-L249 PolarHBondContact O-N 3.22Å; D247-L249 VanDerWaalsContact O-N 3.13Å; D247-P438 HydrophobicContact CB-CG 4.38Å; D247-P438 VanDerWaalsContact CG-CG 3.47Å; D247-P438 VanDerWaalsContact OD2-CG 3.27Å; D247-P438 WeakPolarHBondContact OD2-CG 3.38Å
248	G	87.7	Confident	95	Very high	47 Å²	47	44.5 Å²	44.5	49%	0.485	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.3	-4.3	176.4	0	0	0	0	0	116.5	Q213 T250	Q213-G248 WeakPolarHBondContact CG-O 3.42Å; Q213-G248 PolarHBondContact NE2-O 2.86Å; G248-T250 PolarHBondContact O-N 3.26Å
249	L	92.9	Very high	95	Very high	39 Å²	39	50.9 Å²	50.9	20%	0.204	26%	0.256	C	S	.	.			trans	-64.1	126.4	176.9	-65.3	-169.3	0	0	0	112	Y245 P246 D247 E253 R254 Y257	Y245-L249 HydrophobicContact CD1-CD1 4.45Å; P246-L249 HydrophobicContact CB-CD1 4.41Å; P246-L249 HydrophobicContact CB-CG 4.33Å; P246-L249 HydrophobicContact CG-CD1 4.28Å; D247-L249 PolarHBondContact O-N 3.22Å; D247-L249 VanDerWaalsContact O-N 3.13Å; L249-E253 HydrophobicContact CB-CB 4.32Å; L249-E253 HydrophobicContact CD2-CB 4.22Å; L249-R254 HydrophobicContact CB-CG 3.63Å; L249-R254 HydrophobicContact CD1-CG 4.31Å; L249-R254 PolarHBondContact O-NH1 3.3Å; L249-Y257 HydrophobicContact CD1-CD2 4.22Å; L249-Y257 HydrophobicContact CD1-CG 4.21Å
250	T	94.4	Very high	95	Very high	29 Å²	29	53.8 Å²	53.8	18%	0.178	27%	0.267	C	S	.	.			trans	-66.3	167.3	174.5	63.4	0	0	0	0	112.5	E211 Q213 G248 R252 E253 R254	E211-T250 HydrophobicContact CB-CG2 3.76Å; E211-T250 WeakPolarHBondContact O-CB 3.38Å; Q213-T250 HydrophobicContact CG-CG2 3.88Å; G248-T250 PolarHBondContact O-N 3.26Å; T250-R252 PolarHBondContact O-N 3.07Å; T250-E253 VanDerWaalsContact CB-OE2 3.24Å; T250-E253 WeakPolarHBondContact CB-OE2 3.45Å; T250-E253 WeakPolarHBondContact CG2-OE2 2.89Å; T250-E253 PolarHBondContact N-OE2 2.99Å; T250-E253 PolarHBondContact O-N 2.97Å; T250-E253 VanDerWaalsContact OG1-CD 3.24Å; T250-E253 VanDerWaalsContact OG1-CG 3.31Å; T250-E253 WeakPolarHBondContact OG1-CG 3.12Å; T250-E253 PolarHBondContact OG1-N 3.05Å; T250-E253 PolarHBondContact OG1-OE2 2.83Å; T250-R254 WeakPolarHBondContact O-CG 3.29Å; T250-R254 PolarHBondContact O-N 2.76Å
251	G	90.3	Very high	95.1	Very high	26 Å²	26	52.5 Å²	52.5	27%	0.268	26%	0.262	S	S	.	.	H	α-helix	trans	-53.6	-39.4	177.2	0	0	0	0	0	113.4	E211 M255	E211-G251 PolarHBondContact O-N 2.88Å; G251-M255 WeakPolarHBondContact O-CG 3.25Å
252	R	93.3	Very high	95.2	Very high	191 Å²	191	52.9 Å²	52.9	72%	0.721	27%	0.265	S	S	*	.	H	α-helix	trans	-71.8	-48.6	177.6	-178.7	177.2	176.5	169	0.4	112.4	T250 R254 M255 D256	T250-R252 PolarHBondContact O-N 3.07Å; R252-R254 PolarHBondContact O-N 2.75Å; R252-M255 WeakPolarHBondContact O-CA 3.49Å; R252-M255 WeakPolarHBondContact O-CB 3.47Å; R252-M255 PolarHBondContact O-N 2.78Å; R252-D256 IonicContact NE-OD2 2.75Å; R252-D256 PolarHBondContact O-N 3.32Å; R252-D256 VanDerWaalsContact O-N 3.08Å
253	E	96.3	Very high	95.3	Very high	94 Å²	94	59.7 Å²	59.7	44%	0.439	29%	0.29	S	S	.	.	H	α-helix	trans	-62	-34.4	-178.6	-69.7	161.1	139.4	0	0	111.7	L249 T250 M255 D256 Y257	L249-E253 HydrophobicContact CB-CB 4.32Å; L249-E253 HydrophobicContact CD2-CB 4.22Å; T250-E253 VanDerWaalsContact CB-OE2 3.24Å; T250-E253 WeakPolarHBondContact CB-OE2 3.45Å; T250-E253 WeakPolarHBondContact CG2-OE2 2.89Å; T250-E253 PolarHBondContact N-OE2 2.99Å; T250-E253 PolarHBondContact O-N 2.97Å; T250-E253 VanDerWaalsContact OG1-CD 3.24Å; T250-E253 VanDerWaalsContact OG1-CG 3.31Å; T250-E253 WeakPolarHBondContact OG1-CG 3.12Å; T250-E253 PolarHBondContact OG1-N 3.05Å; T250-E253 PolarHBondContact OG1-OE2 2.83Å; E253-M255 VanDerWaalsContact C-N 3.29Å; E253-M255 PolarHBondContact O-N 2.83Å; E253-D256 PolarHBondContact O-N 2.59Å; E253-Y257 WeakPolarHBondContact O-CB 3.43Å; E253-Y257 PolarHBondContact O-N 3.33Å
254	R	95.4	Very high	95.4	Very high	23 Å²	23	60.5 Å²	60.5	9%	0.087	29%	0.293	C	S	.	.	H	α-helix	trans	-63.8	-30.6	172.4	-70.9	-167	-50.1	-94.6	8.5	113.7	G212 Y240 Y245 L249 T250 R252 M258	G212-R254 PolarHBondContact O-NH1 3.25Å; G212-R254 PolarHBondContact O-NH2 3.04Å; Y240-R254 PolarHBondContact OH-NE 2.93Å; Y240-R254 VanDerWaalsContact OH-NE 3.07Å; Y240-R254 PolarHBondContact OH-NH1 3.13Å; Y240-R254 PolarHBondContact OH-NH2 2.9Å; Y240-R254 VanDerWaalsContact OH-NH2 3.11Å; Y245-R254 HydrophobicContact CD1-CB 4.01Å; Y245-R254 HydrophobicContact CD1-CG 3.65Å; Y245-R254 HydrophobicContact CD2-CG 4.38Å; Y245-R254 HydrophobicContact CE1-CB 3.53Å; Y245-R254 HydrophobicContact CE1-CG 3.72Å; Y245-R254 HydrophobicContact CE2-CG 4.43Å; Y245-R254 HydrophobicContact CG-CG 3.99Å; L249-R254 HydrophobicContact CB-CG 3.63Å; L249-R254 HydrophobicContact CD1-CG 4.31Å; L249-R254 PolarHBondContact O-NH1 3.3Å; T250-R254 WeakPolarHBondContact O-CG 3.29Å; T250-R254 PolarHBondContact O-N 2.76Å; R252-R254 PolarHBondContact O-N 2.75Å; R254-M258 WeakPolarHBondContact O-CG 3.38Å; R254-M258 PolarHBondContact O-N 3.21Å
255	M	94.3	Very high	95.5	Very high	138 Å²	138	60.5 Å²	60.5	68%	0.68	29%	0.293	S	S	*	.	H	α-helix	trans	-72.3	-48.7	173.4	-65	174.7	68.2	0	0	110.7	G251 R252 E253 Y257 M258 K259	G251-M255 WeakPolarHBondContact O-CG 3.25Å; R252-M255 WeakPolarHBondContact O-CA 3.49Å; R252-M255 WeakPolarHBondContact O-CB 3.47Å; R252-M255 PolarHBondContact O-N 2.78Å; E253-M255 VanDerWaalsContact C-N 3.29Å; E253-M255 PolarHBondContact O-N 2.83Å; M255-Y257 VanDerWaalsContact C-N 3.33Å; M255-Y257 PolarHBondContact O-N 2.95Å; M255-M258 PolarHBondContact O-N 3.36Å; M255-K259 WeakPolarHBondContact O-CB 3.28Å; M255-K259 PolarHBondContact O-N 3.06Å
256	D	97.3	Very high	95.6	Very high	83 Å²	83	63.7 Å²	63.7	44%	0.444	31%	0.309	S	S	.	.	H	α-helix	trans	-65.6	-35	179.5	-75.2	-43.6	0	0	0	112.2	R252 E253 K259 R260	R252-D256 IonicContact NE-OD2 2.75Å; R252-D256 PolarHBondContact O-N 3.32Å; R252-D256 VanDerWaalsContact O-N 3.08Å; E253-D256 PolarHBondContact O-N 2.59Å; D256-K259 PolarHBondContact O-N 3.17Å; D256-R260 WeakPolarHBondContact O-CB 3.35Å; D256-R260 PolarHBondContact O-N 2.83Å
257	Y	97.6	Very high	95.8	Very high	13 Å²	13	68.4 Å²	68.4	5%	0.051	33%	0.33	C	S	.	.	H	α-helix	trans	-60.3	-52.7	171.7	175	-92.2	0	0	0	112.1	V244 Y245 P246 L249 E253 M255 K259 R260 K261 E442 V443	V244-Y257 HydrophobicContact CG1-CE1 4.23Å; V244-Y257 WeakPolarHBondContact O-CE1 3.43Å; V244-Y257 PolarHBondContact O-OH 3.35Å; Y245-Y257 AromaticContact CD1-CD1 3.81Å; Y245-Y257 HydrophobicContact CD1-CD1 3.81Å; Y245-Y257 HydrophobicContact CD1-CE1 4.04Å; Y245-Y257 AromaticContact CE1-CD1 3.87Å; Y245-Y257 HydrophobicContact CE1-CD1 3.87Å; Y245-Y257 HydrophobicContact CE1-CE1 4.37Å; P246-Y257 HydrophobicContact CG-CE2 4.17Å; L249-Y257 HydrophobicContact CD1-CD2 4.22Å; L249-Y257 HydrophobicContact CD1-CG 4.21Å; E253-Y257 WeakPolarHBondContact O-CB 3.43Å; E253-Y257 PolarHBondContact O-N 3.33Å; M255-Y257 VanDerWaalsContact C-N 3.33Å; M255-Y257 PolarHBondContact O-N 2.95Å; Y257-K259 VanDerWaalsContact C-N 3.3Å; Y257-K259 PolarHBondContact O-N 3.37Å; Y257-R260 WeakPolarHBondContact O-CB 3.41Å; Y257-R260 PolarHBondContact O-N 3.03Å; Y257-R260 VanDerWaalsContact O-N 3.13Å; Y257-K261 HydrophobicContact CE1-CG 4.27Å; Y257-K261 HydrophobicContact CE2-CG 4.35Å; Y257-K261 PolarHBondContact O-N 2.8Å; Y257-E442 HydrophobicContact CE2-CB 3.83Å; Y257-V443 PolarHBondContact OH-N 3.4Å; Y257-V443 VanDerWaalsContact OH-N 3.07Å
258	M	97.6	Very high	96.2	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.015	30%	0.302	C	S	.	.	H	α-helix	trans	-63.6	-38.8	177.2	-67.5	-54.5	-58.1	0	0	111.4	V244 Y245 R254 M255 R260 K261 S262 H350 V353	V244-M258 HydrophobicContact CG1-CE 4.27Å; V244-M258 HydrophobicContact CG1-SD 3.59Å; V244-M258 VanDerWaalsContact CG1-SD 3.59Å; Y245-M258 HydrophobicContact CE1-CG 3.76Å; Y245-M258 HydrophobicContact CE1-SD 3.84Å; Y245-M258 WeakPolarHBondContact OH-CG 3.3Å; R254-M258 WeakPolarHBondContact O-CG 3.38Å; R254-M258 PolarHBondContact O-N 3.21Å; M255-M258 PolarHBondContact O-N 3.36Å; M258-R260 VanDerWaalsContact C-N 3.27Å; M258-R260 PolarHBondContact O-N 3.28Å; M258-K261 PolarHBondContact O-N 3.44Å; M258-S262 VanDerWaalsContact O-CB 3.29Å; M258-S262 WeakPolarHBondContact O-CB 3.47Å; M258-S262 PolarHBondContact O-N 2.96Å; M258-H350 HydrophobicContact CE-CB 4.18Å; M258-V353 HydrophobicContact CE-CB 4.06Å; M258-V353 HydrophobicContact CE-CG1 4.1Å; M258-V353 HydrophobicContact CE-CG2 4.42Å; M258-V353 HydrophobicContact SD-CG1 4.45Å
259	K	97.8	Very high	96.7	Very high	134 Å²	134	62.9 Å²	62.9	58%	0.583	29%	0.287	S	S	*	.	H	α-helix	trans	-63.9	-31.7	175.9	-158.4	-172.6	179.9	176.8	0	112	M255 D256 Y257 R263	M255-K259 WeakPolarHBondContact O-CB 3.28Å; M255-K259 PolarHBondContact O-N 3.06Å; D256-K259 PolarHBondContact O-N 3.17Å; Y257-K259 VanDerWaalsContact C-N 3.3Å; Y257-K259 PolarHBondContact O-N 3.37Å; K259-R263 WeakPolarHBondContact O-CG 3.35Å; K259-R263 PolarHBondContact O-NH1 3.37Å
260	R	98.3	Very high	97	Very high	94 Å²	94	65.2 Å²	65.2	36%	0.355	31%	0.307	S	S	.	.	H	α-helix	trans	-72.3	-55.9	171.8	177.5	175.8	62.8	85.6	-11.3	111.4	D256 Y257 M258 S262 R263 E264 E442	D256-R260 WeakPolarHBondContact O-CB 3.35Å; D256-R260 PolarHBondContact O-N 2.83Å; Y257-R260 WeakPolarHBondContact O-CB 3.41Å; Y257-R260 PolarHBondContact O-N 3.03Å; Y257-R260 VanDerWaalsContact O-N 3.13Å; M258-R260 VanDerWaalsContact C-N 3.27Å; M258-R260 PolarHBondContact O-N 3.28Å; R260-S262 PolarHBondContact O-N 3.49Å; R260-R263 WeakPolarHBondContact O-CB 3.28Å; R260-R263 PolarHBondContact O-N 2.9Å; R260-E264 IonicContact NH1-OE2 2.88Å; R260-E264 PolarHBondContact O-N 3.3Å; R260-E442 IonicContact CZ-OE2 2.76Å; R260-E442 IonicContact NH1-OE1 2.76Å; R260-E442 IonicContact NH1-OE2 2.69Å; R260-E442 PolarHBondContact NH1-OE2 2.86Å; R260-E442 IonicContact NH2-OE2 3.17Å; R260-E442 PolarHBondContact NH2-OE2 3.13Å
261	K	98.3	Very high	97.1	Very high	0 Å²	0	65.1 Å²	65.1	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.5	-29.5	-178.6	-78.6	-75.9	172.6	-158.3	0	112.9	Y257 M258 E264 Y265 V353 E442 V443 L445	Y257-K261 HydrophobicContact CE1-CG 4.27Å; Y257-K261 HydrophobicContact CE2-CG 4.35Å; Y257-K261 PolarHBondContact O-N 2.8Å; M258-K261 PolarHBondContact O-N 3.44Å; K261-E264 WeakPolarHBondContact CD-OE2 3.41Å; K261-E264 WeakPolarHBondContact CE-OE2 3.38Å; K261-E264 IonicContact NZ-OE1 3.62Å; K261-E264 PolarHBondContact NZ-OE1 3.2Å; K261-E264 IonicContact NZ-OE2 3.93Å; K261-E264 PolarHBondContact NZ-OE2 3.41Å; K261-E264 WeakPolarHBondContact O-CB 3.47Å; K261-E264 PolarHBondContact O-N 3.3Å; K261-Y265 PolarHBondContact O-N 2.91Å; K261-V353 HydrophobicContact CB-CG2 3.71Å; K261-E442 WeakPolarHBondContact CE-OE1 3.36Å; K261-E442 WeakPolarHBondContact CE-OE2 3.15Å; K261-E442 IonicContact NZ-OE1 3.75Å; K261-E442 PolarHBondContact NZ-OE1 3.36Å; K261-E442 IonicContact NZ-OE2 2.8Å; K261-E442 PolarHBondContact NZ-OE2 2.88Å; K261-V443 WeakPolarHBondContact CE-O 3.13Å; K261-V443 PolarHBondContact NZ-O 2.89Å; K261-L445 HydrophobicContact CB-CD1 4.48Å; K261-L445 HydrophobicContact CD-CD1 3.68Å; K261-L445 HydrophobicContact CD-CD2 4.27Å; K261-L445 HydrophobicContact CD-CG 3.83Å
262	S	98.3	Very high	97.4	Very high	12 Å²	12	65.3 Å²	65.3	8%	0.084	30%	0.297	C	S	.	.	H	α-helix	trans	-71.6	-27.8	171.3	-166.4	0	0	0	0	113.7	M258 R260 E266 H347	M258-S262 VanDerWaalsContact O-CB 3.29Å; M258-S262 WeakPolarHBondContact O-CB 3.47Å; M258-S262 PolarHBondContact O-N 2.96Å; R260-S262 PolarHBondContact O-N 3.49Å; S262-E266 WeakPolarHBondContact O-CG 3.41Å; S262-E266 PolarHBondContact O-N 3.49Å; S262-H347 PolarHBondContact OG-CE1 3.09Å; S262-H347 VanDerWaalsContact OG-CE1 3.32Å
263	R	98.6	Very high	97.5	Very high	145 Å²	145	60.2 Å²	60.2	55%	0.547	30%	0.296	S	S	.	.	H	α-helix	trans	-75.1	-37.1	171.6	-70.9	-172.8	-58.3	-89.2	7.1	111.7	K259 R260 Y265 E266 Q267	K259-R263 WeakPolarHBondContact O-CG 3.35Å; K259-R263 PolarHBondContact O-NH1 3.37Å; R260-R263 WeakPolarHBondContact O-CB 3.28Å; R260-R263 PolarHBondContact O-N 2.9Å; R263-Y265 VanDerWaalsContact C-N 3.28Å; R263-Y265 PolarHBondContact O-N 2.79Å; R263-E266 PolarHBondContact O-N 3.48Å; R263-Q267 PolarHBondContact O-N 3.26Å
264	E	98.6	Very high	97.4	Very high	52 Å²	52	63.2 Å²	63.2	24%	0.243	31%	0.31	C	S	.	.	H	α-helix	trans	-59.4	-40.8	171.9	-164.6	-177	131.4	0	0	110.7	R260 K261 Q267 L268 L445	R260-E264 IonicContact NH1-OE2 2.88Å; R260-E264 PolarHBondContact O-N 3.3Å; K261-E264 WeakPolarHBondContact CD-OE2 3.41Å; K261-E264 WeakPolarHBondContact CE-OE2 3.38Å; K261-E264 IonicContact NZ-OE1 3.62Å; K261-E264 PolarHBondContact NZ-OE1 3.2Å; K261-E264 IonicContact NZ-OE2 3.93Å; K261-E264 PolarHBondContact NZ-OE2 3.41Å; K261-E264 WeakPolarHBondContact O-CB 3.47Å; K261-E264 PolarHBondContact O-N 3.3Å; E264-Q267 PolarHBondContact O-N 3.37Å; E264-L268 VanDerWaalsContact O-CG 3.26Å; E264-L268 WeakPolarHBondContact O-CG 3.49Å; E264-L268 PolarHBondContact O-N 3.49Å; E264-L445 HydrophobicContact CB-CD1 4.07Å; E264-L445 HydrophobicContact CG-CD1 4.03Å; E264-L445 WeakPolarHBondContact OE1-CD1 3.36Å; E264-L445 WeakPolarHBondContact OE1-CG 3.43Å
265	Y	98.6	Very high	97.4	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-58.4	-52	170.4	174	-105.8	0	0	0	113.5	K261 R263 Q267 L268 K269 D316 L317 T320 E348 G349 F352	K261-Y265 PolarHBondContact O-N 2.91Å; R263-Y265 VanDerWaalsContact C-N 3.28Å; R263-Y265 PolarHBondContact O-N 2.79Å; Y265-Q267 PolarHBondContact O-N 3Å; Y265-L268 PolarHBondContact O-N 3.11Å; Y265-L268 VanDerWaalsContact O-N 3.1Å; Y265-K269 HydrophobicContact CE1-CD 4.07Å; Y265-K269 WeakPolarHBondContact O-CB 3.22Å; Y265-K269 PolarHBondContact O-N 3.23Å; Y265-D316 PolarHBondContact OH-O 2.72Å; Y265-L317 WeakPolarHBondContact OH-CA 3.22Å; Y265-L317 PolarHBondContact OH-N 2.73Å; Y265-T320 HydrophobicContact CD2-CG2 4.08Å; Y265-T320 HydrophobicContact CE2-CG2 3.7Å; Y265-E348 HydrophobicContact CE1-CB 4.33Å; Y265-E348 HydrophobicContact CE1-CG 3.82Å; Y265-E348 VanDerWaalsContact CE1-OE1 3.29Å; Y265-E348 WeakPolarHBondContact CE1-OE1 3.29Å; Y265-E348 VanDerWaalsContact CZ-OE1 3.3Å; Y265-E348 PolarHBondContact OH-OE1 3.47Å; Y265-G349 VanDerWaalsContact CD1-CA 3.44Å; Y265-F352 HydrophobicContact CD2-CB 3.56Å; Y265-F352 AromaticContact CD2-CD1 3.3Å; Y265-F352 HydrophobicContact CD2-CD1 3.3Å; Y265-F352 AromaticContact CD2-CD2 3.6Å; Y265-F352 HydrophobicContact CD2-CD2 3.6Å; Y265-F352 AromaticContact CD2-CE1 3.81Å; Y265-F352 HydrophobicContact CD2-CE1 3.81Å; Y265-F352 HydrophobicContact CD2-CE2 4.08Å; Y265-F352 AromaticContact CD2-CG 3.17Å; Y265-F352 HydrophobicContact CD2-CG 3.17Å; Y265-F352 HydrophobicContact CD2-CZ 4.17Å; Y265-F352 HydrophobicContact CE2-CB 3.66Å; Y265-F352 HydrophobicContact CE2-CD1 4.01Å; Y265-F352 AromaticContact CE2-CD2 3.38Å; Y265-F352 HydrophobicContact CE2-CD2 3.38Å; Y265-F352 AromaticContact CE2-CE2 3.96Å; Y265-F352 HydrophobicContact CE2-CE2 3.96Å; Y265-F352 AromaticContact CE2-CG 3.39Å; Y265-F352 HydrophobicContact CE2-CG 3.39Å; Y265-F352 HydrophobicContact CE2-CZ 4.49Å; Y265-F352 HydrophobicContact CG-CB 4.1Å; Y265-F352 HydrophobicContact CG-CD1 4.07Å; Y265-F352 HydrophobicContact CG-CG 4.09Å
266	E	98.6	Very high	97.3	Very high	87 Å²	87	61.2 Å²	61.2	41%	0.407	30%	0.298	S	S	.	.	H	α-helix	trans	-60.6	-34.6	179.5	-61.6	-51.5	144.5	0	0	112.2	S262 R263 K269 S270	S262-E266 WeakPolarHBondContact O-CG 3.41Å; S262-E266 PolarHBondContact O-N 3.49Å; R263-E266 PolarHBondContact O-N 3.48Å; E266-K269 PolarHBondContact O-N 3.07Å; E266-S270 PolarHBondContact O-N 3.23Å
267	Q	98.4	Very high	97.2	Very high	112 Å²	112	58.9 Å²	58.9	52%	0.523	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-53.2	171.3	177.4	176.6	-11.5	0	0	111	R263 E264 Y265 K269 S270 E271	R263-Q267 PolarHBondContact O-N 3.26Å; E264-Q267 PolarHBondContact O-N 3.37Å; Y265-Q267 PolarHBondContact O-N 3Å; Q267-K269 PolarHBondContact O-N 2.9Å; Q267-S270 WeakPolarHBondContact O-CA 3.35Å; Q267-S270 WeakPolarHBondContact O-CB 3.37Å; Q267-S270 PolarHBondContact O-N 2.81Å; Q267-S270 PolarHBondContact O-OG 3.31Å; Q267-E271 HydrophobicContact CG-CG 4.43Å; Q267-E271 VanDerWaalsContact CG-OE1 3.23Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.46Å; Q267-E271 PolarHBondContact NE2-OE1 3.06Å; Q267-E271 WeakPolarHBondContact O-CG 3.35Å; Q267-E271 PolarHBondContact O-N 3.12Å; Q267-E271 VanDerWaalsContact O-N 3.07Å
268	L	98.4	Very high	97.2	Very high	6 Å²	6	63.7 Å²	63.7	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-58.6	-35.4	178.7	-67.9	170.3	0	0	0	112.7	E264 Y265 E271 R275 T320 T324 L445 V446	E264-L268 VanDerWaalsContact O-CG 3.26Å; E264-L268 WeakPolarHBondContact O-CG 3.49Å; E264-L268 PolarHBondContact O-N 3.49Å; Y265-L268 PolarHBondContact O-N 3.11Å; Y265-L268 VanDerWaalsContact O-N 3.1Å; L268-E271 PolarHBondContact O-N 2.84Å; L268-R275 VanDerWaalsContact CD2-CZ 3.49Å; L268-R275 VanDerWaalsContact CD2-NH2 3.3Å; L268-T320 HydrophobicContact CB-CG2 3.95Å; L268-T324 HydrophobicContact CB-CG2 4.05Å; L268-T324 HydrophobicContact CD1-CG2 4.28Å; L268-T324 HydrophobicContact CD2-CG2 3.94Å; L268-T324 HydrophobicContact CG-CG2 4.3Å; L268-L445 HydrophobicContact CD1-CB 3.64Å; L268-L445 HydrophobicContact CD1-CD1 4.37Å; L268-V446 HydrophobicContact CD1-CG2 3.96Å; L268-V446 HydrophobicContact CD2-CG2 3.61Å; L268-V446 HydrophobicContact CG-CG2 4.46Å
269	K	98.3	Very high	97.1	Very high	40 Å²	40	70.7 Å²	70.7	17%	0.174	35%	0.354	C	S	.	.	H	α-helix	trans	-64.4	-40.7	172.9	-177.2	174.5	178.7	167.5	0	112.1	Y265 E266 Q267 E271 W272 D316 E348	Y265-K269 HydrophobicContact CE1-CD 4.07Å; Y265-K269 WeakPolarHBondContact O-CB 3.22Å; Y265-K269 PolarHBondContact O-N 3.23Å; E266-K269 PolarHBondContact O-N 3.07Å; Q267-K269 PolarHBondContact O-N 2.9Å; K269-E271 VanDerWaalsContact C-N 3.28Å; K269-E271 PolarHBondContact O-N 3.31Å; K269-W272 HydrophobicContact CG-CH2 4.44Å; K269-W272 HydrophobicContact CG-CZ2 3.88Å; K269-D316 HydrophobicContact CD-CB 4.43Å; K269-D316 WeakPolarHBondContact CE-OD2 3.43Å; K269-D316 IonicContact NZ-OD2 2.88Å; K269-D316 PolarHBondContact NZ-OD2 3.28Å; K269-E348 IonicContact NZ-OE1 3.46Å; K269-E348 PolarHBondContact NZ-OE1 3.23Å; K269-E348 IonicContact NZ-OE2 3.67Å; K269-E348 PolarHBondContact NZ-OE2 3Å
270	S	98	Very high	96.9	Very high	88 Å²	88	65.5 Å²	65.5	62%	0.615	33%	0.332	S	S	*	.	H	α-helix	trans	-70.5	-21.9	175.1	78.6	0	0	0	0	114.1	E266 Q267	E266-S270 PolarHBondContact O-N 3.23Å; Q267-S270 WeakPolarHBondContact O-CA 3.35Å; Q267-S270 WeakPolarHBondContact O-CB 3.37Å; Q267-S270 PolarHBondContact O-N 2.81Å; Q267-S270 PolarHBondContact O-OG 3.31Å
271	E	96.7	Very high	96.9	Very high	26 Å²	26	62.1 Å²	62.1	12%	0.121	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	2.5	-174.5	-74	175.6	-176	0	0	114.6	Q267 L268 K269 A273 Q274 R275	Q267-E271 HydrophobicContact CG-CG 4.43Å; Q267-E271 VanDerWaalsContact CG-OE1 3.23Å; Q267-E271 WeakPolarHBondContact CG-OE1 3.46Å; Q267-E271 PolarHBondContact NE2-OE1 3.06Å; Q267-E271 WeakPolarHBondContact O-CG 3.35Å; Q267-E271 PolarHBondContact O-N 3.12Å; Q267-E271 VanDerWaalsContact O-N 3.07Å; L268-E271 PolarHBondContact O-N 2.84Å; K269-E271 VanDerWaalsContact C-N 3.28Å; K269-E271 PolarHBondContact O-N 3.31Å; E271-A273 VanDerWaalsContact C-N 3.32Å; E271-A273 PolarHBondContact O-N 3.39Å; E271-A273 VanDerWaalsContact O-N 3.16Å; E271-Q274 WeakPolarHBondContact O-CA 3.27Å; E271-Q274 WeakPolarHBondContact O-CB 3.19Å; E271-Q274 PolarHBondContact O-N 2.77Å; E271-R275 HydrophobicContact CB-CG 4.41Å; E271-R275 PolarHBondContact O-N 2.97Å; E271-R275 IonicContact OE2-CZ 3.82Å; E271-R275 IonicContact OE2-NE 3.27Å; E271-R275 PolarHBondContact OE2-NE 2.74Å; E271-R275 IonicContact OE2-NH2 3.13Å; E271-R275 PolarHBondContact OE2-NH2 3.3Å
272	W	97.3	Very high	96.8	Very high	31 Å²	31	67.2 Å²	67.2	12%	0.117	35%	0.345	C	S	.	.	H	α-helix	trans	-48.7	-48	-174.3	-69.4	-13.3	0	0	0	114.2	K269 Q274 R275 A276 L281 D316 T319 T320	K269-W272 HydrophobicContact CG-CH2 4.44Å; K269-W272 HydrophobicContact CG-CZ2 3.88Å; W272-Q274 PolarHBondContact O-N 3.13Å; W272-R275 PolarHBondContact O-N 3.17Å; W272-R275 VanDerWaalsContact O-N 3.12Å; W272-A276 PolarHBondContact O-N 2.84Å; W272-L281 HydrophobicContact CB-CD1 3.89Å; W272-L281 HydrophobicContact CB-CD2 3.87Å; W272-L281 HydrophobicContact CD2-CD1 4.41Å; W272-L281 HydrophobicContact CE3-CD1 4.4Å; W272-L281 HydrophobicContact CG-CD1 4.26Å; W272-D316 HydrophobicContact CH2-CB 4.07Å; W272-D316 HydrophobicContact CZ2-CB 4.16Å; W272-T319 HydrophobicContact CD2-CG2 3.95Å; W272-T319 HydrophobicContact CE3-CG2 4.16Å; W272-T319 HydrophobicContact CH2-CG2 3.97Å; W272-T319 HydrophobicContact CZ2-CG2 3.73Å; W272-T319 HydrophobicContact CZ3-CG2 4.19Å; W272-T320 WeakPolarHBondContact CZ2-OG1 3.31Å; W272-T320 PolarHBondContact NE1-OG1 3.17Å
273	A	94.7	Very high	96.7	Very high	84 Å²	84	72.9 Å²	72.9	69%	0.694	37%	0.368	S	S	*	.	H	α-helix	trans	-73.4	-7	-178.9	0	0	0	0	0	114.3	E271 L281	E271-A273 VanDerWaalsContact C-N 3.32Å; E271-A273 PolarHBondContact O-N 3.39Å; E271-A273 VanDerWaalsContact O-N 3.16Å; A273-L281 HydrophobicContact CB-CD2 4.4Å
274	Q	95.2	Very high	96.6	Very high	156 Å²	156	66.4 Å²	66.4	73%	0.729	34%	0.344	S	S	*	.	H	α-helix	trans	-94.4	-20.9	171.7	-51.1	178.2	37.2	0	0	111.5	E271 W272	E271-Q274 WeakPolarHBondContact O-CA 3.27Å; E271-Q274 WeakPolarHBondContact O-CB 3.19Å; E271-Q274 PolarHBondContact O-N 2.77Å; W272-Q274 PolarHBondContact O-N 3.13Å
275	R	93.7	Very high	96.6	Very high	104 Å²	104	67.7 Å²	67.7	39%	0.392	35%	0.347	S	S	.	.	H	α-helix	trans	-104.6	-22.3	-172.1	-69.3	173.7	173.8	-88.9	-3.7	113.8	L268 E271 W272 V323	L268-R275 VanDerWaalsContact CD2-CZ 3.49Å; L268-R275 VanDerWaalsContact CD2-NH2 3.3Å; E271-R275 HydrophobicContact CB-CG 4.41Å; E271-R275 PolarHBondContact O-N 2.97Å; E271-R275 IonicContact OE2-CZ 3.82Å; E271-R275 IonicContact OE2-NE 3.27Å; E271-R275 PolarHBondContact OE2-NE 2.74Å; E271-R275 IonicContact OE2-NH2 3.13Å; E271-R275 PolarHBondContact OE2-NH2 3.3Å; W272-R275 PolarHBondContact O-N 3.17Å; W272-R275 VanDerWaalsContact O-N 3.12Å; R275-V323 HydrophobicContact CB-CG1 3.43Å; R275-V323 VanDerWaalsContact CB-CG1 3.43Å
276	A	93.8	Very high	96.5	Very high	16 Å²	16	69.3 Å²	69.3	13%	0.132	36%	0.358	C	S	.	.	S	Bend	trans	-132.4	154	174.2	0	0	0	0	0	111	W272 D280 L281 V323	W272-A276 PolarHBondContact O-N 2.84Å; A276-D280 HydrophobicContact CB-CB 4.34Å; A276-L281 HydrophobicContact CB-CB 4.26Å; A276-V323 HydrophobicContact CB-CG1 4.22Å; A276-V323 HydrophobicContact CB-CG2 4.34Å
277	S	95.6	Very high	96.4	Very high	33 Å²	33	67 Å²	67	23%	0.231	35%	0.35	C	S	.	.			trans	-70	161.1	172.3	88	0	0	0	0	111	E279 D280 L281	S277-E279 VanDerWaalsContact C-N 3.33Å; S277-E279 PolarHBondContact O-N 2.97Å; S277-D280 WeakPolarHBondContact CB-OD2 3.29Å; S277-D280 PolarHBondContact O-N 3.02Å; S277-D280 VanDerWaalsContact O-N 3.15Å; S277-D280 PolarHBondContact OG-N 3.36Å; S277-D280 PolarHBondContact OG-OD2 3.29Å; S277-L281 WeakPolarHBondContact O-CB 3.37Å; S277-L281 PolarHBondContact O-N 3.31Å
278	P	96.3	Very high	96.3	Very high	115 Å²	115	61.6 Å²	61.6	75%	0.747	33%	0.325	S	S	*	.	H	α-helix	trans	-59	-40.5	179.8	-25.7	35.6	0	0	0	113.8	D280 E282	P278-D280 VanDerWaalsContact C-N 3.32Å; P278-D280 PolarHBondContact O-N 3.48Å; P278-E282 PolarHBondContact O-N 3.4Å
279	E	96	Very high	96.3	Very high	150 Å²	150	64.9 Å²	64.9	70%	0.701	34%	0.342	S	S	*	.	H	α-helix	trans	-63.7	-39.9	176.9	-64	-176.8	-151.6	0	0	111.3	S277 F283	S277-E279 VanDerWaalsContact C-N 3.33Å; S277-E279 PolarHBondContact O-N 2.97Å; E279-F283 WeakPolarHBondContact O-CB 2.83Å; E279-F283 PolarHBondContact O-N 2.89Å
280	D	94.2	Very high	96.2	Very high	25 Å²	25	69.2 Å²	69.2	13%	0.134	36%	0.361	C	S	.	.	H	α-helix	trans	-74.5	-41.1	-177.5	-65	-48.3	0	0	0	113	A276 S277 P278 E282 F283 I284 R466	A276-D280 HydrophobicContact CB-CB 4.34Å; S277-D280 WeakPolarHBondContact CB-OD2 3.29Å; S277-D280 PolarHBondContact O-N 3.02Å; S277-D280 VanDerWaalsContact O-N 3.15Å; S277-D280 PolarHBondContact OG-N 3.36Å; S277-D280 PolarHBondContact OG-OD2 3.29Å; P278-D280 VanDerWaalsContact C-N 3.32Å; P278-D280 PolarHBondContact O-N 3.48Å; D280-E282 VanDerWaalsContact C-N 3.32Å; D280-F283 PolarHBondContact O-N 3.45Å; D280-I284 WeakPolarHBondContact O-CB 3.42Å; D280-I284 VanDerWaalsContact O-CG1 3.27Å; D280-I284 WeakPolarHBondContact O-CG1 3.46Å; D280-I284 PolarHBondContact O-N 3.47Å; D280-R466 VanDerWaalsContact CG-CD 3.4Å; D280-R466 WeakPolarHBondContact OD1-CD 3.41Å; D280-R466 IonicContact OD1-CZ 3.47Å; D280-R466 IonicContact OD1-NE 3.25Å; D280-R466 PolarHBondContact OD1-NE 2.81Å; D280-R466 IonicContact OD1-NH1 2.71Å; D280-R466 PolarHBondContact OD1-NH1 2.85Å; D280-R466 WeakPolarHBondContact OD2-CD 3.41Å; D280-R466 IonicContact OD2-CZ 3.19Å; D280-R466 VanDerWaalsContact OD2-CZ 3.27Å; D280-R466 IonicContact OD2-NE 3.57Å; D280-R466 PolarHBondContact OD2-NE 3.48Å; D280-R466 VanDerWaalsContact OD2-NE 3.13Å; D280-R466 IonicContact OD2-NH1 2.71Å; D280-R466 IonicContact OD2-NH2 3.55Å
281	L	96.8	Very high	96.1	Very high	23 Å²	23	65.5 Å²	65.5	12%	0.12	33%	0.334	C	S	.	.	H	α-helix	trans	-63.5	-41.9	177.4	-179.4	55.4	0	0	0	110.2	W272 A273 A276 S277 I284 R285 T319 V323	W272-L281 HydrophobicContact CB-CD1 3.89Å; W272-L281 HydrophobicContact CB-CD2 3.87Å; W272-L281 HydrophobicContact CD2-CD1 4.41Å; W272-L281 HydrophobicContact CE3-CD1 4.4Å; W272-L281 HydrophobicContact CG-CD1 4.26Å; A273-L281 HydrophobicContact CB-CD2 4.4Å; A276-L281 HydrophobicContact CB-CB 4.26Å; S277-L281 WeakPolarHBondContact O-CB 3.37Å; S277-L281 PolarHBondContact O-N 3.31Å; L281-I284 PolarHBondContact O-N 3.41Å; L281-R285 HydrophobicContact CD1-CG 4.16Å; L281-R285 WeakPolarHBondContact O-CB 3.34Å; L281-R285 VanDerWaalsContact O-CD 3.31Å; L281-R285 WeakPolarHBondContact O-CD 3.11Å; L281-R285 WeakPolarHBondContact O-CG 3.44Å; L281-R285 PolarHBondContact O-N 3.22Å; L281-T319 HydrophobicContact CD1-CG2 4.1Å; L281-V323 HydrophobicContact CD1-CG2 3.94Å
282	E	96.9	Very high	96.2	Very high	106 Å²	106	64.3 Å²	64.3	50%	0.495	33%	0.329	S	S	.	.	H	α-helix	trans	-71.9	-34.8	176.6	-169.8	52.2	-147.6	0	0	112.5	P278 D280 R285 S286	P278-E282 PolarHBondContact O-N 3.4Å; D280-E282 VanDerWaalsContact C-N 3.32Å; E282-R285 IonicContact OE2-NE 3.93Å; E282-R285 PolarHBondContact OE2-NE 3.35Å; E282-S286 VanDerWaalsContact O-CB 3.22Å; E282-S286 WeakPolarHBondContact O-CB 3.18Å; E282-S286 PolarHBondContact O-N 3.37Å; E282-S286 PolarHBondContact O-OG 3.2Å
283	F	96.3	Very high	96.2	Very high	132 Å²	132	65.1 Å²	65.1	58%	0.579	34%	0.335	S	S	*	.	H	α-helix	trans	-62.1	-43.6	170.3	178.7	-96.6	0	0	0	112.6	E279 D280 S286 T287	E279-F283 WeakPolarHBondContact O-CB 2.83Å; E279-F283 PolarHBondContact O-N 2.89Å; D280-F283 PolarHBondContact O-N 3.45Å; F283-S286 PolarHBondContact O-OG 2.77Å; F283-T287 VanDerWaalsContact O-CB 3.29Å; F283-T287 WeakPolarHBondContact O-CB 3.5Å; F283-T287 PolarHBondContact O-N 3.18Å; F283-T287 VanDerWaalsContact O-N 3.1Å; F283-T287 PolarHBondContact O-OG1 3.46Å
284	I	96.9	Very high	96.1	Very high	8 Å²	8	64.1 Å²	64.1	4%	0.041	31%	0.313	C	S	.	.	H	α-helix	trans	-63	-54.6	176.3	-72.5	166.3	0	0	0	109.7	D280 L281 S286 T287 V288 T319 A322 V323	D280-I284 WeakPolarHBondContact O-CB 3.42Å; D280-I284 VanDerWaalsContact O-CG1 3.27Å; D280-I284 WeakPolarHBondContact O-CG1 3.46Å; D280-I284 PolarHBondContact O-N 3.47Å; L281-I284 PolarHBondContact O-N 3.41Å; I284-S286 PolarHBondContact O-N 3.41Å; I284-T287 PolarHBondContact O-N 3.34Å; I284-T287 VanDerWaalsContact O-N 3.1Å; I284-V288 HydrophobicContact CG2-CG2 4.15Å; I284-V288 VanDerWaalsContact O-CG2 3.24Å; I284-V288 WeakPolarHBondContact O-CG2 3.49Å; I284-V288 PolarHBondContact O-N 3.48Å; I284-T319 HydrophobicContact CG2-CG2 4.35Å; I284-A322 HydrophobicContact CG2-CB 3.66Å; I284-V323 HydrophobicContact CD1-CG2 4.01Å
285	R	97.8	Very high	96.2	Very high	79 Å²	79	56.7 Å²	56.7	30%	0.298	28%	0.279	S	S	.	.	H	α-helix	trans	-56.7	-50.3	-178.9	-72.7	163.2	56.4	73.1	8.3	112.1	L281 E282 T287 V288 L289 T319	L281-R285 HydrophobicContact CD1-CG 4.16Å; L281-R285 WeakPolarHBondContact O-CB 3.34Å; L281-R285 VanDerWaalsContact O-CD 3.31Å; L281-R285 WeakPolarHBondContact O-CD 3.11Å; L281-R285 WeakPolarHBondContact O-CG 3.44Å; L281-R285 PolarHBondContact O-N 3.22Å; E282-R285 IonicContact OE2-NE 3.93Å; E282-R285 PolarHBondContact OE2-NE 3.35Å; R285-T287 PolarHBondContact O-N 3.19Å; R285-V288 PolarHBondContact O-N 3.5Å; R285-L289 VanDerWaalsContact O-CB 3.26Å; R285-L289 WeakPolarHBondContact O-CB 3.24Å; R285-L289 PolarHBondContact O-N 3.08Å; R285-T319 HydrophobicContact CG-CG2 3.69Å
286	S	96.8	Very high	96.2	Very high	35 Å²	35	52 Å²	52	25%	0.245	26%	0.262	C	S	.	.	H	α-helix	trans	-67.3	-22.1	179.3	65.4	0	0	0	0	113.6	E282 F283 I284 K290	E282-S286 VanDerWaalsContact O-CB 3.22Å; E282-S286 WeakPolarHBondContact O-CB 3.18Å; E282-S286 PolarHBondContact O-N 3.37Å; E282-S286 PolarHBondContact O-OG 3.2Å; F283-S286 PolarHBondContact O-OG 2.77Å; I284-S286 PolarHBondContact O-N 3.41Å; S286-K290 VanDerWaalsContact O-CD 3.24Å; S286-K290 WeakPolarHBondContact O-CD 3.43Å; S286-K290 WeakPolarHBondContact O-CE 3.41Å; S286-K290 VanDerWaalsContact O-CG 3.25Å; S286-K290 WeakPolarHBondContact O-CG 3.39Å
287	T	95.6	Very high	96.3	Very high	37 Å²	37	54.6 Å²	54.6	23%	0.227	27%	0.268	C	S	.	.	H	α-helix	trans	-82	-44.3	172.9	-57.6	0	0	0	0	111.6	F283 I284 R285 L289 K290 Y330	F283-T287 VanDerWaalsContact O-CB 3.29Å; F283-T287 WeakPolarHBondContact O-CB 3.5Å; F283-T287 PolarHBondContact O-N 3.18Å; F283-T287 VanDerWaalsContact O-N 3.1Å; F283-T287 PolarHBondContact O-OG1 3.46Å; I284-T287 PolarHBondContact O-N 3.34Å; I284-T287 VanDerWaalsContact O-N 3.1Å; R285-T287 PolarHBondContact O-N 3.19Å; T287-L289 VanDerWaalsContact C-N 3.35Å; T287-L289 PolarHBondContact O-N 2.96Å; T287-K290 PolarHBondContact O-N 3.48Å; T287-Y330 HydrophobicContact CG2-CD1 3.96Å; T287-Y330 HydrophobicContact CG2-CE1 4.41Å
288	V	98.3	Very high	96.1	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-57.2	-47.3	172.7	171.7	0	0	0	0	110.6	I284 R285 K290 D291 V292 H315 L318 Y330	I284-V288 HydrophobicContact CG2-CG2 4.15Å; I284-V288 VanDerWaalsContact O-CG2 3.24Å; I284-V288 WeakPolarHBondContact O-CG2 3.49Å; I284-V288 PolarHBondContact O-N 3.48Å; R285-V288 PolarHBondContact O-N 3.5Å; V288-K290 PolarHBondContact O-N 3.3Å; V288-D291 WeakPolarHBondContact O-CB 3.45Å; V288-D291 PolarHBondContact O-N 3.47Å; V288-D291 VanDerWaalsContact O-N 3.1Å; V288-V292 HydrophobicContact CG1-CG2 3.96Å; V288-V292 WeakPolarHBondContact O-CG2 3.3Å; V288-V292 PolarHBondContact O-N 3.31Å; V288-H315 HydrophobicContact CG1-CB 4.4Å; V288-L318 HydrophobicContact CG1-CB 3.62Å; V288-L318 HydrophobicContact CG1-CD1 4.12Å; V288-L318 HydrophobicContact CG2-CB 4.27Å; V288-Y330 HydrophobicContact CG2-CD1 4.1Å; V288-Y330 HydrophobicContact CG2-CD2 3.59Å; V288-Y330 HydrophobicContact CG2-CE2 4.16Å; V288-Y330 HydrophobicContact CG2-CG 3.58Å
289	L	97.8	Very high	96.1	Very high	75 Å²	75	53.9 Å²	53.9	39%	0.393	27%	0.266	S	S	.	.	H	α-helix	trans	-60.6	-42.5	-175.8	-175.5	61.6	0	0	0	112.7	R285 T287 D291 V292 L293	R285-L289 VanDerWaalsContact O-CB 3.26Å; R285-L289 WeakPolarHBondContact O-CB 3.24Å; R285-L289 PolarHBondContact O-N 3.08Å; T287-L289 VanDerWaalsContact C-N 3.35Å; T287-L289 PolarHBondContact O-N 2.96Å; L289-D291 PolarHBondContact O-N 3.36Å; L289-V292 PolarHBondContact O-N 2.92Å; L289-L293 HydrophobicContact CD1-CD1 4.13Å; L289-L293 HydrophobicContact CD1-CD2 4.25Å; L289-L293 HydrophobicContact CD1-CG 3.95Å; L289-L293 HydrophobicContact CG-CD1 4Å; L289-L293 HydrophobicContact CG-CG 4.25Å; L289-L293 VanDerWaalsContact O-CG 3.3Å; L289-L293 WeakPolarHBondContact O-CG 3.31Å; L289-L293 PolarHBondContact O-N 2.95Å
290	K	96.1	Very high	96	Very high	131 Å²	131	51.9 Å²	51.9	57%	0.57	27%	0.266	S	S	*	.	H	α-helix	trans	-56.8	-36.9	176	-70.3	162.5	-163.7	159.6	0	112.2	S286 T287 V288 R294	S286-K290 VanDerWaalsContact O-CD 3.24Å; S286-K290 WeakPolarHBondContact O-CD 3.43Å; S286-K290 WeakPolarHBondContact O-CE 3.41Å; S286-K290 VanDerWaalsContact O-CG 3.25Å; S286-K290 WeakPolarHBondContact O-CG 3.39Å; T287-K290 PolarHBondContact O-N 3.48Å; V288-K290 PolarHBondContact O-N 3.3Å; K290-R294 WeakPolarHBondContact O-CD 3.44Å; K290-R294 WeakPolarHBondContact O-CG 3.47Å
291	D	96.5	Very high	96.1	Very high	9 Å²	9	52.4 Å²	52.4	5%	0.048	27%	0.267	C	S	.	.	H	α-helix	trans	-78.8	-40.9	177.8	-97	15.7	0	0	0	112.6	V288 L289 R294 T295 Y330 Q332 G333	V288-D291 WeakPolarHBondContact O-CB 3.45Å; V288-D291 PolarHBondContact O-N 3.47Å; V288-D291 VanDerWaalsContact O-N 3.1Å; L289-D291 PolarHBondContact O-N 3.36Å; D291-R294 VanDerWaalsContact CG-NH2 3.29Å; D291-R294 WeakPolarHBondContact O-CG 3.24Å; D291-R294 PolarHBondContact O-N 3.27Å; D291-R294 IonicContact OD1-CZ 3.07Å; D291-R294 IonicContact OD1-NE 2.62Å; D291-R294 PolarHBondContact OD1-NE 3.29Å; D291-R294 IonicContact OD1-NH2 3.48Å; D291-R294 PolarHBondContact OD1-NH2 2.77Å; D291-R294 IonicContact OD2-NH2 2.72Å; D291-R294 PolarHBondContact OD2-NH2 2.66Å; D291-T295 WeakPolarHBondContact O-CB 3.27Å; D291-T295 PolarHBondContact O-N 3.4Å; D291-T295 PolarHBondContact O-OG1 3.03Å; D291-Y330 HydrophobicContact CB-CE1 4.24Å; D291-Y330 WeakPolarHBondContact CB-OH 3.32Å; D291-Y330 PolarHBondContact OD2-OH 3.02Å; D291-Q332 WeakPolarHBondContact OD2-CA 3.49Å; D291-G333 PolarHBondContact OD2-N 3.29Å
292	V	97.9	Very high	96.1	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.261	C	S	.	.	H	α-helix	trans	-61.6	-46.6	177.8	167.5	0	0	0	0	111.7	V288 L289 R294 T295 L311 L314 H315 L318	V288-V292 HydrophobicContact CG1-CG2 3.96Å; V288-V292 WeakPolarHBondContact O-CG2 3.3Å; V288-V292 PolarHBondContact O-N 3.31Å; L289-V292 PolarHBondContact O-N 2.92Å; V292-R294 PolarHBondContact O-N 3.32Å; V292-R294 VanDerWaalsContact O-N 3.12Å; V292-T295 PolarHBondContact O-N 2.89Å; V292-L311 HydrophobicContact CG1-CB 3.96Å; V292-L311 HydrophobicContact CG1-CD2 3.84Å; V292-L311 HydrophobicContact CG1-CG 4.46Å; V292-L311 WeakPolarHBondContact CG1-O 3.25Å; V292-L314 HydrophobicContact CG1-CB 4.38Å; V292-L314 HydrophobicContact CG1-CD2 4.38Å; V292-L314 HydrophobicContact CG2-CB 4.4Å; V292-L314 HydrophobicContact CG2-CD2 4.19Å; V292-L314 HydrophobicContact CG2-CG 4.03Å; V292-H315 HydrophobicContact CG1-CB 4.37Å; V292-H315 HydrophobicContact CG2-CB 4.2Å; V292-L318 HydrophobicContact CG2-CD1 3.89Å
293	L	96.6	Very high	96	Very high	49 Å²	49	49.1 Å²	49.1	26%	0.257	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-23.8	-178.3	-67.3	177.3	0	0	0	113.7	L289 R297 E306	L289-L293 HydrophobicContact CD1-CD1 4.13Å; L289-L293 HydrophobicContact CD1-CD2 4.25Å; L289-L293 HydrophobicContact CD1-CG 3.95Å; L289-L293 HydrophobicContact CG-CD1 4Å; L289-L293 HydrophobicContact CG-CG 4.25Å; L289-L293 VanDerWaalsContact O-CG 3.3Å; L289-L293 WeakPolarHBondContact O-CG 3.31Å; L289-L293 PolarHBondContact O-N 2.95Å; L293-R297 VanDerWaalsContact O-CD 3.27Å; L293-R297 WeakPolarHBondContact O-CD 3.28Å; L293-R297 VanDerWaalsContact O-CG 3.22Å; L293-R297 WeakPolarHBondContact O-CG 3.39Å; L293-R297 PolarHBondContact O-NE 2.89Å; L293-E306 HydrophobicContact CD2-CB 3.64Å; L293-E306 HydrophobicContact CD2-CG 3.88Å
294	R	94.5	Very high	95.7	Very high	63 Å²	63	45.2 Å²	45.2	24%	0.238	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	5.2	176.4	69.5	-175.1	-167.5	81.5	3	114.2	K290 D291 V292 M517	K290-R294 WeakPolarHBondContact O-CD 3.44Å; K290-R294 WeakPolarHBondContact O-CG 3.47Å; D291-R294 VanDerWaalsContact CG-NH2 3.29Å; D291-R294 WeakPolarHBondContact O-CG 3.24Å; D291-R294 PolarHBondContact O-N 3.27Å; D291-R294 IonicContact OD1-CZ 3.07Å; D291-R294 IonicContact OD1-NE 2.62Å; D291-R294 PolarHBondContact OD1-NE 3.29Å; D291-R294 IonicContact OD1-NH2 3.48Å; D291-R294 PolarHBondContact OD1-NH2 2.77Å; D291-R294 IonicContact OD2-NH2 2.72Å; D291-R294 PolarHBondContact OD2-NH2 2.66Å; V292-R294 PolarHBondContact O-N 3.32Å; V292-R294 VanDerWaalsContact O-N 3.12Å; R294-M517 PolarHBondContact NH1-O 2.79Å
295	T	95.4	Very high	95.5	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	28%	0.281	C	S	.	.	S	Bend	trans	-90.4	120.8	-178.3	-65.1	0	0	0	0	110.8	D291 V292 R297 L314 S335	D291-T295 WeakPolarHBondContact O-CB 3.27Å; D291-T295 PolarHBondContact O-N 3.4Å; D291-T295 PolarHBondContact O-OG1 3.03Å; V292-T295 PolarHBondContact O-N 2.89Å; T295-R297 PolarHBondContact O-N 2.76Å; T295-L314 HydrophobicContact CG2-CD2 4.03Å; T295-S335 WeakPolarHBondContact OG1-CB 3.2Å; T295-S335 PolarHBondContact OG1-OG 2.71Å
296	D	95.3	Very high	95.2	Very high	6 Å²	6	51 Å²	51	3%	0.032	30%	0.295	C	S	.	.	S	Bend	trans	42	30.5	171.7	-55.9	-47.2	0	0	0	118.5	A298 H299 Y302 S339 K415 F420 R652	D296-A298 PolarHBondContact O-N 2.84Å; D296-H299 HydrophobicContact CB-CB 4.32Å; D296-H299 WeakPolarHBondContact O-CB 3.48Å; D296-H299 PolarHBondContact O-N 2.97Å; D296-Y302 HydrophobicContact CB-CD2 4.01Å; D296-S339 WeakPolarHBondContact OD2-CB 3.27Å; D296-S339 PolarHBondContact OD2-OG 2.76Å; D296-K415 IonicContact OD1-NZ 3.7Å; D296-K415 PolarHBondContact OD1-NZ 3.17Å; D296-K415 IonicContact OD2-NZ 2.76Å; D296-K415 PolarHBondContact OD2-NZ 3.26Å; D296-F420 HydrophobicContact CB-CD2 4.38Å; D296-F420 HydrophobicContact CB-CE2 4.2Å; D296-R652 IonicContact OD1-NH2 2.74Å; D296-R652 PolarHBondContact OD1-NH2 2.74Å
297	R	94.8	Very high	94.9	Very high	70 Å²	70	54.2 Å²	54.2	26%	0.264	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-11.5	-177.7	-55.6	-72	-86	120.6	-0.5	115.7	L293 T295 Y302 G304	L293-R297 VanDerWaalsContact O-CD 3.27Å; L293-R297 WeakPolarHBondContact O-CD 3.28Å; L293-R297 VanDerWaalsContact O-CG 3.22Å; L293-R297 WeakPolarHBondContact O-CG 3.39Å; L293-R297 PolarHBondContact O-NE 2.89Å; T295-R297 PolarHBondContact O-N 2.76Å; R297-Y302 PolarHBondContact NH1-O 2.91Å; R297-G304 PolarHBondContact NH1-O 2.95Å; R297-G304 PolarHBondContact NH2-O 2.85Å
298	A	92.6	Very high	94.8	Very high	90 Å²	90	53 Å²	53	74%	0.744	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.1	-13.7	173	0	0	0	0	0	114	D296	D296-A298 PolarHBondContact O-N 2.84Å
299	H	94.3	Very high	94.7	Very high	43 Å²	43	57.4 Å²	57.4	20%	0.199	33%	0.333	C	S	.	.	S	Bend	trans	-84.7	133.1	174.6	179.2	-109	0	0	0	109.5	D296 Y301 Y302 A303 F420	D296-H299 HydrophobicContact CB-CB 4.32Å; D296-H299 WeakPolarHBondContact O-CB 3.48Å; D296-H299 PolarHBondContact O-N 2.97Å; H299-Y301 WeakPolarHBondContact ND1-CB 3.38Å; H299-Y301 PolarHBondContact O-N 2.99Å; H299-Y302 CarbonylContact O-C 3.58Å; H299-Y302 PolarHBondContact O-N 2.88Å; H299-A303 PolarHBondContact O-N 2.8Å; H299-A303 VanDerWaalsContact O-N 3.12Å; H299-F420 HydrophobicContact CB-CD2 4.22Å; H299-F420 HydrophobicContact CB-CG 4.36Å; H299-F420 AromaticContact CD2-CD1 3.44Å; H299-F420 VanDerWaalsContact CD2-CD1 3.44Å; H299-F420 WeakPolarHBondContact CD2-CD1 3.42Å; H299-F420 AromaticContact CD2-CE1 3.9Å; H299-F420 AromaticContact CD2-CG 3.68Å; H299-F420 AromaticContact CE1-CD1 3.82Å; H299-F420 AromaticContact CE1-CE1 3.47Å; H299-F420 VanDerWaalsContact CE1-CE1 3.47Å; H299-F420 WeakPolarHBondContact CE1-CE1 3.23Å; H299-F420 AromaticContact CE1-CZ 3.96Å; H299-F420 AromaticContact CG-CD1 3.89Å; H299-F420 AromaticContact CG-CG 3.92Å; H299-F420 AromaticContact ND1-CE1 3.78Å; H299-F420 AromaticContact ND1-CZ 3.85Å; H299-F420 AromaticContact NE2-CD1 3.44Å; H299-F420 WeakPolarHBondContact NE2-CD1 3.46Å; H299-F420 AromaticContact NE2-CE1 3.57Å
300	P	95.6	Very high	94.7	Very high	108 Å²	108	57 Å²	57	70%	0.701	33%	0.329	S	S	*	.	G	3₁₀ helix	trans	-53.4	-33.9	-172.2	-31	36.9	0	0	0	115.5	Y302 A303	P300-Y302 VanDerWaalsContact C-N 3.28Å; P300-Y302 PolarHBondContact O-N 2.88Å; P300-A303 WeakPolarHBondContact O-CB 3.43Å; P300-A303 PolarHBondContact O-N 2.84Å
301	Y	96.4	Very high	94.8	Very high	36 Å²	36	51 Å²	51	14%	0.141	30%	0.303	C	S	.	.	G	3₁₀ helix	trans	-62.3	-32.9	176.9	-167.2	-97.5	0	0	0	113	H299 H310 L342 A343 D346	H299-Y301 WeakPolarHBondContact ND1-CB 3.38Å; H299-Y301 PolarHBondContact O-N 2.99Å; Y301-H310 HydrophobicContact CD1-CB 3.9Å; Y301-H310 AromaticContact CD1-CG 3.98Å; Y301-H310 AromaticContact CD2-ND1 3.99Å; Y301-H310 HydrophobicContact CE1-CB 3.59Å; Y301-H310 AromaticContact CE1-CD2 4Å; Y301-H310 AromaticContact CE1-CG 3.63Å; Y301-H310 AromaticContact CE2-CD2 3.92Å; Y301-H310 AromaticContact CE2-CE1 3.88Å; Y301-H310 AromaticContact CE2-NE2 3.86Å; Y301-H310 AromaticContact CZ-CD2 3.56Å; Y301-H310 AromaticContact CZ-CG 3.65Å; Y301-H310 AromaticContact CZ-NE2 3.99Å; Y301-H310 WeakPolarHBondContact O-CB 3.37Å; Y301-H310 PolarHBondContact O-ND1 3.35Å; Y301-L342 HydrophobicContact CE1-CG 4.21Å; Y301-A343 HydrophobicContact CD1-CB 3.78Å; Y301-A343 HydrophobicContact CE1-CB 4.19Å; Y301-A343 HydrophobicContact CG-CB 4.05Å; Y301-D346 WeakPolarHBondContact CE2-OD1 3.4Å; Y301-D346 PolarHBondContact OH-OD1 2.84Å
302	Y	96.9	Very high	94.9	Very high	2 Å²	2	57.1 Å²	57.1	1%	0.008	33%	0.325	C	S	.	.	G	3₁₀ helix	trans	-108.1	16.3	178.3	-60.3	-66.7	0	0	0	112.9	D296 R297 H299 P300 H310 L311 L314 S339 L342 A343	D296-Y302 HydrophobicContact CB-CD2 4.01Å; R297-Y302 PolarHBondContact NH1-O 2.91Å; H299-Y302 CarbonylContact O-C 3.58Å; H299-Y302 PolarHBondContact O-N 2.88Å; P300-Y302 VanDerWaalsContact C-N 3.28Å; P300-Y302 PolarHBondContact O-N 2.88Å; Y302-H310 HydrophobicContact CD1-CB 4.08Å; Y302-H310 HydrophobicContact CE1-CB 4.11Å; Y302-L311 HydrophobicContact CD1-CD2 3.91Å; Y302-L314 HydrophobicContact CE1-CB 4.43Å; Y302-L314 HydrophobicContact CE1-CD2 4.12Å; Y302-S339 WeakPolarHBondContact CE2-OG 3.46Å; Y302-S339 WeakPolarHBondContact OH-CA 3.48Å; Y302-S339 PolarHBondContact OH-O 3.48Å; Y302-L342 HydrophobicContact CE1-CD2 4.39Å; Y302-L342 WeakPolarHBondContact OH-CB 3.14Å; Y302-A343 HydrophobicContact CE2-CB 4.04Å
303	A	93.4	Very high	94.9	Very high	57 Å²	57	57.6 Å²	57.6	47%	0.471	33%	0.329	S	S	.	.			trans	-78.9	169.3	171.4	0	0	0	0	0	111.4	H299 P300	H299-A303 PolarHBondContact O-N 2.8Å; H299-A303 VanDerWaalsContact O-N 3.12Å; P300-A303 WeakPolarHBondContact O-CB 3.43Å; P300-A303 PolarHBondContact O-N 2.84Å
304	G	91.1	Very high	95	Very high	50 Å²	50	55.3 Å²	55.3	52%	0.515	32%	0.317	S	S	.	.	S	Bend	trans	88.7	-162.2	179.7	0	0	0	0	0	114.2	R297	R297-G304 PolarHBondContact NH1-O 2.95Å; R297-G304 PolarHBondContact NH2-O 2.85Å
305	P	92.3	Very high	95.2	Very high	85 Å²	85	53 Å²	53	55%	0.552	31%	0.309	S	S	*	.			trans	-70.4	158.9	-169.9	31.5	-37.2	0	0	0	113.1	D307 G308	P305-D307 VanDerWaalsContact C-N 3.31Å; P305-D307 WeakPolarHBondContact CB-OD1 3.42Å; P305-D307 PolarHBondContact O-N 3.23Å; P305-G308 PolarHBondContact O-N 2.87Å; P305-G308 VanDerWaalsContact O-N 3.14Å
306	E	90.4	Very high	95.4	Very high	123 Å²	123	54 Å²	54	58%	0.575	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-25.5	-173.3	-69.9	-168.5	161.4	0	0	114	L293 G308	L293-E306 HydrophobicContact CD2-CB 3.64Å; L293-E306 HydrophobicContact CD2-CG 3.88Å; E306-G308 VanDerWaalsContact C-N 3.32Å
307	D	90.4	Very high	95.5	Very high	103 Å²	103	53.7 Å²	53.7	55%	0.551	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	2	174.7	73.7	-49.2	0	0	0	113.3	P305 R312	P305-D307 VanDerWaalsContact C-N 3.31Å; P305-D307 WeakPolarHBondContact CB-OD1 3.42Å; P305-D307 PolarHBondContact O-N 3.23Å; D307-R312 PolarHBondContact O-NE 3.39Å; D307-R312 PolarHBondContact O-NH2 3.08Å; D307-R312 IonicContact OD2-NH2 2.69Å
308	G	93.8	Very high	95.7	Very high	11 Å²	11	50.3 Å²	50.3	11%	0.113	30%	0.3	C	S	.	.			trans	-56.3	152.1	-174.8	0	0	0	0	0	114.2	P305 E306 H310 L311 R312	P305-G308 PolarHBondContact O-N 2.87Å; P305-G308 VanDerWaalsContact O-N 3.14Å; E306-G308 VanDerWaalsContact C-N 3.32Å; G308-H310 VanDerWaalsContact C-N 3.3Å; G308-H310 PolarHBondContact O-N 3.05Å; G308-H310 VanDerWaalsContact O-N 3.16Å; G308-L311 PolarHBondContact O-N 3.07Å; G308-L311 VanDerWaalsContact O-N 3.12Å; G308-R312 PolarHBondContact O-N 3.12Å
309	P	96.8	Very high	96	Very high	94 Å²	94	46 Å²	46	61%	0.61	27%	0.265	S	S	*	.	H	α-helix	trans	-58.9	-36.9	-167	22.6	-33.9	0	0	0	113.5	R312 A313	P309-R312 PolarHBondContact O-N 3.49Å; P309-A313 WeakPolarHBondContact O-CB 3.42Å; P309-A313 PolarHBondContact O-N 3.45Å
310	H	97.6	Very high	96.2	Very high	66 Å²	66	44 Å²	44	31%	0.306	26%	0.255	S	S	.	.	H	α-helix	trans	-73.7	-32.9	-178.8	-51.7	143.8	0	0	0	113.3	Y301 Y302 G308 L314	Y301-H310 HydrophobicContact CD1-CB 3.9Å; Y301-H310 AromaticContact CD1-CG 3.98Å; Y301-H310 AromaticContact CD2-ND1 3.99Å; Y301-H310 HydrophobicContact CE1-CB 3.59Å; Y301-H310 AromaticContact CE1-CD2 4Å; Y301-H310 AromaticContact CE1-CG 3.63Å; Y301-H310 AromaticContact CE2-CD2 3.92Å; Y301-H310 AromaticContact CE2-CE1 3.88Å; Y301-H310 AromaticContact CE2-NE2 3.86Å; Y301-H310 AromaticContact CZ-CD2 3.56Å; Y301-H310 AromaticContact CZ-CG 3.65Å; Y301-H310 AromaticContact CZ-NE2 3.99Å; Y301-H310 WeakPolarHBondContact O-CB 3.37Å; Y301-H310 PolarHBondContact O-ND1 3.35Å; Y302-H310 HydrophobicContact CD1-CB 4.08Å; Y302-H310 HydrophobicContact CE1-CB 4.11Å; G308-H310 VanDerWaalsContact C-N 3.3Å; G308-H310 PolarHBondContact O-N 3.05Å; G308-H310 VanDerWaalsContact O-N 3.16Å; H310-L314 WeakPolarHBondContact O-CB 3.41Å; H310-L314 PolarHBondContact O-N 3.31Å
311	L	97.9	Very high	96.4	Very high	6 Å²	6	39 Å²	39	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-71.7	-39.8	171.8	-68.1	177.6	0	0	0	110.8	V292 Y302 G308 L314 H315	V292-L311 HydrophobicContact CG1-CB 3.96Å; V292-L311 HydrophobicContact CG1-CD2 3.84Å; V292-L311 HydrophobicContact CG1-CG 4.46Å; V292-L311 WeakPolarHBondContact CG1-O 3.25Å; Y302-L311 HydrophobicContact CD1-CD2 3.91Å; G308-L311 PolarHBondContact O-N 3.07Å; G308-L311 VanDerWaalsContact O-N 3.12Å; L311-L314 PolarHBondContact O-N 3.16Å; L311-H315 WeakPolarHBondContact O-CB 3.48Å; L311-H315 PolarHBondContact O-N 2.76Å
312	R	98.1	Very high	96.4	Very high	137 Å²	137	37.4 Å²	37.4	52%	0.517	22%	0.216	S	C	.	.	H	α-helix	trans	-60.1	-46.4	174	-163.9	179.5	-55.9	176.4	1.1	111.6	D307 G308 P309 L314 H315 D316	D307-R312 PolarHBondContact O-NE 3.39Å; D307-R312 PolarHBondContact O-NH2 3.08Å; D307-R312 IonicContact OD2-NH2 2.69Å; G308-R312 PolarHBondContact O-N 3.12Å; P309-R312 PolarHBondContact O-N 3.49Å; R312-L314 PolarHBondContact O-N 2.98Å; R312-H315 PolarHBondContact O-N 3.34Å; R312-D316 WeakPolarHBondContact O-CB 3.31Å; R312-D316 VanDerWaalsContact O-CG 3.22Å; R312-D316 PolarHBondContact O-N 3.36Å
313	A	98.6	Very high	96.4	Very high	11 Å²	11	37.8 Å²	37.8	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-62	-39.9	175	0	0	0	0	0	112.6	P309 L317 L342 E348	P309-A313 WeakPolarHBondContact O-CB 3.42Å; P309-A313 PolarHBondContact O-N 3.45Å; A313-L317 WeakPolarHBondContact O-CB 3.18Å; A313-L317 PolarHBondContact O-N 3.07Å; A313-L342 HydrophobicContact CB-CD1 4.41Å; A313-L342 HydrophobicContact CB-CD2 3.99Å; A313-E348 WeakPolarHBondContact CA-OE2 3.47Å; A313-E348 HydrophobicContact CB-CB 4.26Å; A313-E348 HydrophobicContact CB-CG 3.93Å
314	L	98.8	Very high	96.6	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-65.9	-43.1	175.6	-170.5	62	0	0	0	111.8	V292 T295 Y302 H310 L311 R312 L318 A338 L342	V292-L314 HydrophobicContact CG1-CB 4.38Å; V292-L314 HydrophobicContact CG1-CD2 4.38Å; V292-L314 HydrophobicContact CG2-CB 4.4Å; V292-L314 HydrophobicContact CG2-CD2 4.19Å; V292-L314 HydrophobicContact CG2-CG 4.03Å; T295-L314 HydrophobicContact CG2-CD2 4.03Å; Y302-L314 HydrophobicContact CE1-CB 4.43Å; Y302-L314 HydrophobicContact CE1-CD2 4.12Å; H310-L314 WeakPolarHBondContact O-CB 3.41Å; H310-L314 PolarHBondContact O-N 3.31Å; L311-L314 PolarHBondContact O-N 3.16Å; R312-L314 PolarHBondContact O-N 2.98Å; L314-L318 HydrophobicContact CD1-CD1 4.19Å; L314-L318 HydrophobicContact CG-CD1 4.02Å; L314-L318 WeakPolarHBondContact O-CB 3.47Å; L314-L318 WeakPolarHBondContact O-CD1 3.49Å; L314-L318 WeakPolarHBondContact O-CG 3.4Å; L314-L318 PolarHBondContact O-N 2.79Å; L314-L318 VanDerWaalsContact O-N 3.14Å; L314-A338 HydrophobicContact CD1-CB 3.63Å; L314-L342 HydrophobicContact CB-CD2 3.74Å; L314-L342 HydrophobicContact CD1-CD2 4.05Å; L314-L342 HydrophobicContact CG-CD2 4.49Å
315	H	98.7	Very high	96.9	Very high	14 Å²	14	33.4 Å²	33.4	7%	0.065	18%	0.175	C	C	.	.	H	α-helix	trans	-61	-46.7	175	167.8	-81.6	0	0	0	112.2	V288 V292 L311 R312 L318 T319	V288-H315 HydrophobicContact CG1-CB 4.4Å; V292-H315 HydrophobicContact CG1-CB 4.37Å; V292-H315 HydrophobicContact CG2-CB 4.2Å; L311-H315 WeakPolarHBondContact O-CB 3.48Å; L311-H315 PolarHBondContact O-N 2.76Å; R312-H315 PolarHBondContact O-N 3.34Å; H315-L318 PolarHBondContact O-N 3.31Å; H315-T319 PolarHBondContact CE1-OG1 3.25Å; H315-T319 VanDerWaalsContact O-CB 3.27Å; H315-T319 WeakPolarHBondContact O-CB 3.44Å; H315-T319 PolarHBondContact O-N 2.85Å; H315-T319 PolarHBondContact O-OG1 3.42Å
316	D	98.8	Very high	96.9	Very high	21 Å²	21	32 Å²	32	11%	0.112	17%	0.166	C	C	.	.	H	α-helix	trans	-72.4	-37.3	-175.8	-69.2	-3.8	0	0	0	111.8	Y265 K269 W272 R312 T319 T320 E348	Y265-D316 PolarHBondContact OH-O 2.72Å; K269-D316 HydrophobicContact CD-CB 4.43Å; K269-D316 WeakPolarHBondContact CE-OD2 3.43Å; K269-D316 IonicContact NZ-OD2 2.88Å; K269-D316 PolarHBondContact NZ-OD2 3.28Å; W272-D316 HydrophobicContact CH2-CB 4.07Å; W272-D316 HydrophobicContact CZ2-CB 4.16Å; R312-D316 WeakPolarHBondContact O-CB 3.31Å; R312-D316 VanDerWaalsContact O-CG 3.22Å; R312-D316 PolarHBondContact O-N 3.36Å; D316-T319 PolarHBondContact O-N 3.07Å; D316-T320 WeakPolarHBondContact O-CB 3.15Å; D316-T320 PolarHBondContact O-N 3.07Å; D316-T320 PolarHBondContact O-OG1 3.06Å; D316-E348 WeakPolarHBondContact CB-OE1 3.14Å
317	L	98.8	Very high	96.8	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-58.2	-50.2	171.8	-179.6	164.3	0	0	0	111.3	Y265 A313 T320 Y321 A338 A351 F352 F355	Y265-L317 WeakPolarHBondContact OH-CA 3.22Å; Y265-L317 PolarHBondContact OH-N 2.73Å; A313-L317 WeakPolarHBondContact O-CB 3.18Å; A313-L317 PolarHBondContact O-N 3.07Å; L317-T320 PolarHBondContact O-N 2.76Å; L317-Y321 PolarHBondContact O-N 2.99Å; L317-A338 HydrophobicContact CD2-CB 3.99Å; L317-A351 HydrophobicContact CD1-CB 3.59Å; L317-F352 HydrophobicContact CD1-CB 4.41Å; L317-F352 HydrophobicContact CG-CB 4.08Å; L317-F352 HydrophobicContact CG-CD2 4.18Å; L317-F355 HydrophobicContact CD2-CB 4.09Å; L317-F355 HydrophobicContact CD2-CD1 3.88Å; L317-F355 HydrophobicContact CD2-CE1 4.5Å; L317-F355 HydrophobicContact CD2-CG 3.92Å
318	L	98.8	Very high	96.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.8	-38.8	-178.8	-70.9	168.1	0	0	0	112.3	V288 V292 L314 H315 Y321 A322 Y330 M334 A338 F355	V288-L318 HydrophobicContact CG1-CB 3.62Å; V288-L318 HydrophobicContact CG1-CD1 4.12Å; V288-L318 HydrophobicContact CG2-CB 4.27Å; V292-L318 HydrophobicContact CG2-CD1 3.89Å; L314-L318 HydrophobicContact CD1-CD1 4.19Å; L314-L318 HydrophobicContact CG-CD1 4.02Å; L314-L318 WeakPolarHBondContact O-CB 3.47Å; L314-L318 WeakPolarHBondContact O-CD1 3.49Å; L314-L318 WeakPolarHBondContact O-CG 3.4Å; L314-L318 PolarHBondContact O-N 2.79Å; L314-L318 VanDerWaalsContact O-N 3.14Å; H315-L318 PolarHBondContact O-N 3.31Å; L318-Y321 PolarHBondContact O-N 3.46Å; L318-A322 WeakPolarHBondContact O-CB 3.33Å; L318-A322 PolarHBondContact O-N 3.47Å; L318-Y330 HydrophobicContact CB-CD2 4.26Å; L318-Y330 HydrophobicContact CB-CE2 4.18Å; L318-Y330 HydrophobicContact CD1-CE2 4.03Å; L318-Y330 HydrophobicContact CD2-CD2 4.43Å; L318-Y330 HydrophobicContact CD2-CE2 3.96Å; L318-Y330 HydrophobicContact CG-CE2 4.27Å; L318-M334 HydrophobicContact CD2-CB 4.27Å; L318-A338 HydrophobicContact CD2-CB 3.7Å; L318-A338 HydrophobicContact CG-CB 4.2Å; L318-F355 HydrophobicContact CD2-CE1 4.12Å; L318-F355 HydrophobicContact CD2-CZ 3.96Å
319	T	98.8	Very high	97	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-45.9	174.1	-60.4	0	0	0	0	110.6	W272 L281 I284 R285 H315 D316 Y321 A322 V323	W272-T319 HydrophobicContact CD2-CG2 3.95Å; W272-T319 HydrophobicContact CE3-CG2 4.16Å; W272-T319 HydrophobicContact CH2-CG2 3.97Å; W272-T319 HydrophobicContact CZ2-CG2 3.73Å; W272-T319 HydrophobicContact CZ3-CG2 4.19Å; L281-T319 HydrophobicContact CD1-CG2 4.1Å; I284-T319 HydrophobicContact CG2-CG2 4.35Å; R285-T319 HydrophobicContact CG-CG2 3.69Å; H315-T319 PolarHBondContact CE1-OG1 3.25Å; H315-T319 VanDerWaalsContact O-CB 3.27Å; H315-T319 WeakPolarHBondContact O-CB 3.44Å; H315-T319 PolarHBondContact O-N 2.85Å; H315-T319 PolarHBondContact O-OG1 3.42Å; D316-T319 PolarHBondContact O-N 3.07Å; T319-Y321 PolarHBondContact O-N 2.95Å; T319-A322 PolarHBondContact O-N 3.33Å; T319-V323 WeakPolarHBondContact O-CB 3.33Å; T319-V323 VanDerWaalsContact O-CG2 3.31Å; T319-V323 WeakPolarHBondContact O-CG2 3.32Å; T319-V323 PolarHBondContact O-N 2.89Å
320	T	98.8	Very high	97	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-60.8	-46.1	176.5	-53.8	0	0	0	0	110.8	Y265 L268 W272 D316 L317 A322 V323 T324 F352	Y265-T320 HydrophobicContact CD2-CG2 4.08Å; Y265-T320 HydrophobicContact CE2-CG2 3.7Å; L268-T320 HydrophobicContact CB-CG2 3.95Å; W272-T320 WeakPolarHBondContact CZ2-OG1 3.31Å; W272-T320 PolarHBondContact NE1-OG1 3.17Å; D316-T320 WeakPolarHBondContact O-CB 3.15Å; D316-T320 PolarHBondContact O-N 3.07Å; D316-T320 PolarHBondContact O-OG1 3.06Å; L317-T320 PolarHBondContact O-N 2.76Å; T320-A322 PolarHBondContact O-N 3.36Å; T320-V323 PolarHBondContact O-N 2.89Å; T320-T324 HydrophobicContact CG2-CG2 4.14Å; T320-T324 WeakPolarHBondContact O-CG2 3.18Å; T320-T324 PolarHBondContact O-N 2.97Å; T320-T324 PolarHBondContact O-OG1 3.38Å; T320-F352 HydrophobicContact CG2-CE2 3.83Å; T320-F352 HydrophobicContact CG2-CZ 4.05Å
321	Y	98.6	Very high	96.8	Very high	3 Å²	3	21.5 Å²	21.5	1%	0.012	11%	0.111	C	C	.	.	H	α-helix	trans	-59.6	-48.2	179	-179.2	-86.8	0	0	0	111.5	L317 L318 T319 V323 T324 H325 V328 M334 F355 M359	L317-Y321 PolarHBondContact O-N 2.99Å; L318-Y321 PolarHBondContact O-N 3.46Å; T319-Y321 PolarHBondContact O-N 2.95Å; Y321-V323 VanDerWaalsContact C-N 3.28Å; Y321-V323 PolarHBondContact O-N 3.49Å; Y321-T324 PolarHBondContact O-N 3.37Å; Y321-T324 PolarHBondContact O-OG1 3.08Å; Y321-H325 HydrophobicContact CD1-CB 4.36Å; Y321-H325 AromaticContact CD2-CE1 3.58Å; Y321-H325 AromaticContact CD2-CG 3.98Å; Y321-H325 AromaticContact CD2-ND1 3.45Å; Y321-H325 WeakPolarHBondContact CD2-ND1 3.24Å; Y321-H325 HydrophobicContact CE1-CB 3.85Å; Y321-H325 HydrophobicContact CE2-CB 4.19Å; Y321-H325 AromaticContact CE2-CD2 3.56Å; Y321-H325 AromaticContact CE2-CE1 3.44Å; Y321-H325 VanDerWaalsContact CE2-CE1 3.44Å; Y321-H325 WeakPolarHBondContact CE2-CE1 3.49Å; Y321-H325 AromaticContact CE2-CG 3.5Å; Y321-H325 VanDerWaalsContact CE2-CG 3.5Å; Y321-H325 AromaticContact CE2-ND1 3.42Å; Y321-H325 WeakPolarHBondContact CE2-ND1 3.45Å; Y321-H325 AromaticContact CE2-NE2 3.53Å; Y321-H325 AromaticContact CG-ND1 3.97Å; Y321-H325 AromaticContact CZ-CD2 3.71Å; Y321-H325 AromaticContact CZ-CG 3.53Å; Y321-H325 AromaticContact CZ-ND1 3.9Å; Y321-H325 WeakPolarHBondContact O-CB 3.37Å; Y321-H325 PolarHBondContact O-N 3.04Å; Y321-H325 PolarHBondContact O-ND1 3.24Å; Y321-V328 HydrophobicContact CE1-CB 4.34Å; Y321-V328 HydrophobicContact CE1-CG1 4.37Å; Y321-M334 HydrophobicContact CD1-CE 3.45Å; Y321-M334 VanDerWaalsContact CD1-CE 3.45Å; Y321-M334 HydrophobicContact CE1-CE 3.53Å; Y321-M334 HydrophobicContact CG-CE 4.5Å; Y321-F355 AromaticContact CD1-CE1 3.9Å; Y321-F355 HydrophobicContact CD1-CE1 3.9Å; Y321-F355 AromaticContact CD2-CD1 3.69Å; Y321-F355 HydrophobicContact CD2-CD1 3.69Å; Y321-F355 AromaticContact CD2-CE1 3.78Å; Y321-F355 HydrophobicContact CD2-CE1 3.78Å; Y321-F355 HydrophobicContact CE1-CE1 4.42Å; Y321-F355 HydrophobicContact CE2-CD1 4.35Å; Y321-F355 HydrophobicContact CE2-CE1 4.31Å; Y321-F355 AromaticContact CG-CD1 3.84Å; Y321-F355 HydrophobicContact CG-CD1 3.84Å; Y321-F355 AromaticContact CG-CE1 3.57Å; Y321-F355 HydrophobicContact CG-CE1 3.57Å; Y321-M359 HydrophobicContact CE1-CE 3.89Å; Y321-M359 HydrophobicContact CE1-CG 4.45Å; Y321-M359 HydrophobicContact CE2-CB 3.79Å; Y321-M359 HydrophobicContact CE2-CG 3.89Å; Y321-M359 WeakPolarHBondContact OH-CB 3.26Å
322	A	97.8	Very high	96.4	Very high	2 Å²	2	23.8 Å²	23.8	2%	0.017	12%	0.122	C	C	.	.	H	α-helix	trans	-61.9	-35.3	-178.9	0	0	0	0	0	113.2	I284 L318 T319 T320	I284-A322 HydrophobicContact CG2-CB 3.66Å; L318-A322 WeakPolarHBondContact O-CB 3.33Å; L318-A322 PolarHBondContact O-N 3.47Å; T319-A322 PolarHBondContact O-N 3.33Å; T320-A322 PolarHBondContact O-N 3.36Å
323	V	97.1	Very high	96.1	Very high	10 Å²	10	17.3 Å²	17.3	6%	0.061	10%	0.098	C	C	.	.	H	α-helix	trans	-79.8	-31	177.5	174.5	0	0	0	0	112.3	R275 A276 L281 I284 T319 T320 Y321	R275-V323 HydrophobicContact CB-CG1 3.43Å; R275-V323 VanDerWaalsContact CB-CG1 3.43Å; A276-V323 HydrophobicContact CB-CG1 4.22Å; A276-V323 HydrophobicContact CB-CG2 4.34Å; L281-V323 HydrophobicContact CD1-CG2 3.94Å; I284-V323 HydrophobicContact CD1-CG2 4.01Å; T319-V323 WeakPolarHBondContact O-CB 3.33Å; T319-V323 VanDerWaalsContact O-CG2 3.31Å; T319-V323 WeakPolarHBondContact O-CG2 3.32Å; T319-V323 PolarHBondContact O-N 2.89Å; T320-V323 PolarHBondContact O-N 2.89Å; Y321-V323 VanDerWaalsContact C-N 3.28Å; Y321-V323 PolarHBondContact O-N 3.49Å
324	T	97.3	Very high	96.1	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.006	9%	0.094	C	C	.	.	H	α-helix	trans	-88.3	-16.1	177.5	67	0	0	0	0	114.3	L268 T320 Y321 P326 L445 V446 G447	L268-T324 HydrophobicContact CB-CG2 4.05Å; L268-T324 HydrophobicContact CD1-CG2 4.28Å; L268-T324 HydrophobicContact CD2-CG2 3.94Å; L268-T324 HydrophobicContact CG-CG2 4.3Å; T320-T324 HydrophobicContact CG2-CG2 4.14Å; T320-T324 WeakPolarHBondContact O-CG2 3.18Å; T320-T324 PolarHBondContact O-N 2.97Å; T320-T324 PolarHBondContact O-OG1 3.38Å; Y321-T324 PolarHBondContact O-N 3.37Å; Y321-T324 PolarHBondContact O-OG1 3.08Å; T324-P326 VanDerWaalsContact C-CD 3.46Å; T324-P326 WeakPolarHBondContact O-CD 3.28Å; T324-L445 PolarHBondContact OG1-O 3.06Å; T324-V446 HydrophobicContact CG2-CG2 4.45Å; T324-V446 WeakPolarHBondContact O-CG1 3.29Å; T324-G447 PolarHBondContact O-N 2.92Å
325	H	96.4	Very high	96	Very high	14 Å²	14	16.8 Å²	16.8	7%	0.065	9%	0.094	C	C	.	.			trans	-122	65.4	178.5	-60.4	72.3	0	0	0	110.8	Y321 Q327 V328 S329 L445	Y321-H325 HydrophobicContact CD1-CB 4.36Å; Y321-H325 AromaticContact CD2-CE1 3.58Å; Y321-H325 AromaticContact CD2-CG 3.98Å; Y321-H325 AromaticContact CD2-ND1 3.45Å; Y321-H325 WeakPolarHBondContact CD2-ND1 3.24Å; Y321-H325 HydrophobicContact CE1-CB 3.85Å; Y321-H325 HydrophobicContact CE2-CB 4.19Å; Y321-H325 AromaticContact CE2-CD2 3.56Å; Y321-H325 AromaticContact CE2-CE1 3.44Å; Y321-H325 VanDerWaalsContact CE2-CE1 3.44Å; Y321-H325 WeakPolarHBondContact CE2-CE1 3.49Å; Y321-H325 AromaticContact CE2-CG 3.5Å; Y321-H325 VanDerWaalsContact CE2-CG 3.5Å; Y321-H325 AromaticContact CE2-ND1 3.42Å; Y321-H325 WeakPolarHBondContact CE2-ND1 3.45Å; Y321-H325 AromaticContact CE2-NE2 3.53Å; Y321-H325 AromaticContact CG-ND1 3.97Å; Y321-H325 AromaticContact CZ-CD2 3.71Å; Y321-H325 AromaticContact CZ-CG 3.53Å; Y321-H325 AromaticContact CZ-ND1 3.9Å; Y321-H325 WeakPolarHBondContact O-CB 3.37Å; Y321-H325 PolarHBondContact O-N 3.04Å; Y321-H325 PolarHBondContact O-ND1 3.24Å; H325-Q327 VanDerWaalsContact CA-OE1 3.24Å; H325-Q327 PolarHBondContact O-N 2.77Å; H325-Q327 PolarHBondContact O-OE1 3.32Å; H325-V328 PolarHBondContact O-N 3.22Å; H325-S329 PolarHBondContact O-N 2.62Å; H325-L445 PolarHBondContact CE1-O 3.49Å; H325-L445 VanDerWaalsContact CE1-O 3.31Å
326	P	92.1	Very high	96	Very high	56 Å²	56	16.3 Å²	16.3	36%	0.364	9%	0.091	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-13.7	-170.5	30.1	-38.3	0	0	0	114.5	T324 V328 S450	T324-P326 VanDerWaalsContact C-CD 3.46Å; T324-P326 WeakPolarHBondContact O-CD 3.28Å; P326-V328 VanDerWaalsContact C-N 3.32Å; P326-S450 PolarHBondContact O-OG 3.22Å; P326-S450 VanDerWaalsContact O-OG 3.14Å
327	Q	89.6	Confident	96	Very high	64 Å²	64	15.5 Å²	15.5	30%	0.299	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-13.8	174	82.6	-66.3	-5.4	0	0	113.7	H325 P448 S450	H325-Q327 VanDerWaalsContact CA-OE1 3.24Å; H325-Q327 PolarHBondContact O-N 2.77Å; H325-Q327 PolarHBondContact O-OE1 3.32Å; Q327-P448 HydrophobicContact CG-CG 4.32Å; Q327-P448 PolarHBondContact OE1-O 3.26Å; Q327-S450 PolarHBondContact N-OG 3.04Å
328	V	92.6	Very high	96	Very high	20 Å²	20	15.5 Å²	15.5	12%	0.121	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-40.1	172.1	-172.9	0	0	0	0	110.5	Y321 H325 P326 M334 M359 A363 F366	Y321-V328 HydrophobicContact CE1-CB 4.34Å; Y321-V328 HydrophobicContact CE1-CG1 4.37Å; H325-V328 PolarHBondContact O-N 3.22Å; P326-V328 VanDerWaalsContact C-N 3.32Å; V328-M334 HydrophobicContact CG1-SD 4.42Å; V328-M359 HydrophobicContact CG1-CE 4.04Å; V328-A363 HydrophobicContact CG2-CB 3.79Å; V328-F366 HydrophobicContact CG1-CB 4.23Å
329	S	94.8	Very high	96	Very high	37 Å²	37	15.5 Å²	15.5	26%	0.259	9%	0.088	S	C	.	.			trans	55.7	-152.2	-171.9	-165.8	0	0	0	0	111.7	H325	H325-S329 PolarHBondContact O-N 2.62Å
330	Y	96.8	Very high	95.9	Very high	20 Å²	20	15.7 Å²	15.7	8%	0.078	9%	0.089	C	C	.	.			trans	-92.9	130.3	167	-172	-98.5	0	0	0	110.8	T287 V288 D291 L318 M334 S335	T287-Y330 HydrophobicContact CG2-CD1 3.96Å; T287-Y330 HydrophobicContact CG2-CE1 4.41Å; V288-Y330 HydrophobicContact CG2-CD1 4.1Å; V288-Y330 HydrophobicContact CG2-CD2 3.59Å; V288-Y330 HydrophobicContact CG2-CE2 4.16Å; V288-Y330 HydrophobicContact CG2-CG 3.58Å; D291-Y330 HydrophobicContact CB-CE1 4.24Å; D291-Y330 WeakPolarHBondContact CB-OH 3.32Å; D291-Y330 PolarHBondContact OD2-OH 3.02Å; L318-Y330 HydrophobicContact CB-CD2 4.26Å; L318-Y330 HydrophobicContact CB-CE2 4.18Å; L318-Y330 HydrophobicContact CD1-CE2 4.03Å; L318-Y330 HydrophobicContact CD2-CD2 4.43Å; L318-Y330 HydrophobicContact CD2-CE2 3.96Å; L318-Y330 HydrophobicContact CG-CE2 4.27Å; Y330-M334 HydrophobicContact CD2-CB 4.24Å; Y330-M334 HydrophobicContact CE2-CB 3.69Å; Y330-S335 PolarHBondContact OH-N 2.9Å
331	C	94.8	Very high	95.9	Very high	36 Å²	36	15.7 Å²	15.7	24%	0.243	9%	0.089	C	C	.	.			trans	-121.3	145.6	167.7	-72.4	0	0	0	0	110.8	G333 M334 F366	C331-G333 PolarHBondContact O-N 3.26Å; C331-M334 HydrophobicContact CB-SD 3.92Å; C331-M334 PolarHBondContact N-SD 3.38Å; C331-M334 WeakPolarHBondContact O-CB 3.3Å; C331-M334 WeakPolarHBondContact O-CG 3.32Å; C331-M334 PolarHBondContact O-N 3.41Å; C331-F366 HydrophobicContact CB-CB 4.04Å; C331-F366 HydrophobicContact CB-CD1 3.62Å; C331-F366 HydrophobicContact CB-CG 4.18Å
332	Q	89.1	Confident	96	Very high	53 Å²	53	15.6 Å²	15.6	25%	0.248	9%	0.088	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	132.6	-176.6	-177	172.9	-24.6	0	0	111.8	D291 R514	D291-Q332 WeakPolarHBondContact OD2-CA 3.49Å; Q332-R514 PolarHBondContact NE2-O 2.76Å; Q332-R514 PolarHBondContact OE1-O 2.89Å
333	G	91.7	Very high	96	Very high	2 Å²	2	16.4 Å²	16.4	2%	0.021	10%	0.095	C	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	-4.9	-175.1	0	0	0	0	0	115.3	D291 C331 S335 D336 L412	D291-G333 PolarHBondContact OD2-N 3.29Å; C331-G333 PolarHBondContact O-N 3.26Å; G333-S335 PolarHBondContact O-N 2.81Å; G333-D336 WeakPolarHBondContact O-CB 3.34Å; G333-D336 PolarHBondContact O-N 2.99Å; G333-L412 WeakPolarHBondContact O-CD2 3.5Å
334	M	97.6	Very high	96	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61.3	-27	167.8	-76.6	170.9	56.3	0	0	112.1	L318 Y321 V328 Y330 C331 D336 L337 A338 F355 M359 F366	L318-M334 HydrophobicContact CD2-CB 4.27Å; Y321-M334 HydrophobicContact CD1-CE 3.45Å; Y321-M334 VanDerWaalsContact CD1-CE 3.45Å; Y321-M334 HydrophobicContact CE1-CE 3.53Å; Y321-M334 HydrophobicContact CG-CE 4.5Å; V328-M334 HydrophobicContact CG1-SD 4.42Å; Y330-M334 HydrophobicContact CD2-CB 4.24Å; Y330-M334 HydrophobicContact CE2-CB 3.69Å; C331-M334 HydrophobicContact CB-SD 3.92Å; C331-M334 PolarHBondContact N-SD 3.38Å; C331-M334 WeakPolarHBondContact O-CB 3.3Å; C331-M334 WeakPolarHBondContact O-CG 3.32Å; C331-M334 PolarHBondContact O-N 3.41Å; M334-D336 VanDerWaalsContact C-N 3.27Å; M334-D336 PolarHBondContact O-N 3Å; M334-L337 PolarHBondContact O-N 3.2Å; M334-A338 PolarHBondContact O-N 2.91Å; M334-F355 HydrophobicContact CB-CZ 4.31Å; M334-F355 HydrophobicContact CE-CE1 4.03Å; M334-F355 HydrophobicContact CE-CZ 3.94Å; M334-M359 HydrophobicContact CE-CE 3.81Å; M334-M359 HydrophobicContact SD-CE 4.17Å; M334-F366 HydrophobicContact CG-CD1 4Å; M334-F366 HydrophobicContact CG-CD2 4.36Å; M334-F366 HydrophobicContact CG-CE1 3.73Å; M334-F366 HydrophobicContact CG-CE2 4.13Å; M334-F366 HydrophobicContact CG-CG 4.31Å; M334-F366 HydrophobicContact CG-CZ 3.82Å; M334-F366 HydrophobicContact SD-CD1 4.42Å; M334-F366 HydrophobicContact SD-CG 4.39Å
335	S	98.2	Very high	96.1	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60.4	-32.9	170.1	68.3	0	0	0	0	113.7	T295 Y330 G333 L337 A338 S339	T295-S335 WeakPolarHBondContact OG1-CB 3.2Å; T295-S335 PolarHBondContact OG1-OG 2.71Å; Y330-S335 PolarHBondContact OH-N 2.9Å; G333-S335 PolarHBondContact O-N 2.81Å; S335-L337 VanDerWaalsContact C-N 3.29Å; S335-L337 PolarHBondContact O-N 3.06Å; S335-A338 PolarHBondContact O-N 2.99Å; S335-S339 WeakPolarHBondContact O-CB 3.19Å; S335-S339 PolarHBondContact O-N 2.75Å
336	D	97.6	Very high	96.1	Very high	3 Å²	3	20 Å²	20	2%	0.016	11%	0.114	C	C	.	.	H	α-helix	trans	-70.5	-24.7	177.4	-85.6	-58.5	0	0	0	113	G333 M334 P340 L412 K415 R416	G333-D336 WeakPolarHBondContact O-CB 3.34Å; G333-D336 PolarHBondContact O-N 2.99Å; M334-D336 VanDerWaalsContact C-N 3.27Å; M334-D336 PolarHBondContact O-N 3Å; D336-P340 WeakPolarHBondContact O-CD 3.43Å; D336-L412 HydrophobicContact CB-CD1 4.1Å; D336-L412 HydrophobicContact CB-CD2 4.34Å; D336-K415 HydrophobicContact CB-CD 4.16Å; D336-K415 WeakPolarHBondContact O-CD 3.28Å; D336-K415 WeakPolarHBondContact O-CE 3.11Å; D336-K415 IonicContact OD1-NZ 3.53Å; D336-K415 PolarHBondContact OD1-NZ 2.75Å; D336-R416 VanDerWaalsContact CG-NH2 3.28Å; D336-R416 IonicContact OD1-CZ 3.23Å; D336-R416 IonicContact OD1-NE 3.88Å; D336-R416 PolarHBondContact OD1-NE 3.22Å; D336-R416 IonicContact OD1-NH2 3.59Å; D336-R416 PolarHBondContact OD1-NH2 3.46Å; D336-R416 IonicContact OD2-CZ 3.65Å; D336-R416 VanDerWaalsContact OD2-CZ 3.23Å; D336-R416 IonicContact OD2-NE 3.39Å; D336-R416 PolarHBondContact OD2-NE 2.85Å; D336-R416 IonicContact OD2-NH2 3.2Å; D336-R416 PolarHBondContact OD2-NH2 3.32Å
337	L	98.3	Very high	96.4	Very high	4 Å²	4	21.2 Å²	21.2	2%	0.021	12%	0.115	C	C	.	.	H	α-helix	trans	-84.9	-39.8	173.5	-65.5	174	0	0	0	112	M334 S335 P340 F355 L362 F366	M334-L337 PolarHBondContact O-N 3.2Å; S335-L337 VanDerWaalsContact C-N 3.29Å; S335-L337 PolarHBondContact O-N 3.06Å; L337-P340 WeakPolarHBondContact O-CD 3.12Å; L337-P340 WeakPolarHBondContact O-CG 3.18Å; L337-F355 HydrophobicContact CB-CE2 4.11Å; L337-L362 HydrophobicContact CD1-CD1 3.72Å; L337-L362 HydrophobicContact CD2-CD1 3.9Å; L337-L362 HydrophobicContact CG-CD1 4.46Å; L337-F366 HydrophobicContact CD1-CE2 3.67Å; L337-F366 HydrophobicContact CD1-CZ 3.56Å
338	A	98.7	Very high	96.8	Very high	1 Å²	1	19.9 Å²	19.9	1%	0.008	11%	0.109	C	C	.	.	H	α-helix	trans	-71.4	-35.6	178.1	0	0	0	0	0	112.9	L314 L317 L318 M334 S335 I341 L342 F355	L314-A338 HydrophobicContact CD1-CB 3.63Å; L317-A338 HydrophobicContact CD2-CB 3.99Å; L318-A338 HydrophobicContact CD2-CB 3.7Å; L318-A338 HydrophobicContact CG-CB 4.2Å; M334-A338 PolarHBondContact O-N 2.91Å; S335-A338 PolarHBondContact O-N 2.99Å; A338-I341 PolarHBondContact O-N 3.46Å; A338-L342 PolarHBondContact O-N 2.86Å; A338-F355 HydrophobicContact CB-CD2 3.79Å; A338-F355 HydrophobicContact CB-CE2 3.73Å; A338-F355 HydrophobicContact CB-CG 4.48Å; A338-F355 HydrophobicContact CB-CZ 4.35Å
339	S	98.6	Very high	97.1	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-50.3	-56.4	-179.2	165.4	0	0	0	0	114.8	D296 Y302 S335 I341 L342 A343	D296-S339 WeakPolarHBondContact OD2-CB 3.27Å; D296-S339 PolarHBondContact OD2-OG 2.76Å; Y302-S339 WeakPolarHBondContact CE2-OG 3.46Å; Y302-S339 WeakPolarHBondContact OH-CA 3.48Å; Y302-S339 PolarHBondContact OH-O 3.48Å; S335-S339 WeakPolarHBondContact O-CB 3.19Å; S335-S339 PolarHBondContact O-N 2.75Å; S339-I341 VanDerWaalsContact C-N 3.31Å; S339-I341 PolarHBondContact O-N 3.44Å; S339-L342 PolarHBondContact O-N 3.45Å; S339-A343 WeakPolarHBondContact O-CB 3.3Å; S339-A343 PolarHBondContact O-N 3Å
340	P	98.4	Very high	97.3	Very high	4 Å²	4	18.9 Å²	18.9	3%	0.026	10%	0.099	C	C	.	.	H	α-helix	trans	-65.4	-34.4	179.3	24.7	-34.4	0	0	0	112.3	W238 D336 L337 V344 F420 L424 L427	W238-P340 HydrophobicContact CH2-CB 4.26Å; W238-P340 HydrophobicContact CZ3-CB 4.44Å; D336-P340 WeakPolarHBondContact O-CD 3.43Å; L337-P340 WeakPolarHBondContact O-CD 3.12Å; L337-P340 WeakPolarHBondContact O-CG 3.18Å; P340-V344 WeakPolarHBondContact O-CB 3.35Å; P340-V344 WeakPolarHBondContact O-CG2 3.1Å; P340-V344 PolarHBondContact O-N 2.82Å; P340-F420 HydrophobicContact CB-CZ 4.46Å; P340-L424 HydrophobicContact CB-CD2 3.43Å; P340-L424 VanDerWaalsContact CB-CD2 3.43Å; P340-L427 HydrophobicContact CB-CD1 4.29Å; P340-L427 HydrophobicContact CG-CD1 4.02Å
341	I	98.7	Very high	97.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67	-43.9	178.4	-66.6	174.5	0	0	0	110.9	W238 L242 A338 S339 M345 A351 C354 I358 W431	W238-I341 HydrophobicContact CE3-CG1 4.43Å; W238-I341 HydrophobicContact CZ3-CG1 4.07Å; L242-I341 HydrophobicContact CD1-CD1 3.89Å; L242-I341 HydrophobicContact CD1-CG1 4.24Å; A338-I341 PolarHBondContact O-N 3.46Å; S339-I341 VanDerWaalsContact C-N 3.31Å; S339-I341 PolarHBondContact O-N 3.44Å; I341-M345 HydrophobicContact CG2-CG 4.32Å; I341-M345 VanDerWaalsContact O-CB 3.24Å; I341-M345 WeakPolarHBondContact O-CB 3.39Å; I341-M345 VanDerWaalsContact O-CG 3.26Å; I341-M345 WeakPolarHBondContact O-CG 3.27Å; I341-M345 PolarHBondContact O-N 2.77Å; I341-A351 HydrophobicContact CG2-CB 4.29Å; I341-C354 HydrophobicContact CG2-CB 3.48Å; I341-C354 VanDerWaalsContact CG2-CB 3.48Å; I341-I358 HydrophobicContact CD1-CB 4.27Å; I341-I358 HydrophobicContact CD1-CD1 4.24Å; I341-I358 HydrophobicContact CD1-CG2 3.57Å; I341-W431 HydrophobicContact CD1-CH2 4.47Å; I341-W431 HydrophobicContact CG1-CH2 4.2Å
342	L	98.8	Very high	97.6	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-69.2	-43	177.3	176.6	64.7	0	0	0	112	Y301 Y302 A313 L314 A338 S339 V344 M345 D346 A351	Y301-L342 HydrophobicContact CE1-CG 4.21Å; Y302-L342 HydrophobicContact CE1-CD2 4.39Å; Y302-L342 WeakPolarHBondContact OH-CB 3.14Å; A313-L342 HydrophobicContact CB-CD1 4.41Å; A313-L342 HydrophobicContact CB-CD2 3.99Å; L314-L342 HydrophobicContact CB-CD2 3.74Å; L314-L342 HydrophobicContact CD1-CD2 4.05Å; L314-L342 HydrophobicContact CG-CD2 4.49Å; A338-L342 PolarHBondContact O-N 2.86Å; S339-L342 PolarHBondContact O-N 3.45Å; L342-V344 VanDerWaalsContact C-N 3.29Å; L342-V344 PolarHBondContact O-N 2.78Å; L342-M345 PolarHBondContact O-N 3.29Å; L342-D346 PolarHBondContact O-N 3.23Å; L342-A351 HydrophobicContact CB-CB 3.94Å; L342-A351 HydrophobicContact CD1-CB 3.62Å; L342-A351 HydrophobicContact CG-CB 4.4Å
343	A	98.4	Very high	98.1	Very high	19 Å²	19	13.7 Å²	13.7	16%	0.157	7%	0.072	C	C	.	.	H	α-helix	trans	-64.2	-32.7	176.7	0	0	0	0	0	112.9	Y301 Y302 S339 F420	Y301-A343 HydrophobicContact CD1-CB 3.78Å; Y301-A343 HydrophobicContact CE1-CB 4.19Å; Y301-A343 HydrophobicContact CG-CB 4.05Å; Y302-A343 HydrophobicContact CE2-CB 4.04Å; S339-A343 WeakPolarHBondContact O-CB 3.3Å; S339-A343 PolarHBondContact O-N 3Å; A343-F420 HydrophobicContact CB-CE1 4.22Å; A343-F420 HydrophobicContact CB-CZ 3.87Å
344	V	98.5	Very high	98.4	Very high	12 Å²	12	13.6 Å²	13.6	7%	0.073	7%	0.071	C	C	.	.	H	α-helix	trans	-74.2	-51.7	171.1	165	0	0	0	0	111.3	R234 K235 W238 P340 L342 D346 L424	R234-V344 HydrophobicContact CB-CG1 3.59Å; R234-V344 HydrophobicContact CB-CG2 4.32Å; K235-V344 WeakPolarHBondContact CE-O 3.21Å; K235-V344 WeakPolarHBondContact CG-O 3.21Å; W238-V344 HydrophobicContact CD2-CB 4.41Å; W238-V344 HydrophobicContact CD2-CG1 3.91Å; W238-V344 HydrophobicContact CD2-CG2 4.3Å; W238-V344 HydrophobicContact CE3-CB 3.97Å; W238-V344 HydrophobicContact CE3-CG1 3.87Å; W238-V344 HydrophobicContact CE3-CG2 4.05Å; W238-V344 HydrophobicContact CG-CG1 4.3Å; W238-V344 HydrophobicContact CH2-CG2 3.84Å; W238-V344 HydrophobicContact CZ2-CG2 4.02Å; W238-V344 HydrophobicContact CZ3-CB 4.07Å; W238-V344 HydrophobicContact CZ3-CG1 4.46Å; W238-V344 HydrophobicContact CZ3-CG2 3.81Å; P340-V344 WeakPolarHBondContact O-CB 3.35Å; P340-V344 WeakPolarHBondContact O-CG2 3.1Å; P340-V344 PolarHBondContact O-N 2.82Å; L342-V344 VanDerWaalsContact C-N 3.29Å; L342-V344 PolarHBondContact O-N 2.78Å; V344-D346 PolarHBondContact O-N 3.29Å; V344-L424 HydrophobicContact CG2-CD1 4.2Å; V344-L424 HydrophobicContact CG2-CD2 4.07Å
345	M	98.2	Very high	98.4	Very high	6 Å²	6	13.6 Å²	13.6	3%	0.03	7%	0.071	C	C	.	.	H	α-helix	trans	-73.2	-27.4	-171.5	-71.8	-65.4	150.6	0	0	113.6	W238 R239 I341 L342 H347 H350 A351	W238-M345 HydrophobicContact CB-CE 3.68Å; R239-M345 HydrophobicContact CG-CE 3.78Å; R239-M345 HydrophobicContact CG-SD 4.26Å; R239-M345 PolarHBondContact NE-SD 2.84Å; I341-M345 HydrophobicContact CG2-CG 4.32Å; I341-M345 VanDerWaalsContact O-CB 3.24Å; I341-M345 WeakPolarHBondContact O-CB 3.39Å; I341-M345 VanDerWaalsContact O-CG 3.26Å; I341-M345 WeakPolarHBondContact O-CG 3.27Å; I341-M345 PolarHBondContact O-N 2.77Å; L342-M345 PolarHBondContact O-N 3.29Å; M345-H347 PolarHBondContact O-N 3.37Å; M345-H347 VanDerWaalsContact O-N 3.15Å; M345-H350 HydrophobicContact CB-CB 4.28Å; M345-A351 HydrophobicContact CB-CB 4.04Å
346	D	97.6	Very high	98.5	Very high	81 Å²	81	13.8 Å²	13.8	43%	0.433	7%	0.072	S	C	.	.			trans	57.9	30	171.1	-160.9	20.4	0	0	0	113.4	K235 Y301 L342 V344	K235-D346 IonicContact NZ-OD2 3.35Å; K235-D346 PolarHBondContact NZ-OD2 3.15Å; Y301-D346 WeakPolarHBondContact CE2-OD1 3.4Å; Y301-D346 PolarHBondContact OH-OD1 2.84Å; L342-D346 PolarHBondContact O-N 3.23Å; V344-D346 PolarHBondContact O-N 3.29Å
347	H	98.1	Very high	98.4	Very high	83 Å²	83	14.1 Å²	14.1	38%	0.384	8%	0.076	S	C	.	.	S	Bend	trans	-165.2	121.1	-177.1	-175.2	-51.7	0	0	0	108.7	S262 M345 G349 H350 A351	S262-H347 PolarHBondContact OG-CE1 3.09Å; S262-H347 VanDerWaalsContact OG-CE1 3.32Å; M345-H347 PolarHBondContact O-N 3.37Å; M345-H347 VanDerWaalsContact O-N 3.15Å; H347-G349 PolarHBondContact ND1-N 3.28Å; H347-G349 PolarHBondContact O-N 2.74Å; H347-H350 HydrophobicContact CB-CB 4.11Å; H347-H350 WeakPolarHBondContact CB-ND1 3.36Å; H347-H350 AromaticContact CD2-CE1 3.68Å; H347-H350 AromaticContact CD2-ND1 3.63Å; H347-H350 AromaticContact CG-CE1 3.89Å; H347-H350 AromaticContact CG-CG 3.91Å; H347-H350 AromaticContact CG-ND1 3.38Å; H347-H350 AromaticContact ND1-ND1 3.91Å; H347-H350 PolarHBondContact O-N 3.23Å; H347-A351 WeakPolarHBondContact O-CB 3.49Å; H347-A351 PolarHBondContact O-N 3.2Å
348	E	98.4	Very high	98.3	Very high	35 Å²	35	13.9 Å²	13.9	16%	0.164	8%	0.075	C	C	.	.	H	α-helix	trans	-55.8	-56.2	-169	-162.1	-177.7	130.4	0	0	113.1	Y265 K269 A313 D316 H350 A351 F352	Y265-E348 HydrophobicContact CE1-CB 4.33Å; Y265-E348 HydrophobicContact CE1-CG 3.82Å; Y265-E348 VanDerWaalsContact CE1-OE1 3.29Å; Y265-E348 WeakPolarHBondContact CE1-OE1 3.29Å; Y265-E348 VanDerWaalsContact CZ-OE1 3.3Å; Y265-E348 PolarHBondContact OH-OE1 3.47Å; K269-E348 IonicContact NZ-OE1 3.46Å; K269-E348 PolarHBondContact NZ-OE1 3.23Å; K269-E348 IonicContact NZ-OE2 3.67Å; K269-E348 PolarHBondContact NZ-OE2 3Å; A313-E348 WeakPolarHBondContact CA-OE2 3.47Å; A313-E348 HydrophobicContact CB-CB 4.26Å; A313-E348 HydrophobicContact CB-CG 3.93Å; D316-E348 WeakPolarHBondContact CB-OE1 3.14Å; E348-H350 PolarHBondContact O-N 2.98Å; E348-A351 WeakPolarHBondContact O-CB 3.32Å; E348-A351 PolarHBondContact O-N 3.18Å; E348-A351 VanDerWaalsContact O-N 3.13Å; E348-F352 PolarHBondContact O-N 2.98Å
349	G	98.4	Very high	98.2	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-62.4	-33.9	177.9	0	0	0	0	0	115.2	Y265 H347 V353	Y265-G349 VanDerWaalsContact CD1-CA 3.44Å; H347-G349 PolarHBondContact ND1-N 3.28Å; H347-G349 PolarHBondContact O-N 2.74Å; G349-V353 VanDerWaalsContact O-CG2 3.27Å; G349-V353 WeakPolarHBondContact O-CG2 3.38Å; G349-V353 PolarHBondContact O-N 3.34Å
350	H	98.6	Very high	98	Very high	36 Å²	36	19.6 Å²	19.6	17%	0.167	10%	0.1	C	C	.	.	H	α-helix	trans	-67.7	-40.8	173	-65.5	151.6	0	0	0	111.6	M258 M345 H347 E348 C354	M258-H350 HydrophobicContact CE-CB 4.18Å; M345-H350 HydrophobicContact CB-CB 4.28Å; H347-H350 HydrophobicContact CB-CB 4.11Å; H347-H350 WeakPolarHBondContact CB-ND1 3.36Å; H347-H350 AromaticContact CD2-CE1 3.68Å; H347-H350 AromaticContact CD2-ND1 3.63Å; H347-H350 AromaticContact CG-CE1 3.89Å; H347-H350 AromaticContact CG-CG 3.91Å; H347-H350 AromaticContact CG-ND1 3.38Å; H347-H350 AromaticContact ND1-ND1 3.91Å; H347-H350 PolarHBondContact O-N 3.23Å; E348-H350 PolarHBondContact O-N 2.98Å; H350-C354 PolarHBondContact O-N 3.31Å; H350-C354 VanDerWaalsContact O-N 3.16Å; H350-C354 PolarHBondContact O-SG 3.04Å
351	A	98.8	Very high	97.6	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-40.6	176.6	0	0	0	0	0	111.6	L317 I341 L342 M345 H347 E348 C354 F355	L317-A351 HydrophobicContact CD1-CB 3.59Å; I341-A351 HydrophobicContact CG2-CB 4.29Å; L342-A351 HydrophobicContact CB-CB 3.94Å; L342-A351 HydrophobicContact CD1-CB 3.62Å; L342-A351 HydrophobicContact CG-CB 4.4Å; M345-A351 HydrophobicContact CB-CB 4.04Å; H347-A351 WeakPolarHBondContact O-CB 3.49Å; H347-A351 PolarHBondContact O-N 3.2Å; E348-A351 WeakPolarHBondContact O-CB 3.32Å; E348-A351 PolarHBondContact O-N 3.18Å; E348-A351 VanDerWaalsContact O-N 3.13Å; A351-C354 CarbonylContact O-C 3.46Å; A351-C354 PolarHBondContact O-N 2.78Å; A351-F355 WeakPolarHBondContact O-CB 3.45Å; A351-F355 PolarHBondContact O-N 3.06Å
352	F	98.8	Very high	97.4	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-61.3	-44.8	176.1	178.5	-93	0	0	0	113	Y265 L317 T320 E348 C354 F355 C356 L445	Y265-F352 HydrophobicContact CD2-CB 3.56Å; Y265-F352 AromaticContact CD2-CD1 3.3Å; Y265-F352 HydrophobicContact CD2-CD1 3.3Å; Y265-F352 AromaticContact CD2-CD2 3.6Å; Y265-F352 HydrophobicContact CD2-CD2 3.6Å; Y265-F352 AromaticContact CD2-CE1 3.81Å; Y265-F352 HydrophobicContact CD2-CE1 3.81Å; Y265-F352 HydrophobicContact CD2-CE2 4.08Å; Y265-F352 AromaticContact CD2-CG 3.17Å; Y265-F352 HydrophobicContact CD2-CG 3.17Å; Y265-F352 HydrophobicContact CD2-CZ 4.17Å; Y265-F352 HydrophobicContact CE2-CB 3.66Å; Y265-F352 HydrophobicContact CE2-CD1 4.01Å; Y265-F352 AromaticContact CE2-CD2 3.38Å; Y265-F352 HydrophobicContact CE2-CD2 3.38Å; Y265-F352 AromaticContact CE2-CE2 3.96Å; Y265-F352 HydrophobicContact CE2-CE2 3.96Å; Y265-F352 AromaticContact CE2-CG 3.39Å; Y265-F352 HydrophobicContact CE2-CG 3.39Å; Y265-F352 HydrophobicContact CE2-CZ 4.49Å; Y265-F352 HydrophobicContact CG-CB 4.1Å; Y265-F352 HydrophobicContact CG-CD1 4.07Å; Y265-F352 HydrophobicContact CG-CG 4.09Å; L317-F352 HydrophobicContact CD1-CB 4.41Å; L317-F352 HydrophobicContact CG-CB 4.08Å; L317-F352 HydrophobicContact CG-CD2 4.18Å; T320-F352 HydrophobicContact CG2-CE2 3.83Å; T320-F352 HydrophobicContact CG2-CZ 4.05Å; E348-F352 PolarHBondContact O-N 2.98Å; F352-C354 VanDerWaalsContact C-N 3.31Å; F352-C354 PolarHBondContact O-N 2.86Å; F352-F355 WeakPolarHBondContact O-CA 3.26Å; F352-F355 WeakPolarHBondContact O-CB 3.41Å; F352-F355 PolarHBondContact O-N 3.08Å; F352-F355 VanDerWaalsContact O-N 3.08Å; F352-C356 VanDerWaalsContact CE1-SG 3.55Å; F352-C356 PolarHBondContact O-N 3.22Å; F352-C356 PolarHBondContact O-SG 3.17Å; F352-C356 VanDerWaalsContact O-SG 3.4Å; F352-L445 HydrophobicContact CD1-CD1 4.35Å; F352-L445 HydrophobicContact CD1-CD2 4.2Å; F352-L445 HydrophobicContact CE1-CB 3.95Å; F352-L445 HydrophobicContact CE1-CD1 4.08Å; F352-L445 HydrophobicContact CE1-CD2 3.91Å; F352-L445 HydrophobicContact CE1-CG 4.18Å
353	V	98.6	Very high	97.2	Very high	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-62.8	-40.9	176.9	177.2	0	0	0	0	110.8	V244 M258 K261 G349 F355 C356 G357 V443 L445	V244-V353 HydrophobicContact CG1-CG1 3.68Å; M258-V353 HydrophobicContact CE-CB 4.06Å; M258-V353 HydrophobicContact CE-CG1 4.1Å; M258-V353 HydrophobicContact CE-CG2 4.42Å; M258-V353 HydrophobicContact SD-CG1 4.45Å; K261-V353 HydrophobicContact CB-CG2 3.71Å; G349-V353 VanDerWaalsContact O-CG2 3.27Å; G349-V353 WeakPolarHBondContact O-CG2 3.38Å; G349-V353 PolarHBondContact O-N 3.34Å; V353-F355 VanDerWaalsContact C-N 3.31Å; V353-F355 PolarHBondContact O-N 2.81Å; V353-C356 PolarHBondContact O-N 3.4Å; V353-G357 PolarHBondContact O-N 3.27Å; V353-G357 VanDerWaalsContact O-N 3.15Å; V353-V443 HydrophobicContact CG1-CB 4.47Å; V353-L445 HydrophobicContact CB-CD2 4.46Å; V353-L445 HydrophobicContact CG1-CD2 4.49Å; V353-L445 HydrophobicContact CG2-CD1 4.25Å; V353-L445 HydrophobicContact CG2-CD2 4.05Å
354	C	98.8	Very high	97	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-65.6	-34.5	172.9	-62.7	0	0	0	0	112.2	L242 V244 I341 H350 A351 F352 G357 I358	L242-C354 HydrophobicContact CD1-CB 3.97Å; V244-C354 HydrophobicContact CG2-CB 4.38Å; I341-C354 HydrophobicContact CG2-CB 3.48Å; I341-C354 VanDerWaalsContact CG2-CB 3.48Å; H350-C354 PolarHBondContact O-N 3.31Å; H350-C354 VanDerWaalsContact O-N 3.16Å; H350-C354 PolarHBondContact O-SG 3.04Å; A351-C354 CarbonylContact O-C 3.46Å; A351-C354 PolarHBondContact O-N 2.78Å; F352-C354 VanDerWaalsContact C-N 3.31Å; F352-C354 PolarHBondContact O-N 2.86Å; C354-G357 PolarHBondContact O-N 2.98Å; C354-I358 PolarHBondContact O-N 3.22Å
355	F	98.8	Very high	96.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-66.9	-41	176.3	-168.4	-111.6	0	0	0	111.8	L317 L318 Y321 M334 L337 A338 A351 F352 V353 G357 I358 M359	L317-F355 HydrophobicContact CD2-CB 4.09Å; L317-F355 HydrophobicContact CD2-CD1 3.88Å; L317-F355 HydrophobicContact CD2-CE1 4.5Å; L317-F355 HydrophobicContact CD2-CG 3.92Å; L318-F355 HydrophobicContact CD2-CE1 4.12Å; L318-F355 HydrophobicContact CD2-CZ 3.96Å; Y321-F355 AromaticContact CD1-CE1 3.9Å; Y321-F355 HydrophobicContact CD1-CE1 3.9Å; Y321-F355 AromaticContact CD2-CD1 3.69Å; Y321-F355 HydrophobicContact CD2-CD1 3.69Å; Y321-F355 AromaticContact CD2-CE1 3.78Å; Y321-F355 HydrophobicContact CD2-CE1 3.78Å; Y321-F355 HydrophobicContact CE1-CE1 4.42Å; Y321-F355 HydrophobicContact CE2-CD1 4.35Å; Y321-F355 HydrophobicContact CE2-CE1 4.31Å; Y321-F355 AromaticContact CG-CD1 3.84Å; Y321-F355 HydrophobicContact CG-CD1 3.84Å; Y321-F355 AromaticContact CG-CE1 3.57Å; Y321-F355 HydrophobicContact CG-CE1 3.57Å; M334-F355 HydrophobicContact CB-CZ 4.31Å; M334-F355 HydrophobicContact CE-CE1 4.03Å; M334-F355 HydrophobicContact CE-CZ 3.94Å; L337-F355 HydrophobicContact CB-CE2 4.11Å; A338-F355 HydrophobicContact CB-CD2 3.79Å; A338-F355 HydrophobicContact CB-CE2 3.73Å; A338-F355 HydrophobicContact CB-CG 4.48Å; A338-F355 HydrophobicContact CB-CZ 4.35Å; A351-F355 WeakPolarHBondContact O-CB 3.45Å; A351-F355 PolarHBondContact O-N 3.06Å; F352-F355 WeakPolarHBondContact O-CA 3.26Å; F352-F355 WeakPolarHBondContact O-CB 3.41Å; F352-F355 PolarHBondContact O-N 3.08Å; F352-F355 VanDerWaalsContact O-N 3.08Å; V353-F355 VanDerWaalsContact C-N 3.31Å; V353-F355 PolarHBondContact O-N 2.81Å; F355-G357 VanDerWaalsContact C-N 3.31Å; F355-G357 PolarHBondContact O-N 3.39Å; F355-I358 HydrophobicContact CD2-CG2 3.97Å; F355-I358 WeakPolarHBondContact O-CG2 3.48Å; F355-I358 PolarHBondContact O-N 2.94Å; F355-M359 HydrophobicContact CD1-CG 4.04Å; F355-M359 HydrophobicContact CD2-CG 4.38Å; F355-M359 HydrophobicContact CE1-CG 3.69Å; F355-M359 HydrophobicContact CE1-SD 4.36Å; F355-M359 HydrophobicContact CE2-CG 4.04Å; F355-M359 HydrophobicContact CE2-SD 4.24Å; F355-M359 HydrophobicContact CG-CG 4.37Å; F355-M359 HydrophobicContact CZ-CG 3.68Å; F355-M359 HydrophobicContact CZ-SD 3.85Å; F355-M359 VanDerWaalsContact O-CB 3.29Å; F355-M359 WeakPolarHBondContact O-CB 3.33Å; F355-M359 WeakPolarHBondContact O-CG 3.48Å; F355-M359 PolarHBondContact O-N 3.39Å
356	C	98.4	Very high	96.5	Very high	4 Å²	4	24.4 Å²	24.4	3%	0.027	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-41.8	171	-64.2	0	0	0	0	111.3	F352 V353 M359 K360 V443 L445	F352-C356 VanDerWaalsContact CE1-SG 3.55Å; F352-C356 PolarHBondContact O-N 3.22Å; F352-C356 PolarHBondContact O-SG 3.17Å; F352-C356 VanDerWaalsContact O-SG 3.4Å; V353-C356 PolarHBondContact O-N 3.4Å; C356-M359 PolarHBondContact O-N 3.31Å; C356-K360 PolarHBondContact O-N 3.11Å; C356-V443 HydrophobicContact CB-CG1 3.73Å; C356-L445 HydrophobicContact CB-CD2 4.13Å
357	G	96.9	Very high	96.1	Very high	10 Å²	10	24.5 Å²	24.5	10%	0.103	12%	0.122	C	C	.	.	H	α-helix	trans	-57.7	-50.4	175.1	0	0	0	0	0	114.1	V353 C354 F355 K360	V353-G357 PolarHBondContact O-N 3.27Å; V353-G357 VanDerWaalsContact O-N 3.15Å; C354-G357 PolarHBondContact O-N 2.98Å; F355-G357 VanDerWaalsContact C-N 3.31Å; F355-G357 PolarHBondContact O-N 3.39Å; G357-K360 PolarHBondContact O-N 3.17Å
358	I	96.6	Very high	95.3	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-66.2	-36.7	174.5	-175.7	161.9	0	0	0	112.3	L242 I341 C354 F355 K360 R361 L362 W431	L242-I358 HydrophobicContact CD2-CB 3.99Å; L242-I358 HydrophobicContact CD2-CD1 4.46Å; L242-I358 HydrophobicContact CD2-CG1 4.49Å; I341-I358 HydrophobicContact CD1-CB 4.27Å; I341-I358 HydrophobicContact CD1-CD1 4.24Å; I341-I358 HydrophobicContact CD1-CG2 3.57Å; C354-I358 PolarHBondContact O-N 3.22Å; F355-I358 HydrophobicContact CD2-CG2 3.97Å; F355-I358 WeakPolarHBondContact O-CG2 3.48Å; F355-I358 PolarHBondContact O-N 2.94Å; I358-K360 VanDerWaalsContact C-N 3.31Å; I358-K360 PolarHBondContact O-N 3.1Å; I358-R361 VanDerWaalsContact CD1-NH2 3.33Å; I358-R361 WeakPolarHBondContact O-CG 3.4Å; I358-R361 PolarHBondContact O-N 3.34Å; I358-L362 HydrophobicContact CD1-CD1 3.76Å; I358-L362 HydrophobicContact CG1-CD1 3.59Å; I358-L362 HydrophobicContact CG1-CG 3.85Å; I358-L362 PolarHBondContact O-N 2.89Å; I358-W431 HydrophobicContact CD1-CZ2 3.76Å
359	M	96.8	Very high	94.7	Very high	2 Å²	2	27 Å²	27	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-70.3	-23.8	-178.7	-72.3	-60.6	-69	0	0	113.1	Y321 V328 M334 F355 C356 R361 L362 A363 F366	Y321-M359 HydrophobicContact CE1-CE 3.89Å; Y321-M359 HydrophobicContact CE1-CG 4.45Å; Y321-M359 HydrophobicContact CE2-CB 3.79Å; Y321-M359 HydrophobicContact CE2-CG 3.89Å; Y321-M359 WeakPolarHBondContact OH-CB 3.26Å; V328-M359 HydrophobicContact CG1-CE 4.04Å; M334-M359 HydrophobicContact CE-CE 3.81Å; M334-M359 HydrophobicContact SD-CE 4.17Å; F355-M359 HydrophobicContact CD1-CG 4.04Å; F355-M359 HydrophobicContact CD2-CG 4.38Å; F355-M359 HydrophobicContact CE1-CG 3.69Å; F355-M359 HydrophobicContact CE1-SD 4.36Å; F355-M359 HydrophobicContact CE2-CG 4.04Å; F355-M359 HydrophobicContact CE2-SD 4.24Å; F355-M359 HydrophobicContact CG-CG 4.37Å; F355-M359 HydrophobicContact CZ-CG 3.68Å; F355-M359 HydrophobicContact CZ-SD 3.85Å; F355-M359 VanDerWaalsContact O-CB 3.29Å; F355-M359 WeakPolarHBondContact O-CB 3.33Å; F355-M359 WeakPolarHBondContact O-CG 3.48Å; F355-M359 PolarHBondContact O-N 3.39Å; C356-M359 PolarHBondContact O-N 3.31Å; M359-R361 PolarHBondContact O-N 3.09Å; M359-L362 PolarHBondContact O-N 2.88Å; M359-L362 HydrophobicContact SD-CB 4.36Å; M359-A363 HydrophobicContact CE-CB 4.14Å; M359-A363 WeakPolarHBondContact O-CB 3.12Å; M359-A363 PolarHBondContact O-N 2.93Å; M359-F366 HydrophobicContact CE-CD2 4.07Å; M359-F366 HydrophobicContact CE-CE2 4.4Å; M359-F366 HydrophobicContact SD-CE2 4.38Å
360	K	93	Very high	94.1	Very high	119 Å²	119	27.9 Å²	27.9	52%	0.517	16%	0.155	S	C	.	.	H	α-helix	trans	-52.4	-38.6	168.7	-75.1	-162.3	170.7	-152	0	112.4	C356 G357 I358 E444	C356-K360 PolarHBondContact O-N 3.11Å; G357-K360 PolarHBondContact O-N 3.17Å; I358-K360 VanDerWaalsContact C-N 3.31Å; I358-K360 PolarHBondContact O-N 3.1Å; K360-E444 VanDerWaalsContact CE-OE2 3.23Å; K360-E444 WeakPolarHBondContact CE-OE2 3.38Å; K360-E444 IonicContact NZ-OE2 3.92Å; K360-E444 PolarHBondContact NZ-OE2 3.08Å
361	R	91.3	Very high	93.8	Very high	64 Å²	64	34 Å²	34	24%	0.242	18%	0.176	C	C	.	.	H	α-helix	trans	-92.8	-28.7	176.3	69.5	164.3	-161.2	-90.4	-8.5	114.7	I358 M359 E413	I358-R361 VanDerWaalsContact CD1-NH2 3.33Å; I358-R361 WeakPolarHBondContact O-CG 3.4Å; I358-R361 PolarHBondContact O-N 3.34Å; M359-R361 PolarHBondContact O-N 3.09Å; R361-E413 IonicContact CZ-OE1 2.69Å; R361-E413 IonicContact CZ-OE2 2.9Å; R361-E413 IonicContact NE-OE1 2.67Å; R361-E413 PolarHBondContact NE-OE1 3.01Å; R361-E413 IonicContact NH2-OE1 3.14Å; R361-E413 PolarHBondContact NH2-OE1 3.1Å; R361-E413 IonicContact NH2-OE2 3.87Å; R361-E413 PolarHBondContact NH2-OE2 2.81Å
362	L	94.7	Very high	93.4	Very high	4 Å²	4	34.3 Å²	34.3	2%	0.021	18%	0.179	C	C	.	.	H	α-helix	trans	-97.4	-18.8	-173.9	-61.1	-165.2	0	0	0	115.8	L337 I358 M359 A364 N365 F366 E413	L337-L362 HydrophobicContact CD1-CD1 3.72Å; L337-L362 HydrophobicContact CD2-CD1 3.9Å; L337-L362 HydrophobicContact CG-CD1 4.46Å; I358-L362 HydrophobicContact CD1-CD1 3.76Å; I358-L362 HydrophobicContact CG1-CD1 3.59Å; I358-L362 HydrophobicContact CG1-CG 3.85Å; I358-L362 PolarHBondContact O-N 2.89Å; M359-L362 PolarHBondContact O-N 2.88Å; M359-L362 HydrophobicContact SD-CB 4.36Å; L362-A364 PolarHBondContact O-N 2.76Å; L362-A364 VanDerWaalsContact O-N 3.1Å; L362-N365 VanDerWaalsContact O-CB 3.32Å; L362-N365 WeakPolarHBondContact O-CB 3.38Å; L362-N365 PolarHBondContact O-N 3.03Å; L362-F366 HydrophobicContact CB-CE2 4.44Å; L362-F366 WeakPolarHBondContact O-CD2 3.47Å; L362-E413 HydrophobicContact CD1-CG 4.08Å; L362-E413 HydrophobicContact CD2-CG 4.22Å; L362-E413 WeakPolarHBondContact CD2-OE1 3.33Å
363	A	94.6	Very high	93.1	Very high	21 Å²	21	34.6 Å²	34.6	17%	0.174	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-51.3	-39.2	-177.3	0	0	0	0	0	113.6	V328 M359 N365 F366 H367	V328-A363 HydrophobicContact CG2-CB 3.79Å; M359-A363 HydrophobicContact CE-CB 4.14Å; M359-A363 WeakPolarHBondContact O-CB 3.12Å; M359-A363 PolarHBondContact O-N 2.93Å; A363-N365 PolarHBondContact O-N 3.31Å; A363-F366 PolarHBondContact O-N 3.08Å; A363-H367 PolarHBondContact O-N 3.29Å
364	A	93.4	Very high	92.8	Very high	35 Å²	35	35.2 Å²	35.2	29%	0.289	19%	0.185	S	C	.	.	G	3₁₀ helix	trans	-61.5	-26.2	179	0	0	0	0	0	113.8	L362 F366 H367 A372	L362-A364 PolarHBondContact O-N 2.76Å; L362-A364 VanDerWaalsContact O-N 3.1Å; A364-F366 PolarHBondContact O-N 3.48Å; A364-H367 PolarHBondContact O-N 2.76Å; A364-A372 HydrophobicContact CB-CB 3.91Å; A364-A372 VanDerWaalsContact O-CB 3.27Å; A364-A372 WeakPolarHBondContact O-CB 3.48Å
365	N	93.4	Very high	92.6	Very high	3 Å²	3	37 Å²	37	2%	0.016	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-67.6	-27.2	175.7	-55.4	-19.7	0	0	0	112.2	L362 A363 M373 K376 L411	L362-N365 VanDerWaalsContact O-CB 3.32Å; L362-N365 WeakPolarHBondContact O-CB 3.38Å; L362-N365 PolarHBondContact O-N 3.03Å; A363-N365 PolarHBondContact O-N 3.31Å; N365-M373 HydrophobicContact CB-CG 4.47Å; N365-M373 HydrophobicContact CB-SD 3.94Å; N365-M373 WeakPolarHBondContact O-CG 3.3Å; N365-K376 PolarHBondContact ND2-NZ 2.62Å; N365-K376 PolarHBondContact OD1-NZ 2.88Å; N365-L411 HydrophobicContact CB-CD1 3.77Å
366	F	93.8	Very high	92.5	Very high	16 Å²	16	37.7 Å²	37.7	7%	0.07	20%	0.199	C	C	.	.	G	3₁₀ helix	trans	-94.2	-5.3	-177.3	-63	-79.9	0	0	0	113	V328 C331 M334 L337 M359 L362 A363 A364 L411	V328-F366 HydrophobicContact CG1-CB 4.23Å; C331-F366 HydrophobicContact CB-CB 4.04Å; C331-F366 HydrophobicContact CB-CD1 3.62Å; C331-F366 HydrophobicContact CB-CG 4.18Å; M334-F366 HydrophobicContact CG-CD1 4Å; M334-F366 HydrophobicContact CG-CD2 4.36Å; M334-F366 HydrophobicContact CG-CE1 3.73Å; M334-F366 HydrophobicContact CG-CE2 4.13Å; M334-F366 HydrophobicContact CG-CG 4.31Å; M334-F366 HydrophobicContact CG-CZ 3.82Å; M334-F366 HydrophobicContact SD-CD1 4.42Å; M334-F366 HydrophobicContact SD-CG 4.39Å; L337-F366 HydrophobicContact CD1-CE2 3.67Å; L337-F366 HydrophobicContact CD1-CZ 3.56Å; M359-F366 HydrophobicContact CE-CD2 4.07Å; M359-F366 HydrophobicContact CE-CE2 4.4Å; M359-F366 HydrophobicContact SD-CE2 4.38Å; L362-F366 HydrophobicContact CB-CE2 4.44Å; L362-F366 WeakPolarHBondContact O-CD2 3.47Å; A363-F366 PolarHBondContact O-N 3.08Å; A364-F366 PolarHBondContact O-N 3.48Å; F366-L411 HydrophobicContact CD1-CD1 3.8Å; F366-L411 HydrophobicContact CD1-CG 4.47Å; F366-L411 HydrophobicContact CE1-CD1 3.55Å; F366-L411 HydrophobicContact CE1-CD2 4.05Å; F366-L411 HydrophobicContact CE1-CG 3.8Å; F366-L411 HydrophobicContact CE2-CD1 4.35Å; F366-L411 HydrophobicContact CG-CD1 4.3Å; F366-L411 HydrophobicContact CZ-CD1 3.84Å; F366-L411 HydrophobicContact CZ-CG 4.07Å
367	H	88.7	Confident	92.4	Very high	82 Å²	82	38 Å²	38	38%	0.38	20%	0.2	S	C	.	.	S	Bend	trans	-67.4	136.1	-176.2	-171.6	-107	0	0	0	111.7	A363 A364 D369 G370	A363-H367 PolarHBondContact O-N 3.29Å; A364-H367 PolarHBondContact O-N 2.76Å; H367-D369 VanDerWaalsContact C-N 3.25Å; H367-D369 IonicContact CE1-OD1 2.81Å; H367-D369 IonicContact CE1-OD2 2.71Å; H367-D369 PolarHBondContact CE1-OD2 2.96Å; H367-D369 IonicContact CG-OD1 2.69Å; H367-D369 IonicContact ND1-OD1 3.27Å; H367-D369 PolarHBondContact ND1-OD1 2.86Å; H367-D369 IonicContact ND1-OD2 3.15Å; H367-D369 PolarHBondContact ND1-OD2 2.86Å; H367-D369 PolarHBondContact O-N 3.07Å; H367-D369 VanDerWaalsContact O-N 3.08Å; H367-G370 PolarHBondContact O-N 3.48Å
368	P	80.6	Confident	92.4	Very high	109 Å²	109	39.1 Å²	39.1	71%	0.708	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-23.9	-168.8	-28.9	36.9	0	0	0	116.5	G370	P368-G370 PolarHBondContact O-N 3.29Å
369	D	86.1	Confident	92.4	Very high	61 Å²	61	40.6 Å²	40.6	33%	0.326	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-8.4	177.6	69	15.2	0	0	0	114.3	H367 R371	H367-D369 VanDerWaalsContact C-N 3.25Å; H367-D369 IonicContact CE1-OD1 2.81Å; H367-D369 IonicContact CE1-OD2 2.71Å; H367-D369 PolarHBondContact CE1-OD2 2.96Å; H367-D369 IonicContact CG-OD1 2.69Å; H367-D369 IonicContact ND1-OD1 3.27Å; H367-D369 PolarHBondContact ND1-OD1 2.86Å; H367-D369 IonicContact ND1-OD2 3.15Å; H367-D369 PolarHBondContact ND1-OD2 2.86Å; H367-D369 PolarHBondContact O-N 3.07Å; H367-D369 VanDerWaalsContact O-N 3.08Å; D369-R371 HydrophobicContact CB-CG 4.41Å; D369-R371 PolarHBondContact O-N 2.81Å; D369-R371 PolarHBondContact OD1-N 3.33Å; D369-R371 IonicContact OD1-NE 3.48Å; D369-R371 IonicContact OD2-CZ 2.85Å; D369-R371 IonicContact OD2-NE 2.73Å; D369-R371 PolarHBondContact OD2-NE 2.77Å; D369-R371 IonicContact OD2-NH2 2.7Å; D369-R371 PolarHBondContact OD2-NH2 2.88Å
370	G	86.5	Confident	92.4	Very high	19 Å²	19	40.5 Å²	40.5	20%	0.196	22%	0.215	C	C	.	.			trans	64.5	2.7	176.9	0	0	0	0	0	115.8	H367 P368 A372 M373 A374	H367-G370 PolarHBondContact O-N 3.48Å; P368-G370 PolarHBondContact O-N 3.29Å; G370-A372 VanDerWaalsContact C-N 3.33Å; G370-A372 PolarHBondContact O-N 2.88Å; G370-M373 PolarHBondContact O-N 3.28Å; G370-A374 PolarHBondContact O-N 3.28Å
371	R	91	Very high	92.6	Very high	166 Å²	166	37 Å²	37	63%	0.626	20%	0.199	S	C	*	.	H	α-helix	trans	-57.3	-42.8	-168.6	-78.3	-172.6	-75.7	-174.3	-9.1	112.8	D369 M373 A374 T375	D369-R371 HydrophobicContact CB-CG 4.41Å; D369-R371 PolarHBondContact O-N 2.81Å; D369-R371 PolarHBondContact OD1-N 3.33Å; D369-R371 IonicContact OD1-NE 3.48Å; D369-R371 IonicContact OD2-CZ 2.85Å; D369-R371 IonicContact OD2-NE 2.73Å; D369-R371 PolarHBondContact OD2-NE 2.77Å; D369-R371 IonicContact OD2-NH2 2.7Å; D369-R371 PolarHBondContact OD2-NH2 2.88Å; R371-M373 VanDerWaalsContact C-N 3.31Å; R371-M373 PolarHBondContact O-N 2.95Å; R371-A374 PolarHBondContact O-N 3.48Å; R371-T375 PolarHBondContact O-N 2.72Å; R371-T375 PolarHBondContact O-OG1 2.96Å; R371-T375 VanDerWaalsContact O-OG1 3.11Å
372	A	90.6	Very high	92.8	Very high	6 Å²	6	36.1 Å²	36.1	5%	0.05	20%	0.2	C	C	.	.	H	α-helix	trans	-65	-32.8	178.7	0	0	0	0	0	113.5	A364 G370 K376	A364-A372 HydrophobicContact CB-CB 3.91Å; A364-A372 VanDerWaalsContact O-CB 3.27Å; A364-A372 WeakPolarHBondContact O-CB 3.48Å; G370-A372 VanDerWaalsContact C-N 3.33Å; G370-A372 PolarHBondContact O-N 2.88Å; A372-K376 WeakPolarHBondContact O-CG 2.94Å; A372-K376 PolarHBondContact O-N 3.39Å
373	M	92.5	Very high	93	Very high	5 Å²	5	36 Å²	36	3%	0.025	20%	0.199	C	C	.	.	H	α-helix	trans	-74.7	-43.1	175.2	-68.2	-63.9	-70	0	0	110.6	N365 G370 R371 T375 K376 F377 Y407 L410 L411	N365-M373 HydrophobicContact CB-CG 4.47Å; N365-M373 HydrophobicContact CB-SD 3.94Å; N365-M373 WeakPolarHBondContact O-CG 3.3Å; G370-M373 PolarHBondContact O-N 3.28Å; R371-M373 VanDerWaalsContact C-N 3.31Å; R371-M373 PolarHBondContact O-N 2.95Å; M373-T375 VanDerWaalsContact C-N 3.35Å; M373-T375 PolarHBondContact O-N 3.47Å; M373-K376 PolarHBondContact O-N 3.42Å; M373-K376 VanDerWaalsContact O-N 3.08Å; M373-F377 HydrophobicContact CE-CE2 4.13Å; M373-F377 WeakPolarHBondContact O-CD2 3.47Å; M373-F377 PolarHBondContact O-N 2.69Å; M373-Y407 HydrophobicContact CE-CD2 4.01Å; M373-Y407 HydrophobicContact CE-CE2 3.95Å; M373-Y407 HydrophobicContact CE-CG 4.36Å; M373-L410 HydrophobicContact CE-CB 3.83Å; M373-L411 HydrophobicContact CE-CB 4.01Å; M373-L411 HydrophobicContact SD-CD1 4.29Å
374	A	93.1	Very high	93.1	Very high	13 Å²	13	35 Å²	35	11%	0.107	19%	0.191	C	C	.	.	H	α-helix	trans	-56.4	-45.5	176	0	0	0	0	0	112.1	G370 R371 K376 F377 A378 F481 V485	G370-A374 PolarHBondContact O-N 3.28Å; R371-A374 PolarHBondContact O-N 3.48Å; A374-K376 PolarHBondContact O-N 3.19Å; A374-F377 PolarHBondContact O-N 3.08Å; A374-A378 PolarHBondContact O-N 3.35Å; A374-F481 HydrophobicContact CB-CE2 4.29Å; A374-V485 HydrophobicContact CB-CG2 4.45Å
375	T	95.1	Very high	93.2	Very high	39 Å²	39	39.3 Å²	39.3	24%	0.239	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-43.9	173.3	-52	0	0	0	0	112.2	R371 M373 F377 A378 H379 R613	R371-T375 PolarHBondContact O-N 2.72Å; R371-T375 PolarHBondContact O-OG1 2.96Å; R371-T375 VanDerWaalsContact O-OG1 3.11Å; M373-T375 VanDerWaalsContact C-N 3.35Å; M373-T375 PolarHBondContact O-N 3.47Å; T375-F377 PolarHBondContact O-N 3.17Å; T375-A378 PolarHBondContact O-N 2.84Å; T375-H379 VanDerWaalsContact CG2-CE1 3.47Å; T375-H379 WeakPolarHBondContact CG2-CE1 3.44Å; T375-H379 WeakPolarHBondContact O-CB 3.44Å; T375-H379 VanDerWaalsContact O-CG 3.25Å; T375-H379 PolarHBondContact O-N 3.35Å; T375-R613 HydrophobicContact CG2-CG 3.83Å
376	K	95.2	Very high	93.3	Very high	13 Å²	13	44 Å²	44	6%	0.057	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-37.7	178.1	-77.5	174.8	169.3	177.8	0	112.7	N365 A372 M373 A374 L380 L410 G612	N365-K376 PolarHBondContact ND2-NZ 2.62Å; N365-K376 PolarHBondContact OD1-NZ 2.88Å; A372-K376 WeakPolarHBondContact O-CG 2.94Å; A372-K376 PolarHBondContact O-N 3.39Å; M373-K376 PolarHBondContact O-N 3.42Å; M373-K376 VanDerWaalsContact O-N 3.08Å; A374-K376 PolarHBondContact O-N 3.19Å; K376-L380 WeakPolarHBondContact O-CB 3.15Å; K376-L380 PolarHBondContact O-N 3.36Å; K376-L410 HydrophobicContact CB-CD1 4.21Å; K376-G612 VanDerWaalsContact CE-O 3.29Å; K376-G612 WeakPolarHBondContact CE-O 3.42Å
377	F	96.4	Very high	93.4	Very high	11 Å²	11	45.2 Å²	45.2	5%	0.048	23%	0.234	C	C	.	.	H	α-helix	trans	-66.7	-47.6	172.5	-80.4	-69.7	0	0	0	112.1	M373 A374 T375 H379 L380 K381 L403 F404 C406 Y407 L410	M373-F377 HydrophobicContact CE-CE2 4.13Å; M373-F377 WeakPolarHBondContact O-CD2 3.47Å; M373-F377 PolarHBondContact O-N 2.69Å; A374-F377 PolarHBondContact O-N 3.08Å; T375-F377 PolarHBondContact O-N 3.17Å; F377-H379 VanDerWaalsContact C-N 3.27Å; F377-H379 PolarHBondContact O-N 2.96Å; F377-L380 PolarHBondContact O-N 3.4Å; F377-L380 VanDerWaalsContact O-N 3.1Å; F377-K381 WeakPolarHBondContact O-CG 2.96Å; F377-K381 PolarHBondContact O-N 3.16Å; F377-L403 HydrophobicContact CD1-CB 4.37Å; F377-L403 HydrophobicContact CE1-CB 4.46Å; F377-L403 WeakPolarHBondContact CE1-O 3.35Å; F377-F404 HydrophobicContact CD1-CD1 4.36Å; F377-F404 HydrophobicContact CD2-CD1 4.37Å; F377-F404 HydrophobicContact CD2-CE1 4.14Å; F377-F404 AromaticContact CE1-CD1 3.95Å; F377-F404 HydrophobicContact CE1-CD1 3.95Å; F377-F404 AromaticContact CE2-CD1 3.97Å; F377-F404 HydrophobicContact CE2-CD1 3.97Å; F377-F404 HydrophobicContact CE2-CE1 4.11Å; F377-F404 HydrophobicContact CG-CE1 4.39Å; F377-F404 AromaticContact CZ-CD1 3.72Å; F377-F404 HydrophobicContact CZ-CD1 3.72Å; F377-F404 HydrophobicContact CZ-CE1 4.3Å; F377-C406 HydrophobicContact CE1-CB 4.43Å; F377-Y407 AromaticContact CE2-CD2 3.71Å; F377-Y407 HydrophobicContact CE2-CD2 3.71Å; F377-Y407 HydrophobicContact CE2-CE2 4.41Å; F377-Y407 AromaticContact CZ-CD2 3.86Å; F377-Y407 HydrophobicContact CZ-CD2 3.86Å; F377-Y407 HydrophobicContact CZ-CG 4.33Å; F377-L410 HydrophobicContact CD1-CD1 3.97Å; F377-L410 HydrophobicContact CD2-CD1 4.44Å; F377-L410 HydrophobicContact CE1-CD1 3.88Å; F377-L410 HydrophobicContact CE2-CD1 4.35Å; F377-L410 HydrophobicContact CG-CD1 4.26Å; F377-L410 HydrophobicContact CZ-CD1 4.09Å
378	A	96.3	Very high	93.8	Very high	33 Å²	33	42.2 Å²	42.2	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-55.1	-44.6	176.2	0	0	0	0	0	111.6	A374 T375 K381 L382	A374-A378 PolarHBondContact O-N 3.35Å; T375-A378 PolarHBondContact O-N 2.84Å; A378-K381 PolarHBondContact O-N 3.15Å; A378-L382 WeakPolarHBondContact O-CB 3.34Å; A378-L382 PolarHBondContact O-N 3.47Å
379	H	97.3	Very high	94.6	Very high	31 Å²	31	40.8 Å²	40.8	14%	0.144	21%	0.212	C	C	.	.	H	α-helix	trans	-67.3	-37.8	175.6	-67.2	172.4	0	0	0	113.3	T375 F377 L382 L383 E610 F611 G612 L619	T375-H379 VanDerWaalsContact CG2-CE1 3.47Å; T375-H379 WeakPolarHBondContact CG2-CE1 3.44Å; T375-H379 WeakPolarHBondContact O-CB 3.44Å; T375-H379 VanDerWaalsContact O-CG 3.25Å; T375-H379 PolarHBondContact O-N 3.35Å; F377-H379 VanDerWaalsContact C-N 3.27Å; F377-H379 PolarHBondContact O-N 2.96Å; H379-L382 PolarHBondContact O-N 3.25Å; H379-L383 VanDerWaalsContact O-CB 3.27Å; H379-L383 WeakPolarHBondContact O-CB 3.35Å; H379-L383 PolarHBondContact O-N 2.8Å; H379-E610 PolarHBondContact CE1-O 2.95Å; H379-F611 HydrophobicContact CB-CD2 3.78Å; H379-F611 HydrophobicContact CB-CE2 3.66Å; H379-F611 AromaticContact CG-CD2 3.75Å; H379-F611 AromaticContact ND1-CD2 3.94Å; H379-G612 PolarHBondContact ND1-N 2.93Å; H379-L619 HydrophobicContact CB-CD1 3.49Å; H379-L619 VanDerWaalsContact CB-CD1 3.49Å
380	L	97.9	Very high	95.1	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-67.7	-38.2	175.5	-174.8	61.6	0	0	0	112.3	K376 F377 L383 L384 L403 C406 L410 L619 C622	K376-L380 WeakPolarHBondContact O-CB 3.15Å; K376-L380 PolarHBondContact O-N 3.36Å; F377-L380 PolarHBondContact O-N 3.4Å; F377-L380 VanDerWaalsContact O-N 3.1Å; L380-L383 PolarHBondContact O-N 3.44Å; L380-L384 WeakPolarHBondContact O-CB 3.49Å; L380-L384 PolarHBondContact O-N 3.5Å; L380-L403 HydrophobicContact CB-CD1 4.37Å; L380-L403 HydrophobicContact CD2-CD1 3.89Å; L380-L403 HydrophobicContact CG-CD1 3.75Å; L380-C406 HydrophobicContact CD2-CB 4.26Å; L380-L410 HydrophobicContact CD2-CD1 4.16Å; L380-L619 HydrophobicContact CB-CD2 4.38Å; L380-L619 HydrophobicContact CD1-CB 4.39Å; L380-C622 HydrophobicContact CD1-CB 3.75Å; L380-C622 HydrophobicContact CD2-CB 4.08Å
381	K	96.5	Very high	95.7	Very high	45 Å²	45	42.1 Å²	42.1	20%	0.196	21%	0.214	C	C	.	.	H	α-helix	trans	-64.9	-44.9	174.5	-67.4	-165.9	-55.2	176.4	0	111.6	F377 A378 L384 R385 Y392 D401 L403	F377-K381 WeakPolarHBondContact O-CG 2.96Å; F377-K381 PolarHBondContact O-N 3.16Å; A378-K381 PolarHBondContact O-N 3.15Å; K381-L384 PolarHBondContact O-N 3.15Å; K381-R385 WeakPolarHBondContact O-CB 3.26Å; K381-R385 PolarHBondContact O-N 3.45Å; K381-Y392 HydrophobicContact CB-CE2 4.13Å; K381-D401 WeakPolarHBondContact CD-O 3.49Å; K381-D401 WeakPolarHBondContact CG-O 3.38Å; K381-D401 IonicContact NZ-OD2 2.74Å; K381-L403 HydrophobicContact CG-CD1 3.85Å; K381-L403 HydrophobicContact CG-CG 4.17Å
382	L	96.3	Very high	96	Very high	47 Å²	47	35.2 Å²	35.2	25%	0.246	19%	0.188	C	C	.	.	H	α-helix	trans	-61	-44.4	174.6	-178.5	61.3	0	0	0	111.5	A378 H379 R385 H386 L605 P606	A378-L382 WeakPolarHBondContact O-CB 3.34Å; A378-L382 PolarHBondContact O-N 3.47Å; H379-L382 PolarHBondContact O-N 3.25Å; L382-R385 PolarHBondContact O-N 2.71Å; L382-H386 WeakPolarHBondContact O-CB 3.24Å; L382-H386 PolarHBondContact O-N 2.78Å; L382-L605 HydrophobicContact CD2-CD2 4.46Å; L382-L605 HydrophobicContact CG-CD2 3.98Å; L382-P606 HydrophobicContact CD2-CG 4.17Å
383	L	97.1	Very high	96.4	Very high	2 Å²	2	40 Å²	40	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-47	176.4	-177.3	52.7	0	0	0	112.3	H379 L380 H386 A387 L605 F611 L619 F620 L623	H379-L383 VanDerWaalsContact O-CB 3.27Å; H379-L383 WeakPolarHBondContact O-CB 3.35Å; H379-L383 PolarHBondContact O-N 2.8Å; L380-L383 PolarHBondContact O-N 3.44Å; L383-H386 PolarHBondContact O-N 3.43Å; L383-A387 WeakPolarHBondContact O-CB 3.44Å; L383-A387 PolarHBondContact O-N 3.45Å; L383-L605 HydrophobicContact CD1-CD1 3.86Å; L383-F611 HydrophobicContact CB-CZ 3.9Å; L383-F611 HydrophobicContact CD1-CE1 4.32Å; L383-F611 HydrophobicContact CD1-CZ 4.19Å; L383-F611 HydrophobicContact CD2-CE1 4.43Å; L383-F611 HydrophobicContact CD2-CZ 4.37Å; L383-F611 HydrophobicContact CG-CZ 4.36Å; L383-L619 HydrophobicContact CD2-CB 3.6Å; L383-F620 HydrophobicContact CD1-CD1 4.21Å; L383-F620 HydrophobicContact CD1-CE1 3.56Å; L383-F620 HydrophobicContact CD1-CE2 4.39Å; L383-F620 HydrophobicContact CD1-CZ 3.64Å; L383-F620 HydrophobicContact CD2-CD1 4.19Å; L383-F620 HydrophobicContact CD2-CD2 4.34Å; L383-F620 HydrophobicContact CD2-CE1 4.28Å; L383-F620 HydrophobicContact CD2-CE2 4.38Å; L383-F620 HydrophobicContact CD2-CG 4.23Å; L383-F620 HydrophobicContact CD2-CZ 4.35Å; L383-L623 HydrophobicContact CD1-CD2 4.01Å; L383-L623 HydrophobicContact CD2-CB 4.09Å; L383-L623 HydrophobicContact CD2-CD2 4.22Å; L383-L623 HydrophobicContact CG-CB 4.39Å; L383-L623 HydrophobicContact CG-CD2 3.83Å
384	L	97.4	Very high	96.7	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-65.2	-43.1	178.8	-177	60.4	0	0	0	111.6	L380 K381 H386 A387 D388 F391 Y392 L395 L403 L623 L626 L627	L380-L384 WeakPolarHBondContact O-CB 3.49Å; L380-L384 PolarHBondContact O-N 3.5Å; K381-L384 PolarHBondContact O-N 3.15Å; L384-H386 VanDerWaalsContact C-N 3.3Å; L384-H386 PolarHBondContact O-N 3.04Å; L384-A387 PolarHBondContact O-N 3.28Å; L384-D388 CarbonylContact O-C 3.51Å; L384-D388 PolarHBondContact O-N 2.91Å; L384-F391 HydrophobicContact CD1-CD1 3.95Å; L384-F391 HydrophobicContact CD1-CE1 4.35Å; L384-Y392 HydrophobicContact CB-CD2 4.4Å; L384-Y392 HydrophobicContact CD2-CD2 4.29Å; L384-Y392 HydrophobicContact CG-CD2 4.27Å; L384-L395 HydrophobicContact CD2-CD1 3.62Å; L384-L403 HydrophobicContact CD2-CD1 4.17Å; L384-L403 HydrophobicContact CD2-CD2 3.99Å; L384-L623 HydrophobicContact CB-CD1 4.37Å; L384-L623 HydrophobicContact CD1-CD1 3.56Å; L384-L626 HydrophobicContact CD2-CD1 4.23Å; L384-L627 HydrophobicContact CD1-CD2 4.48Å
385	R	96.4	Very high	96.9	Very high	124 Å²	124	41 Å²	41	47%	0.468	21%	0.21	S	C	.	.	H	α-helix	trans	-63.3	-33.5	176.6	-173	178.2	-177.8	-169.6	1.6	113.1	K381 L382 Y392	K381-R385 WeakPolarHBondContact O-CB 3.26Å; K381-R385 PolarHBondContact O-N 3.45Å; L382-R385 PolarHBondContact O-N 2.71Å; R385-Y392 HydrophobicContact CB-CD1 3.84Å; R385-Y392 HydrophobicContact CB-CD2 3.93Å; R385-Y392 HydrophobicContact CB-CE1 4.2Å; R385-Y392 HydrophobicContact CB-CE2 4.28Å; R385-Y392 HydrophobicContact CB-CG 3.7Å; R385-Y392 HydrophobicContact CG-CD1 3.68Å; R385-Y392 HydrophobicContact CG-CE1 4.03Å; R385-Y392 HydrophobicContact CG-CG 4.03Å
386	H	94.1	Very high	96.9	Very high	101 Å²	101	43.6 Å²	43.6	47%	0.468	22%	0.22	S	C	.	.	H	α-helix	trans	-74.7	-44.2	175.5	-174.7	114.8	0	0	0	111.6	L382 L383 L384 L605	L382-H386 WeakPolarHBondContact O-CB 3.24Å; L382-H386 PolarHBondContact O-N 2.78Å; L383-H386 PolarHBondContact O-N 3.43Å; L384-H386 VanDerWaalsContact C-N 3.3Å; L384-H386 PolarHBondContact O-N 3.04Å; H386-L605 HydrophobicContact CB-CD1 4.49Å; H386-L605 HydrophobicContact CB-CD2 3.82Å; H386-L605 HydrophobicContact CB-CG 4.35Å
387	A	95.4	Very high	97	Very high	42 Å²	42	49.8 Å²	49.8	35%	0.347	25%	0.249	S	C	.	.	H	α-helix	trans	-78.7	-31	-175	0	0	0	0	0	114.3	L383 L384 L623	L383-A387 WeakPolarHBondContact O-CB 3.44Å; L383-A387 PolarHBondContact O-N 3.45Å; L384-A387 PolarHBondContact O-N 3.28Å; A387-L623 HydrophobicContact CB-CD1 4.18Å; A387-L623 HydrophobicContact CB-CD2 3.58Å; A387-L623 HydrophobicContact CB-CG 4.49Å
388	D	97.3	Very high	96.9	Very high	20 Å²	20	50.7 Å²	50.7	11%	0.107	26%	0.259	C	S	.	.			trans	-152	79.6	-176	-156.1	-42.9	0	0	0	111.3	L384 D390 F391 Y392 L627 R630	L384-D388 CarbonylContact O-C 3.51Å; L384-D388 PolarHBondContact O-N 2.91Å; D388-D390 VanDerWaalsContact C-N 3.3Å; D388-D390 PolarHBondContact O-N 3.1Å; D388-F391 HydrophobicContact CB-CB 4.07Å; D388-F391 PolarHBondContact O-N 3.02Å; D388-F391 VanDerWaalsContact OD1-CB 3.24Å; D388-F391 WeakPolarHBondContact OD1-CB 3.17Å; D388-F391 PolarHBondContact OD1-N 3.38Å; D388-F391 VanDerWaalsContact OD1-N 3.13Å; D388-Y392 PolarHBondContact O-N 3.3Å; D388-L627 HydrophobicContact CB-CD2 3.87Å; D388-L627 VanDerWaalsContact OD2-CD2 3.3Å; D388-L627 WeakPolarHBondContact OD2-CD2 3.43Å; D388-R630 VanDerWaalsContact CG-NE 3.3Å; D388-R630 IonicContact OD1-CZ 3.64Å; D388-R630 IonicContact OD1-NE 3.48Å; D388-R630 PolarHBondContact OD1-NE 3.5Å; D388-R630 IonicContact OD1-NH2 3.71Å; D388-R630 PolarHBondContact OD1-NH2 3.33Å; D388-R630 VanDerWaalsContact OD2-CD 3.23Å; D388-R630 WeakPolarHBondContact OD2-CD 3.34Å; D388-R630 IonicContact OD2-CZ 2.67Å; D388-R630 IonicContact OD2-NE 3.63Å; D388-R630 PolarHBondContact OD2-NE 3.16Å; D388-R630 IonicContact OD2-NH2 2.73Å
389	P	97.3	Very high	96.8	Very high	79 Å²	79	51.5 Å²	51.5	51%	0.513	27%	0.27	S	S	.	.	H	α-helix	trans	-57.4	-40.3	-176.8	-25.3	33.7	0	0	0	113.3	Y392 Q393	P389-Y392 PolarHBondContact O-N 3.03Å; P389-Q393 WeakPolarHBondContact O-CB 3.13Å; P389-Q393 PolarHBondContact O-N 2.92Å
390	D	98	Very high	96.6	Very high	106 Å²	106	50 Å²	50	57%	0.567	26%	0.263	S	S	*	.	H	α-helix	trans	-62.7	-45.3	179.4	-62.7	-8.6	0	0	0	111.6	D388 Q393 Y394 R630 M634	D388-D390 VanDerWaalsContact C-N 3.3Å; D388-D390 PolarHBondContact O-N 3.1Å; D390-Q393 PolarHBondContact O-N 3.07Å; D390-Y394 WeakPolarHBondContact O-CB 3.48Å; D390-Y394 PolarHBondContact O-N 3.47Å; D390-R630 IonicContact OD2-NH2 3.11Å; D390-M634 HydrophobicContact CB-CE 4.37Å
391	F	98.4	Very high	96.4	Very high	1 Å²	1	52.1 Å²	52.1	0%	0.004	27%	0.274	C	S	.	.	H	α-helix	trans	-72.4	-34.2	179.2	-177.3	-147.2	0	0	0	111.8	L384 D388 Y394 L395 L626 L627 R630 I633 M634	L384-F391 HydrophobicContact CD1-CD1 3.95Å; L384-F391 HydrophobicContact CD1-CE1 4.35Å; D388-F391 HydrophobicContact CB-CB 4.07Å; D388-F391 PolarHBondContact O-N 3.02Å; D388-F391 VanDerWaalsContact OD1-CB 3.24Å; D388-F391 WeakPolarHBondContact OD1-CB 3.17Å; D388-F391 PolarHBondContact OD1-N 3.38Å; D388-F391 VanDerWaalsContact OD1-N 3.13Å; F391-Y394 HydrophobicContact CD2-CD1 4.23Å; F391-Y394 HydrophobicContact CE2-CD1 4.29Å; F391-Y394 PolarHBondContact O-N 3.26Å; F391-L395 HydrophobicContact CD2-CD1 4.33Å; F391-L395 HydrophobicContact CD2-CG 4.23Å; F391-L395 HydrophobicContact CE1-CD1 4.45Å; F391-L395 HydrophobicContact CE2-CD1 3.97Å; F391-L395 HydrophobicContact CE2-CD2 4.1Å; F391-L395 HydrophobicContact CE2-CG 3.92Å; F391-L395 HydrophobicContact CZ-CD1 4.03Å; F391-L395 HydrophobicContact CZ-CG 4.45Å; F391-L395 WeakPolarHBondContact O-CG 3.4Å; F391-L395 PolarHBondContact O-N 2.87Å; F391-L395 VanDerWaalsContact O-N 3.08Å; F391-L626 HydrophobicContact CE1-CB 4.2Å; F391-L627 HydrophobicContact CD1-CD2 4.12Å; F391-R630 HydrophobicContact CB-CG 4.03Å; F391-R630 HydrophobicContact CD1-CB 3.99Å; F391-R630 HydrophobicContact CD1-CG 3.8Å; F391-R630 HydrophobicContact CD2-CG 4.21Å; F391-R630 HydrophobicContact CE1-CB 4.02Å; F391-R630 HydrophobicContact CE1-CG 4.3Å; F391-R630 HydrophobicContact CG-CB 4.38Å; F391-R630 HydrophobicContact CG-CG 3.76Å; F391-R630 HydrophobicContact CZ-CB 4.45Å; F391-I633 HydrophobicContact CE2-CB 4.31Å; F391-I633 HydrophobicContact CE2-CD1 4.22Å; F391-I633 HydrophobicContact CE2-CG2 3.92Å; F391-I633 HydrophobicContact CZ-CD1 3.76Å; F391-M634 HydrophobicContact CB-SD 3.98Å; F391-M634 HydrophobicContact CD2-CG 3.89Å; F391-M634 HydrophobicContact CD2-SD 3.85Å; F391-M634 HydrophobicContact CE2-CG 4.39Å; F391-M634 HydrophobicContact CG-SD 4.2Å
392	Y	98.1	Very high	96.1	Very high	21 Å²	21	51.6 Å²	51.6	8%	0.082	27%	0.273	C	S	.	.	H	α-helix	trans	-62.4	-46.5	170.6	-176.4	-96.5	0	0	0	111.6	K381 L384 R385 D388 P389 Y394 L395 Q396 D401	K381-Y392 HydrophobicContact CB-CE2 4.13Å; L384-Y392 HydrophobicContact CB-CD2 4.4Å; L384-Y392 HydrophobicContact CD2-CD2 4.29Å; L384-Y392 HydrophobicContact CG-CD2 4.27Å; R385-Y392 HydrophobicContact CB-CD1 3.84Å; R385-Y392 HydrophobicContact CB-CD2 3.93Å; R385-Y392 HydrophobicContact CB-CE1 4.2Å; R385-Y392 HydrophobicContact CB-CE2 4.28Å; R385-Y392 HydrophobicContact CB-CG 3.7Å; R385-Y392 HydrophobicContact CG-CD1 3.68Å; R385-Y392 HydrophobicContact CG-CE1 4.03Å; R385-Y392 HydrophobicContact CG-CG 4.03Å; D388-Y392 PolarHBondContact O-N 3.3Å; P389-Y392 PolarHBondContact O-N 3.03Å; Y392-Y394 PolarHBondContact O-N 3.42Å; Y392-L395 PolarHBondContact O-N 3.45Å; Y392-L395 VanDerWaalsContact O-N 3.15Å; Y392-Q396 HydrophobicContact CD1-CG 4.18Å; Y392-Q396 HydrophobicContact CE1-CG 3.75Å; Y392-Q396 VanDerWaalsContact CE1-OE1 3.26Å; Y392-Q396 WeakPolarHBondContact O-CG 3.49Å; Y392-Q396 PolarHBondContact O-N 3.03Å; Y392-D401 HydrophobicContact CE2-CB 4.41Å
393	Q	98.1	Very high	96	Very high	106 Å²	106	49.3 Å²	49.3	50%	0.495	26%	0.262	S	S	.	.	H	α-helix	trans	-59.8	-45.2	175.8	179.8	179.1	-30.2	0	0	111.6	P389 D390 L395 Q396 E397	P389-Q393 WeakPolarHBondContact O-CB 3.13Å; P389-Q393 PolarHBondContact O-N 2.92Å; D390-Q393 PolarHBondContact O-N 3.07Å; Q393-L395 VanDerWaalsContact C-N 3.26Å; Q393-L395 PolarHBondContact O-N 3.44Å; Q393-Q396 WeakPolarHBondContact O-CB 3.29Å; Q393-Q396 PolarHBondContact O-N 3.11Å; Q393-E397 HydrophobicContact CG-CG 4.49Å; Q393-E397 WeakPolarHBondContact CG-OE1 3.31Å; Q393-E397 PolarHBondContact NE2-OE1 3.1Å; Q393-E397 PolarHBondContact O-N 3.47Å
394	Y	98.3	Very high	95.8	Very high	39 Å²	39	50.2 Å²	50.2	15%	0.153	27%	0.266	C	S	.	.	H	α-helix	trans	-53.9	-43.2	174.2	171.6	-83.8	0	0	0	112	D390 F391 Y392 E397 A398 I633 M634 G637 L638	D390-Y394 WeakPolarHBondContact O-CB 3.48Å; D390-Y394 PolarHBondContact O-N 3.47Å; F391-Y394 HydrophobicContact CD2-CD1 4.23Å; F391-Y394 HydrophobicContact CE2-CD1 4.29Å; F391-Y394 PolarHBondContact O-N 3.26Å; Y392-Y394 PolarHBondContact O-N 3.42Å; Y394-E397 PolarHBondContact O-N 2.73Å; Y394-A398 HydrophobicContact CE1-CB 4.22Å; Y394-A398 WeakPolarHBondContact O-CB 3.46Å; Y394-A398 PolarHBondContact O-N 3.22Å; Y394-I633 HydrophobicContact CD1-CG2 4.21Å; Y394-I633 HydrophobicContact CE1-CG2 3.53Å; Y394-M634 HydrophobicContact CD1-CG 4.12Å; Y394-M634 HydrophobicContact CD2-CB 4.43Å; Y394-M634 HydrophobicContact CD2-CG 4.08Å; Y394-M634 HydrophobicContact CG-CE 4.37Å; Y394-M634 HydrophobicContact CG-CG 3.88Å; Y394-G637 VanDerWaalsContact OH-CA 3.29Å; Y394-G637 WeakPolarHBondContact OH-CA 3.49Å; Y394-L638 PolarHBondContact OH-N 2.69Å; Y394-L638 PolarHBondContact OH-O 2.53Å
395	L	97.6	Very high	95.7	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-32.6	177.6	-68.3	170.2	0	0	0	112.3	L384 F391 Y392 Q393 A398 G399 A400 D401 L403 L643	L384-L395 HydrophobicContact CD2-CD1 3.62Å; F391-L395 HydrophobicContact CD2-CD1 4.33Å; F391-L395 HydrophobicContact CD2-CG 4.23Å; F391-L395 HydrophobicContact CE1-CD1 4.45Å; F391-L395 HydrophobicContact CE2-CD1 3.97Å; F391-L395 HydrophobicContact CE2-CD2 4.1Å; F391-L395 HydrophobicContact CE2-CG 3.92Å; F391-L395 HydrophobicContact CZ-CD1 4.03Å; F391-L395 HydrophobicContact CZ-CG 4.45Å; F391-L395 WeakPolarHBondContact O-CG 3.4Å; F391-L395 PolarHBondContact O-N 2.87Å; F391-L395 VanDerWaalsContact O-N 3.08Å; Y392-L395 PolarHBondContact O-N 3.45Å; Y392-L395 VanDerWaalsContact O-N 3.15Å; Q393-L395 VanDerWaalsContact C-N 3.26Å; Q393-L395 PolarHBondContact O-N 3.44Å; L395-A398 PolarHBondContact O-N 3.13Å; L395-G399 PolarHBondContact O-N 3.06Å; L395-A400 HydrophobicContact CD2-CB 4Å; L395-A400 CarbonylContact O-C 3.56Å; L395-A400 WeakPolarHBondContact O-CA 3.34Å; L395-A400 PolarHBondContact O-N 2.76Å; L395-D401 PolarHBondContact O-N 3.17Å; L395-L403 HydrophobicContact CD1-CD2 3.9Å; L395-L643 HydrophobicContact CD2-CD1 3.55Å; L395-L643 HydrophobicContact CD2-CD2 4.39Å
396	Q	96.8	Very high	95.7	Very high	94 Å²	94	45.2 Å²	45.2	44%	0.439	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-43.5	171.2	-63.1	-167.9	-79	0	0	111.7	Y392 Q393 A398 G399 D401	Y392-Q396 HydrophobicContact CD1-CG 4.18Å; Y392-Q396 HydrophobicContact CE1-CG 3.75Å; Y392-Q396 VanDerWaalsContact CE1-OE1 3.26Å; Y392-Q396 WeakPolarHBondContact O-CG 3.49Å; Y392-Q396 PolarHBondContact O-N 3.03Å; Q393-Q396 WeakPolarHBondContact O-CB 3.29Å; Q393-Q396 PolarHBondContact O-N 3.11Å; Q396-A398 VanDerWaalsContact C-N 3.33Å; Q396-A398 PolarHBondContact O-N 3.36Å; Q396-G399 PolarHBondContact O-N 2.99Å; Q396-D401 HydrophobicContact CB-CB 4.39Å; Q396-D401 HydrophobicContact CG-CB 3.65Å
397	E	96.8	Very high	95.7	Very high	144 Å²	144	41.8 Å²	41.8	67%	0.673	23%	0.23	S	C	*	.	H	α-helix	trans	-65.6	-34.6	177.1	-69.6	175.6	-167.1	0	0	112.3	Q393 Y394 G399	Q393-E397 HydrophobicContact CG-CG 4.49Å; Q393-E397 WeakPolarHBondContact CG-OE1 3.31Å; Q393-E397 PolarHBondContact NE2-OE1 3.1Å; Q393-E397 PolarHBondContact O-N 3.47Å; Y394-E397 PolarHBondContact O-N 2.73Å; E397-G399 VanDerWaalsContact C-N 3.29Å; E397-G399 PolarHBondContact O-N 3.37Å
398	A	93.9	Very high	95.7	Very high	30 Å²	30	41.3 Å²	41.3	25%	0.248	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.3	-0.4	174.7	0	0	0	0	0	114.5	Y394 L395 Q396 A400	Y394-A398 HydrophobicContact CE1-CB 4.22Å; Y394-A398 WeakPolarHBondContact O-CB 3.46Å; Y394-A398 PolarHBondContact O-N 3.22Å; L395-A398 PolarHBondContact O-N 3.13Å; Q396-A398 VanDerWaalsContact C-N 3.33Å; Q396-A398 PolarHBondContact O-N 3.36Å; A398-A400 VanDerWaalsContact C-N 3.28Å; A398-A400 HydrophobicContact CB-CB 4.44Å; A398-A400 PolarHBondContact O-N 3.17Å
399	G	93.4	Very high	95.7	Very high	49 Å²	49	40.4 Å²	40.4	51%	0.505	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.6	28.6	-177.1	0	0	0	0	0	114.1	L395 Q396 E397	L395-G399 PolarHBondContact O-N 3.06Å; Q396-G399 PolarHBondContact O-N 2.99Å; E397-G399 VanDerWaalsContact C-N 3.29Å; E397-G399 PolarHBondContact O-N 3.37Å
400	A	94.3	Very high	95.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.19	C	C	.	.			trans	-123.4	14.1	-171.9	0	0	0	0	0	113.9	L395 A398 D402 L403 F405 Y640 L643	L395-A400 HydrophobicContact CD2-CB 4Å; L395-A400 CarbonylContact O-C 3.56Å; L395-A400 WeakPolarHBondContact O-CA 3.34Å; L395-A400 PolarHBondContact O-N 2.76Å; A398-A400 VanDerWaalsContact C-N 3.28Å; A398-A400 HydrophobicContact CB-CB 4.44Å; A398-A400 PolarHBondContact O-N 3.17Å; A400-D402 PolarHBondContact O-N 3.03Å; A400-L403 PolarHBondContact O-N 2.7Å; A400-F405 HydrophobicContact CB-CE1 4.33Å; A400-Y640 HydrophobicContact CB-CD2 3.78Å; A400-L643 HydrophobicContact CB-CD1 3.69Å
401	D	92.3	Very high	95.5	Very high	45 Å²	45	31.9 Å²	31.9	24%	0.241	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-14.9	178.4	76.4	-67.7	0	0	0	113.5	K381 Y392 L395 Q396 L403	K381-D401 WeakPolarHBondContact CD-O 3.49Å; K381-D401 WeakPolarHBondContact CG-O 3.38Å; K381-D401 IonicContact NZ-OD2 2.74Å; Y392-D401 HydrophobicContact CE2-CB 4.41Å; L395-D401 PolarHBondContact O-N 3.17Å; Q396-D401 HydrophobicContact CB-CB 4.39Å; Q396-D401 HydrophobicContact CG-CB 3.65Å; D401-L403 PolarHBondContact O-N 2.94Å
402	D	90.7	Very high	95.4	Very high	33 Å²	33	31.9 Å²	31.9	18%	0.176	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-19.8	172.6	71.9	21.9	0	0	0	113.6	A400 F404	A400-D402 PolarHBondContact O-N 3.03Å; D402-F404 HydrophobicContact CB-CD2 3.84Å; D402-F404 HydrophobicContact CB-CE2 3.83Å; D402-F404 HydrophobicContact CB-CG 4.26Å; D402-F404 HydrophobicContact CB-CZ 4.26Å; D402-F404 PolarHBondContact O-N 2.64Å; D402-F404 PolarHBondContact OD1-N 2.83Å; D402-F404 WeakPolarHBondContact OD2-CD2 3.28Å
403	L	95.4	Very high	95.3	Very high	0 Å²	0	31 Å²	31	0%	0	16%	0.162	C	C	.	.			trans	56.7	21.6	-177.7	-53.6	179.2	0	0	0	114.5	F377 L380 K381 L384 L395 A400 D401 F405 C406	F377-L403 HydrophobicContact CD1-CB 4.37Å; F377-L403 HydrophobicContact CE1-CB 4.46Å; F377-L403 WeakPolarHBondContact CE1-O 3.35Å; L380-L403 HydrophobicContact CB-CD1 4.37Å; L380-L403 HydrophobicContact CD2-CD1 3.89Å; L380-L403 HydrophobicContact CG-CD1 3.75Å; K381-L403 HydrophobicContact CG-CD1 3.85Å; K381-L403 HydrophobicContact CG-CG 4.17Å; L384-L403 HydrophobicContact CD2-CD1 4.17Å; L384-L403 HydrophobicContact CD2-CD2 3.99Å; L395-L403 HydrophobicContact CD1-CD2 3.9Å; A400-L403 PolarHBondContact O-N 2.7Å; D401-L403 PolarHBondContact O-N 2.94Å; L403-F405 HydrophobicContact CD2-CE1 4.26Å; L403-F405 HydrophobicContact CD2-CZ 3.74Å; L403-F405 PolarHBondContact O-N 2.95Å; L403-C406 WeakPolarHBondContact O-CA 3.44Å; L403-C406 WeakPolarHBondContact O-CB 3.12Å; L403-C406 PolarHBondContact O-N 3.47Å
404	F	92.6	Very high	95.3	Very high	21 Å²	21	26 Å²	26	9%	0.092	14%	0.138	C	C	.	.	G	3₁₀ helix	trans	-64.4	-16.9	-172.5	-71.8	-36.5	0	0	0	115	F377 D402 C406 Y407 F481 S506 L510 L513	F377-F404 HydrophobicContact CD1-CD1 4.36Å; F377-F404 HydrophobicContact CD2-CD1 4.37Å; F377-F404 HydrophobicContact CD2-CE1 4.14Å; F377-F404 AromaticContact CE1-CD1 3.95Å; F377-F404 HydrophobicContact CE1-CD1 3.95Å; F377-F404 AromaticContact CE2-CD1 3.97Å; F377-F404 HydrophobicContact CE2-CD1 3.97Å; F377-F404 HydrophobicContact CE2-CE1 4.11Å; F377-F404 HydrophobicContact CG-CE1 4.39Å; F377-F404 AromaticContact CZ-CD1 3.72Å; F377-F404 HydrophobicContact CZ-CD1 3.72Å; F377-F404 HydrophobicContact CZ-CE1 4.3Å; D402-F404 HydrophobicContact CB-CD2 3.84Å; D402-F404 HydrophobicContact CB-CE2 3.83Å; D402-F404 HydrophobicContact CB-CG 4.26Å; D402-F404 HydrophobicContact CB-CZ 4.26Å; D402-F404 PolarHBondContact O-N 2.64Å; D402-F404 PolarHBondContact OD1-N 2.83Å; D402-F404 WeakPolarHBondContact OD2-CD2 3.28Å; F404-C406 PolarHBondContact O-N 2.95Å; F404-Y407 WeakPolarHBondContact O-CB 3.33Å; F404-Y407 PolarHBondContact O-N 2.92Å; F404-F481 HydrophobicContact CE1-CZ 4.42Å; F404-F481 HydrophobicContact CZ-CE1 4.14Å; F404-F481 AromaticContact CZ-CZ 3.96Å; F404-F481 HydrophobicContact CZ-CZ 3.96Å; F404-S506 WeakPolarHBondContact CE2-OG 3.37Å; F404-L510 HydrophobicContact CD1-CD2 3.83Å; F404-L510 HydrophobicContact CD2-CD2 4.07Å; F404-L510 HydrophobicContact CD2-CG 4.26Å; F404-L510 HydrophobicContact CE1-CD1 4.4Å; F404-L510 HydrophobicContact CE1-CD2 3.99Å; F404-L510 HydrophobicContact CE2-CD1 4.04Å; F404-L510 HydrophobicContact CE2-CD2 4.22Å; F404-L510 HydrophobicContact CE2-CG 4.15Å; F404-L510 HydrophobicContact CG-CD2 3.9Å; F404-L510 HydrophobicContact CZ-CD1 3.92Å; F404-L510 HydrophobicContact CZ-CD2 4.19Å; F404-L510 HydrophobicContact CZ-CG 4.36Å; F404-L513 HydrophobicContact CB-CD1 4.36Å
405	F	93.9	Very high	95.2	Very high	18 Å²	18	24.5 Å²	24.5	8%	0.079	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-59.1	-21.4	165	53.4	-90.8	0	0	0	113.5	A400 L403 L626 Y640 A644 F647	A400-F405 HydrophobicContact CB-CE1 4.33Å; L403-F405 HydrophobicContact CD2-CE1 4.26Å; L403-F405 HydrophobicContact CD2-CZ 3.74Å; L403-F405 PolarHBondContact O-N 2.95Å; F405-L626 HydrophobicContact CE2-CD2 3.79Å; F405-L626 HydrophobicContact CZ-CD2 4.44Å; F405-Y640 HydrophobicContact CD1-CE2 4.18Å; F405-A644 HydrophobicContact CB-CB 4.16Å; F405-F647 AromaticContact CD2-CD2 3.65Å; F405-F647 HydrophobicContact CD2-CD2 3.65Å; F405-F647 AromaticContact CD2-CE2 3.94Å; F405-F647 HydrophobicContact CD2-CE2 3.94Å; F405-F647 AromaticContact CE2-CD2 3.93Å; F405-F647 HydrophobicContact CE2-CD2 3.93Å; F405-F647 AromaticContact CE2-CE2 3.7Å; F405-F647 HydrophobicContact CE2-CE2 3.7Å
406	C	96.3	Very high	95.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-83.8	0.3	172.6	-55.3	0	0	0	0	114.2	F377 L380 L403 F404 R408 W409 L410	F377-C406 HydrophobicContact CE1-CB 4.43Å; L380-C406 HydrophobicContact CD2-CB 4.26Å; L403-C406 WeakPolarHBondContact O-CA 3.44Å; L403-C406 WeakPolarHBondContact O-CB 3.12Å; L403-C406 PolarHBondContact O-N 3.47Å; F404-C406 PolarHBondContact O-N 2.95Å; C406-R408 VanDerWaalsContact C-N 3.33Å; C406-R408 PolarHBondContact O-N 3.23Å; C406-W409 HydrophobicContact CB-CD2 4.14Å; C406-W409 HydrophobicContact CB-CE3 3.81Å; C406-W409 HydrophobicContact CB-CZ3 4.31Å; C406-W409 VanDerWaalsContact O-CB 3.27Å; C406-W409 WeakPolarHBondContact O-CB 3.18Å; C406-W409 PolarHBondContact O-N 3.43Å; C406-W409 WeakPolarHBondContact SG-CZ3 3.37Å; C406-L410 PolarHBondContact O-N 2.68Å
407	Y	94.6	Very high	95.1	Very high	29 Å²	29	22 Å²	22	11%	0.114	12%	0.119	C	C	.	.	H	α-helix	trans	-57.3	-43.4	-175.1	-173.5	-85.3	0	0	0	113	M373 F377 F404 W409 L410 L411 L510	M373-Y407 HydrophobicContact CE-CD2 4.01Å; M373-Y407 HydrophobicContact CE-CE2 3.95Å; M373-Y407 HydrophobicContact CE-CG 4.36Å; F377-Y407 AromaticContact CE2-CD2 3.71Å; F377-Y407 HydrophobicContact CE2-CD2 3.71Å; F377-Y407 HydrophobicContact CE2-CE2 4.41Å; F377-Y407 AromaticContact CZ-CD2 3.86Å; F377-Y407 HydrophobicContact CZ-CD2 3.86Å; F377-Y407 HydrophobicContact CZ-CG 4.33Å; F404-Y407 WeakPolarHBondContact O-CB 3.33Å; F404-Y407 PolarHBondContact O-N 2.92Å; Y407-W409 VanDerWaalsContact C-N 3.26Å; Y407-W409 PolarHBondContact O-N 2.82Å; Y407-L410 PolarHBondContact O-N 2.7Å; Y407-L411 HydrophobicContact CD1-CD2 4.46Å; Y407-L411 HydrophobicContact CE1-CD2 3.79Å; Y407-L411 WeakPolarHBondContact O-CB 3.13Å; Y407-L411 PolarHBondContact O-N 3.09Å; Y407-L411 VanDerWaalsContact O-N 3.09Å; Y407-L510 HydrophobicContact CD2-CD2 4.16Å; Y407-L510 HydrophobicContact CE2-CD2 4.36Å
408	R	95.8	Very high	95.1	Very high	33 Å²	33	15.2 Å²	15.2	13%	0.125	9%	0.087	C	C	.	.	H	α-helix	trans	-58.5	-37.8	175.4	-176.3	172.4	67.7	-127.9	-3.2	112.2	C406 L412 R416 E417 M517 D648	C406-R408 VanDerWaalsContact C-N 3.33Å; C406-R408 PolarHBondContact O-N 3.23Å; R408-L412 HydrophobicContact CG-CD1 3.93Å; R408-L412 WeakPolarHBondContact O-CB 3.21Å; R408-L412 WeakPolarHBondContact O-CG 3.37Å; R408-L412 PolarHBondContact O-N 3.49Å; R408-L412 VanDerWaalsContact O-N 3.1Å; R408-R416 HydrophobicContact CG-CB 4.21Å; R408-R416 HydrophobicContact CG-CG 4.44Å; R408-E417 IonicContact CZ-OE1 2.76Å; R408-E417 IonicContact CZ-OE2 3.3Å; R408-E417 IonicContact NE-OE1 2.85Å; R408-E417 PolarHBondContact NE-OE1 3.05Å; R408-E417 IonicContact NE-OE2 3.21Å; R408-E417 PolarHBondContact NE-OE2 3.12Å; R408-E417 IonicContact NH2-OE1 3.02Å; R408-E417 IonicContact NH2-OE2 3.23Å; R408-E417 PolarHBondContact NH2-OE2 2.89Å; R408-M517 HydrophobicContact CB-SD 3.79Å; R408-M517 HydrophobicContact CG-SD 3.61Å; R408-D648 IonicContact CZ-OD1 3.48Å; R408-D648 IonicContact NH1-OD1 3.61Å; R408-D648 PolarHBondContact NH1-OD1 2.9Å; R408-D648 IonicContact NH2-OD1 3.61Å; R408-D648 PolarHBondContact NH2-OD1 3.33Å
409	W	97.6	Very high	95.2	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-67.7	-48.6	-176.8	-55.2	-5.6	0	0	0	111.5	C406 Y407 E413 L414 E417 M618 C622 I625 L626 F647	C406-W409 HydrophobicContact CB-CD2 4.14Å; C406-W409 HydrophobicContact CB-CE3 3.81Å; C406-W409 HydrophobicContact CB-CZ3 4.31Å; C406-W409 VanDerWaalsContact O-CB 3.27Å; C406-W409 WeakPolarHBondContact O-CB 3.18Å; C406-W409 PolarHBondContact O-N 3.43Å; C406-W409 WeakPolarHBondContact SG-CZ3 3.37Å; Y407-W409 VanDerWaalsContact C-N 3.26Å; Y407-W409 PolarHBondContact O-N 2.82Å; W409-E413 PolarHBondContact O-N 2.84Å; W409-L414 HydrophobicContact CB-CD2 3.53Å; W409-L414 HydrophobicContact CB-CG 4.01Å; W409-L414 HydrophobicContact CD2-CD2 3.86Å; W409-L414 HydrophobicContact CE3-CD2 4.29Å; W409-L414 HydrophobicContact CG-CD2 3.52Å; W409-L414 PolarHBondContact O-N 2.67Å; W409-E417 HydrophobicContact CG-CG 4.13Å; W409-E417 PolarHBondContact NE1-OE2 2.81Å; W409-M618 WeakPolarHBondContact O-CE 3.44Å; W409-C622 HydrophobicContact CE3-CB 4.14Å; W409-I625 HydrophobicContact CH2-CB 4.3Å; W409-I625 HydrophobicContact CH2-CG2 3.46Å; W409-I625 VanDerWaalsContact CH2-CG2 3.46Å; W409-I625 HydrophobicContact CZ2-CG2 4Å; W409-I625 HydrophobicContact CZ3-CB 4.24Å; W409-I625 HydrophobicContact CZ3-CG2 3.9Å; W409-L626 HydrophobicContact CH2-CD2 4.17Å; W409-L626 HydrophobicContact CZ3-CD2 4.03Å; W409-L626 HydrophobicContact CZ3-CG 4.09Å; W409-F647 AromaticContact CH2-CD1 3.66Å; W409-F647 HydrophobicContact CH2-CD1 3.66Å; W409-F647 HydrophobicContact CH2-CD2 4.41Å; W409-F647 AromaticContact CH2-CE1 3.71Å; W409-F647 HydrophobicContact CH2-CE1 3.71Å; W409-F647 HydrophobicContact CH2-CE2 4.46Å; W409-F647 HydrophobicContact CH2-CG 4.03Å; W409-F647 HydrophobicContact CH2-CZ 4.13Å; W409-F647 HydrophobicContact CZ2-CB 3.99Å; W409-F647 AromaticContact CZ2-CD1 3.53Å; W409-F647 HydrophobicContact CZ2-CD1 3.53Å; W409-F647 HydrophobicContact CZ2-CD2 4.45Å; W409-F647 HydrophobicContact CZ2-CE1 4.08Å; W409-F647 AromaticContact CZ2-CG 3.74Å; W409-F647 HydrophobicContact CZ2-CG 3.74Å
410	L	96	Very high	95.3	Very high	1 Å²	1	15.1 Å²	15.1	1%	0.005	8%	0.076	C	C	.	.	H	α-helix	trans	-73.3	-29.8	-178.2	-65.9	175	0	0	0	113.1	M373 K376 F377 L380 C406 Y407 L619	M373-L410 HydrophobicContact CE-CB 3.83Å; K376-L410 HydrophobicContact CB-CD1 4.21Å; F377-L410 HydrophobicContact CD1-CD1 3.97Å; F377-L410 HydrophobicContact CD2-CD1 4.44Å; F377-L410 HydrophobicContact CE1-CD1 3.88Å; F377-L410 HydrophobicContact CE2-CD1 4.35Å; F377-L410 HydrophobicContact CG-CD1 4.26Å; F377-L410 HydrophobicContact CZ-CD1 4.09Å; L380-L410 HydrophobicContact CD2-CD1 4.16Å; C406-L410 PolarHBondContact O-N 2.68Å; Y407-L410 PolarHBondContact O-N 2.7Å; L410-L619 HydrophobicContact CD2-CD2 3.82Å
411	L	95.4	Very high	95.4	Very high	6 Å²	6	19.4 Å²	19.4	3%	0.031	10%	0.099	C	C	.	.	H	α-helix	trans	-76.6	-41.4	178.2	-174.1	64.8	0	0	0	112.4	N365 F366 M373 Y407 M517	N365-L411 HydrophobicContact CB-CD1 3.77Å; F366-L411 HydrophobicContact CD1-CD1 3.8Å; F366-L411 HydrophobicContact CD1-CG 4.47Å; F366-L411 HydrophobicContact CE1-CD1 3.55Å; F366-L411 HydrophobicContact CE1-CD2 4.05Å; F366-L411 HydrophobicContact CE1-CG 3.8Å; F366-L411 HydrophobicContact CE2-CD1 4.35Å; F366-L411 HydrophobicContact CG-CD1 4.3Å; F366-L411 HydrophobicContact CZ-CD1 3.84Å; F366-L411 HydrophobicContact CZ-CG 4.07Å; M373-L411 HydrophobicContact CE-CB 4.01Å; M373-L411 HydrophobicContact SD-CD1 4.29Å; Y407-L411 HydrophobicContact CD1-CD2 4.46Å; Y407-L411 HydrophobicContact CE1-CD2 3.79Å; Y407-L411 WeakPolarHBondContact O-CB 3.13Å; Y407-L411 PolarHBondContact O-N 3.09Å; Y407-L411 VanDerWaalsContact O-N 3.09Å; L411-M517 HydrophobicContact CD2-CE 4.13Å
412	L	95.9	Very high	95.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	10%	0.103	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107.3	20.4	-170.5	-52	-178.2	0	0	0	113.9	G333 D336 R408 L414 K415 R416	G333-L412 WeakPolarHBondContact O-CD2 3.5Å; D336-L412 HydrophobicContact CB-CD1 4.1Å; D336-L412 HydrophobicContact CB-CD2 4.34Å; R408-L412 HydrophobicContact CG-CD1 3.93Å; R408-L412 WeakPolarHBondContact O-CB 3.21Å; R408-L412 WeakPolarHBondContact O-CG 3.37Å; R408-L412 PolarHBondContact O-N 3.49Å; R408-L412 VanDerWaalsContact O-N 3.1Å; L412-L414 VanDerWaalsContact C-N 3.25Å; L412-L414 PolarHBondContact O-N 3.36Å; L412-K415 WeakPolarHBondContact O-CB 3.29Å; L412-K415 PolarHBondContact O-N 2.89Å; L412-R416 HydrophobicContact CD1-CG 3.85Å
413	E	95.5	Very high	95.9	Very high	3 Å²	3	18.8 Å²	18.8	1%	0.014	10%	0.096	C	C	.	.	T	Hydrogen-bonded Turn	trans	44.2	48.4	-174.5	-67.4	-171.7	147	0	0	112.7	R361 L362 W409 K415 L427 W431 M618	R361-E413 IonicContact CZ-OE1 2.69Å; R361-E413 IonicContact CZ-OE2 2.9Å; R361-E413 IonicContact NE-OE1 2.67Å; R361-E413 PolarHBondContact NE-OE1 3.01Å; R361-E413 IonicContact NH2-OE1 3.14Å; R361-E413 PolarHBondContact NH2-OE1 3.1Å; R361-E413 IonicContact NH2-OE2 3.87Å; R361-E413 PolarHBondContact NH2-OE2 2.81Å; L362-E413 HydrophobicContact CD1-CG 4.08Å; L362-E413 HydrophobicContact CD2-CG 4.22Å; L362-E413 WeakPolarHBondContact CD2-OE1 3.33Å; W409-E413 PolarHBondContact O-N 2.84Å; E413-K415 PolarHBondContact O-N 2.82Å; E413-L427 HydrophobicContact CB-CD2 3.82Å; E413-W431 PolarHBondContact OE2-NE1 3.29Å; E413-M618 HydrophobicContact CB-SD 4.14Å; E413-M618 HydrophobicContact CG-SD 4.21Å
414	L	97.5	Very high	96	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	6.4	-177.6	-81.1	163.4	0	0	0	116.8	W409 L412 R416 E417 F418 M618 L621 I625	W409-L414 HydrophobicContact CB-CD2 3.53Å; W409-L414 HydrophobicContact CB-CG 4.01Å; W409-L414 HydrophobicContact CD2-CD2 3.86Å; W409-L414 HydrophobicContact CE3-CD2 4.29Å; W409-L414 HydrophobicContact CG-CD2 3.52Å; W409-L414 PolarHBondContact O-N 2.67Å; L412-L414 VanDerWaalsContact C-N 3.25Å; L412-L414 PolarHBondContact O-N 3.36Å; L414-R416 VanDerWaalsContact C-N 3.26Å; L414-R416 PolarHBondContact O-N 3.41Å; L414-E417 HydrophobicContact CD2-CB 4.08Å; L414-E417 HydrophobicContact CD2-CG 3.45Å; L414-E417 VanDerWaalsContact CD2-CG 3.45Å; L414-E417 PolarHBondContact O-N 3.47Å; L414-F418 HydrophobicContact CB-CD2 4.46Å; L414-F418 HydrophobicContact CB-CE2 4.08Å; L414-M618 HydrophobicContact CB-CE 4.05Å; L414-M618 HydrophobicContact CD1-CE 3.63Å; L414-M618 HydrophobicContact CG-CE 3.54Å; L414-L621 HydrophobicContact CD1-CB 3.52Å; L414-L621 HydrophobicContact CD1-CD1 4.41Å; L414-I625 HydrophobicContact CD1-CD1 3.91Å; L414-I625 HydrophobicContact CD2-CD1 3.5Å; L414-I625 VanDerWaalsContact CD2-CD1 3.5Å; L414-I625 HydrophobicContact CG-CD1 4.37Å
415	K	96.4	Very high	96.3	Very high	8 Å²	8	21 Å²	21	4%	0.035	10%	0.104	C	C	.	.	G	3₁₀ helix	trans	-51.1	-38.7	-173.8	-178.8	-85.2	-169.3	177.8	0	114.5	D296 D336 L412 E413 E417 A423 L427	D296-K415 IonicContact OD1-NZ 3.7Å; D296-K415 PolarHBondContact OD1-NZ 3.17Å; D296-K415 IonicContact OD2-NZ 2.76Å; D296-K415 PolarHBondContact OD2-NZ 3.26Å; D336-K415 HydrophobicContact CB-CD 4.16Å; D336-K415 WeakPolarHBondContact O-CD 3.28Å; D336-K415 WeakPolarHBondContact O-CE 3.11Å; D336-K415 IonicContact OD1-NZ 3.53Å; D336-K415 PolarHBondContact OD1-NZ 2.75Å; L412-K415 WeakPolarHBondContact O-CB 3.29Å; L412-K415 PolarHBondContact O-N 2.89Å; E413-K415 PolarHBondContact O-N 2.82Å; K415-E417 VanDerWaalsContact C-N 3.31Å; K415-E417 PolarHBondContact O-N 3.38Å; K415-A423 HydrophobicContact CG-CB 4.4Å; K415-L427 HydrophobicContact CG-CD1 4.45Å
416	R	96.1	Very high	96.4	Very high	40 Å²	40	20.2 Å²	20.2	15%	0.151	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-73	-18.3	-178.5	-81.2	-79.6	-176.6	173.8	-5	113.7	D336 R408 L412 L414 R652	D336-R416 VanDerWaalsContact CG-NH2 3.28Å; D336-R416 IonicContact OD1-CZ 3.23Å; D336-R416 IonicContact OD1-NE 3.88Å; D336-R416 PolarHBondContact OD1-NE 3.22Å; D336-R416 IonicContact OD1-NH2 3.59Å; D336-R416 PolarHBondContact OD1-NH2 3.46Å; D336-R416 IonicContact OD2-CZ 3.65Å; D336-R416 VanDerWaalsContact OD2-CZ 3.23Å; D336-R416 IonicContact OD2-NE 3.39Å; D336-R416 PolarHBondContact OD2-NE 2.85Å; D336-R416 IonicContact OD2-NH2 3.2Å; D336-R416 PolarHBondContact OD2-NH2 3.32Å; R408-R416 HydrophobicContact CG-CB 4.21Å; R408-R416 HydrophobicContact CG-CG 4.44Å; L412-R416 HydrophobicContact CD1-CG 3.85Å; L414-R416 VanDerWaalsContact C-N 3.26Å; L414-R416 PolarHBondContact O-N 3.41Å; R416-R652 PolarHBondContact O-N 3.33Å
417	E	96.7	Very high	96.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.101	C	C	.	.	G	3₁₀ helix	trans	-87.6	-14.8	-171.7	-43.3	-40	118.7	0	0	113.2	R408 W409 L414 K415 R652 K653	R408-E417 IonicContact CZ-OE1 2.76Å; R408-E417 IonicContact CZ-OE2 3.3Å; R408-E417 IonicContact NE-OE1 2.85Å; R408-E417 PolarHBondContact NE-OE1 3.05Å; R408-E417 IonicContact NE-OE2 3.21Å; R408-E417 PolarHBondContact NE-OE2 3.12Å; R408-E417 IonicContact NH2-OE1 3.02Å; R408-E417 IonicContact NH2-OE2 3.23Å; R408-E417 PolarHBondContact NH2-OE2 2.89Å; W409-E417 HydrophobicContact CG-CG 4.13Å; W409-E417 PolarHBondContact NE1-OE2 2.81Å; L414-E417 HydrophobicContact CD2-CB 4.08Å; L414-E417 HydrophobicContact CD2-CG 3.45Å; L414-E417 VanDerWaalsContact CD2-CG 3.45Å; L414-E417 PolarHBondContact O-N 3.47Å; K415-E417 VanDerWaalsContact C-N 3.31Å; K415-E417 PolarHBondContact O-N 3.38Å; E417-R652 CarbonylContact O-C 3.51Å; E417-R652 VanDerWaalsContact O-CA 3.25Å; E417-R652 WeakPolarHBondContact O-CA 3.4Å; E417-R652 PolarHBondContact O-N 3.1Å; E417-R652 VanDerWaalsContact O-N 3.07Å; E417-K653 PolarHBondContact O-N 2.69Å
418	F	97.4	Very high	96.7	Very high	2 Å²	2	18.9 Å²	18.9	1%	0.009	10%	0.096	C	C	.	.	S	Bend	trans	-112.4	155	179.7	-64	-74.8	0	0	0	112.1	L414 D422 A423 M426 I625 R652 H654 L656 V659	L414-F418 HydrophobicContact CB-CD2 4.46Å; L414-F418 HydrophobicContact CB-CE2 4.08Å; F418-D422 HydrophobicContact CB-CB 4.01Å; F418-D422 HydrophobicContact CD1-CB 4.5Å; F418-A423 HydrophobicContact CB-CB 4.05Å; F418-M426 HydrophobicContact CD2-CB 4.24Å; F418-M426 HydrophobicContact CD2-CE 4.27Å; F418-M426 HydrophobicContact CD2-CG 4.13Å; F418-M426 HydrophobicContact CE1-CE 4.18Å; F418-M426 HydrophobicContact CE2-CB 4.45Å; F418-M426 HydrophobicContact CE2-CE 3.38Å; F418-M426 HydrophobicContact CE2-CG 3.96Å; F418-M426 HydrophobicContact CZ-CE 3.33Å; F418-I625 HydrophobicContact CZ-CD1 4.31Å; F418-R652 WeakPolarHBondContact O-CG 3.45Å; F418-H654 HydrophobicContact CD1-CB 4.13Å; F418-H654 VanDerWaalsContact CD1-O 3.3Å; F418-H654 WeakPolarHBondContact CD1-O 3.27Å; F418-H654 HydrophobicContact CE1-CB 3.65Å; F418-H654 WeakPolarHBondContact CE1-O 3.25Å; F418-H654 HydrophobicContact CZ-CB 4.16Å; F418-L656 HydrophobicContact CD1-CB 4.19Å; F418-L656 HydrophobicContact CD1-CD1 4.3Å; F418-L656 HydrophobicContact CE1-CB 4.23Å; F418-L656 HydrophobicContact CE1-CD1 4.18Å; F418-V659 HydrophobicContact CE1-CG2 4.3Å; F418-V659 HydrophobicContact CZ-CB 4.27Å; F418-V659 HydrophobicContact CZ-CG1 4.2Å; F418-V659 HydrophobicContact CZ-CG2 4.19Å
419	A	95.9	Very high	96.7	Very high	45 Å²	45	17.3 Å²	17.3	37%	0.372	9%	0.09	S	C	.	.			trans	-61.9	157.8	167.2	0	0	0	0	0	110.4	D421 D422 A423	A419-D421 PolarHBondContact O-N 3.44Å; A419-D422 CarbonylContact O-C 3.54Å; A419-D422 PolarHBondContact O-N 3.15Å; A419-A423 PolarHBondContact O-N 3.44Å
420	F	95.8	Very high	96.6	Very high	32 Å²	32	17.3 Å²	17.3	14%	0.14	9%	0.09	C	C	.	.	H	α-helix	trans	-54.9	-52.6	-164.7	-164.9	-91.9	0	0	0	113.7	D296 H299 P340 A343 D422 A423 L424	D296-F420 HydrophobicContact CB-CD2 4.38Å; D296-F420 HydrophobicContact CB-CE2 4.2Å; H299-F420 HydrophobicContact CB-CD2 4.22Å; H299-F420 HydrophobicContact CB-CG 4.36Å; H299-F420 AromaticContact CD2-CD1 3.44Å; H299-F420 VanDerWaalsContact CD2-CD1 3.44Å; H299-F420 WeakPolarHBondContact CD2-CD1 3.42Å; H299-F420 AromaticContact CD2-CE1 3.9Å; H299-F420 AromaticContact CD2-CG 3.68Å; H299-F420 AromaticContact CE1-CD1 3.82Å; H299-F420 AromaticContact CE1-CE1 3.47Å; H299-F420 VanDerWaalsContact CE1-CE1 3.47Å; H299-F420 WeakPolarHBondContact CE1-CE1 3.23Å; H299-F420 AromaticContact CE1-CZ 3.96Å; H299-F420 AromaticContact CG-CD1 3.89Å; H299-F420 AromaticContact CG-CG 3.92Å; H299-F420 AromaticContact ND1-CE1 3.78Å; H299-F420 AromaticContact ND1-CZ 3.85Å; H299-F420 AromaticContact NE2-CD1 3.44Å; H299-F420 WeakPolarHBondContact NE2-CD1 3.46Å; H299-F420 AromaticContact NE2-CE1 3.57Å; P340-F420 HydrophobicContact CB-CZ 4.46Å; A343-F420 HydrophobicContact CB-CE1 4.22Å; A343-F420 HydrophobicContact CB-CZ 3.87Å; F420-D422 PolarHBondContact O-N 2.82Å; F420-A423 WeakPolarHBondContact O-CB 3.32Å; F420-A423 PolarHBondContact O-N 2.87Å; F420-A423 VanDerWaalsContact O-N 3.16Å; F420-L424 HydrophobicContact CD1-CD1 4.16Å; F420-L424 HydrophobicContact CD1-CG 4.26Å; F420-L424 HydrophobicContact CE1-CD1 4.02Å; F420-L424 HydrophobicContact CE1-CD2 4.06Å; F420-L424 HydrophobicContact CE1-CG 4.21Å; F420-L424 HydrophobicContact CZ-CD2 4.49Å; F420-L424 WeakPolarHBondContact O-CG 3.38Å; F420-L424 PolarHBondContact O-N 3.3Å
421	D	95.1	Very high	96.6	Very high	91 Å²	91	17.3 Å²	17.3	49%	0.487	9%	0.09	S	C	.	.	H	α-helix	trans	-65.5	-34.2	177.5	-77.6	-76.4	0	0	0	114.5	R234 A419 A423 L424 R425	R234-D421 IonicContact NH1-OD1 3.21Å; R234-D421 PolarHBondContact NH1-OD1 3.46Å; A419-D421 PolarHBondContact O-N 3.44Å; D421-A423 VanDerWaalsContact C-N 3.32Å; D421-L424 PolarHBondContact O-N 2.94Å; D421-R425 PolarHBondContact O-N 3.19Å; D421-R425 VanDerWaalsContact O-N 3.08Å
422	D	97	Very high	96.6	Very high	61 Å²	61	17.3 Å²	17.3	33%	0.326	9%	0.09	S	C	.	.	H	α-helix	trans	-68.3	-34.7	173.5	-92.7	-4.1	0	0	0	111	F418 A419 F420 R425 M426 L656	F418-D422 HydrophobicContact CB-CB 4.01Å; F418-D422 HydrophobicContact CD1-CB 4.5Å; A419-D422 CarbonylContact O-C 3.54Å; A419-D422 PolarHBondContact O-N 3.15Å; F420-D422 PolarHBondContact O-N 2.82Å; D422-R425 PolarHBondContact O-N 2.88Å; D422-M426 WeakPolarHBondContact O-CB 3.35Å; D422-M426 PolarHBondContact O-N 3.02Å; D422-L656 HydrophobicContact CB-CB 4.08Å; D422-L656 HydrophobicContact CB-CD2 3.95Å; D422-L656 HydrophobicContact CB-CG 4.49Å; D422-L656 VanDerWaalsContact OD1-CD2 3.25Å; D422-L656 WeakPolarHBondContact OD1-CD2 3.24Å; D422-L656 WeakPolarHBondContact OD2-CB 3.35Å
423	A	97.6	Very high	96.5	Very high	4 Å²	4	18.8 Å²	18.8	3%	0.033	10%	0.1	C	C	.	.	H	α-helix	trans	-66.5	-41.3	172.5	0	0	0	0	0	111.1	K415 F418 A419 F420 D421 R425 M426 L427	K415-A423 HydrophobicContact CG-CB 4.4Å; F418-A423 HydrophobicContact CB-CB 4.05Å; A419-A423 PolarHBondContact O-N 3.44Å; F420-A423 WeakPolarHBondContact O-CB 3.32Å; F420-A423 PolarHBondContact O-N 2.87Å; F420-A423 VanDerWaalsContact O-N 3.16Å; D421-A423 VanDerWaalsContact C-N 3.32Å; A423-R425 VanDerWaalsContact C-N 3.31Å; A423-R425 PolarHBondContact O-N 3.41Å; A423-M426 PolarHBondContact O-N 2.85Å; A423-L427 WeakPolarHBondContact O-CB 3.49Å; A423-L427 WeakPolarHBondContact O-CG 3.03Å; A423-L427 PolarHBondContact O-N 2.69Å
424	L	97.9	Very high	96.3	Very high	7 Å²	7	19.9 Å²	19.9	4%	0.037	11%	0.106	C	C	.	.	H	α-helix	trans	-57.1	-45.3	172.7	-59.3	-178.5	0	0	0	111.1	R234 W238 P340 V344 F420 D421 L427 E428	R234-L424 VanDerWaalsContact NH1-CD1 3.29Å; W238-L424 HydrophobicContact CH2-CB 4.38Å; W238-L424 HydrophobicContact CH2-CD2 3.51Å; W238-L424 HydrophobicContact CH2-CG 4.5Å; W238-L424 HydrophobicContact CZ2-CB 4.02Å; W238-L424 HydrophobicContact CZ2-CD2 3.98Å; W238-L424 HydrophobicContact CZ3-CD2 4.47Å; P340-L424 HydrophobicContact CB-CD2 3.43Å; P340-L424 VanDerWaalsContact CB-CD2 3.43Å; V344-L424 HydrophobicContact CG2-CD1 4.2Å; V344-L424 HydrophobicContact CG2-CD2 4.07Å; F420-L424 HydrophobicContact CD1-CD1 4.16Å; F420-L424 HydrophobicContact CD1-CG 4.26Å; F420-L424 HydrophobicContact CE1-CD1 4.02Å; F420-L424 HydrophobicContact CE1-CD2 4.06Å; F420-L424 HydrophobicContact CE1-CG 4.21Å; F420-L424 HydrophobicContact CZ-CD2 4.49Å; F420-L424 WeakPolarHBondContact O-CG 3.38Å; F420-L424 PolarHBondContact O-N 3.3Å; D421-L424 PolarHBondContact O-N 2.94Å; L424-L427 PolarHBondContact O-N 2.95Å; L424-E428 VanDerWaalsContact O-CG 3.28Å; L424-E428 WeakPolarHBondContact O-CG 3.33Å; L424-E428 PolarHBondContact O-N 2.97Å
425	R	97.3	Very high	95.8	Very high	60 Å²	60	24.2 Å²	24.2	23%	0.226	13%	0.134	C	C	.	.	H	α-helix	trans	-72.8	-32.1	178.9	-166.8	176.7	-173.1	-167.7	4.7	113.4	G227 D421 D422 A423 V429 L656	G227-R425 PolarHBondContact O-NE 2.74Å; G227-R425 PolarHBondContact O-NH2 2.76Å; D421-R425 PolarHBondContact O-N 3.19Å; D421-R425 VanDerWaalsContact O-N 3.08Å; D422-R425 PolarHBondContact O-N 2.88Å; A423-R425 VanDerWaalsContact C-N 3.31Å; A423-R425 PolarHBondContact O-N 3.41Å; R425-V429 WeakPolarHBondContact O-CG2 3.35Å; R425-V429 PolarHBondContact O-N 2.59Å; R425-L656 HydrophobicContact CB-CD2 3.88Å; R425-L656 HydrophobicContact CG-CD2 4.11Å
426	M	97.3	Very high	95.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-63.6	-47.8	171.7	178.6	54.7	84.9	0	0	111	F418 D422 A423 V429 T430 L621 L656 V659 L660	F418-M426 HydrophobicContact CD2-CB 4.24Å; F418-M426 HydrophobicContact CD2-CE 4.27Å; F418-M426 HydrophobicContact CD2-CG 4.13Å; F418-M426 HydrophobicContact CE1-CE 4.18Å; F418-M426 HydrophobicContact CE2-CB 4.45Å; F418-M426 HydrophobicContact CE2-CE 3.38Å; F418-M426 HydrophobicContact CE2-CG 3.96Å; F418-M426 HydrophobicContact CZ-CE 3.33Å; D422-M426 WeakPolarHBondContact O-CB 3.35Å; D422-M426 PolarHBondContact O-N 3.02Å; A423-M426 PolarHBondContact O-N 2.85Å; M426-V429 PolarHBondContact O-N 3.42Å; M426-T430 WeakPolarHBondContact O-CB 3.45Å; M426-T430 PolarHBondContact O-N 3.16Å; M426-T430 PolarHBondContact O-OG1 2.9Å; M426-L621 HydrophobicContact CE-CD2 3.68Å; M426-L621 HydrophobicContact SD-CD1 3.6Å; M426-L621 VanDerWaalsContact SD-CD1 3.6Å; M426-L621 HydrophobicContact SD-CD2 3.64Å; M426-L621 HydrophobicContact SD-CG 4.26Å; M426-L656 HydrophobicContact CB-CD1 3.85Å; M426-L656 HydrophobicContact CE-CD1 3.5Å; M426-L656 HydrophobicContact SD-CD1 4.32Å; M426-V659 HydrophobicContact CE-CG1 4.1Å; M426-L660 HydrophobicContact CE-CD2 3.85Å; M426-L660 HydrophobicContact CE-CG 4.13Å; M426-L660 HydrophobicContact SD-CD2 3.74Å
427	L	97.9	Very high	95.1	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-60.9	-46.9	177.9	-71.9	171	0	0	0	110.7	P340 E413 K415 A423 L424 V429 T430 W431	P340-L427 HydrophobicContact CB-CD1 4.29Å; P340-L427 HydrophobicContact CG-CD1 4.02Å; E413-L427 HydrophobicContact CB-CD2 3.82Å; K415-L427 HydrophobicContact CG-CD1 4.45Å; A423-L427 WeakPolarHBondContact O-CB 3.49Å; A423-L427 WeakPolarHBondContact O-CG 3.03Å; A423-L427 PolarHBondContact O-N 2.69Å; L424-L427 PolarHBondContact O-N 2.95Å; L427-V429 VanDerWaalsContact C-N 3.34Å; L427-V429 PolarHBondContact O-N 3.37Å; L427-T430 PolarHBondContact O-N 3.36Å; L427-W431 HydrophobicContact CB-CD2 4.21Å; L427-W431 HydrophobicContact CB-CH2 4.14Å; L427-W431 HydrophobicContact CB-CZ2 3.64Å; L427-W431 HydrophobicContact CD1-CH2 4.47Å; L427-W431 HydrophobicContact CD1-CZ2 4Å; L427-W431 HydrophobicContact CD2-CZ2 3.85Å; L427-W431 HydrophobicContact CG-CZ2 4.02Å; L427-W431 WeakPolarHBondContact O-CB 3.29Å; L427-W431 VanDerWaalsContact O-CD2 3.3Å; L427-W431 PolarHBondContact O-N 3.19Å
428	E	98	Very high	94.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-49.9	-50.6	172.7	-76.6	161.4	-168.9	0	0	112.9	I224 V229 R234 W238 L241 L424 S432	I224-E428 HydrophobicContact CG2-CB 4.25Å; V229-E428 HydrophobicContact CB-CG 4.39Å; V229-E428 HydrophobicContact CG2-CB 4.39Å; V229-E428 HydrophobicContact CG2-CG 3.88Å; V229-E428 PolarHBondContact N-OE2 3.42Å; R234-E428 WeakPolarHBondContact CD-OE1 3.48Å; R234-E428 WeakPolarHBondContact CG-OE1 3.34Å; R234-E428 IonicContact CZ-OE1 4Å; R234-E428 IonicContact NE-OE1 3.36Å; R234-E428 PolarHBondContact NE-OE1 2.86Å; R234-E428 IonicContact NH2-OE1 3.28Å; W238-E428 HydrophobicContact CZ2-CG 4.14Å; W238-E428 VanDerWaalsContact NE1-CG 3.27Å; W238-E428 PolarHBondContact NE1-OE1 3.41Å; L241-E428 HydrophobicContact CD1-CB 4.46Å; L241-E428 HydrophobicContact CD1-CG 4.4Å; L424-E428 VanDerWaalsContact O-CG 3.28Å; L424-E428 WeakPolarHBondContact O-CG 3.33Å; L424-E428 PolarHBondContact O-N 2.97Å; E428-S432 VanDerWaalsContact O-CB 3.24Å; E428-S432 WeakPolarHBondContact O-CB 3.35Å; E428-S432 PolarHBondContact O-N 2.88Å; E428-S432 PolarHBondContact O-OG 3.44Å; E428-S432 VanDerWaalsContact O-OG 3.07Å
429	V	96.2	Very high	94.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-65.4	-48.7	179.9	175.3	0	0	0	0	110.8	Y225 R425 M426 L427 W431 S432 S433 F617 L660	Y225-V429 HydrophobicContact CD2-CG1 3.66Å; Y225-V429 HydrophobicContact CE2-CG1 4.03Å; Y225-V429 HydrophobicContact CG-CG1 4.49Å; Y225-V429 WeakPolarHBondContact O-CG1 3.37Å; R425-V429 WeakPolarHBondContact O-CG2 3.35Å; R425-V429 PolarHBondContact O-N 2.59Å; M426-V429 PolarHBondContact O-N 3.42Å; L427-V429 VanDerWaalsContact C-N 3.34Å; L427-V429 PolarHBondContact O-N 3.37Å; V429-W431 VanDerWaalsContact C-N 3.32Å; V429-W431 PolarHBondContact O-N 2.84Å; V429-S432 WeakPolarHBondContact CA-OG 3.48Å; V429-S432 PolarHBondContact O-N 3.45Å; V429-S432 VanDerWaalsContact O-N 3.13Å; V429-S432 PolarHBondContact O-OG 3.2Å; V429-S433 PolarHBondContact O-N 2.88Å; V429-S433 PolarHBondContact O-OG 3.13Å; V429-F617 HydrophobicContact CG1-CE1 3.85Å; V429-F617 HydrophobicContact CG1-CZ 4.18Å; V429-L660 HydrophobicContact CB-CD2 4.23Å; V429-L660 HydrophobicContact CG1-CD2 3.9Å; V429-L660 HydrophobicContact CG2-CD1 4.26Å; V429-L660 HydrophobicContact CG2-CD2 4.5Å
430	T	95.3	Very high	94.3	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-60.5	-38.7	-179.2	-54.5	0	0	0	0	112.7	M426 L427 S433 M618 L621	M426-T430 WeakPolarHBondContact O-CB 3.45Å; M426-T430 PolarHBondContact O-N 3.16Å; M426-T430 PolarHBondContact O-OG1 2.9Å; L427-T430 PolarHBondContact O-N 3.36Å; T430-S433 PolarHBondContact O-OG 3.38Å; T430-M618 HydrophobicContact CG2-SD 4Å; T430-L621 HydrophobicContact CG2-CD1 4.35Å; T430-L621 VanDerWaalsContact OG1-CD1 3.28Å; T430-L621 WeakPolarHBondContact OG1-CD1 3.5Å
431	W	96.8	Very high	94.1	Very high	2 Å²	2	43.9 Å²	43.9	1%	0.008	23%	0.233	C	C	.	.	H	α-helix	trans	-74.9	-32.1	178.6	-54.8	-10.5	0	0	0	111.3	R221 W238 L241 L242 I341 I358 E413 L427 V429 L434	R221-W431 PolarHBondContact NH1-O 2.78Å; W238-W431 HydrophobicContact CD2-CH2 4.39Å; W238-W431 AromaticContact CD2-CZ3 3.7Å; W238-W431 HydrophobicContact CD2-CZ3 3.7Å; W238-W431 AromaticContact CE3-CH2 3.83Å; W238-W431 HydrophobicContact CE3-CH2 3.83Å; W238-W431 AromaticContact CE3-CZ3 3.55Å; W238-W431 HydrophobicContact CE3-CZ3 3.55Å; W238-W431 HydrophobicContact CG-CZ3 4.26Å; W238-W431 AromaticContact CH2-CH2 3.83Å; W238-W431 HydrophobicContact CH2-CH2 3.83Å; W238-W431 AromaticContact CH2-CZ3 3.99Å; W238-W431 HydrophobicContact CH2-CZ3 3.99Å; W238-W431 HydrophobicContact CZ2-CH2 4.44Å; W238-W431 HydrophobicContact CZ2-CZ3 4.2Å; W238-W431 AromaticContact CZ3-CH2 3.52Å; W238-W431 HydrophobicContact CZ3-CH2 3.52Å; W238-W431 AromaticContact CZ3-CZ3 3.71Å; W238-W431 HydrophobicContact CZ3-CZ3 3.71Å; L241-W431 HydrophobicContact CB-CB 4.13Å; L241-W431 HydrophobicContact CB-CE3 4.19Å; L241-W431 HydrophobicContact CD1-CE3 4.43Å; L242-W431 HydrophobicContact CD1-CE3 4.5Å; L242-W431 HydrophobicContact CD1-CH2 4.13Å; L242-W431 HydrophobicContact CD1-CZ3 3.88Å; L242-W431 HydrophobicContact CD2-CD2 3.73Å; L242-W431 HydrophobicContact CD2-CE3 3.53Å; L242-W431 HydrophobicContact CD2-CG 4.38Å; L242-W431 HydrophobicContact CD2-CH2 4Å; L242-W431 HydrophobicContact CD2-CZ2 4.19Å; L242-W431 HydrophobicContact CD2-CZ3 3.68Å; L242-W431 HydrophobicContact CG-CE3 3.96Å; L242-W431 HydrophobicContact CG-CH2 4.41Å; L242-W431 HydrophobicContact CG-CZ3 3.84Å; I341-W431 HydrophobicContact CD1-CH2 4.47Å; I341-W431 HydrophobicContact CG1-CH2 4.2Å; I358-W431 HydrophobicContact CD1-CZ2 3.76Å; E413-W431 PolarHBondContact OE2-NE1 3.29Å; L427-W431 HydrophobicContact CB-CD2 4.21Å; L427-W431 HydrophobicContact CB-CH2 4.14Å; L427-W431 HydrophobicContact CB-CZ2 3.64Å; L427-W431 HydrophobicContact CD1-CH2 4.47Å; L427-W431 HydrophobicContact CD1-CZ2 4Å; L427-W431 HydrophobicContact CD2-CZ2 3.85Å; L427-W431 HydrophobicContact CG-CZ2 4.02Å; L427-W431 WeakPolarHBondContact O-CB 3.29Å; L427-W431 VanDerWaalsContact O-CD2 3.3Å; L427-W431 PolarHBondContact O-N 3.19Å; V429-W431 VanDerWaalsContact C-N 3.32Å; V429-W431 PolarHBondContact O-N 2.84Å; W431-L434 PolarHBondContact O-N 3.01Å
432	S	96	Very high	94.1	Very high	6 Å²	6	42.6 Å²	42.6	4%	0.042	22%	0.224	C	C	.	.	H	α-helix	trans	-78.9	-18.3	177.8	72.5	0	0	0	0	114.9	R221 Y225 E428 V429 L434	R221-S432 WeakPolarHBondContact O-CB 3.36Å; Y225-S432 WeakPolarHBondContact CA-OG 3.26Å; Y225-S432 WeakPolarHBondContact CB-OG 3.23Å; Y225-S432 PolarHBondContact N-OG 3.47Å; Y225-S432 VanDerWaalsContact N-OG 3.1Å; E428-S432 VanDerWaalsContact O-CB 3.24Å; E428-S432 WeakPolarHBondContact O-CB 3.35Å; E428-S432 PolarHBondContact O-N 2.88Å; E428-S432 PolarHBondContact O-OG 3.44Å; E428-S432 VanDerWaalsContact O-OG 3.07Å; V429-S432 WeakPolarHBondContact CA-OG 3.48Å; V429-S432 PolarHBondContact O-N 3.45Å; V429-S432 VanDerWaalsContact O-N 3.13Å; V429-S432 PolarHBondContact O-OG 3.2Å; S432-L434 PolarHBondContact O-N 3.02Å
433	S	93.4	Very high	94	Very high	31 Å²	31	39.8 Å²	39.8	22%	0.217	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-10.4	168.8	39.9	0	0	0	0	114.1	V429 T430 F617	V429-S433 PolarHBondContact O-N 2.88Å; V429-S433 PolarHBondContact O-OG 3.13Å; T430-S433 PolarHBondContact O-OG 3.38Å; S433-F617 VanDerWaalsContact OG-CD1 3.29Å; S433-F617 WeakPolarHBondContact OG-CD1 3.42Å
434	L	89.8	Confident	93.8	Very high	26 Å²	26	45.2 Å²	45.2	14%	0.136	23%	0.234	C	C	.	.	S	Bend	trans	-85.5	148.5	171.7	-56.1	177.8	0	0	0	110.1	R221 W431 S432 G614 N615	R221-L434 WeakPolarHBondContact CD-O 3.29Å; R221-L434 PolarHBondContact NH1-O 3.24Å; W431-L434 PolarHBondContact O-N 3.01Å; S432-L434 PolarHBondContact O-N 3.02Å; L434-G614 VanDerWaalsContact CD2-O 3.29Å; L434-G614 WeakPolarHBondContact CD2-O 3.45Å; L434-N615 HydrophobicContact CD2-CB 3.83Å
435	P	87.2	Confident	93.8	Very high	91 Å²	91	45 Å²	45	59%	0.591	23%	0.233	S	C	*	.	P	Polyproline II helix	trans	-59.8	158.9	171.8	26.9	-35.1	0	0	0	111.9	R221 D437	R221-P435 PolarHBondContact NH1-O 3.21Å; P435-D437 PolarHBondContact O-N 2.76Å
436	P	88.8	Confident	93.7	Very high	43 Å²	43	44.9 Å²	44.9	28%	0.279	24%	0.238	S	C	.	.	P	Polyproline II helix	trans	-58.3	134.3	162.1	-12.5	25.5	0	0	0	109.9	P217 E218	P217-P436 HydrophobicContact CB-CB 4.25Å; P217-P436 HydrophobicContact CB-CG 3.98Å; P217-P436 HydrophobicContact CG-CG 4.32Å; E218-P436 HydrophobicContact CG-CG 4.01Å
437	D	90.8	Very high	93.4	Very high	119 Å²	119	45.4 Å²	45.4	64%	0.636	24%	0.244	S	C	*	.			trans	-142.9	63.5	175.4	172.4	47.8	0	0	0	108.9	N243 P435	N243-D437 WeakPolarHBondContact CB-O 3.41Å; N243-D437 WeakPolarHBondContact ND2-CB 3.38Å; N243-D437 PolarHBondContact ND2-N 3.26Å; N243-D437 PolarHBondContact ND2-O 3.32Å; P435-D437 PolarHBondContact O-N 2.76Å
438	P	91.6	Very high	92.8	Very high	36 Å²	36	49.3 Å²	49.3	23%	0.234	27%	0.269	C	S	.	.			trans	-70.7	141.9	-176.3	29.6	-32.5	0	0	0	110.9	D247 E440	D247-P438 HydrophobicContact CB-CG 4.38Å; D247-P438 VanDerWaalsContact CG-CG 3.47Å; D247-P438 VanDerWaalsContact OD2-CG 3.27Å; D247-P438 WeakPolarHBondContact OD2-CG 3.38Å; P438-E440 PolarHBondContact O-N 3.48Å
439	P	92.6	Very high	91.9	Very high	19 Å²	19	54.5 Å²	54.5	12%	0.123	30%	0.303	C	S	.	.			trans	-66.2	131.1	179.6	26.4	-34.5	0	0	0	111	N243 P246 H441 E442 V443	N243-P439 WeakPolarHBondContact O-CD 3.48Å; P246-P439 VanDerWaalsContact CA-O 3.3Å; P246-P439 WeakPolarHBondContact CA-O 3.48Å; P246-P439 WeakPolarHBondContact CB-O 3.37Å; P246-P439 HydrophobicContact CG-CG 4.31Å; P439-H441 PolarHBondContact O-N 3.26Å; P439-H441 VanDerWaalsContact O-N 3.08Å; P439-E442 WeakPolarHBondContact CB-O 3.46Å; P439-V443 HydrophobicContact CG-CG2 4.23Å
440	E	88.7	Confident	90.7	Very high	176 Å²	176	57.1 Å²	57.1	82%	0.822	32%	0.322	S	S	*	.	S	Bend	trans	-49.7	-38.4	179.3	-60.1	179.9	163.7	0	0	113.7	P438	P438-E440 PolarHBondContact O-N 3.48Å
441	H	90.9	Very high	88.8	Confident	148 Å²	148	66.4 Å²	66.4	69%	0.685	37%	0.365	S	S	*	.	S	Bend	trans	-126.7	-53.9	-170.9	-65.3	91.7	0	0	0	112.1	P246 P439	P246-H441 WeakPolarHBondContact CG-O 3.38Å; P439-H441 PolarHBondContact O-N 3.26Å; P439-H441 VanDerWaalsContact O-N 3.08Å
442	E	94.5	Very high	86.5	Confident	64 Å²	64	72.2 Å²	72.2	30%	0.299	40%	0.4	S	S	.	.			trans	-170.9	173	173.6	53.5	173	-142.7	0	0	113.3	Y257 R260 K261 P439	Y257-E442 HydrophobicContact CE2-CB 3.83Å; R260-E442 IonicContact CZ-OE2 2.76Å; R260-E442 IonicContact NH1-OE1 2.76Å; R260-E442 IonicContact NH1-OE2 2.69Å; R260-E442 PolarHBondContact NH1-OE2 2.86Å; R260-E442 IonicContact NH2-OE2 3.17Å; R260-E442 PolarHBondContact NH2-OE2 3.13Å; K261-E442 WeakPolarHBondContact CE-OE1 3.36Å; K261-E442 WeakPolarHBondContact CE-OE2 3.15Å; K261-E442 IonicContact NZ-OE1 3.75Å; K261-E442 PolarHBondContact NZ-OE1 3.36Å; K261-E442 IonicContact NZ-OE2 2.8Å; K261-E442 PolarHBondContact NZ-OE2 2.88Å; P439-E442 WeakPolarHBondContact CB-O 3.46Å
443	V	94.7	Very high	83.7	Confident	1 Å²	1	75.7 Å²	75.7	1%	0.006	43%	0.43	C	S	.	.			trans	-75.6	122.7	167.8	-178.7	0	0	0	0	110.3	V244 Y257 K261 V353 C356 P439 L445	V244-V443 WeakPolarHBondContact O-CG2 3.42Å; Y257-V443 PolarHBondContact OH-N 3.4Å; Y257-V443 VanDerWaalsContact OH-N 3.07Å; K261-V443 WeakPolarHBondContact CE-O 3.13Å; K261-V443 PolarHBondContact NZ-O 2.89Å; V353-V443 HydrophobicContact CG1-CB 4.47Å; C356-V443 HydrophobicContact CB-CG1 3.73Å; P439-V443 HydrophobicContact CG-CG2 4.23Å; V443-L445 HydrophobicContact CG1-CD2 4.09Å
444	E	95	Very high	81.1	Confident	119 Å²	119	81.3 Å²	81.3	56%	0.556	46%	0.457	S	S	*	.			trans	-67	128.1	168.7	-64	157.3	129.7	0	0	110.1	K360	K360-E444 VanDerWaalsContact CE-OE2 3.23Å; K360-E444 WeakPolarHBondContact CE-OE2 3.38Å; K360-E444 IonicContact NZ-OE2 3.92Å; K360-E444 PolarHBondContact NZ-OE2 3.08Å
445	L	96.8	Very high	78.5	Confident	3 Å²	3	86.4 Å²	86.4	2%	0.016	49%	0.489	C	S	.	.	S	Bend	trans	-101.8	0.2	178.5	-63.9	-161.2	0	0	0	113.3	K261 E264 L268 T324 H325 F352 V353 C356 V443	K261-L445 HydrophobicContact CB-CD1 4.48Å; K261-L445 HydrophobicContact CD-CD1 3.68Å; K261-L445 HydrophobicContact CD-CD2 4.27Å; K261-L445 HydrophobicContact CD-CG 3.83Å; E264-L445 HydrophobicContact CB-CD1 4.07Å; E264-L445 HydrophobicContact CG-CD1 4.03Å; E264-L445 WeakPolarHBondContact OE1-CD1 3.36Å; E264-L445 WeakPolarHBondContact OE1-CG 3.43Å; L268-L445 HydrophobicContact CD1-CB 3.64Å; L268-L445 HydrophobicContact CD1-CD1 4.37Å; T324-L445 PolarHBondContact OG1-O 3.06Å; H325-L445 PolarHBondContact CE1-O 3.49Å; H325-L445 VanDerWaalsContact CE1-O 3.31Å; F352-L445 HydrophobicContact CD1-CD1 4.35Å; F352-L445 HydrophobicContact CD1-CD2 4.2Å; F352-L445 HydrophobicContact CE1-CB 3.95Å; F352-L445 HydrophobicContact CE1-CD1 4.08Å; F352-L445 HydrophobicContact CE1-CD2 3.91Å; F352-L445 HydrophobicContact CE1-CG 4.18Å; V353-L445 HydrophobicContact CB-CD2 4.46Å; V353-L445 HydrophobicContact CG1-CD2 4.49Å; V353-L445 HydrophobicContact CG2-CD1 4.25Å; V353-L445 HydrophobicContact CG2-CD2 4.05Å; C356-L445 HydrophobicContact CB-CD2 4.13Å; V443-L445 HydrophobicContact CG1-CD2 4.09Å
446	V	95.9	Very high	76.2	Confident	56 Å²	56	84.3 Å²	84.3	34%	0.339	49%	0.485	S	S	.	.	S	Bend	trans	-138	130.6	-177.9	-173.7	0	0	0	0	107.5	L268 T324	L268-V446 HydrophobicContact CD1-CG2 3.96Å; L268-V446 HydrophobicContact CD2-CG2 3.61Å; L268-V446 HydrophobicContact CG-CG2 4.46Å; T324-V446 HydrophobicContact CG2-CG2 4.45Å; T324-V446 WeakPolarHBondContact O-CG1 3.29Å
447	G	90	Very high	73.5	Confident	12 Å²	12	92.5 Å²	92.5	12%	0.124	52%	0.516	C	S	.	.	P	Polyproline II helix	trans	-79.1	166.8	175.8	0	0	0	0	0	113	T324	T324-G447 PolarHBondContact O-N 2.92Å
448	P	86.2	Confident	70.7	Confident	84 Å²	84	90.5 Å²	90.5	55%	0.545	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-59.5	145.5	171.4	26.8	-35.5	0	0	0	111.1	Q327 S450	Q327-P448 HydrophobicContact CG-CG 4.32Å; Q327-P448 PolarHBondContact OE1-O 3.26Å; P448-S450 PolarHBondContact O-N 3.31Å
449	P	79.4	Confident	68.1	Low	109 Å²	109	92.4 Å²	92.4	71%	0.708	55%	0.55	S	S	*	*	P	Polyproline II helix	trans	-63.1	138	175.8	27.7	-34.7	0	0	0	110.6	Q451	P449-Q451 PolarHBondContact O-N 3.39Å; P449-Q451 VanDerWaalsContact O-N 3.16Å
450	S	69.7	Low	65	Low	55 Å²	55	100.7 Å²	100.7	39%	0.385	59%	0.587	S	S	.	*	P	Polyproline II helix	trans	-60.4	117.9	179.3	-57.6	0	0	0	0	111	P326 Q327 P448 V452	P326-S450 PolarHBondContact O-OG 3.22Å; P326-S450 VanDerWaalsContact O-OG 3.14Å; Q327-S450 PolarHBondContact N-OG 3.04Å; P448-S450 PolarHBondContact O-N 3.31Å; S450-V452 PolarHBondContact O-N 3.44Å
451	Q	56	Low	62.6	Low	194 Å²	194	104.9 Å²	104.9	91%	0.907	60%	0.595	S	S	*	*			trans	-75.2	72.7	179.5	-63.6	-174.9	15.6	0	0	111.4	P449 A453	P449-Q451 PolarHBondContact O-N 3.39Å; P449-Q451 VanDerWaalsContact O-N 3.16Å; Q451-A453 PolarHBondContact O-N 3.13Å
452	V	47.7	Very low	59.5	Low	124 Å²	124	100.9 Å²	100.9	75%	0.752	59%	0.593	S	S	*	*			trans	-79.9	102	162.8	-175.1	0	0	0	0	106.9	S450 D454	S450-V452 PolarHBondContact O-N 3.44Å; V452-D454 PolarHBondContact O-N 2.79Å
453	A	38.4	Very low	56.4	Low	80 Å²	80	109 Å²	109	66%	0.661	62%	0.621	S	S	*	*			trans	-66.9	117.1	-178.6	0	0	0	0	0	110.8	Q451 T455	Q451-A453 PolarHBondContact O-N 3.13Å; A453-T455 VanDerWaalsContact C-N 3.29Å; A453-T455 PolarHBondContact O-N 2.79Å
454	D	38.5	Very low	53.2	Low	149 Å²	149	113.9 Å²	113.9	80%	0.797	65%	0.653	S	S	*	*			trans	-75.1	81.3	174.4	-170	10.9	0	0	0	109.7	V452 G456	V452-D454 PolarHBondContact O-N 2.79Å; D454-G456 PolarHBondContact O-N 3.45Å
455	T	35.8	Very low	50.1	Low	132 Å²	132	114.5 Å²	114.5	81%	0.81	67%	0.665	S	S	*	*			trans	-73	71	172.7	56.7	0	0	0	0	109.3	A453	A453-T455 VanDerWaalsContact C-N 3.29Å; A453-T455 PolarHBondContact O-N 2.79Å
456	G	37.5	Very low	47.3	Very low	48 Å²	48	121.1 Å²	121.1	50%	0.495	69%	0.69	S	S	.	*			trans	-70.8	148.5	-156.8	0	0	0	0	0	116	D454	D454-G456 PolarHBondContact O-N 3.45Å
457	F	32.5	Very low	44.2	Very low	214 Å²	214	126.1 Å²	126.1	94%	0.939	71%	0.709	S	S	*	*			trans	-142	130.2	159	-104.5	-85.2	0	0	0	109.9	G459	F457-G459 PolarHBondContact O-N 3.12Å
458	G	31.8	Very low	41.6	Very low	77 Å²	77	135.9 Å²	135.9	79%	0.794	74%	0.743	S	S	*	*	S	Bend	trans	64	48.9	147.3	0	0	0	0	0	119.6	H460	G458-H460 PolarHBondContact O-N 2.67Å
459	G	36.7	Very low	38.9	Very low	77 Å²	77	138.6 Å²	138.6	79%	0.794	75%	0.747	S	S	*	*			trans	29.1	85.9	149.7	0	0	0	0	0	120.4	F457	F457-G459 PolarHBondContact O-N 3.12Å
460	H	28.4	Very low	36.5	Very low	192 Å²	192	139.7 Å²	139.7	89%	0.889	75%	0.745	S	S	*	*			trans	-137.8	144.3	143.7	-102	-89.2	0	0	0	108.9	G458 G462	G458-H460 PolarHBondContact O-N 2.67Å; H460-G462 PolarHBondContact O-N 2.7Å
461	R	37.8	Very low	34.5	Very low	265 Å²	265	144.9 Å²	144.9	100%	1	77%	0.768	S	S	*	*			trans	-74.9	90.4	-179.5	-71	-169.4	-173.4	-136.4	4.6	111.4
462	G	26.9	Very low	33	Very low	63 Å²	63	146.3 Å²	146.3	65%	0.649	76%	0.764	S	S	*	*			trans	-140.6	130.2	158.9	0	0	0	0	0	108.8	H460	H460-G462 PolarHBondContact O-N 2.7Å
463	W	28.4	Very low	32.1	Very low	234 Å²	234	146.1 Å²	146.1	89%	0.886	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-60.4	140.4	162.6	-93.7	-35.7	0	0	0	108.3	V465	W463-V465 PolarHBondContact O-N 3.41Å; W463-V465 VanDerWaalsContact O-N 3.16Å
464	P	27.5	Very low	31.4	Very low	104 Å²	104	146.7 Å²	146.7	68%	0.675	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-53.7	123.9	170.2	-24.9	34.5	0	0	0	109.6	R466	P464-R466 PolarHBondContact O-N 3.05Å; P464-R466 VanDerWaalsContact O-N 3.17Å
465	V	30.6	Very low	31.1	Very low	132 Å²	132	143.9 Å²	143.9	80%	0.8	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-56	123.1	-179.2	173.9	0	0	0	0	108.6	W463 Q467	W463-V465 PolarHBondContact O-N 3.41Å; W463-V465 VanDerWaalsContact O-N 3.16Å; V465-Q467 PolarHBondContact O-N 2.73Å
466	R	38.3	Very low	30.9	Very low	143 Å²	143	141.7 Å²	141.7	54%	0.54	78%	0.78	S	S	.	*			trans	-51.7	115.6	176	-83.2	174.5	165.3	-142.8	2.4	109.4	D280 P464 R468	D280-R466 VanDerWaalsContact CG-CD 3.4Å; D280-R466 WeakPolarHBondContact OD1-CD 3.41Å; D280-R466 IonicContact OD1-CZ 3.47Å; D280-R466 IonicContact OD1-NE 3.25Å; D280-R466 PolarHBondContact OD1-NE 2.81Å; D280-R466 IonicContact OD1-NH1 2.71Å; D280-R466 PolarHBondContact OD1-NH1 2.85Å; D280-R466 WeakPolarHBondContact OD2-CD 3.41Å; D280-R466 IonicContact OD2-CZ 3.19Å; D280-R466 VanDerWaalsContact OD2-CZ 3.27Å; D280-R466 IonicContact OD2-NE 3.57Å; D280-R466 PolarHBondContact OD2-NE 3.48Å; D280-R466 VanDerWaalsContact OD2-NE 3.13Å; D280-R466 IonicContact OD2-NH1 2.71Å; D280-R466 IonicContact OD2-NH2 3.55Å; P464-R466 PolarHBondContact O-N 3.05Å; P464-R466 VanDerWaalsContact O-N 3.17Å; R466-R468 PolarHBondContact O-N 3.31Å
467	Q	29.5	Very low	30.4	Very low	160 Å²	160	143 Å²	143	75%	0.748	79%	0.794	S	S	*	*			trans	-69	109.7	-167.7	-148.9	178	-5.1	0	0	109.1	V465 H469	V465-Q467 PolarHBondContact O-N 2.73Å; Q467-H469 VanDerWaalsContact CD-NE2 3.25Å; Q467-H469 VanDerWaalsContact CG-NE2 3.3Å; Q467-H469 WeakPolarHBondContact CG-NE2 3.27Å; Q467-H469 PolarHBondContact NE2-NE2 3.37Å; Q467-H469 PolarHBondContact O-CD2 3.23Å; Q467-H469 PolarHBondContact O-N 2.71Å
468	R	35.9	Very low	30.2	Very low	218 Å²	218	136.3 Å²	136.3	82%	0.823	79%	0.785	S	S	*	*			trans	-67.7	85.2	-170.8	-71.4	-178.7	172.8	-180	-2.4	111.7	R466	R466-R468 PolarHBondContact O-N 3.31Å
469	H	29.8	Very low	30.5	Very low	140 Å²	140	135.1 Å²	135.1	65%	0.648	77%	0.765	S	S	*	*			trans	-109.9	76.2	-179.1	-74.1	-60.4	0	0	0	113.3	Q467	Q467-H469 VanDerWaalsContact CD-NE2 3.25Å; Q467-H469 VanDerWaalsContact CG-NE2 3.3Å; Q467-H469 WeakPolarHBondContact CG-NE2 3.27Å; Q467-H469 PolarHBondContact NE2-NE2 3.37Å; Q467-H469 PolarHBondContact O-CD2 3.23Å; Q467-H469 PolarHBondContact O-N 2.71Å
470	M	29.4	Very low	30.5	Very low	133 Å²	133	137.1 Å²	137.1	66%	0.655	76%	0.762	S	S	*	*			trans	-147.9	71.4	151	-102.8	-63.1	-104.4	0	0	108.4
471	L	27.8	Very low	30.8	Very low	164 Å²	164	130.9 Å²	130.9	86%	0.859	73%	0.732	S	S	*	*	S	Bend	trans	-168.9	108.3	161.9	-108.1	172	0	0	0	110.4
472	R	24.2	Very low	30.7	Very low	223 Å²	223	120.8 Å²	120.8	84%	0.842	70%	0.697	S	S	*	*			trans	43.5	105.9	153.9	-168.2	178	-163.3	147.3	6.4	118.7	A474	R472-A474 PolarHBondContact O-N 2.85Å
473	P	28.4	Very low	31	Very low	120 Å²	120	121 Å²	121	78%	0.779	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-59.9	134.6	155.2	-16.4	30.7	0	0	0	110.7
474	A	23.7	Very low	31.3	Very low	93 Å²	93	111.8 Å²	111.8	77%	0.769	66%	0.657	S	S	*	*	P	Polyproline II helix	trans	-71.9	144.3	152.1	0	0	0	0	0	108	R472 G476	R472-A474 PolarHBondContact O-N 2.85Å; A474-G476 PolarHBondContact O-N 3.5Å
475	G	32.6	Very low	31.6	Very low	89 Å²	89	109 Å²	109	92%	0.918	64%	0.637	S	S	*	*	S	Bend	trans	-63.8	130.2	-172.7	0	0	0	0	0	112.9
476	G	31.9	Very low	31.7	Very low	86 Å²	86	105 Å²	105	89%	0.887	61%	0.612	S	S	*	*			trans	146	76	177.8	0	0	0	0	0	113.6	A474	A474-G476 PolarHBondContact O-N 3.5Å
477	G	25.8	Very low	31.4	Very low	76 Å²	76	105 Å²	105	78%	0.784	62%	0.618	S	S	*	*			trans	-179.9	118.8	175.8	0	0	0	0	0	110.5
478	G	29.6	Very low	31.6	Very low	73 Å²	73	102.7 Å²	102.7	75%	0.753	61%	0.61	S	S	*	*			trans	-81.5	160.6	-176.6	0	0	0	0	0	113.9
479	S	36.4	Very low	31.3	Very low	53 Å²	53	94.8 Å²	94.8	37%	0.371	59%	0.591	S	S	.	*			trans	-4.7	136.7	163.3	58.8	0	0	0	0	119.9	D483	S479-D483 VanDerWaalsContact CB-CG 3.49Å; S479-D483 WeakPolarHBondContact CB-OD2 3.38Å; S479-D483 VanDerWaalsContact O-OD2 3.12Å; S479-D483 VanDerWaalsContact OG-CG 3.29Å; S479-D483 PolarHBondContact OG-OD1 3.11Å; S479-D483 PolarHBondContact OG-OD2 3.3Å
480	T	37.2	Very low	31.3	Very low	119 Å²	119	92.7 Å²	92.7	73%	0.73	59%	0.588	S	S	*	*	S	Bend	trans	-149	-41.5	152.8	42.5	0	0	0	0	109.3	D483 A484	T480-D483 PolarHBondContact O-N 3.3Å; T480-A484 WeakPolarHBondContact O-CB 3.37Å; T480-A484 PolarHBondContact O-N 3.2Å
481	F	35.3	Very low	31.3	Very low	61 Å²	61	90.9 Å²	90.9	27%	0.268	59%	0.594	S	S	.	*	H	α-helix	trans	-62.8	-46.9	169.1	178.3	-101.9	0	0	0	112	A374 F404 A484 V485 L507 L510	A374-F481 HydrophobicContact CB-CE2 4.29Å; F404-F481 HydrophobicContact CE1-CZ 4.42Å; F404-F481 HydrophobicContact CZ-CE1 4.14Å; F404-F481 AromaticContact CZ-CZ 3.96Å; F404-F481 HydrophobicContact CZ-CZ 3.96Å; F481-A484 PolarHBondContact O-N 3.38Å; F481-V485 WeakPolarHBondContact O-CG2 3.46Å; F481-V485 PolarHBondContact O-N 3.08Å; F481-L507 HydrophobicContact CD1-CD2 4.06Å; F481-L510 HydrophobicContact CE1-CD1 3.84Å; F481-L510 HydrophobicContact CZ-CD1 3.84Å
482	E	35.9	Very low	31.5	Very low	53 Å²	53	85.2 Å²	85.2	25%	0.248	57%	0.569	C	S	.	*	H	α-helix	trans	-60.9	-47.6	173.7	-64.6	-162.1	107.1	0	0	111.1	A484 V485 D486 R503	E482-A484 VanDerWaalsContact C-N 3.28Å; E482-A484 PolarHBondContact O-N 3.43Å; E482-V485 PolarHBondContact O-N 3.03Å; E482-V485 VanDerWaalsContact O-N 3.1Å; E482-D486 WeakPolarHBondContact O-CB 3.43Å; E482-D486 PolarHBondContact O-N 2.89Å; E482-R503 WeakPolarHBondContact OE1-CB 3.43Å; E482-R503 WeakPolarHBondContact OE1-CD 3.16Å; E482-R503 WeakPolarHBondContact OE1-CG 3.33Å; E482-R503 IonicContact OE1-CZ 3.72Å; E482-R503 IonicContact OE1-NE 3.67Å; E482-R503 IonicContact OE1-NH1 2.71Å; E482-R503 PolarHBondContact OE1-NH1 3.16Å
483	D	32.7	Very low	31.8	Very low	66 Å²	66	82.3 Å²	82.3	35%	0.353	56%	0.564	S	S	.	*	H	α-helix	trans	-62.1	-33.6	178.9	-62.5	-39.4	0	0	0	112.4	S479 T480 H487	S479-D483 VanDerWaalsContact CB-CG 3.49Å; S479-D483 WeakPolarHBondContact CB-OD2 3.38Å; S479-D483 VanDerWaalsContact O-OD2 3.12Å; S479-D483 VanDerWaalsContact OG-CG 3.29Å; S479-D483 PolarHBondContact OG-OD1 3.11Å; S479-D483 PolarHBondContact OG-OD2 3.3Å; T480-D483 PolarHBondContact O-N 3.3Å; D483-H487 WeakPolarHBondContact O-CA 3.47Å; D483-H487 WeakPolarHBondContact O-CB 3.34Å; D483-H487 PolarHBondContact O-CD2 2.94Å; D483-H487 VanDerWaalsContact O-CG 3.26Å; D483-H487 PolarHBondContact O-N 3.1Å
484	A	34.4	Very low	31.8	Very low	42 Å²	42	79.7 Å²	79.7	35%	0.347	56%	0.56	S	S	.	*	H	α-helix	trans	-69.1	-34.4	175.5	0	0	0	0	0	113	T480 F481 E482	T480-A484 WeakPolarHBondContact O-CB 3.37Å; T480-A484 PolarHBondContact O-N 3.2Å; F481-A484 PolarHBondContact O-N 3.38Å; E482-A484 VanDerWaalsContact C-N 3.28Å; E482-A484 PolarHBondContact O-N 3.43Å
485	V	35	Very low	32.1	Very low	44 Å²	44	82.1 Å²	82.1	27%	0.267	57%	0.567	S	S	.	*	H	α-helix	trans	-77.9	-44.3	175.7	174.7	0	0	0	0	110.7	A374 F481 E482 L488 A489	A374-V485 HydrophobicContact CB-CG2 4.45Å; F481-V485 WeakPolarHBondContact O-CG2 3.46Å; F481-V485 PolarHBondContact O-N 3.08Å; E482-V485 PolarHBondContact O-N 3.03Å; E482-V485 VanDerWaalsContact O-N 3.1Å; V485-L488 PolarHBondContact O-N 3.09Å; V485-A489 WeakPolarHBondContact O-CB 3.44Å; V485-A489 PolarHBondContact O-N 2.99Å
486	D	32.2	Very low	31.8	Very low	49 Å²	49	81.7 Å²	81.7	26%	0.262	56%	0.563	S	S	.	*	H	α-helix	trans	-70.8	-29.6	178.5	-72	-30.3	0	0	0	111.4	E482 A489 T490 R503	E482-D486 WeakPolarHBondContact O-CB 3.43Å; E482-D486 PolarHBondContact O-N 2.89Å; D486-A489 PolarHBondContact O-N 2.71Å; D486-T490 VanDerWaalsContact O-CB 3.24Å; D486-T490 WeakPolarHBondContact O-CB 3.39Å; D486-T490 WeakPolarHBondContact O-CG2 3.1Å; D486-T490 PolarHBondContact O-N 3.41Å; D486-T490 PolarHBondContact O-OG1 3.19Å; D486-R503 IonicContact OD1-CZ 3.44Å; D486-R503 IonicContact OD1-NH1 2.89Å; D486-R503 IonicContact OD1-NH2 3.54Å; D486-R503 PolarHBondContact OD1-NH2 3.4Å; D486-R503 IonicContact OD2-CZ 3.99Å; D486-R503 IonicContact OD2-NH1 2.76Å; D486-R503 PolarHBondContact OD2-NH1 3.14Å; D486-R503 IonicContact OD2-NH2 3.23Å; D486-R503 PolarHBondContact OD2-NH2 2.87Å; D486-R503 VanDerWaalsContact OD2-NH2 3.09Å
487	H	30.9	Very low	31.6	Very low	143 Å²	143	81.6 Å²	81.6	66%	0.662	56%	0.562	S	S	*	*	H	α-helix	trans	-67.9	-32	170.1	-84.7	-53.3	0	0	0	113.5	D483 T490	D483-H487 WeakPolarHBondContact O-CA 3.47Å; D483-H487 WeakPolarHBondContact O-CB 3.34Å; D483-H487 PolarHBondContact O-CD2 2.94Å; D483-H487 VanDerWaalsContact O-CG 3.26Å; D483-H487 PolarHBondContact O-N 3.1Å; H487-T490 WeakPolarHBondContact CA-OG1 3.34Å
488	L	33.7	Very low	32	Very low	112 Å²	112	82.2 Å²	82.2	59%	0.586	57%	0.569	S	S	*	*	H	α-helix	trans	-77.1	-28.7	171.6	-73.9	168.4	0	0	0	112	V485	V485-L488 PolarHBondContact O-N 3.09Å
489	A	30.4	Very low	31.9	Very low	51 Å²	51	81.5 Å²	81.5	42%	0.421	56%	0.561	S	S	.	*	H	α-helix	trans	-84.1	-31.8	178.2	0	0	0	0	0	114.2	V485 D486 A491 S492	V485-A489 WeakPolarHBondContact O-CB 3.44Å; V485-A489 PolarHBondContact O-N 2.99Å; D486-A489 PolarHBondContact O-N 2.71Å; A489-A491 PolarHBondContact O-N 2.9Å; A489-S492 CarbonylContact O-C 3.58Å; A489-S492 PolarHBondContact O-N 2.93Å
490	T	30.6	Very low	31.5	Very low	96 Å²	96	90.9 Å²	90.9	59%	0.589	59%	0.589	S	S	*	*	G	3₁₀ helix	trans	-72.5	-7.5	-177.1	45	0	0	0	0	114.2	D486 H487 S492	D486-T490 VanDerWaalsContact O-CB 3.24Å; D486-T490 WeakPolarHBondContact O-CB 3.39Å; D486-T490 WeakPolarHBondContact O-CG2 3.1Å; D486-T490 PolarHBondContact O-N 3.41Å; D486-T490 PolarHBondContact O-OG1 3.19Å; H487-T490 WeakPolarHBondContact CA-OG1 3.34Å; T490-S492 PolarHBondContact O-N 3.36Å
491	A	28.1	Very low	31	Very low	95 Å²	95	93.3 Å²	93.3	79%	0.785	60%	0.596	S	S	*	*	G	3₁₀ helix	trans	-63.7	-12.6	159.8	0	0	0	0	0	113	A489	A489-A491 PolarHBondContact O-N 2.9Å
492	S	32.1	Very low	30.8	Very low	46 Å²	46	97.7 Å²	97.7	32%	0.322	62%	0.622	S	S	.	*	G	3₁₀ helix	trans	-146.5	69.7	-176.3	-161.2	0	0	0	0	113.8	A489 T490	A489-S492 CarbonylContact O-C 3.58Å; A489-S492 PolarHBondContact O-N 2.93Å; T490-S492 PolarHBondContact O-N 3.36Å
493	Q	31.6	Very low	30.6	Very low	161 Å²	161	101 Å²	101	75%	0.752	63%	0.632	S	S	*	*			trans	165	160.4	137	-89.4	157	108.7	0	0	113.1
494	G	28.4	Very low	30.4	Very low	66 Å²	66	104.8 Å²	104.8	68%	0.68	65%	0.647	S	S	*	*			trans	-84.9	175.3	179	0	0	0	0	0	114.9
495	P	29.7	Very low	30	Very low	143 Å²	143	106.2 Å²	106.2	93%	0.929	66%	0.659	S	S	*	*			trans	-84.5	126.8	-165.5	31.7	-35.3	0	0	0	114.8
496	G	26.7	Very low	30.1	Very low	80 Å²	80	106 Å²	106	83%	0.825	66%	0.659	S	S	*	*			trans	173.1	139.6	164.5	0	0	0	0	0	114.5
497	G	27	Very low	30.1	Very low	85 Å²	85	107 Å²	107	88%	0.876	67%	0.665	S	S	*	*			trans	100.6	112.4	170.8	0	0	0	0	0	115
498	G	33	Very low	30.1	Very low	89 Å²	89	105.6 Å²	105.6	92%	0.918	66%	0.662	S	S	*	*			trans	-85.8	141.9	-177.7	0	0	0	0	0	114.3
499	G	28.3	Very low	30.1	Very low	58 Å²	58	101.4 Å²	101.4	60%	0.598	65%	0.646	S	S	*	*			trans	-146.5	26.2	179	0	0	0	0	0	114.9	L501	G499-L501 VanDerWaalsContact C-N 3.26Å; G499-L501 PolarHBondContact O-N 2.7Å
500	R	27.4	Very low	30.6	Very low	250 Å²	250	100.5 Å²	100.5	94%	0.943	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	22.9	-162.2	-143.7	-175.4	-169.3	-154.4	2.1	116.6
501	L	27.8	Very low	30.7	Very low	170 Å²	170	98.9 Å²	98.9	89%	0.89	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.6	-3.7	-177.3	-85.1	167.7	0	0	0	115.7	G499	G499-L501 VanDerWaalsContact C-N 3.26Å; G499-L501 PolarHBondContact O-N 2.7Å
502	L	31.5	Very low	31.1	Very low	153 Å²	153	100.4 Å²	100.4	80%	0.801	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	-26.6	179	-79.2	162.9	0	0	0	114.4	Q504 A505	L502-Q504 VanDerWaalsContact C-N 3.26Å; L502-Q504 PolarHBondContact O-N 3.19Å; L502-Q504 VanDerWaalsContact O-N 3.17Å; L502-A505 PolarHBondContact O-N 2.8Å
503	R	31.2	Very low	31.4	Very low	122 Å²	122	101.2 Å²	101.2	46%	0.46	61%	0.611	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.4	-30.9	-177.8	-90.2	165.9	160.6	-134.4	11.4	114.6	E482 D486 A505 S506	E482-R503 WeakPolarHBondContact OE1-CB 3.43Å; E482-R503 WeakPolarHBondContact OE1-CD 3.16Å; E482-R503 WeakPolarHBondContact OE1-CG 3.33Å; E482-R503 IonicContact OE1-CZ 3.72Å; E482-R503 IonicContact OE1-NE 3.67Å; E482-R503 IonicContact OE1-NH1 2.71Å; E482-R503 PolarHBondContact OE1-NH1 3.16Å; D486-R503 IonicContact OD1-CZ 3.44Å; D486-R503 IonicContact OD1-NH1 2.89Å; D486-R503 IonicContact OD1-NH2 3.54Å; D486-R503 PolarHBondContact OD1-NH2 3.4Å; D486-R503 IonicContact OD2-CZ 3.99Å; D486-R503 IonicContact OD2-NH1 2.76Å; D486-R503 PolarHBondContact OD2-NH1 3.14Å; D486-R503 IonicContact OD2-NH2 3.23Å; D486-R503 PolarHBondContact OD2-NH2 2.87Å; D486-R503 VanDerWaalsContact OD2-NH2 3.09Å; R503-A505 PolarHBondContact O-N 2.98Å; R503-A505 VanDerWaalsContact O-N 3.13Å; R503-S506 PolarHBondContact O-N 3.44Å; R503-S506 VanDerWaalsContact O-N 3.11Å
504	Q	27.4	Very low	31.9	Very low	146 Å²	146	98.4 Å²	98.4	68%	0.682	59%	0.593	S	S	*	*	H	α-helix	trans	-57	-31.4	-177.2	-161.8	73.9	59.5	0	0	113.4	L502 S506	L502-Q504 VanDerWaalsContact C-N 3.26Å; L502-Q504 PolarHBondContact O-N 3.19Å; L502-Q504 VanDerWaalsContact O-N 3.17Å; Q504-S506 VanDerWaalsContact C-N 3.34Å; Q504-S506 PolarHBondContact O-N 3.37Å
505	A	27.8	Very low	32.2	Very low	71 Å²	71	98.4 Å²	98.4	59%	0.587	58%	0.578	S	S	*	*	H	α-helix	trans	-72.1	-23.8	-178.7	0	0	0	0	0	114	L502 R503 G509	L502-A505 PolarHBondContact O-N 2.8Å; R503-A505 PolarHBondContact O-N 2.98Å; R503-A505 VanDerWaalsContact O-N 3.13Å; A505-G509 PolarHBondContact O-N 2.94Å; A505-G509 VanDerWaalsContact O-N 3.11Å
506	S	36.3	Very low	32.5	Very low	39 Å²	39	96.2 Å²	96.2	27%	0.273	56%	0.558	S	S	.	*	H	α-helix	trans	-72.4	-34.2	-175.6	-174.1	0	0	0	0	112.5	F404 R503 Q504 G509 L510	F404-S506 WeakPolarHBondContact CE2-OG 3.37Å; R503-S506 PolarHBondContact O-N 3.44Å; R503-S506 VanDerWaalsContact O-N 3.11Å; Q504-S506 VanDerWaalsContact C-N 3.34Å; Q504-S506 PolarHBondContact O-N 3.37Å; S506-G509 CarbonylContact O-C 3.58Å; S506-G509 WeakPolarHBondContact O-CA 3.2Å; S506-G509 PolarHBondContact O-N 2.74Å; S506-L510 PolarHBondContact O-N 2.86Å
507	L	31.2	Very low	33.3	Very low	72 Å²	72	94.6 Å²	94.6	38%	0.377	53%	0.53	S	S	.	.	H	α-helix	trans	-67.7	-44.8	178	-76.6	165.8	0	0	0	112.7	F481 G509 L510 Q511	F481-L507 HydrophobicContact CD1-CD2 4.06Å; L507-G509 PolarHBondContact O-N 3.45Å; L507-L510 PolarHBondContact O-N 3.48Å; L507-Q511 PolarHBondContact O-N 3.04Å
508	D	31.4	Very low	33.7	Very low	112 Å²	112	92.2 Å²	92.2	60%	0.599	51%	0.505	S	S	*	.	H	α-helix	trans	-63.5	-34.2	171.5	-76.1	-32.8	0	0	0	110.9	Q511 Q512	D508-Q511 PolarHBondContact O-N 2.69Å; D508-Q512 WeakPolarHBondContact O-CB 3.4Å; D508-Q512 WeakPolarHBondContact O-CG 3.44Å; D508-Q512 PolarHBondContact O-N 3.09Å
509	G	35	Very low	33.5	Very low	25 Å²	25	92.4 Å²	92.4	26%	0.258	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-43.8	172.4	0	0	0	0	0	113.9	A505 S506 L507 Q511 Q512 L513	A505-G509 PolarHBondContact O-N 2.94Å; A505-G509 VanDerWaalsContact O-N 3.11Å; S506-G509 CarbonylContact O-C 3.58Å; S506-G509 WeakPolarHBondContact O-CA 3.2Å; S506-G509 PolarHBondContact O-N 2.74Å; L507-G509 PolarHBondContact O-N 3.45Å; G509-Q511 PolarHBondContact O-N 2.86Å; G509-Q512 PolarHBondContact O-N 3.44Å; G509-L513 WeakPolarHBondContact O-CB 3.41Å; G509-L513 VanDerWaalsContact O-CG 3.28Å; G509-L513 WeakPolarHBondContact O-CG 3.37Å; G509-L513 PolarHBondContact O-N 3.35Å
510	L	39.1	Very low	33.8	Very low	31 Å²	31	98.7 Å²	98.7	16%	0.162	50%	0.498	C	S	.	.	H	α-helix	trans	-64.2	-39.1	176.4	-79.1	171.1	0	0	0	112.6	F404 Y407 F481 S506 L507 R514	F404-L510 HydrophobicContact CD1-CD2 3.83Å; F404-L510 HydrophobicContact CD2-CD2 4.07Å; F404-L510 HydrophobicContact CD2-CG 4.26Å; F404-L510 HydrophobicContact CE1-CD1 4.4Å; F404-L510 HydrophobicContact CE1-CD2 3.99Å; F404-L510 HydrophobicContact CE2-CD1 4.04Å; F404-L510 HydrophobicContact CE2-CD2 4.22Å; F404-L510 HydrophobicContact CE2-CG 4.15Å; F404-L510 HydrophobicContact CG-CD2 3.9Å; F404-L510 HydrophobicContact CZ-CD1 3.92Å; F404-L510 HydrophobicContact CZ-CD2 4.19Å; F404-L510 HydrophobicContact CZ-CG 4.36Å; Y407-L510 HydrophobicContact CD2-CD2 4.16Å; Y407-L510 HydrophobicContact CE2-CD2 4.36Å; F481-L510 HydrophobicContact CE1-CD1 3.84Å; F481-L510 HydrophobicContact CZ-CD1 3.84Å; S506-L510 PolarHBondContact O-N 2.86Å; L507-L510 PolarHBondContact O-N 3.48Å; L510-R514 WeakPolarHBondContact O-CB 3.42Å; L510-R514 PolarHBondContact O-N 3.16Å; L510-R514 VanDerWaalsContact O-N 3.13Å
511	Q	34.2	Very low	34	Very low	63 Å²	63	98.4 Å²	98.4	29%	0.294	50%	0.497	S	S	.	.	H	α-helix	trans	-69.5	-43.9	174.9	-175	57.2	48.5	0	0	111	L507 D508 G509 L513 R514 D515	L507-Q511 PolarHBondContact O-N 3.04Å; D508-Q511 PolarHBondContact O-N 2.69Å; G509-Q511 PolarHBondContact O-N 2.86Å; Q511-L513 PolarHBondContact O-N 3.27Å; Q511-R514 WeakPolarHBondContact O-CB 3.44Å; Q511-R514 PolarHBondContact O-N 2.75Å; Q511-D515 VanDerWaalsContact NE2-CG 3.31Å; Q511-D515 PolarHBondContact NE2-OD1 3.45Å; Q511-D515 VanDerWaalsContact NE2-OD1 3.1Å; Q511-D515 PolarHBondContact NE2-OD2 3.22Å; Q511-D515 VanDerWaalsContact O-CG 3.29Å; Q511-D515 PolarHBondContact O-N 3.32Å
512	Q	35.1	Very low	34	Very low	126 Å²	126	97.1 Å²	97.1	59%	0.589	49%	0.491	S	S	*	.	H	α-helix	trans	-64.3	-35.3	174.7	-77.3	-169.8	-8	0	0	113.4	D508 G509 D515 N516	D508-Q512 WeakPolarHBondContact O-CB 3.4Å; D508-Q512 WeakPolarHBondContact O-CG 3.44Å; D508-Q512 PolarHBondContact O-N 3.09Å; G509-Q512 PolarHBondContact O-N 3.44Å; Q512-D515 PolarHBondContact O-N 3.26Å; Q512-N516 WeakPolarHBondContact O-CB 3.42Å; Q512-N516 PolarHBondContact O-N 3.41Å; Q512-N516 PolarHBondContact O-ND2 3.48Å; Q512-N516 VanDerWaalsContact O-ND2 3.12Å
513	L	39.4	Very low	33.7	Very low	63 Å²	63	95.6 Å²	95.6	33%	0.33	49%	0.49	S	S	.	.	H	α-helix	trans	-68.2	-39	175.8	-78.5	169.1	0	0	0	111.6	F404 G509 Q511 M517	F404-L513 HydrophobicContact CB-CD1 4.36Å; G509-L513 WeakPolarHBondContact O-CB 3.41Å; G509-L513 VanDerWaalsContact O-CG 3.28Å; G509-L513 WeakPolarHBondContact O-CG 3.37Å; G509-L513 PolarHBondContact O-N 3.35Å; Q511-L513 PolarHBondContact O-N 3.27Å; L513-M517 WeakPolarHBondContact O-CG 3.45Å; L513-M517 PolarHBondContact O-N 3.47Å
514	R	41	Very low	33.4	Very low	102 Å²	102	97.8 Å²	97.8	39%	0.385	51%	0.51	S	S	.	.	H	α-helix	trans	-58.2	-52.5	170.9	177.8	178.7	-68.1	171.9	-4.9	110.6	Q332 L510 Q511 M517	Q332-R514 PolarHBondContact NE2-O 2.76Å; Q332-R514 PolarHBondContact OE1-O 2.89Å; L510-R514 WeakPolarHBondContact O-CB 3.42Å; L510-R514 PolarHBondContact O-N 3.16Å; L510-R514 VanDerWaalsContact O-N 3.13Å; Q511-R514 WeakPolarHBondContact O-CB 3.44Å; Q511-R514 PolarHBondContact O-N 2.75Å; R514-M517 PolarHBondContact O-N 3.26Å
515	D	35.4	Very low	33.4	Very low	67 Å²	67	97 Å²	97	36%	0.358	52%	0.515	S	S	.	.	H	α-helix	trans	-70.1	-39.2	-176.3	-61.7	-28.8	0	0	0	112.1	Q511 Q512 M517 G518	Q511-D515 VanDerWaalsContact NE2-CG 3.31Å; Q511-D515 PolarHBondContact NE2-OD1 3.45Å; Q511-D515 VanDerWaalsContact NE2-OD1 3.1Å; Q511-D515 PolarHBondContact NE2-OD2 3.22Å; Q511-D515 VanDerWaalsContact O-CG 3.29Å; Q511-D515 PolarHBondContact O-N 3.32Å; Q512-D515 PolarHBondContact O-N 3.26Å; D515-M517 VanDerWaalsContact C-N 3.31Å; D515-M517 PolarHBondContact O-N 3.04Å; D515-G518 PolarHBondContact O-N 2.62Å
516	N	36.2	Very low	33.1	Very low	97 Å²	97	102.6 Å²	102.6	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-69.3	-19.6	179.5	-78.6	-34.7	0	0	0	114.4	Q512 G518 S519	Q512-N516 WeakPolarHBondContact O-CB 3.42Å; Q512-N516 PolarHBondContact O-N 3.41Å; Q512-N516 PolarHBondContact O-ND2 3.48Å; Q512-N516 VanDerWaalsContact O-ND2 3.12Å; N516-G518 PolarHBondContact O-N 2.99Å; N516-S519 PolarHBondContact O-N 3.12Å
517	M	44.3	Very low	32.4	Very low	45 Å²	45	108.2 Å²	108.2	22%	0.222	56%	0.555	C	S	.	*	T	Hydrogen-bonded Turn	trans	-61.2	-5.9	173.3	-82.9	-145.2	-68.8	0	0	113.9	R294 R408 L411 L513 R514 D515	R294-M517 PolarHBondContact NH1-O 2.79Å; R408-M517 HydrophobicContact CB-SD 3.79Å; R408-M517 HydrophobicContact CG-SD 3.61Å; L411-M517 HydrophobicContact CD2-CE 4.13Å; L513-M517 WeakPolarHBondContact O-CG 3.45Å; L513-M517 PolarHBondContact O-N 3.47Å; R514-M517 PolarHBondContact O-N 3.26Å; D515-M517 VanDerWaalsContact C-N 3.31Å; D515-M517 PolarHBondContact O-N 3.04Å
518	G	34.8	Very low	32.1	Very low	35 Å²	35	110.5 Å²	110.5	36%	0.361	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-94.7	-17.4	170.1	0	0	0	0	0	116.4	D515 N516	D515-G518 PolarHBondContact O-N 2.62Å; N516-G518 PolarHBondContact O-N 2.99Å
519	S	29.4	Very low	31.7	Very low	94 Å²	94	114.1 Å²	114.1	66%	0.657	59%	0.588	S	S	*	*			trans	-134.9	65.1	-155.8	-159.3	0	0	0	0	115.4	N516	N516-S519 PolarHBondContact O-N 3.12Å
520	R	32.8	Very low	31.2	Very low	189 Å²	189	118.8 Å²	118.8	71%	0.713	61%	0.613	S	S	*	*			trans	-131.6	124.2	156.6	-95.1	-179	167	164.3	-2.9	109.7	D648	R520-D648 IonicContact CZ-OD2 3.09Å; R520-D648 IonicContact NH1-OD2 2.89Å; R520-D648 PolarHBondContact NH1-OD2 3.19Å
521	R	31.9	Very low	30.4	Very low	244 Å²	244	122.1 Å²	122.1	92%	0.921	65%	0.645	S	S	*	*			trans	-90.5	134.5	172.8	-67.1	176.8	176	168.9	-2.8	108.7
522	D	27.5	Very low	29.9	Very low	143 Å²	143	123.5 Å²	123.5	77%	0.765	67%	0.667	S	S	*	*			trans	-67.7	132.6	168	-70.4	-54.4	0	0	0	110.1	L524	D522-L524 PolarHBondContact O-N 3.35Å; D522-L524 VanDerWaalsContact O-N 3.16Å
523	P	25.6	Very low	29.3	Very low	121 Å²	121	124.6 Å²	124.6	79%	0.786	68%	0.677	S	S	*	*			trans	-77.2	100.4	176.3	30.3	-32.7	0	0	0	110.3	V525	P523-V525 PolarHBondContact O-N 3.26Å
524	L	25.9	Very low	28.5	Very low	168 Å²	168	128.6 Å²	128.6	88%	0.88	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-64.1	128.3	173.6	-87.7	168.6	0	0	0	111.4	D522 Q526	D522-L524 PolarHBondContact O-N 3.35Å; D522-L524 VanDerWaalsContact O-N 3.16Å; L524-Q526 PolarHBondContact O-N 2.87Å
525	V	26.5	Very low	27.6	Very low	130 Å²	130	129.1 Å²	129.1	79%	0.788	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-66	128	173.3	175.7	0	0	0	0	109.5	P523	P523-V525 PolarHBondContact O-N 3.26Å
526	Q	21.5	Very low	27.1	Very low	189 Å²	189	129.9 Å²	129.9	88%	0.883	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-76.8	131.6	175.3	-68.5	-179.9	-16.8	0	0	111.1	L524	L524-Q526 PolarHBondContact O-N 2.87Å
527	L	22.5	Very low	26.5	Very low	156 Å²	156	134.8 Å²	134.8	82%	0.817	74%	0.743	S	S	*	*			trans	-126.8	145.5	161.6	-87.6	160.4	0	0	0	108.6
528	P	24.6	Very low	25.5	Very low	120 Å²	120	136.8 Å²	136.8	78%	0.779	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-81.4	146.7	-164.1	-12.7	29.9	0	0	0	114.5
529	H	23.3	Very low	25.1	Very low	189 Å²	189	142.8 Å²	142.8	88%	0.875	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-72.9	139.3	165.4	-80.4	-84.2	0	0	0	112.2
530	P	24	Very low	24.8	Very low	122 Å²	122	143.8 Å²	143.8	79%	0.792	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-80.1	159.2	146.8	33	-28.8	0	0	0	110.8
531	A	21.6	Very low	24.4	Very low	101 Å²	101	143.2 Å²	143.2	84%	0.835	80%	0.797	S	S	*	*			trans	-107.3	-168.5	-167.5	0	0	0	0	0	114.4
532	A	23.7	Very low	24.6	Very low	92 Å²	92	136.1 Å²	136.1	76%	0.76	78%	0.783	S	S	*	*			trans	85.1	143	176.8	0	0	0	0	0	116
533	L	22.7	Very low	24.5	Very low	150 Å²	150	136.1 Å²	136.1	79%	0.785	78%	0.782	S	S	*	*			cis	-164.5	168.2	-5.8	-117.6	174	0	0	0	111.5
534	I	23.5	Very low	24.5	Very low	147 Å²	147	136.7 Å²	136.7	75%	0.754	78%	0.778	S	S	*	*			trans	71.2	106.6	160	-63.7	155.1	0	0	0	116.5
535	S	21.7	Very low	24.4	Very low	112 Å²	112	135.5 Å²	135.5	78%	0.783	77%	0.772	S	S	*	*				84.6	145.1	83.2	-139.1	0	0	0	0	114.1
536	S	24.6	Very low	24.3	Very low	84 Å²	84	134.8 Å²	134.8	59%	0.587	77%	0.773	S	S	*	*			cis	-162.3	154.8	17.1	79.5	0	0	0	0	115
537	K	24.7	Very low	25.2	Very low	200 Å²	200	131.5 Å²	131.5	87%	0.87	77%	0.768	S	S	*	*			trans	68.2	153.2	147.4	-71.3	176.3	-179.4	179.8	0	119.6
538	S	23.3	Very low	25.4	Very low	87 Å²	87	131 Å²	131	61%	0.608	77%	0.766	S	S	*	*			cis	-174.6	124.5	-12	162.5	0	0	0	0	114.1
539	L	24.9	Very low	26.3	Very low	161 Å²	161	130.5 Å²	130.5	84%	0.843	76%	0.763	S	S	*	*			trans	60.7	161.1	148.8	-55.4	173.4	0	0	0	118.7
540	S	23.9	Very low	26.4	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	76%	0.762	S	S	*	*			cis	-145.6	154.5	14.7	-46.7	0	0	0	0	114
541	E	24.1	Very low	26.5	Very low	177 Å²	177	131.7 Å²	131.7	83%	0.827	77%	0.767	S	S	*	*			trans	-102.9	-149	162.3	-136.8	-163.3	-130.2	0	0	108.4
542	P	36.5	Very low	26.6	Very low	96 Å²	96	131.3 Å²	131.3	62%	0.623	76%	0.758	S	S	*	*			cis	-115.4	-154.7	-2.1	21.5	6.6	0	0	0	111.9
543	L	24.9	Very low	26.6	Very low	142 Å²	142	131.4 Å²	131.4	74%	0.743	75%	0.753	S	S	*	*			cis	-158.6	168.8	24.2	-68.6	161.4	0	0	0	107.7
544	L	26	Very low	26.6	Very low	134 Å²	134	133.5 Å²	133.5	70%	0.702	76%	0.757	S	S	*	*			cis	-166.9	177.5	-8.7	-117.4	178	0	0	0	111.2
545	N	23.8	Very low	26.7	Very low	142 Å²	142	132 Å²	132	76%	0.759	76%	0.76	S	S	*	*			trans	78.3	128.5	152.2	-75.4	0.3	0	0	0	123
546	S	24.6	Very low	27	Very low	116 Å²	116	135.6 Å²	135.6	81%	0.811	76%	0.763	S	S	*	*			trans	-112	-163.2	163.4	-30.9	0	0	0	0	108.2
547	P	40.4	Very low	27.9	Very low	119 Å²	119	136.6 Å²	136.6	77%	0.773	77%	0.768	S	S	*	*			cis	-139.3	-169.3	15.2	43.5	-22.3	0	0	0	117
548	D	27.7	Very low	27.9	Very low	146 Å²	146	134.4 Å²	134.4	78%	0.781	77%	0.766	S	S	*	*			trans	-63.9	-175.1	171.5	-55.2	-79.1	0	0	0	114.3
549	P	42.4	Very low	28.2	Very low	109 Å²	109	135.6 Å²	135.6	71%	0.708	77%	0.774	S	S	*	*			cis	-149.3	176.8	13.7	44.7	-23.3	0	0	0	120.8
550	L	25.7	Very low	28.9	Very low	163 Å²	163	133.2 Å²	133.2	85%	0.853	77%	0.768	S	S	*	*			trans	35.2	132.5	145	-63.3	169.2	0	0	0	123.2
551	L	26.3	Very low	29.2	Very low	173 Å²	173	132.8 Å²	132.8	91%	0.906	77%	0.765	S	S	*	*			trans	-171	-178.3	130.1	-107.4	169	0	0	0	113.7
552	S	22.7	Very low	29.3	Very low	93 Å²	93	129.1 Å²	129.1	65%	0.65	76%	0.759	S	S	*	*			trans	-148.4	157.4	-156.4	61.5	0	0	0	0	118.1
553	S	23.5	Very low	28.9	Very low	94 Å²	94	130 Å²	130	66%	0.657	77%	0.768	S	S	*	*			trans	83.2	127.6	145.1	-65.2	0	0	0	0	123.2
554	F	23.5	Very low	28.9	Very low	194 Å²	194	128.7 Å²	128.7	85%	0.851	77%	0.77	S	S	*	*			trans	43.9	150	148.8	-49.9	-67.4	0	0	0	120.9
555	S	25.7	Very low	29.6	Very low	117 Å²	117	128.1 Å²	128.1	82%	0.818	78%	0.775	S	S	*	*			cis	-158	176.7	33.9	-57.2	0	0	0	0	114.7
556	H	28.4	Very low	30.6	Very low	186 Å²	186	126.6 Å²	126.6	86%	0.861	77%	0.772	S	S	*	*			trans	-72.1	-177.8	166.7	-80	-69.7	0	0	0	113.6
557	P	43.4	Very low	30.8	Very low	105 Å²	105	127 Å²	127	68%	0.682	78%	0.776	S	S	*	*			cis	-141.7	-179.5	15.7	44.6	-25.8	0	0	0	118.2
558	D	24.9	Very low	30	Very low	154 Å²	154	127 Å²	127	82%	0.824	77%	0.774	S	S	*	*				-176.1	176.5	121.3	-100.6	-16.7	0	0	0	114
559	S	28	Very low	29.9	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	77%	0.772	S	S	*	*			trans	-162.2	178.7	-170.4	-76.2	0	0	0	0	109.3
560	P	41.5	Very low	29	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	78%	0.776	S	S	*	*			cis	-151.6	-168.5	25.5	43.2	-20	0	0	0	118.8
561	S	29.5	Very low	29.3	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	77%	0.772	S	S	*	*			trans	70.6	149.4	147.8	62.1	0	0	0	0	121.7
562	S	26.9	Very low	29.3	Very low	100 Å²	100	125 Å²	125	70%	0.699	76%	0.762	S	S	*	*			cis	-172.2	148.2	-19.9	51.8	0	0	0	0	114.8
563	S	26.5	Very low	30.1	Very low	114 Å²	114	125.7 Å²	125.7	80%	0.797	76%	0.764	S	S	*	*			trans	69.1	144.3	145	56.2	0	0	0	0	124
564	S	26	Very low	30.2	Very low	114 Å²	114	127.6 Å²	127.6	80%	0.797	77%	0.772	S	S	*	*			trans	-98.1	-153.3	-174.4	-30.1	0	0	0	0	112.2
565	P	39.7	Very low	30.3	Very low	122 Å²	122	121.9 Å²	121.9	79%	0.792	77%	0.769	S	S	*	*			cis	-135.3	-122.3	7.7	33.1	-3.8	0	0	0	115.8
566	P	45.9	Very low	30.3	Very low	110 Å²	110	123 Å²	123	71%	0.714	77%	0.765	S	S	*	*			trans	-133.2	-166.4	-132.1	42.5	-19.4	0	0	0	116.1
567	S	27.2	Very low	30.3	Very low	126 Å²	126	121.6 Å²	121.6	88%	0.881	76%	0.761	S	S	*	*			trans	-170.3	167.7	147.9	-87.3	0	0	0	0	115.3
568	T	25.1	Very low	29.6	Very low	119 Å²	119	121 Å²	121	73%	0.73	77%	0.765	S	S	*	*			trans	-119.2	169.8	-157.8	-0.8	0	0	0	0	115.6
569	Q	25.8	Very low	29.7	Very low	158 Å²	158	120.8 Å²	120.8	74%	0.738	77%	0.769	S	S	*	*			trans	75.4	125.2	147.6	-77.5	165.3	-50.2	0	0	122.6
570	E	22	Very low	29.6	Very low	172 Å²	172	118.7 Å²	118.7	80%	0.804	77%	0.765	S	S	*	*				33.6	161.8	122	-64.8	-171.2	143	0	0	123
571	P	32.2	Very low	28.8	Very low	117 Å²	117	119.2 Å²	119.2	76%	0.76	77%	0.771	S	S	*	*			cis	-133	-171	-6.6	26.4	-1.2	0	0	0	115.6
572	S	26.4	Very low	29.5	Very low	101 Å²	101	119.2 Å²	119.2	71%	0.706	77%	0.769	S	S	*	*			trans	-57.7	171.2	163.1	63.1	0	0	0	0	114.4
573	P	40.5	Very low	29.4	Very low	107 Å²	107	121.4 Å²	121.4	70%	0.695	77%	0.772	S	S	*	*			cis	-160	-159.5	43.3	44.4	-19.5	0	0	0	119.5
574	T	24.7	Very low	29.3	Very low	134 Å²	134	123.6 Å²	123.6	82%	0.822	77%	0.771	S	S	*	*			trans	79.7	111.1	150.9	42.6	0	0	0	0	123.6
575	G	25.9	Very low	29.2	Very low	75 Å²	75	129 Å²	129	77%	0.773	78%	0.775	S	S	*	*				93.1	159.5	125.3	0	0	0	0	0	120
576	D	25.8	Very low	28.6	Very low	140 Å²	140	132 Å²	132	75%	0.749	78%	0.778	S	S	*	*			cis	-167.2	162.6	-23.9	-152.8	-12.1	0	0	0	111
577	M	28.7	Very low	27.7	Very low	156 Å²	156	134.1 Å²	134.1	77%	0.768	79%	0.788	S	S	*	*			trans	63.2	126.1	164.6	-54.7	-169.4	-165.5	0	0	118.2
578	A	27.5	Very low	27.6	Very low	93 Å²	93	131.1 Å²	131.1	77%	0.769	78%	0.778	S	S	*	*				71.2	146.8	68.4	0	0	0	0	0	113.1
579	V	28	Very low	27.7	Very low	150 Å²	150	131.5 Å²	131.5	91%	0.909	79%	0.785	S	S	*	*			cis	-154.7	156.3	38.2	172.1	0	0	0	0	108.3
580	G	25.9	Very low	28.2	Very low	68 Å²	68	129.4 Å²	129.4	70%	0.701	79%	0.785	S	S	*	*			cis	170.9	-172.4	-2.1	0	0	0	0	0	113.4
581	S	24.4	Very low	28.5	Very low	122 Å²	122	131 Å²	131	85%	0.853	79%	0.789	S	S	*	*			trans	-101.2	-146.5	-174.6	-42.5	0	0	0	0	110.5
582	P	44.7	Very low	28.2	Very low	106 Å²	106	133 Å²	133	69%	0.688	79%	0.794	S	S	*	*			cis	-137.2	-172	-14.6	42.3	-25	0	0	0	114.5
583	L	23.6	Very low	28.9	Very low	146 Å²	146	134.1 Å²	134.1	76%	0.764	80%	0.798	S	S	*	*				-167.4	111.4	118.7	-127.7	107.3	0	0	0	115.4
584	M	26	Very low	28.8	Very low	159 Å²	159	132.3 Å²	132.3	78%	0.783	80%	0.8	S	S	*	*			trans	58.7	160	150.5	-57.5	-167.7	-177.8	0	0	120
585	R	24.2	Very low	28.9	Very low	229 Å²	229	135.8 Å²	135.8	86%	0.864	80%	0.803	S	S	*	*			cis	-150.6	151.7	8.6	-155.7	171.6	178	148.5	-2.2	111.8
586	E	26.8	Very low	29.2	Very low	183 Å²	183	137.8 Å²	137.8	86%	0.855	81%	0.805	S	S	*	*			trans	-94	154.3	169.9	-64.2	-177.2	112.6	0	0	113.7
587	V	26.3	Very low	29.6	Very low	155 Å²	155	138.6 Å²	138.6	94%	0.939	81%	0.809	S	S	*	*			trans	-171.6	151.8	133.8	160.8	0	0	0	0	106.2
588	G	24.9	Very low	30	Very low	64 Å²	64	136.2 Å²	136.2	66%	0.66	81%	0.805	S	S	*	*			trans	-169.2	-169.9	178.7	0	0	0	0	0	119
589	S	27.2	Very low	30.5	Very low	127 Å²	127	137.5 Å²	137.5	89%	0.888	81%	0.806	S	S	*	*			trans	69.5	158.2	178.1	-65.6	0	0	0	0	117.7
590	P	35.8	Very low	31	Very low	114 Å²	114	136 Å²	136	74%	0.74	80%	0.797	S	S	*	*			cis	-128.9	169.9	2.1	41.6	-26.6	0	0	0	116.9
591	K	29.8	Very low	31.4	Very low	205 Å²	205	137.4 Å²	137.4	89%	0.891	79%	0.793	S	S	*	*			trans	31.2	129.6	153.9	-73.4	-173.7	174.3	-177.1	0	121.6
592	D	26.1	Very low	32.3	Very low	160 Å²	160	137.8 Å²	137.8	86%	0.856	79%	0.793	S	S	*	*			trans	-149.2	126.6	143.3	-152	-1.2	0	0	0	111.2
593	P	39.3	Very low	33	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	79%	0.787	S	S	*	*			trans	-109.7	88	-175.1	37.7	-28.1	0	0	0	113.1
594	G	38.9	Very low	35.6	Very low	70 Å²	70	132.8 Å²	132.8	72%	0.722	77%	0.767	S	S	*	*			trans	160	84	170.2	0	0	0	0	0	116.7
595	K	27.7	Very low	38.6	Very low	206 Å²	206	125.4 Å²	125.4	90%	0.896	73%	0.731	S	S	*	*			trans	-130.6	109.8	148.4	-79.8	-173.6	176	176.1	0	108.8
596	S	31.1	Very low	41.6	Very low	117 Å²	117	115.9 Å²	115.9	82%	0.818	70%	0.698	S	S	*	*	P	Polyproline II helix	trans	-56	136.2	161	47.4	0	0	0	0	108.6
597	L	35	Very low	44.5	Very low	158 Å²	158	108.7 Å²	108.7	83%	0.827	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.7	143.2	162.2	-73.6	160	0	0	0	108.4
598	P	37.4	Very low	47.4	Very low	106 Å²	106	102 Å²	102	69%	0.688	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-57.2	145.1	170.6	27.3	-34	0	0	0	108.8	V600	P598-V600 PolarHBondContact O-N 2.97Å
599	P	38.5	Very low	50.3	Low	120 Å²	120	103.6 Å²	103.6	78%	0.779	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-56.8	134.7	173.9	25.9	-33.5	0	0	0	108.8
600	V	36.9	Very low	53.2	Low	118 Å²	118	103.8 Å²	103.8	72%	0.715	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-57.1	127	171.9	-177.9	0	0	0	0	106.9	P598	P598-V600 PolarHBondContact O-N 2.97Å
601	P	34.3	Very low	55.9	Low	97 Å²	97	98.3 Å²	98.3	63%	0.63	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-58.9	148	177.9	25.6	-34.3	0	0	0	109.5	M603	P601-M603 PolarHBondContact O-N 3.14Å; P601-M603 VanDerWaalsContact O-N 3.1Å
602	P	44.6	Very low	58.7	Low	131 Å²	131	88.6 Å²	88.6	85%	0.851	53%	0.527	S	S	*	.	P	Polyproline II helix	trans	-56.6	121.8	176.7	24.7	-33.2	0	0	0	109.1	G604	P602-G604 VanDerWaalsContact C-N 3.31Å; P602-G604 PolarHBondContact O-N 3.23Å
603	M	59.4	Low	61.8	Low	114 Å²	114	87 Å²	87	56%	0.562	51%	0.509	S	S	*	.			trans	-72.6	87.8	179.4	-68.9	-82.5	-68.3	0	0	108.8	P601	P601-M603 PolarHBondContact O-N 3.14Å; P601-M603 VanDerWaalsContact O-N 3.1Å
604	G	76.8	Confident	64	Low	33 Å²	33	82.6 Å²	82.6	34%	0.34	49%	0.485	S	S	.	.	P	Polyproline II helix	trans	-58.4	157.1	174.7	0	0	0	0	0	112.7	P602 E674	P602-G604 VanDerWaalsContact C-N 3.31Å; P602-G604 PolarHBondContact O-N 3.23Å; G604-E674 WeakPolarHBondContact CA-OE1 3.4Å; G604-E674 WeakPolarHBondContact CA-OE2 3.41Å
605	L	88.7	Confident	66.4	Low	4 Å²	4	79.8 Å²	79.8	2%	0.021	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-77.1	130.9	171.7	-65.3	179.1	0	0	0	108.5	L382 L383 H386 F611 Y670 E674 W676	L382-L605 HydrophobicContact CD2-CD2 4.46Å; L382-L605 HydrophobicContact CG-CD2 3.98Å; L383-L605 HydrophobicContact CD1-CD1 3.86Å; H386-L605 HydrophobicContact CB-CD1 4.49Å; H386-L605 HydrophobicContact CB-CD2 3.82Å; H386-L605 HydrophobicContact CB-CG 4.35Å; L605-F611 HydrophobicContact CB-CE1 4.49Å; L605-F611 HydrophobicContact CB-CZ 4.33Å; L605-F611 HydrophobicContact CD2-CZ 4.06Å; L605-Y670 HydrophobicContact CB-CD2 3.89Å; L605-Y670 HydrophobicContact CB-CE2 3.66Å; L605-Y670 HydrophobicContact CD1-CD2 3.83Å; L605-Y670 HydrophobicContact CD1-CE2 4.39Å; L605-E674 PolarHBondContact N-OE1 3.36Å; L605-W676 WeakPolarHBondContact O-CH2 3.34Å; L605-W676 VanDerWaalsContact O-CZ2 3.25Å; L605-W676 WeakPolarHBondContact O-CZ2 2.86Å
606	P	89.1	Confident	69.5	Low	28 Å²	28	70.5 Å²	70.5	18%	0.182	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-50.7	154.8	-176.4	-30	33.9	0	0	0	114.5	L382 F611 Y670	L382-P606 HydrophobicContact CD2-CG 4.17Å; P606-F611 HydrophobicContact CB-CB 4.16Å; P606-F611 HydrophobicContact CB-CD2 4.02Å; P606-F611 HydrophobicContact CB-CG 4.43Å; P606-F611 HydrophobicContact CG-CD2 3.96Å; P606-F611 HydrophobicContact CG-CE2 4.42Å; P606-F611 WeakPolarHBondContact O-CB 3.42Å; P606-Y670 PolarHBondContact O-OH 2.71Å
607	P	87.8	Confident	72.7	Confident	32 Å²	32	65 Å²	65	21%	0.208	38%	0.376	C	S	.	.	P	Polyproline II helix	trans	-58.8	150.6	-179	21.8	-33	0	0	0	112.4	Q609 E610 F611 W676	P607-Q609 PolarHBondContact O-N 2.9Å; P607-E610 HydrophobicContact CG-CB 4.26Å; P607-E610 HydrophobicContact CG-CG 4.1Å; P607-E610 PolarHBondContact O-N 2.7Å; P607-F611 WeakPolarHBondContact O-CB 3.49Å; P607-F611 PolarHBondContact O-N 3.48Å; P607-W676 HydrophobicContact CB-CD2 4.21Å; P607-W676 HydrophobicContact CB-CE3 3.71Å; P607-W676 HydrophobicContact CB-CH2 4.1Å; P607-W676 HydrophobicContact CB-CZ3 3.66Å; P607-W676 HydrophobicContact CG-CZ3 4.21Å
608	P	86.4	Confident	75.6	Confident	16 Å²	16	57.6 Å²	57.6	10%	0.104	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-26	-173.4	-29.2	35	0	0	0	115.8	P616 Y670 L671	P608-P616 HydrophobicContact CB-CG 4.28Å; P608-P616 WeakPolarHBondContact O-CD 3.35Å; P608-Y670 WeakPolarHBondContact CA-OH 3.13Å; P608-Y670 WeakPolarHBondContact CD-OH 3.33Å; P608-Y670 HydrophobicContact CG-CE1 4.06Å; P608-Y670 VanDerWaalsContact N-OH 3.17Å; P608-L671 HydrophobicContact CG-CD2 3.97Å
609	Q	86.4	Confident	78.5	Confident	96 Å²	96	52.6 Å²	52.6	45%	0.449	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-31.7	178.9	-60.7	79.4	-0.4	0	0	112.4	P607 G614	P607-Q609 PolarHBondContact O-N 2.9Å; Q609-G614 VanDerWaalsContact O-CA 3.26Å; Q609-G614 WeakPolarHBondContact O-CA 3.4Å; Q609-G614 PolarHBondContact O-N 2.81Å; Q609-G614 VanDerWaalsContact O-N 3.14Å
610	E	88.3	Confident	81.3	Confident	131 Å²	131	47.1 Å²	47.1	61%	0.612	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.6	-35.4	179.7	-62.8	-175.8	-176.5	0	0	111.6	H379 P607 G612 R613	H379-E610 PolarHBondContact CE1-O 2.95Å; P607-E610 HydrophobicContact CG-CB 4.26Å; P607-E610 HydrophobicContact CG-CG 4.1Å; P607-E610 PolarHBondContact O-N 2.7Å; E610-G612 PolarHBondContact O-N 3.25Å; E610-R613 VanDerWaalsContact O-CA 3.29Å; E610-R613 WeakPolarHBondContact O-CA 3.42Å; E610-R613 PolarHBondContact O-N 3.32Å
611	F	91.8	Very high	84.2	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-65.7	134.5	-176.1	-159	-137.8	0	0	0	111.6	H379 L383 L605 P606 P607 R613 G614 N615 P616 L619 F620 Y670	H379-F611 HydrophobicContact CB-CD2 3.78Å; H379-F611 HydrophobicContact CB-CE2 3.66Å; H379-F611 AromaticContact CG-CD2 3.75Å; H379-F611 AromaticContact ND1-CD2 3.94Å; L383-F611 HydrophobicContact CB-CZ 3.9Å; L383-F611 HydrophobicContact CD1-CE1 4.32Å; L383-F611 HydrophobicContact CD1-CZ 4.19Å; L383-F611 HydrophobicContact CD2-CE1 4.43Å; L383-F611 HydrophobicContact CD2-CZ 4.37Å; L383-F611 HydrophobicContact CG-CZ 4.36Å; L605-F611 HydrophobicContact CB-CE1 4.49Å; L605-F611 HydrophobicContact CB-CZ 4.33Å; L605-F611 HydrophobicContact CD2-CZ 4.06Å; P606-F611 HydrophobicContact CB-CB 4.16Å; P606-F611 HydrophobicContact CB-CD2 4.02Å; P606-F611 HydrophobicContact CB-CG 4.43Å; P606-F611 HydrophobicContact CG-CD2 3.96Å; P606-F611 HydrophobicContact CG-CE2 4.42Å; P606-F611 WeakPolarHBondContact O-CB 3.42Å; P607-F611 WeakPolarHBondContact O-CB 3.49Å; P607-F611 PolarHBondContact O-N 3.48Å; F611-R613 PolarHBondContact O-N 2.93Å; F611-G614 PolarHBondContact O-N 3.07Å; F611-N615 PolarHBondContact O-N 2.97Å; F611-P616 HydrophobicContact CB-CB 4.18Å; F611-P616 HydrophobicContact CD1-CB 3.73Å; F611-P616 HydrophobicContact CG-CB 4.36Å; F611-L619 HydrophobicContact CD1-CD1 4.44Å; F611-L619 HydrophobicContact CD2-CD1 4.22Å; F611-L619 HydrophobicContact CE1-CD1 4.31Å; F611-L619 HydrophobicContact CE2-CD1 4.08Å; F611-L619 HydrophobicContact CG-CD1 4.4Å; F611-L619 HydrophobicContact CZ-CD1 4.14Å; F611-F620 HydrophobicContact CD1-CE2 4.32Å; F611-F620 AromaticContact CE1-CE2 3.85Å; F611-F620 HydrophobicContact CE1-CE2 3.85Å; F611-F620 HydrophobicContact CE1-CZ 4.2Å; F611-Y670 HydrophobicContact CD1-CE1 4.41Å; F611-Y670 HydrophobicContact CD1-CE2 4.23Å; F611-Y670 AromaticContact CD1-CZ 3.85Å; F611-Y670 HydrophobicContact CE1-CE2 4.41Å
612	G	88.7	Confident	87.3	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	G	3₁₀ helix	trans	58.2	9.2	-166.9	0	0	0	0	0	116.4	K376 H379 E610	K376-G612 VanDerWaalsContact CE-O 3.29Å; K376-G612 WeakPolarHBondContact CE-O 3.42Å; H379-G612 PolarHBondContact ND1-N 2.93Å; E610-G612 PolarHBondContact O-N 3.25Å
613	R	90.9	Very high	89.9	Confident	127 Å²	127	30.7 Å²	30.7	48%	0.479	16%	0.164	S	C	.	.	G	3₁₀ helix	trans	61.5	56.1	-162.8	-58.1	-173.6	66.1	-114.2	-4.5	112.7	T375 E610 F611 N615	T375-R613 HydrophobicContact CG2-CG 3.83Å; E610-R613 VanDerWaalsContact O-CA 3.29Å; E610-R613 WeakPolarHBondContact O-CA 3.42Å; E610-R613 PolarHBondContact O-N 3.32Å; F611-R613 PolarHBondContact O-N 2.93Å; R613-N615 VanDerWaalsContact C-N 3.26Å; R613-N615 PolarHBondContact O-N 3.48Å
614	G	86	Confident	91.7	Very high	30 Å²	30	25.2 Å²	25.2	31%	0.309	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.2	10.3	179.8	0	0	0	0	0	114.4	L434 Q609 F611	L434-G614 VanDerWaalsContact CD2-O 3.29Å; L434-G614 WeakPolarHBondContact CD2-O 3.45Å; Q609-G614 VanDerWaalsContact O-CA 3.26Å; Q609-G614 WeakPolarHBondContact O-CA 3.4Å; Q609-G614 PolarHBondContact O-N 2.81Å; Q609-G614 VanDerWaalsContact O-N 3.14Å; F611-G614 PolarHBondContact O-N 3.07Å
615	N	89.1	Confident	92.8	Very high	12 Å²	12	23.7 Å²	23.7	6%	0.064	12%	0.121	C	C	.	.			trans	-131.6	71.2	170.9	-170.5	-9.5	0	0	0	109.9	L434 F611 R613 M618	L434-N615 HydrophobicContact CD2-CB 3.83Å; F611-N615 PolarHBondContact O-N 2.97Å; R613-N615 VanDerWaalsContact C-N 3.26Å; R613-N615 PolarHBondContact O-N 3.48Å; N615-M618 HydrophobicContact CB-CB 4.43Å; N615-M618 WeakPolarHBondContact OD1-CB 3.37Å; N615-M618 PolarHBondContact OD1-N 2.98Å
616	P	93.4	Very high	93.2	Very high	11 Å²	11	23.5 Å²	23.5	7%	0.071	12%	0.12	C	C	.	.	H	α-helix	trans	-66.1	-39.9	-179.8	25.7	-34.4	0	0	0	111.9	P608 F611 M618 L619 F620 F667 Y670	P608-P616 HydrophobicContact CB-CG 4.28Å; P608-P616 WeakPolarHBondContact O-CD 3.35Å; F611-P616 HydrophobicContact CB-CB 4.18Å; F611-P616 HydrophobicContact CD1-CB 3.73Å; F611-P616 HydrophobicContact CG-CB 4.36Å; P616-M618 PolarHBondContact O-N 3.48Å; P616-M618 VanDerWaalsContact O-N 3.17Å; P616-L619 WeakPolarHBondContact O-CA 3.4Å; P616-L619 WeakPolarHBondContact O-CB 3.35Å; P616-L619 PolarHBondContact O-N 3.4Å; P616-F620 HydrophobicContact CB-CE2 4.49Å; P616-F620 VanDerWaalsContact O-CD2 3.31Å; P616-F620 WeakPolarHBondContact O-CD2 3.4Å; P616-F620 PolarHBondContact O-N 2.65Å; P616-F667 HydrophobicContact CB-CE2 3.9Å; P616-F667 HydrophobicContact CG-CE2 3.65Å; P616-F667 HydrophobicContact CG-CZ 4.01Å; P616-Y670 HydrophobicContact CB-CE1 4.31Å
617	F	96.3	Very high	93.6	Very high	1 Å²	1	23.3 Å²	23.3	0%	0.004	12%	0.118	C	C	.	.	H	α-helix	trans	-58.1	-33.3	-177.2	-174.5	-108.1	0	0	0	112.8	Y225 V429 S433 L619 F620 L621 L660 A663 R664 F667	Y225-F617 HydrophobicContact CE2-CD1 4.18Å; Y225-F617 HydrophobicContact CE2-CD2 4.01Å; Y225-F617 AromaticContact CE2-CE1 3.94Å; Y225-F617 HydrophobicContact CE2-CE1 3.94Å; Y225-F617 AromaticContact CE2-CE2 3.76Å; Y225-F617 HydrophobicContact CE2-CE2 3.76Å; Y225-F617 HydrophobicContact CE2-CG 4.22Å; Y225-F617 AromaticContact CE2-CZ 3.73Å; Y225-F617 HydrophobicContact CE2-CZ 3.73Å; Y225-F617 AromaticContact CZ-CE2 3.96Å; Y225-F617 VanDerWaalsContact OH-CE2 3.28Å; Y225-F617 WeakPolarHBondContact OH-CE2 3.34Å; V429-F617 HydrophobicContact CG1-CE1 3.85Å; V429-F617 HydrophobicContact CG1-CZ 4.18Å; S433-F617 VanDerWaalsContact OG-CD1 3.29Å; S433-F617 WeakPolarHBondContact OG-CD1 3.42Å; F617-L619 VanDerWaalsContact C-N 3.25Å; F617-L619 PolarHBondContact O-N 3.38Å; F617-F620 PolarHBondContact O-N 2.97Å; F617-F620 VanDerWaalsContact O-N 3.11Å; F617-L621 HydrophobicContact CD1-CD1 3.91Å; F617-L621 HydrophobicContact CD1-CG 4.09Å; F617-L621 HydrophobicContact CE1-CD1 3.7Å; F617-L621 HydrophobicContact CE1-CD2 3.79Å; F617-L621 HydrophobicContact CE1-CG 3.73Å; F617-L621 HydrophobicContact CZ-CD2 3.82Å; F617-L621 HydrophobicContact CZ-CG 4.09Å; F617-L621 WeakPolarHBondContact O-CG 3.36Å; F617-L621 PolarHBondContact O-N 3.46Å; F617-L660 HydrophobicContact CZ-CD2 4.43Å; F617-A663 HydrophobicContact CE2-CB 3.94Å; F617-A663 HydrophobicContact CZ-CB 4.1Å; F617-R664 HydrophobicContact CE2-CG 4.16Å; F617-R664 HydrophobicContact CZ-CG 4.24Å; F617-F667 HydrophobicContact CB-CD1 4.44Å; F617-F667 HydrophobicContact CB-CE1 4.32Å; F617-F667 HydrophobicContact CB-CZ 4.4Å; F617-F667 HydrophobicContact CD2-CB 3.96Å; F617-F667 AromaticContact CD2-CD1 3.68Å; F617-F667 HydrophobicContact CD2-CD1 3.68Å; F617-F667 HydrophobicContact CD2-CE1 4.3Å; F617-F667 AromaticContact CD2-CG 3.84Å; F617-F667 HydrophobicContact CD2-CG 3.84Å; F617-F667 HydrophobicContact CE2-CB 4.41Å; F617-F667 HydrophobicContact CE2-CD1 4.46Å; F617-F667 HydrophobicContact CG-CD1 4.45Å
618	M	96.6	Very high	94.1	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.01	12%	0.118	C	C	.	.	H	α-helix	trans	-56.7	-35.9	171.7	-173.3	67.4	-137.5	0	0	113.3	W409 E413 L414 T430 N615 P616 C622	W409-M618 WeakPolarHBondContact O-CE 3.44Å; E413-M618 HydrophobicContact CB-SD 4.14Å; E413-M618 HydrophobicContact CG-SD 4.21Å; L414-M618 HydrophobicContact CB-CE 4.05Å; L414-M618 HydrophobicContact CD1-CE 3.63Å; L414-M618 HydrophobicContact CG-CE 3.54Å; T430-M618 HydrophobicContact CG2-SD 4Å; N615-M618 HydrophobicContact CB-CB 4.43Å; N615-M618 WeakPolarHBondContact OD1-CB 3.37Å; N615-M618 PolarHBondContact OD1-N 2.98Å; P616-M618 PolarHBondContact O-N 3.48Å; P616-M618 VanDerWaalsContact O-N 3.17Å; M618-C622 PolarHBondContact O-N 3.24Å; M618-C622 PolarHBondContact O-SG 3.5Å
619	L	97.9	Very high	94.6	Very high	1 Å²	1	24.4 Å²	24.4	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-73.3	-38.2	175.7	-52.8	-175.1	0	0	0	111.4	H379 L380 L383 L410 F611 P616 F617 L621 C622 L623	H379-L619 HydrophobicContact CB-CD1 3.49Å; H379-L619 VanDerWaalsContact CB-CD1 3.49Å; L380-L619 HydrophobicContact CB-CD2 4.38Å; L380-L619 HydrophobicContact CD1-CB 4.39Å; L383-L619 HydrophobicContact CD2-CB 3.6Å; L410-L619 HydrophobicContact CD2-CD2 3.82Å; F611-L619 HydrophobicContact CD1-CD1 4.44Å; F611-L619 HydrophobicContact CD2-CD1 4.22Å; F611-L619 HydrophobicContact CE1-CD1 4.31Å; F611-L619 HydrophobicContact CE2-CD1 4.08Å; F611-L619 HydrophobicContact CG-CD1 4.4Å; F611-L619 HydrophobicContact CZ-CD1 4.14Å; P616-L619 WeakPolarHBondContact O-CA 3.4Å; P616-L619 WeakPolarHBondContact O-CB 3.35Å; P616-L619 PolarHBondContact O-N 3.4Å; F617-L619 VanDerWaalsContact C-N 3.25Å; F617-L619 PolarHBondContact O-N 3.38Å; L619-L621 VanDerWaalsContact C-N 3.29Å; L619-L621 PolarHBondContact O-N 3.46Å; L619-C622 WeakPolarHBondContact O-CB 3.27Å; L619-C622 PolarHBondContact O-N 3.46Å; L619-L623 PolarHBondContact O-N 2.99Å
620	F	98.2	Very high	95.1	Very high	5 Å²	5	22.2 Å²	22.2	2%	0.022	11%	0.106	C	C	.	.	H	α-helix	trans	-65.5	-29.8	174.9	-73.8	-82.4	0	0	0	113	L383 F611 P616 F617 L623 A624 A663 L666 F667 Y670	L383-F620 HydrophobicContact CD1-CD1 4.21Å; L383-F620 HydrophobicContact CD1-CE1 3.56Å; L383-F620 HydrophobicContact CD1-CE2 4.39Å; L383-F620 HydrophobicContact CD1-CZ 3.64Å; L383-F620 HydrophobicContact CD2-CD1 4.19Å; L383-F620 HydrophobicContact CD2-CD2 4.34Å; L383-F620 HydrophobicContact CD2-CE1 4.28Å; L383-F620 HydrophobicContact CD2-CE2 4.38Å; L383-F620 HydrophobicContact CD2-CG 4.23Å; L383-F620 HydrophobicContact CD2-CZ 4.35Å; F611-F620 HydrophobicContact CD1-CE2 4.32Å; F611-F620 AromaticContact CE1-CE2 3.85Å; F611-F620 HydrophobicContact CE1-CE2 3.85Å; F611-F620 HydrophobicContact CE1-CZ 4.2Å; P616-F620 HydrophobicContact CB-CE2 4.49Å; P616-F620 VanDerWaalsContact O-CD2 3.31Å; P616-F620 WeakPolarHBondContact O-CD2 3.4Å; P616-F620 PolarHBondContact O-N 2.65Å; F617-F620 PolarHBondContact O-N 2.97Å; F617-F620 VanDerWaalsContact O-N 3.11Å; F620-L623 HydrophobicContact CD1-CD2 4.47Å; F620-A624 VanDerWaalsContact O-CB 3.23Å; F620-A624 WeakPolarHBondContact O-CB 3.32Å; F620-A624 PolarHBondContact O-N 2.99Å; F620-A663 HydrophobicContact CB-CB 4.42Å; F620-L666 HydrophobicContact CD1-CB 3.6Å; F620-L666 HydrophobicContact CE1-CB 4.03Å; F620-L666 VanDerWaalsContact CE1-O 3.29Å; F620-L666 WeakPolarHBondContact CE1-O 3.26Å; F620-F667 HydrophobicContact CB-CB 4.26Å; F620-F667 HydrophobicContact CD1-CB 4.3Å; F620-F667 HydrophobicContact CD2-CB 4.06Å; F620-F667 AromaticContact CD2-CD2 3.51Å; F620-F667 HydrophobicContact CD2-CD2 3.51Å; F620-F667 HydrophobicContact CD2-CE2 4.38Å; F620-F667 HydrophobicContact CD2-CG 4.18Å; F620-F667 AromaticContact CE2-CD2 3.61Å; F620-F667 HydrophobicContact CE2-CD2 3.61Å; F620-F667 HydrophobicContact CE2-CE2 4.36Å; F620-F667 HydrophobicContact CG-CB 3.94Å; F620-F667 HydrophobicContact CG-CD2 4.27Å; F620-F667 HydrophobicContact CZ-CD2 4.39Å; F620-Y670 AromaticContact CE2-CD1 3.75Å; F620-Y670 HydrophobicContact CE2-CD1 3.75Å; F620-Y670 HydrophobicContact CE2-CE1 4.19Å; F620-Y670 HydrophobicContact CE2-CG 4.02Å; F620-Y670 VanDerWaalsContact CZ-CB 3.49Å; F620-Y670 AromaticContact CZ-CD1 3.8Å; F620-Y670 HydrophobicContact CZ-CD1 3.8Å; F620-Y670 HydrophobicContact CZ-CD2 4.22Å; F620-Y670 AromaticContact CZ-CG 3.57Å; F620-Y670 HydrophobicContact CZ-CG 3.57Å
621	L	98.4	Very high	95.5	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.5	-45.2	169.9	-68.8	170.4	0	0	0	112.1	L414 M426 T430 F617 L619 A624 I625 V659 L660 A663	L414-L621 HydrophobicContact CD1-CB 3.52Å; L414-L621 HydrophobicContact CD1-CD1 4.41Å; M426-L621 HydrophobicContact CE-CD2 3.68Å; M426-L621 HydrophobicContact SD-CD1 3.6Å; M426-L621 VanDerWaalsContact SD-CD1 3.6Å; M426-L621 HydrophobicContact SD-CD2 3.64Å; M426-L621 HydrophobicContact SD-CG 4.26Å; T430-L621 HydrophobicContact CG2-CD1 4.35Å; T430-L621 VanDerWaalsContact OG1-CD1 3.28Å; T430-L621 WeakPolarHBondContact OG1-CD1 3.5Å; F617-L621 HydrophobicContact CD1-CD1 3.91Å; F617-L621 HydrophobicContact CD1-CG 4.09Å; F617-L621 HydrophobicContact CE1-CD1 3.7Å; F617-L621 HydrophobicContact CE1-CD2 3.79Å; F617-L621 HydrophobicContact CE1-CG 3.73Å; F617-L621 HydrophobicContact CZ-CD2 3.82Å; F617-L621 HydrophobicContact CZ-CG 4.09Å; F617-L621 WeakPolarHBondContact O-CG 3.36Å; F617-L621 PolarHBondContact O-N 3.46Å; L619-L621 VanDerWaalsContact C-N 3.29Å; L619-L621 PolarHBondContact O-N 3.46Å; L621-A624 PolarHBondContact O-N 2.95Å; L621-I625 PolarHBondContact O-N 3.01Å; L621-V659 HydrophobicContact CD2-CG1 4.17Å; L621-L660 HydrophobicContact CD2-CD2 3.97Å; L621-A663 HydrophobicContact CD2-CB 3.65Å; L621-A663 HydrophobicContact CG-CB 4.23Å
622	C	98.6	Very high	95.8	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.3	-47.1	173.5	-67.4	0	0	0	0	111.3	L380 W409 M618 L619 A624 I625 L626	L380-C622 HydrophobicContact CD1-CB 3.75Å; L380-C622 HydrophobicContact CD2-CB 4.08Å; W409-C622 HydrophobicContact CE3-CB 4.14Å; M618-C622 PolarHBondContact O-N 3.24Å; M618-C622 PolarHBondContact O-SG 3.5Å; L619-C622 WeakPolarHBondContact O-CB 3.27Å; L619-C622 PolarHBondContact O-N 3.46Å; C622-A624 VanDerWaalsContact C-N 3.34Å; C622-A624 PolarHBondContact O-N 3.23Å; C622-I625 PolarHBondContact O-N 2.83Å; C622-L626 WeakPolarHBondContact O-CG 3.47Å; C622-L626 PolarHBondContact O-N 3.43Å
623	L	98.6	Very high	96.2	Very high	1 Å²	1	23.7 Å²	23.7	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-57.9	-44.7	175.2	179.1	66.6	0	0	0	111.6	L383 L384 A387 L619 F620 I625 L626 L627 L666	L383-L623 HydrophobicContact CD1-CD2 4.01Å; L383-L623 HydrophobicContact CD2-CB 4.09Å; L383-L623 HydrophobicContact CD2-CD2 4.22Å; L383-L623 HydrophobicContact CG-CB 4.39Å; L383-L623 HydrophobicContact CG-CD2 3.83Å; L384-L623 HydrophobicContact CB-CD1 4.37Å; L384-L623 HydrophobicContact CD1-CD1 3.56Å; A387-L623 HydrophobicContact CB-CD1 4.18Å; A387-L623 HydrophobicContact CB-CD2 3.58Å; A387-L623 HydrophobicContact CB-CG 4.49Å; L619-L623 PolarHBondContact O-N 2.99Å; F620-L623 HydrophobicContact CD1-CD2 4.47Å; L623-I625 VanDerWaalsContact C-N 3.26Å; L623-I625 PolarHBondContact O-N 3.34Å; L623-L626 PolarHBondContact O-N 3.37Å; L623-L627 HydrophobicContact CD1-CD1 3.81Å; L623-L627 HydrophobicContact CD1-CD2 4.32Å; L623-L627 HydrophobicContact CD1-CG 3.82Å; L623-L627 HydrophobicContact CD2-CD1 4.2Å; L623-L627 HydrophobicContact CG-CD1 3.77Å; L623-L627 HydrophobicContact CG-CG 4.12Å; L623-L627 WeakPolarHBondContact O-CB 3.31Å; L623-L627 WeakPolarHBondContact O-CG 3.47Å; L623-L627 PolarHBondContact O-N 3.14Å; L623-L666 HydrophobicContact CD2-CD1 3.84Å; L623-L666 HydrophobicContact CG-CD1 4.22Å
624	A	98.5	Very high	96.6	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-60.5	-35.2	-179.9	0	0	0	0	0	113	F620 L621 C622 E628 V659 R662 A663	F620-A624 VanDerWaalsContact O-CB 3.23Å; F620-A624 WeakPolarHBondContact O-CB 3.32Å; F620-A624 PolarHBondContact O-N 2.99Å; L621-A624 PolarHBondContact O-N 2.95Å; C622-A624 VanDerWaalsContact C-N 3.34Å; C622-A624 PolarHBondContact O-N 3.23Å; A624-E628 PolarHBondContact O-N 2.82Å; A624-E628 VanDerWaalsContact O-N 3.16Å; A624-V659 HydrophobicContact CB-CG1 4.11Å; A624-R662 HydrophobicContact CB-CB 3.99Å; A624-R662 HydrophobicContact CB-CG 3.79Å; A624-A663 HydrophobicContact CB-CB 3.86Å
625	I	98.4	Very high	97.1	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-71.3	-47	173.1	-69.7	163	0	0	0	111.1	W409 L414 F418 L621 C622 L623 L627 E628 H629 F647 H654 V659	W409-I625 HydrophobicContact CH2-CB 4.3Å; W409-I625 HydrophobicContact CH2-CG2 3.46Å; W409-I625 VanDerWaalsContact CH2-CG2 3.46Å; W409-I625 HydrophobicContact CZ2-CG2 4Å; W409-I625 HydrophobicContact CZ3-CB 4.24Å; W409-I625 HydrophobicContact CZ3-CG2 3.9Å; L414-I625 HydrophobicContact CD1-CD1 3.91Å; L414-I625 HydrophobicContact CD2-CD1 3.5Å; L414-I625 VanDerWaalsContact CD2-CD1 3.5Å; L414-I625 HydrophobicContact CG-CD1 4.37Å; F418-I625 HydrophobicContact CZ-CD1 4.31Å; L621-I625 PolarHBondContact O-N 3.01Å; C622-I625 PolarHBondContact O-N 2.83Å; L623-I625 VanDerWaalsContact C-N 3.26Å; L623-I625 PolarHBondContact O-N 3.34Å; I625-L627 VanDerWaalsContact C-N 3.31Å; I625-L627 PolarHBondContact O-N 2.87Å; I625-E628 WeakPolarHBondContact O-CB 3.27Å; I625-E628 PolarHBondContact O-N 3.43Å; I625-H629 PolarHBondContact O-CD2 3.04Å; I625-H629 PolarHBondContact O-N 2.83Å; I625-F647 HydrophobicContact CG2-CD1 4.44Å; I625-F647 HydrophobicContact CG2-CE1 4Å; I625-H654 VanDerWaalsContact CG2-CE1 3.41Å; I625-H654 WeakPolarHBondContact CG2-CE1 3.42Å; I625-V659 HydrophobicContact CD1-CG1 4.18Å; I625-V659 HydrophobicContact CG1-CB 4.45Å; I625-V659 HydrophobicContact CG1-CG1 3.78Å; I625-V659 HydrophobicContact CG1-CG2 3.75Å
626	L	98.3	Very high	97.5	Very high	0 Å²	0	32 Å²	32	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-55.2	-48.4	176.7	-68.7	170.7	0	0	0	110.9	L384 F391 F405 W409 C622 L623 E628 H629 R630 F647	L384-L626 HydrophobicContact CD2-CD1 4.23Å; F391-L626 HydrophobicContact CE1-CB 4.2Å; F405-L626 HydrophobicContact CE2-CD2 3.79Å; F405-L626 HydrophobicContact CZ-CD2 4.44Å; W409-L626 HydrophobicContact CH2-CD2 4.17Å; W409-L626 HydrophobicContact CZ3-CD2 4.03Å; W409-L626 HydrophobicContact CZ3-CG 4.09Å; C622-L626 WeakPolarHBondContact O-CG 3.47Å; C622-L626 PolarHBondContact O-N 3.43Å; L623-L626 PolarHBondContact O-N 3.37Å; L626-E628 VanDerWaalsContact C-N 3.25Å; L626-E628 PolarHBondContact O-N 3.36Å; L626-H629 PolarHBondContact O-N 2.96Å; L626-H629 VanDerWaalsContact O-N 3.09Å; L626-R630 PolarHBondContact O-N 3.1Å; L626-F647 HydrophobicContact CD2-CE2 4.26Å; L626-F647 HydrophobicContact CD2-CZ 4.03Å
627	L	97.7	Very high	97.7	Very high	24 Å²	24	33.7 Å²	33.7	13%	0.126	17%	0.166	C	C	.	.	H	α-helix	trans	-71.6	-11.5	177.1	-61.1	-178.7	0	0	0	114	L384 D388 F391 L623 I625 H629 R662 L666	L384-L627 HydrophobicContact CD1-CD2 4.48Å; D388-L627 HydrophobicContact CB-CD2 3.87Å; D388-L627 VanDerWaalsContact OD2-CD2 3.3Å; D388-L627 WeakPolarHBondContact OD2-CD2 3.43Å; F391-L627 HydrophobicContact CD1-CD2 4.12Å; L623-L627 HydrophobicContact CD1-CD1 3.81Å; L623-L627 HydrophobicContact CD1-CD2 4.32Å; L623-L627 HydrophobicContact CD1-CG 3.82Å; L623-L627 HydrophobicContact CD2-CD1 4.2Å; L623-L627 HydrophobicContact CG-CD1 3.77Å; L623-L627 HydrophobicContact CG-CG 4.12Å; L623-L627 WeakPolarHBondContact O-CB 3.31Å; L623-L627 WeakPolarHBondContact O-CG 3.47Å; L623-L627 PolarHBondContact O-N 3.14Å; I625-L627 VanDerWaalsContact C-N 3.31Å; I625-L627 PolarHBondContact O-N 2.87Å; L627-H629 VanDerWaalsContact C-N 3.31Å; L627-R662 PolarHBondContact O-NH1 3.29Å; L627-L666 HydrophobicContact CD1-CD1 4.15Å
628	E	96.9	Very high	97.7	Very high	45 Å²	45	34.5 Å²	34.5	21%	0.21	17%	0.171	C	C	.	.	H	α-helix	trans	-78.5	-20.3	170	-168.3	166	164.7	0	0	111.6	A624 I625 L626 R658	A624-E628 PolarHBondContact O-N 2.82Å; A624-E628 VanDerWaalsContact O-N 3.16Å; I625-E628 WeakPolarHBondContact O-CB 3.27Å; I625-E628 PolarHBondContact O-N 3.43Å; L626-E628 VanDerWaalsContact C-N 3.25Å; L626-E628 PolarHBondContact O-N 3.36Å; E628-R658 IonicContact OE1-CZ 2.84Å; E628-R658 IonicContact OE1-NE 3.71Å; E628-R658 PolarHBondContact OE1-NE 2.83Å; E628-R658 IonicContact OE1-NH2 3.91Å; E628-R658 PolarHBondContact OE1-NH2 2.74Å; E628-R658 IonicContact OE2-NE 3.19Å
629	H	97	Very high	97.6	Very high	26 Å²	26	37.6 Å²	37.6	12%	0.12	19%	0.187	C	C	.	.	H	α-helix	trans	-115.4	-12.9	-179	-63.3	-68.9	0	0	0	115	I625 L626 L627 D631 H632 I633 H646 F647 L650 H654	I625-H629 PolarHBondContact O-CD2 3.04Å; I625-H629 PolarHBondContact O-N 2.83Å; L626-H629 PolarHBondContact O-N 2.96Å; L626-H629 VanDerWaalsContact O-N 3.09Å; L627-H629 VanDerWaalsContact C-N 3.31Å; H629-D631 PolarHBondContact O-N 3.41Å; H629-H632 WeakPolarHBondContact O-CA 3.43Å; H629-H632 WeakPolarHBondContact O-CB 3.35Å; H629-H632 PolarHBondContact O-N 3.43Å; H629-I633 HydrophobicContact CB-CD1 3.9Å; H629-I633 HydrophobicContact CB-CG1 4.42Å; H629-I633 WeakPolarHBondContact O-CG1 3.22Å; H629-I633 PolarHBondContact O-N 2.83Å; H629-H646 AromaticContact CG-NE2 3.38Å; H629-H646 AromaticContact ND1-CE1 3.82Å; H629-H646 AromaticContact ND1-NE2 3.3Å; H629-H646 PolarHBondContact ND1-NE2 3.33Å; H629-F647 HydrophobicContact CB-CE1 4.14Å; H629-F647 HydrophobicContact CB-CZ 4.13Å; H629-F647 AromaticContact CD2-CE1 3.7Å; H629-L650 VanDerWaalsContact CE1-CD1 3.47Å; H629-L650 WeakPolarHBondContact CE1-CD1 3.36Å; H629-H654 AromaticContact CD2-CE1 3.96Å; H629-H654 AromaticContact NE2-CE1 3.49Å; H629-H654 PolarHBondContact NE2-CE1 3.31Å; H629-H654 AromaticContact NE2-ND1 3.67Å
630	R	97.3	Very high	97.4	Very high	50 Å²	50	40.2 Å²	40.2	19%	0.189	20%	0.198	C	C	.	.	H	α-helix	trans	-28	-66.9	172.4	179.6	-154.4	-163.8	-89.9	-4.5	114.2	D388 D390 F391 L626 H632 I633 M634	D388-R630 VanDerWaalsContact CG-NE 3.3Å; D388-R630 IonicContact OD1-CZ 3.64Å; D388-R630 IonicContact OD1-NE 3.48Å; D388-R630 PolarHBondContact OD1-NE 3.5Å; D388-R630 IonicContact OD1-NH2 3.71Å; D388-R630 PolarHBondContact OD1-NH2 3.33Å; D388-R630 VanDerWaalsContact OD2-CD 3.23Å; D388-R630 WeakPolarHBondContact OD2-CD 3.34Å; D388-R630 IonicContact OD2-CZ 2.67Å; D388-R630 IonicContact OD2-NE 3.63Å; D388-R630 PolarHBondContact OD2-NE 3.16Å; D388-R630 IonicContact OD2-NH2 2.73Å; D390-R630 IonicContact OD2-NH2 3.11Å; F391-R630 HydrophobicContact CB-CG 4.03Å; F391-R630 HydrophobicContact CD1-CB 3.99Å; F391-R630 HydrophobicContact CD1-CG 3.8Å; F391-R630 HydrophobicContact CD2-CG 4.21Å; F391-R630 HydrophobicContact CE1-CB 4.02Å; F391-R630 HydrophobicContact CE1-CG 4.3Å; F391-R630 HydrophobicContact CG-CB 4.38Å; F391-R630 HydrophobicContact CG-CG 3.76Å; F391-R630 HydrophobicContact CZ-CB 4.45Å; L626-R630 PolarHBondContact O-N 3.1Å; R630-H632 PolarHBondContact O-N 2.86Å; R630-I633 WeakPolarHBondContact O-CB 3.49Å; R630-I633 PolarHBondContact O-N 3.16Å; R630-M634 HydrophobicContact CG-SD 3.81Å; R630-M634 PolarHBondContact O-N 3.14Å
631	D	97.7	Very high	97.2	Very high	84 Å²	84	44.4 Å²	44.4	45%	0.449	22%	0.22	S	C	.	.	H	α-helix	trans	-70.9	-21.5	-172.3	-57.7	-39.6	0	0	0	112.4	H629 R635	H629-D631 PolarHBondContact O-N 3.41Å; D631-R635 VanDerWaalsContact O-CB 3.25Å; D631-R635 WeakPolarHBondContact O-CB 3.36Å; D631-R635 VanDerWaalsContact O-CG 3.28Å; D631-R635 WeakPolarHBondContact O-CG 3.2Å; D631-R635 PolarHBondContact O-N 3.14Å; D631-R635 PolarHBondContact O-NE 3.34Å; D631-R635 PolarHBondContact O-NH2 3.27Å
632	H	97.4	Very high	97.1	Very high	79 Å²	79	48.5 Å²	48.5	37%	0.366	24%	0.239	S	C	.	.	H	α-helix	trans	-75.2	-39.3	170.5	178.4	81.4	0	0	0	111.2	H629 R630 N636 H646	H629-H632 WeakPolarHBondContact O-CA 3.43Å; H629-H632 WeakPolarHBondContact O-CB 3.35Å; H629-H632 PolarHBondContact O-N 3.43Å; R630-H632 PolarHBondContact O-N 2.86Å; H632-N636 PolarHBondContact CE1-ND2 2.93Å; H632-N636 PolarHBondContact ND1-ND2 2.8Å; H632-N636 PolarHBondContact O-N 2.87Å; H632-N636 PolarHBondContact O-ND2 2.98Å; H632-H646 AromaticContact CD2-CE1 3.52Å; H632-H646 AromaticContact CD2-ND1 3.9Å; H632-H646 AromaticContact NE2-CE1 3.89Å; H632-H646 AromaticContact NE2-ND1 3.92Å
633	I	97.8	Very high	96.9	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.3	-58.4	177.2	-68.4	159.5	0	0	0	109.8	F391 Y394 H629 R630 R635 N636 G637 L638 L643 F647	F391-I633 HydrophobicContact CE2-CB 4.31Å; F391-I633 HydrophobicContact CE2-CD1 4.22Å; F391-I633 HydrophobicContact CE2-CG2 3.92Å; F391-I633 HydrophobicContact CZ-CD1 3.76Å; Y394-I633 HydrophobicContact CD1-CG2 4.21Å; Y394-I633 HydrophobicContact CE1-CG2 3.53Å; H629-I633 HydrophobicContact CB-CD1 3.9Å; H629-I633 HydrophobicContact CB-CG1 4.42Å; H629-I633 WeakPolarHBondContact O-CG1 3.22Å; H629-I633 PolarHBondContact O-N 2.83Å; R630-I633 WeakPolarHBondContact O-CB 3.49Å; R630-I633 PolarHBondContact O-N 3.16Å; I633-R635 PolarHBondContact O-N 3.4Å; I633-N636 PolarHBondContact O-N 3.42Å; I633-G637 PolarHBondContact O-N 3.02Å; I633-L638 HydrophobicContact CG1-CD1 4.2Å; I633-L638 HydrophobicContact CG2-CB 4.45Å; I633-L638 PolarHBondContact O-N 3.12Å; I633-L643 HydrophobicContact CB-CD2 4.36Å; I633-L643 HydrophobicContact CD1-CD2 3.56Å; I633-L643 HydrophobicContact CG1-CD2 3.73Å; I633-L643 HydrophobicContact CG2-CD2 3.7Å; I633-L643 HydrophobicContact CG2-CG 4.35Å; I633-F647 HydrophobicContact CD1-CE2 4.14Å; I633-F647 HydrophobicContact CD1-CZ 3.98Å
634	M	97.7	Very high	96.6	Very high	54 Å²	54	49.9 Å²	49.9	27%	0.266	25%	0.251	S	S	.	.	H	α-helix	trans	-66.1	-36.8	-173.4	-62.7	174.8	81.8	0	0	112.9	D390 F391 Y394 R630 N636	D390-M634 HydrophobicContact CB-CE 4.37Å; F391-M634 HydrophobicContact CB-SD 3.98Å; F391-M634 HydrophobicContact CD2-CG 3.89Å; F391-M634 HydrophobicContact CD2-SD 3.85Å; F391-M634 HydrophobicContact CE2-CG 4.39Å; F391-M634 HydrophobicContact CG-SD 4.2Å; Y394-M634 HydrophobicContact CD1-CG 4.12Å; Y394-M634 HydrophobicContact CD2-CB 4.43Å; Y394-M634 HydrophobicContact CD2-CG 4.08Å; Y394-M634 HydrophobicContact CG-CE 4.37Å; Y394-M634 HydrophobicContact CG-CG 3.88Å; R630-M634 HydrophobicContact CG-SD 3.81Å; R630-M634 PolarHBondContact O-N 3.14Å; M634-N636 VanDerWaalsContact C-N 3.33Å; M634-N636 PolarHBondContact O-N 2.88Å
635	R	97.8	Very high	96.5	Very high	192 Å²	192	53.2 Å²	53.2	73%	0.725	27%	0.267	S	S	*	.	H	α-helix	trans	-71.8	-23.7	178.4	-75.7	-178.3	-67.2	158.4	0.1	114.2	D631 I633	D631-R635 VanDerWaalsContact O-CB 3.25Å; D631-R635 WeakPolarHBondContact O-CB 3.36Å; D631-R635 VanDerWaalsContact O-CG 3.28Å; D631-R635 WeakPolarHBondContact O-CG 3.2Å; D631-R635 PolarHBondContact O-N 3.14Å; D631-R635 PolarHBondContact O-NE 3.34Å; D631-R635 PolarHBondContact O-NH2 3.27Å; I633-R635 PolarHBondContact O-N 3.4Å
636	N	97.5	Very high	96.4	Very high	97 Å²	97	54.3 Å²	54.3	52%	0.519	27%	0.272	S	S	.	.	H	α-helix	trans	-99.4	-7.9	178.2	-67.1	-66	0	0	0	112.9	H632 I633 M634 L638	H632-N636 PolarHBondContact CE1-ND2 2.93Å; H632-N636 PolarHBondContact ND1-ND2 2.8Å; H632-N636 PolarHBondContact O-N 2.87Å; H632-N636 PolarHBondContact O-ND2 2.98Å; I633-N636 PolarHBondContact O-N 3.42Å; M634-N636 VanDerWaalsContact C-N 3.33Å; M634-N636 PolarHBondContact O-N 2.88Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 HydrophobicContact CB-CD2 3.71Å; N636-L638 HydrophobicContact CB-CG 4.11Å
637	G	96.4	Very high	96.3	Very high	46 Å²	46	54.4 Å²	54.4	47%	0.474	27%	0.273	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.6	32.1	179.1	0	0	0	0	0	113.5	Y394 I633 D639	Y394-G637 VanDerWaalsContact OH-CA 3.29Å; Y394-G637 WeakPolarHBondContact OH-CA 3.49Å; I633-G637 PolarHBondContact O-N 3.02Å; G637-D639 PolarHBondContact O-N 2.76Å
638	L	97.2	Very high	96.1	Very high	19 Å²	19	55.9 Å²	55.9	10%	0.099	28%	0.281	C	S	.	.			trans	-60	127.3	-175.3	-54.9	-172.4	0	0	0	112.2	Y394 I633 N636 E642 L643 H646	Y394-L638 PolarHBondContact OH-N 2.69Å; Y394-L638 PolarHBondContact OH-O 2.53Å; I633-L638 HydrophobicContact CG1-CD1 4.2Å; I633-L638 HydrophobicContact CG2-CB 4.45Å; I633-L638 PolarHBondContact O-N 3.12Å; N636-L638 VanDerWaalsContact C-N 3.34Å; N636-L638 HydrophobicContact CB-CD2 3.71Å; N636-L638 HydrophobicContact CB-CG 4.11Å; L638-E642 WeakPolarHBondContact CA-OE2 3.5Å; L638-E642 HydrophobicContact CB-CB 3.9Å; L638-E642 HydrophobicContact CD2-CB 4.15Å; L638-E642 HydrophobicContact CG-CB 4.47Å; L638-L643 HydrophobicContact CB-CG 4.39Å; L638-H646 HydrophobicContact CD1-CB 4.37Å
639	D	93.8	Very high	96.1	Very high	67 Å²	67	61 Å²	61	36%	0.358	30%	0.298	S	S	.	.			trans	-75.4	178.6	173.8	92.3	-13.2	0	0	0	112.6	G637 N641 E642 L643	G637-D639 PolarHBondContact O-N 2.76Å; D639-N641 VanDerWaalsContact C-N 3.29Å; D639-N641 PolarHBondContact O-N 3.31Å; D639-N641 VanDerWaalsContact OD1-CA 3.32Å; D639-N641 WeakPolarHBondContact OD1-CA 3.29Å; D639-N641 VanDerWaalsContact OD1-CB 3.3Å; D639-N641 WeakPolarHBondContact OD1-CB 3.15Å; D639-N641 PolarHBondContact OD1-N 2.88Å; D639-N641 PolarHBondContact OD2-ND2 3.31Å; D639-E642 PolarHBondContact N-OE2 3.43Å; D639-E642 PolarHBondContact O-N 2.75Å; D639-E642 WeakPolarHBondContact OD1-CG 3.38Å; D639-E642 PolarHBondContact OD1-N 2.87Å; D639-L643 VanDerWaalsContact O-CB 3.28Å; D639-L643 WeakPolarHBondContact O-CB 3.35Å; D639-L643 WeakPolarHBondContact O-CG 3.39Å; D639-L643 PolarHBondContact O-N 3.47Å
640	Y	94.4	Very high	96.1	Very high	56 Å²	56	61.4 Å²	61.4	22%	0.22	30%	0.301	C	S	.	.	H	α-helix	trans	-52.8	-41.4	176	179.1	-90.3	0	0	0	114.1	A400 F405 L643 A644	A400-Y640 HydrophobicContact CB-CD2 3.78Å; F405-Y640 HydrophobicContact CD1-CE2 4.18Å; Y640-L643 WeakPolarHBondContact O-CB 3.22Å; Y640-A644 WeakPolarHBondContact O-CB 3.4Å; Y640-A644 PolarHBondContact O-N 3.26Å
641	N	93.6	Very high	96	Very high	93 Å²	93	60.9 Å²	60.9	50%	0.497	30%	0.303	S	S	.	.	H	α-helix	trans	-73.9	-39.7	-177.4	-54	-75.2	0	0	0	110.8	D639 A644 M645	D639-N641 VanDerWaalsContact C-N 3.29Å; D639-N641 PolarHBondContact O-N 3.31Å; D639-N641 VanDerWaalsContact OD1-CA 3.32Å; D639-N641 WeakPolarHBondContact OD1-CA 3.29Å; D639-N641 VanDerWaalsContact OD1-CB 3.3Å; D639-N641 WeakPolarHBondContact OD1-CB 3.15Å; D639-N641 PolarHBondContact OD1-N 2.88Å; D639-N641 PolarHBondContact OD2-ND2 3.31Å; N641-A644 PolarHBondContact O-N 2.84Å; N641-M645 WeakPolarHBondContact O-CB 3.5Å; N641-M645 VanDerWaalsContact O-CG 3.29Å; N641-M645 WeakPolarHBondContact O-CG 3.22Å; N641-M645 PolarHBondContact O-N 3.47Å
642	E	96.7	Very high	95.9	Very high	86 Å²	86	61.5 Å²	61.5	40%	0.402	30%	0.299	S	S	.	.	H	α-helix	trans	-68.6	-38.2	175.6	-67	-172.6	124.7	0	0	112	L638 D639 M645 H646	L638-E642 WeakPolarHBondContact CA-OE2 3.5Å; L638-E642 HydrophobicContact CB-CB 3.9Å; L638-E642 HydrophobicContact CD2-CB 4.15Å; L638-E642 HydrophobicContact CG-CB 4.47Å; D639-E642 PolarHBondContact N-OE2 3.43Å; D639-E642 PolarHBondContact O-N 2.75Å; D639-E642 WeakPolarHBondContact OD1-CG 3.38Å; D639-E642 PolarHBondContact OD1-N 2.87Å; E642-M645 HydrophobicContact CG-CE 4.2Å; E642-M645 PolarHBondContact O-N 3.1Å; E642-H646 WeakPolarHBondContact O-CB 3.42Å; E642-H646 PolarHBondContact O-N 3.02Å
643	L	94.6	Very high	95.8	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-57.1	-53.3	168.2	-85.5	162.5	0	0	0	111.8	L395 A400 I633 L638 D639 Y640 M645 H646 F647	L395-L643 HydrophobicContact CD2-CD1 3.55Å; L395-L643 HydrophobicContact CD2-CD2 4.39Å; A400-L643 HydrophobicContact CB-CD1 3.69Å; I633-L643 HydrophobicContact CB-CD2 4.36Å; I633-L643 HydrophobicContact CD1-CD2 3.56Å; I633-L643 HydrophobicContact CG1-CD2 3.73Å; I633-L643 HydrophobicContact CG2-CD2 3.7Å; I633-L643 HydrophobicContact CG2-CG 4.35Å; L638-L643 HydrophobicContact CB-CG 4.39Å; D639-L643 VanDerWaalsContact O-CB 3.28Å; D639-L643 WeakPolarHBondContact O-CB 3.35Å; D639-L643 WeakPolarHBondContact O-CG 3.39Å; D639-L643 PolarHBondContact O-N 3.47Å; Y640-L643 WeakPolarHBondContact O-CB 3.22Å; L643-M645 PolarHBondContact O-N 3.39Å; L643-H646 WeakPolarHBondContact O-CB 3.47Å; L643-H646 PolarHBondContact O-N 3.28Å; L643-F647 HydrophobicContact CD2-CE2 4.08Å; L643-F647 VanDerWaalsContact O-CD2 3.29Å; L643-F647 WeakPolarHBondContact O-CD2 3.26Å; L643-F647 PolarHBondContact O-N 3.28Å; L643-F647 VanDerWaalsContact O-N 3.08Å
644	A	92.4	Very high	95.7	Very high	30 Å²	30	65 Å²	65	25%	0.248	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-44.9	177.9	0	0	0	0	0	111.5	F405 Y640 N641 H646 D648	F405-A644 HydrophobicContact CB-CB 4.16Å; Y640-A644 WeakPolarHBondContact O-CB 3.4Å; Y640-A644 PolarHBondContact O-N 3.26Å; N641-A644 PolarHBondContact O-N 2.84Å; A644-H646 PolarHBondContact O-N 3.02Å; A644-D648 WeakPolarHBondContact O-CB 3.45Å; A644-D648 PolarHBondContact O-N 3.27Å
645	M	95.2	Very high	95.5	Very high	69 Å²	69	67 Å²	67	34%	0.34	32%	0.322	S	S	.	.	H	α-helix	trans	-64.5	-36	175.6	-77.6	-168.2	-77.3	0	0	113.3	N641 E642 L643 R649	N641-M645 WeakPolarHBondContact O-CB 3.5Å; N641-M645 VanDerWaalsContact O-CG 3.29Å; N641-M645 WeakPolarHBondContact O-CG 3.22Å; N641-M645 PolarHBondContact O-N 3.47Å; E642-M645 HydrophobicContact CG-CE 4.2Å; E642-M645 PolarHBondContact O-N 3.1Å; L643-M645 PolarHBondContact O-N 3.39Å; M645-R649 VanDerWaalsContact O-CD 3.31Å; M645-R649 WeakPolarHBondContact O-CD 3.32Å; M645-R649 WeakPolarHBondContact O-CG 3.37Å; M645-R649 PolarHBondContact O-N 3.49Å
646	H	97.1	Very high	95.4	Very high	23 Å²	23	58.1 Å²	58.1	11%	0.106	29%	0.289	C	S	.	.	H	α-helix	trans	-63.6	-51	177.9	173.9	70.7	0	0	0	110.8	H629 H632 L638 E642 L643 A644 R649 L650	H629-H646 AromaticContact CG-NE2 3.38Å; H629-H646 AromaticContact ND1-CE1 3.82Å; H629-H646 AromaticContact ND1-NE2 3.3Å; H629-H646 PolarHBondContact ND1-NE2 3.33Å; H632-H646 AromaticContact CD2-CE1 3.52Å; H632-H646 AromaticContact CD2-ND1 3.9Å; H632-H646 AromaticContact NE2-CE1 3.89Å; H632-H646 AromaticContact NE2-ND1 3.92Å; L638-H646 HydrophobicContact CD1-CB 4.37Å; E642-H646 WeakPolarHBondContact O-CB 3.42Å; E642-H646 PolarHBondContact O-N 3.02Å; L643-H646 WeakPolarHBondContact O-CB 3.47Å; L643-H646 PolarHBondContact O-N 3.28Å; A644-H646 PolarHBondContact O-N 3.02Å; H646-R649 PolarHBondContact O-N 3.5Å; H646-L650 WeakPolarHBondContact NE2-CD1 3.39Å; H646-L650 WeakPolarHBondContact O-CG 3.35Å; H646-L650 PolarHBondContact O-N 2.74Å
647	F	96.8	Very high	95.3	Very high	2 Å²	2	54.4 Å²	54.4	1%	0.009	27%	0.273	C	S	.	.	H	α-helix	trans	-68.7	-35.1	177.3	-70.7	-63.6	0	0	0	113.1	F405 W409 I625 L626 H629 I633 L643 R649 L650 V651	F405-F647 AromaticContact CD2-CD2 3.65Å; F405-F647 HydrophobicContact CD2-CD2 3.65Å; F405-F647 AromaticContact CD2-CE2 3.94Å; F405-F647 HydrophobicContact CD2-CE2 3.94Å; F405-F647 AromaticContact CE2-CD2 3.93Å; F405-F647 HydrophobicContact CE2-CD2 3.93Å; F405-F647 AromaticContact CE2-CE2 3.7Å; F405-F647 HydrophobicContact CE2-CE2 3.7Å; W409-F647 AromaticContact CH2-CD1 3.66Å; W409-F647 HydrophobicContact CH2-CD1 3.66Å; W409-F647 HydrophobicContact CH2-CD2 4.41Å; W409-F647 AromaticContact CH2-CE1 3.71Å; W409-F647 HydrophobicContact CH2-CE1 3.71Å; W409-F647 HydrophobicContact CH2-CE2 4.46Å; W409-F647 HydrophobicContact CH2-CG 4.03Å; W409-F647 HydrophobicContact CH2-CZ 4.13Å; W409-F647 HydrophobicContact CZ2-CB 3.99Å; W409-F647 AromaticContact CZ2-CD1 3.53Å; W409-F647 HydrophobicContact CZ2-CD1 3.53Å; W409-F647 HydrophobicContact CZ2-CD2 4.45Å; W409-F647 HydrophobicContact CZ2-CE1 4.08Å; W409-F647 AromaticContact CZ2-CG 3.74Å; W409-F647 HydrophobicContact CZ2-CG 3.74Å; I625-F647 HydrophobicContact CG2-CD1 4.44Å; I625-F647 HydrophobicContact CG2-CE1 4Å; L626-F647 HydrophobicContact CD2-CE2 4.26Å; L626-F647 HydrophobicContact CD2-CZ 4.03Å; H629-F647 HydrophobicContact CB-CE1 4.14Å; H629-F647 HydrophobicContact CB-CZ 4.13Å; H629-F647 AromaticContact CD2-CE1 3.7Å; I633-F647 HydrophobicContact CD1-CE2 4.14Å; I633-F647 HydrophobicContact CD1-CZ 3.98Å; L643-F647 HydrophobicContact CD2-CE2 4.08Å; L643-F647 VanDerWaalsContact O-CD2 3.29Å; L643-F647 WeakPolarHBondContact O-CD2 3.26Å; L643-F647 PolarHBondContact O-N 3.28Å; L643-F647 VanDerWaalsContact O-N 3.08Å; F647-R649 VanDerWaalsContact C-N 3.29Å; F647-R649 PolarHBondContact O-N 2.85Å; F647-L650 HydrophobicContact CD1-CD1 4.2Å; F647-L650 PolarHBondContact O-N 2.89Å; F647-V651 PolarHBondContact O-N 3.5Å
648	D	93.6	Very high	95.2	Very high	56 Å²	56	58.3 Å²	58.3	30%	0.299	27%	0.274	S	S	.	.	H	α-helix	trans	-61.1	-36.1	171.4	-108.5	18	0	0	0	112.8	R408 R520 A644 L650 V651	R408-D648 IonicContact CZ-OD1 3.48Å; R408-D648 IonicContact NH1-OD1 3.61Å; R408-D648 PolarHBondContact NH1-OD1 2.9Å; R408-D648 IonicContact NH2-OD1 3.61Å; R408-D648 PolarHBondContact NH2-OD1 3.33Å; R520-D648 IonicContact CZ-OD2 3.09Å; R520-D648 IonicContact NH1-OD2 2.89Å; R520-D648 PolarHBondContact NH1-OD2 3.19Å; A644-D648 WeakPolarHBondContact O-CB 3.45Å; A644-D648 PolarHBondContact O-N 3.27Å; D648-L650 PolarHBondContact O-N 2.88Å; D648-V651 WeakPolarHBondContact O-CB 3.41Å; D648-V651 VanDerWaalsContact O-CG2 3.31Å; D648-V651 WeakPolarHBondContact O-CG2 3.39Å; D648-V651 PolarHBondContact O-N 2.85Å
649	R	96.6	Very high	95.2	Very high	153 Å²	153	57.4 Å²	57.4	58%	0.577	27%	0.269	S	S	*	.	H	α-helix	trans	-69.6	-18.7	174.8	-70.2	161.4	-168.2	159.5	4.8	112.8	M645 H646 F647 K653	M645-R649 VanDerWaalsContact O-CD 3.31Å; M645-R649 WeakPolarHBondContact O-CD 3.32Å; M645-R649 WeakPolarHBondContact O-CG 3.37Å; M645-R649 PolarHBondContact O-N 3.49Å; H646-R649 PolarHBondContact O-N 3.5Å; F647-R649 VanDerWaalsContact C-N 3.29Å; F647-R649 PolarHBondContact O-N 2.85Å; R649-K653 WeakPolarHBondContact O-CD 3.18Å; R649-K653 WeakPolarHBondContact O-CE 3.38Å; R649-K653 PolarHBondContact O-NZ 3.1Å
650	L	96.3	Very high	95.3	Very high	33 Å²	33	54.2 Å²	54.2	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-95.7	-1.9	-178.6	-67.4	166.7	0	0	0	114.2	H629 H646 F647 D648 R652 K653 H654	H629-L650 VanDerWaalsContact CE1-CD1 3.47Å; H629-L650 WeakPolarHBondContact CE1-CD1 3.36Å; H646-L650 WeakPolarHBondContact NE2-CD1 3.39Å; H646-L650 WeakPolarHBondContact O-CG 3.35Å; H646-L650 PolarHBondContact O-N 2.74Å; F647-L650 HydrophobicContact CD1-CD1 4.2Å; F647-L650 PolarHBondContact O-N 2.89Å; D648-L650 PolarHBondContact O-N 2.88Å; L650-R652 PolarHBondContact O-N 3.44Å; L650-K653 WeakPolarHBondContact O-CA 3.3Å; L650-K653 WeakPolarHBondContact O-CB 3.39Å; L650-K653 PolarHBondContact O-N 2.8Å; L650-H654 VanDerWaalsContact CB-NE2 3.35Å; L650-H654 WeakPolarHBondContact CB-NE2 3.44Å; L650-H654 PolarHBondContact O-CD2 3.07Å
651	V	95.1	Very high	95.3	Very high	40 Å²	40	59.5 Å²	59.5	24%	0.242	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	125.5	167.9	165.7	0	0	0	0	110.9	F647 D648 K653	F647-V651 PolarHBondContact O-N 3.5Å; D648-V651 WeakPolarHBondContact O-CB 3.41Å; D648-V651 VanDerWaalsContact O-CG2 3.31Å; D648-V651 WeakPolarHBondContact O-CG2 3.39Å; D648-V651 PolarHBondContact O-N 2.85Å; V651-K653 PolarHBondContact O-N 2.78Å
652	R	95.3	Very high	95.4	Very high	96 Å²	96	59.9 Å²	59.9	36%	0.362	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	62.7	12	-175.3	-57.9	171.1	168.3	154.2	-6.5	116.5	D296 R416 E417 F418 L650	D296-R652 IonicContact OD1-NH2 2.74Å; D296-R652 PolarHBondContact OD1-NH2 2.74Å; R416-R652 PolarHBondContact O-N 3.33Å; E417-R652 CarbonylContact O-C 3.51Å; E417-R652 VanDerWaalsContact O-CA 3.25Å; E417-R652 WeakPolarHBondContact O-CA 3.4Å; E417-R652 PolarHBondContact O-N 3.1Å; E417-R652 VanDerWaalsContact O-N 3.07Å; F418-R652 WeakPolarHBondContact O-CG 3.45Å; L650-R652 PolarHBondContact O-N 3.44Å
653	K	95.4	Very high	95.4	Very high	147 Å²	147	55.8 Å²	55.8	64%	0.639	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119.2	-2.5	-174.7	-59.5	169.8	-162.6	164.7	0	114.4	E417 R649 L650 V651	E417-K653 PolarHBondContact O-N 2.69Å; R649-K653 WeakPolarHBondContact O-CD 3.18Å; R649-K653 WeakPolarHBondContact O-CE 3.38Å; R649-K653 PolarHBondContact O-NZ 3.1Å; L650-K653 WeakPolarHBondContact O-CA 3.3Å; L650-K653 WeakPolarHBondContact O-CB 3.39Å; L650-K653 PolarHBondContact O-N 2.8Å; V651-K653 PolarHBondContact O-N 2.78Å
654	H	95.6	Very high	95.4	Very high	7 Å²	7	57.1 Å²	57.1	3%	0.032	25%	0.252	C	S	.	.	S	Bend	trans	-67.9	132.9	174.4	-70.5	-80	0	0	0	110.8	F418 I625 H629 L650 L656	F418-H654 HydrophobicContact CD1-CB 4.13Å; F418-H654 VanDerWaalsContact CD1-O 3.3Å; F418-H654 WeakPolarHBondContact CD1-O 3.27Å; F418-H654 HydrophobicContact CE1-CB 3.65Å; F418-H654 WeakPolarHBondContact CE1-O 3.25Å; F418-H654 HydrophobicContact CZ-CB 4.16Å; I625-H654 VanDerWaalsContact CG2-CE1 3.41Å; I625-H654 WeakPolarHBondContact CG2-CE1 3.42Å; H629-H654 AromaticContact CD2-CE1 3.96Å; H629-H654 AromaticContact NE2-CE1 3.49Å; H629-H654 PolarHBondContact NE2-CE1 3.31Å; H629-H654 AromaticContact NE2-ND1 3.67Å; L650-H654 VanDerWaalsContact CB-NE2 3.35Å; L650-H654 WeakPolarHBondContact CB-NE2 3.44Å; L650-H654 PolarHBondContact O-CD2 3.07Å; H654-L656 PolarHBondContact O-N 3.05Å
655	H	95.3	Very high	95.5	Very high	96 Å²	96	57.1 Å²	57.1	44%	0.444	25%	0.252	S	S	.	.			trans	-83.1	98	-174.5	-177.6	-63.5	0	0	0	110.7	G657 R658 V659	H655-G657 VanDerWaalsContact C-N 3.25Å; H655-G657 PolarHBondContact ND1-N 3.47Å; H655-G657 PolarHBondContact O-N 3.44Å; H655-R658 VanDerWaalsContact CB-CZ 3.44Å; H655-R658 PolarHBondContact CD2-NH1 3.29Å; H655-R658 PolarHBondContact ND1-N 2.86Å; H655-R658 PolarHBondContact O-N 3.49Å; H655-V659 PolarHBondContact O-N 2.88Å
656	L	95.2	Very high	95.5	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.026	25%	0.246	C	C	.	.	H	α-helix	trans	-41.5	-48.9	-174.9	179.4	67	0	0	0	113.9	F418 D422 R425 M426 H654 R658 V659 L660	F418-L656 HydrophobicContact CD1-CB 4.19Å; F418-L656 HydrophobicContact CD1-CD1 4.3Å; F418-L656 HydrophobicContact CE1-CB 4.23Å; F418-L656 HydrophobicContact CE1-CD1 4.18Å; D422-L656 HydrophobicContact CB-CB 4.08Å; D422-L656 HydrophobicContact CB-CD2 3.95Å; D422-L656 HydrophobicContact CB-CG 4.49Å; D422-L656 VanDerWaalsContact OD1-CD2 3.25Å; D422-L656 WeakPolarHBondContact OD1-CD2 3.24Å; D422-L656 WeakPolarHBondContact OD2-CB 3.35Å; R425-L656 HydrophobicContact CB-CD2 3.88Å; R425-L656 HydrophobicContact CG-CD2 4.11Å; M426-L656 HydrophobicContact CB-CD1 3.85Å; M426-L656 HydrophobicContact CE-CD1 3.5Å; M426-L656 HydrophobicContact SD-CD1 4.32Å; H654-L656 PolarHBondContact O-N 3.05Å; L656-R658 PolarHBondContact O-N 3.24Å; L656-V659 PolarHBondContact O-N 3.34Å; L656-L660 HydrophobicContact CD1-CD1 3.7Å; L656-L660 HydrophobicContact CD1-CG 3.81Å; L656-L660 HydrophobicContact CD2-CD1 4.33Å; L656-L660 HydrophobicContact CG-CD1 3.81Å; L656-L660 HydrophobicContact CG-CG 4.24Å; L656-L660 WeakPolarHBondContact O-CB 3.23Å; L656-L660 WeakPolarHBondContact O-CG 3.31Å; L656-L660 PolarHBondContact O-N 2.69Å
657	G	94.3	Very high	95.3	Very high	18 Å²	18	55.7 Å²	55.7	19%	0.186	25%	0.245	C	C	.	.	H	α-helix	trans	-64.6	-19.3	-177	0	0	0	0	0	115.9	H655 R661	H655-G657 VanDerWaalsContact C-N 3.25Å; H655-G657 PolarHBondContact ND1-N 3.47Å; H655-G657 PolarHBondContact O-N 3.44Å; G657-R661 WeakPolarHBondContact O-CB 3.29Å
658	R	94.6	Very high	95	Very high	129 Å²	129	55.7 Å²	55.7	49%	0.487	25%	0.245	S	C	.	.	H	α-helix	trans	-89.1	-50.3	175.6	-70.2	-165.2	-59.1	-105	9	110.4	E628 H655 L656 L660 R661 R662	E628-R658 IonicContact OE1-CZ 2.84Å; E628-R658 IonicContact OE1-NE 3.71Å; E628-R658 PolarHBondContact OE1-NE 2.83Å; E628-R658 IonicContact OE1-NH2 3.91Å; E628-R658 PolarHBondContact OE1-NH2 2.74Å; E628-R658 IonicContact OE2-NE 3.19Å; H655-R658 VanDerWaalsContact CB-CZ 3.44Å; H655-R658 PolarHBondContact CD2-NH1 3.29Å; H655-R658 PolarHBondContact ND1-N 2.86Å; H655-R658 PolarHBondContact O-N 3.49Å; L656-R658 PolarHBondContact O-N 3.24Å; R658-L660 PolarHBondContact O-N 2.93Å; R658-R661 PolarHBondContact O-N 3.44Å; R658-R661 VanDerWaalsContact O-N 3.1Å; R658-R662 PolarHBondContact O-N 3.1Å
659	V	96.9	Very high	94.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-53.9	-51.1	175.9	-179.8	0	0	0	0	110.7	F418 M426 L621 A624 I625 H655 L656 R661 R662 A663	F418-V659 HydrophobicContact CE1-CG2 4.3Å; F418-V659 HydrophobicContact CZ-CB 4.27Å; F418-V659 HydrophobicContact CZ-CG1 4.2Å; F418-V659 HydrophobicContact CZ-CG2 4.19Å; M426-V659 HydrophobicContact CE-CG1 4.1Å; L621-V659 HydrophobicContact CD2-CG1 4.17Å; A624-V659 HydrophobicContact CB-CG1 4.11Å; I625-V659 HydrophobicContact CD1-CG1 4.18Å; I625-V659 HydrophobicContact CG1-CB 4.45Å; I625-V659 HydrophobicContact CG1-CG1 3.78Å; I625-V659 HydrophobicContact CG1-CG2 3.75Å; H655-V659 PolarHBondContact O-N 2.88Å; L656-V659 PolarHBondContact O-N 3.34Å; V659-R661 VanDerWaalsContact C-N 3.35Å; V659-R661 PolarHBondContact O-N 3.46Å; V659-R662 PolarHBondContact O-N 2.73Å; V659-A663 VanDerWaalsContact O-CB 3.28Å; V659-A663 WeakPolarHBondContact O-CB 3.24Å; V659-A663 PolarHBondContact O-N 3.43Å
660	L	95.7	Very high	94.3	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61.7	-37.9	177.7	-75.9	-177.5	0	0	0	113.1	F195 M426 V429 F617 L621 L656 R658 R664	F195-L660 HydrophobicContact CE1-CB 4.22Å; F195-L660 HydrophobicContact CE1-CD1 3.9Å; F195-L660 HydrophobicContact CZ-CB 4Å; F195-L660 HydrophobicContact CZ-CD1 4.35Å; M426-L660 HydrophobicContact CE-CD2 3.85Å; M426-L660 HydrophobicContact CE-CG 4.13Å; M426-L660 HydrophobicContact SD-CD2 3.74Å; V429-L660 HydrophobicContact CB-CD2 4.23Å; V429-L660 HydrophobicContact CG1-CD2 3.9Å; V429-L660 HydrophobicContact CG2-CD1 4.26Å; V429-L660 HydrophobicContact CG2-CD2 4.5Å; F617-L660 HydrophobicContact CZ-CD2 4.43Å; L621-L660 HydrophobicContact CD2-CD2 3.97Å; L656-L660 HydrophobicContact CD1-CD1 3.7Å; L656-L660 HydrophobicContact CD1-CG 3.81Å; L656-L660 HydrophobicContact CD2-CD1 4.33Å; L656-L660 HydrophobicContact CG-CD1 3.81Å; L656-L660 HydrophobicContact CG-CG 4.24Å; L656-L660 WeakPolarHBondContact O-CB 3.23Å; L656-L660 WeakPolarHBondContact O-CG 3.31Å; L656-L660 PolarHBondContact O-N 2.69Å; R658-L660 PolarHBondContact O-N 2.93Å; L660-R664 VanDerWaalsContact O-CB 3.29Å; L660-R664 WeakPolarHBondContact O-CB 3.37Å; L660-R664 WeakPolarHBondContact O-CD 3.44Å; L660-R664 WeakPolarHBondContact O-CG 3.36Å; L660-R664 PolarHBondContact O-N 3Å; L660-R664 VanDerWaalsContact O-N 3.11Å
661	R	94.3	Very high	93.8	Very high	166 Å²	166	49 Å²	49	63%	0.626	22%	0.221	S	C	*	.	H	α-helix	trans	-65.3	-47.8	178.6	-172.4	-171.8	-60.7	178	-0.7	110.7	G657 R658 V659 A665	G657-R661 WeakPolarHBondContact O-CB 3.29Å; R658-R661 PolarHBondContact O-N 3.44Å; R658-R661 VanDerWaalsContact O-N 3.1Å; V659-R661 VanDerWaalsContact C-N 3.35Å; V659-R661 PolarHBondContact O-N 3.46Å; R661-A665 PolarHBondContact O-N 3.29Å
662	R	96.5	Very high	93.1	Very high	101 Å²	101	51.9 Å²	51.9	38%	0.381	23%	0.232	S	C	.	.	H	α-helix	trans	-67.8	-45.4	-179.8	175.3	173.8	-79.1	169.5	-15.6	112.2	A624 L627 R658 V659 R664 A665 L666	A624-R662 HydrophobicContact CB-CB 3.99Å; A624-R662 HydrophobicContact CB-CG 3.79Å; L627-R662 PolarHBondContact O-NH1 3.29Å; R658-R662 PolarHBondContact O-N 3.1Å; V659-R662 PolarHBondContact O-N 2.73Å; R662-R664 VanDerWaalsContact C-N 3.33Å; R662-R664 PolarHBondContact O-N 2.9Å; R662-A665 PolarHBondContact O-N 3.02Å; R662-L666 HydrophobicContact CG-CD1 3.64Å; R662-L666 HydrophobicContact CG-CG 4.31Å; R662-L666 WeakPolarHBondContact O-CG 3.49Å; R662-L666 PolarHBondContact O-N 2.87Å
663	A	97.5	Very high	91.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.2	-39.2	178.8	0	0	0	0	0	112.3	F617 F620 L621 A624 V659 F667	F617-A663 HydrophobicContact CE2-CB 3.94Å; F617-A663 HydrophobicContact CZ-CB 4.1Å; F620-A663 HydrophobicContact CB-CB 4.42Å; L621-A663 HydrophobicContact CD2-CB 3.65Å; L621-A663 HydrophobicContact CG-CB 4.23Å; A624-A663 HydrophobicContact CB-CB 3.86Å; V659-A663 VanDerWaalsContact O-CB 3.28Å; V659-A663 WeakPolarHBondContact O-CB 3.24Å; V659-A663 PolarHBondContact O-N 3.43Å; A663-F667 WeakPolarHBondContact O-CB 3.49Å; A663-F667 PolarHBondContact O-N 2.9Å
664	R	94.6	Very high	90.3	Very high	28 Å²	28	45.7 Å²	45.7	11%	0.106	22%	0.217	C	C	.	.	H	α-helix	trans	-67.2	-35.3	175.6	-73.2	174.4	-175.3	152.2	-1.4	113.4	Y225 H226 F617 L660 R662 A668	Y225-R664 HydrophobicContact CE1-CG 4.21Å; Y225-R664 HydrophobicContact CE2-CG 4.46Å; Y225-R664 VanDerWaalsContact O-CZ 3.28Å; Y225-R664 PolarHBondContact O-NE 3.22Å; Y225-R664 PolarHBondContact O-NH2 3.16Å; Y225-R664 WeakPolarHBondContact OH-CG 3.29Å; H226-R664 PolarHBondContact O-NH1 3.45Å; H226-R664 PolarHBondContact O-NH2 2.79Å; F617-R664 HydrophobicContact CE2-CG 4.16Å; F617-R664 HydrophobicContact CZ-CG 4.24Å; L660-R664 VanDerWaalsContact O-CB 3.29Å; L660-R664 WeakPolarHBondContact O-CB 3.37Å; L660-R664 WeakPolarHBondContact O-CD 3.44Å; L660-R664 WeakPolarHBondContact O-CG 3.36Å; L660-R664 PolarHBondContact O-N 3Å; L660-R664 VanDerWaalsContact O-N 3.11Å; R662-R664 VanDerWaalsContact C-N 3.33Å; R662-R664 PolarHBondContact O-N 2.9Å; R664-A668 VanDerWaalsContact O-CB 3.22Å; R664-A668 WeakPolarHBondContact O-CB 3.27Å; R664-A668 PolarHBondContact O-N 2.87Å
665	A	94.1	Very high	88.3	Confident	31 Å²	31	50.4 Å²	50.4	26%	0.256	25%	0.247	S	C	.	.	H	α-helix	trans	-65.4	-60.3	174.3	0	0	0	0	0	110	R661 R662 F667 A668 D669	R661-A665 PolarHBondContact O-N 3.29Å; R662-A665 PolarHBondContact O-N 3.02Å; A665-F667 PolarHBondContact O-N 3.12Å; A665-F667 VanDerWaalsContact O-N 3.12Å; A665-A668 CarbonylContact O-C 3.53Å; A665-A668 WeakPolarHBondContact O-CA 3.3Å; A665-A668 WeakPolarHBondContact O-CB 3.5Å; A665-A668 PolarHBondContact O-N 3.26Å; A665-D669 PolarHBondContact O-N 3.43Å
666	L	94.1	Very high	86.5	Confident	39 Å²	39	49.9 Å²	49.9	20%	0.204	24%	0.241	C	C	.	.	H	α-helix	trans	-55.8	-35.9	-179.2	-63.5	166.2	0	0	0	113.2	F620 L623 L627 R662 Y670	F620-L666 HydrophobicContact CD1-CB 3.6Å; F620-L666 HydrophobicContact CE1-CB 4.03Å; F620-L666 VanDerWaalsContact CE1-O 3.29Å; F620-L666 WeakPolarHBondContact CE1-O 3.26Å; L623-L666 HydrophobicContact CD2-CD1 3.84Å; L623-L666 HydrophobicContact CG-CD1 4.22Å; L627-L666 HydrophobicContact CD1-CD1 4.15Å; R662-L666 HydrophobicContact CG-CD1 3.64Å; R662-L666 HydrophobicContact CG-CG 4.31Å; R662-L666 WeakPolarHBondContact O-CG 3.49Å; R662-L666 PolarHBondContact O-N 2.87Å; L666-Y670 WeakPolarHBondContact O-CB 3.49Å; L666-Y670 PolarHBondContact O-N 2.58Å; L666-Y670 VanDerWaalsContact O-N 3.1Å
667	F	93.9	Very high	84	Confident	22 Å²	22	56.2 Å²	56.2	10%	0.096	27%	0.274	C	S	.	.	H	α-helix	trans	-74.8	-34.7	175.5	-175.6	-123.5	0	0	0	113	Y225 P616 F617 F620 A663 A665 D669 Y670 L671	Y225-F667 WeakPolarHBondContact OH-CD1 3.43Å; P616-F667 HydrophobicContact CB-CE2 3.9Å; P616-F667 HydrophobicContact CG-CE2 3.65Å; P616-F667 HydrophobicContact CG-CZ 4.01Å; F617-F667 HydrophobicContact CB-CD1 4.44Å; F617-F667 HydrophobicContact CB-CE1 4.32Å; F617-F667 HydrophobicContact CB-CZ 4.4Å; F617-F667 HydrophobicContact CD2-CB 3.96Å; F617-F667 AromaticContact CD2-CD1 3.68Å; F617-F667 HydrophobicContact CD2-CD1 3.68Å; F617-F667 HydrophobicContact CD2-CE1 4.3Å; F617-F667 AromaticContact CD2-CG 3.84Å; F617-F667 HydrophobicContact CD2-CG 3.84Å; F617-F667 HydrophobicContact CE2-CB 4.41Å; F617-F667 HydrophobicContact CE2-CD1 4.46Å; F617-F667 HydrophobicContact CG-CD1 4.45Å; F620-F667 HydrophobicContact CB-CB 4.26Å; F620-F667 HydrophobicContact CD1-CB 4.3Å; F620-F667 HydrophobicContact CD2-CB 4.06Å; F620-F667 AromaticContact CD2-CD2 3.51Å; F620-F667 HydrophobicContact CD2-CD2 3.51Å; F620-F667 HydrophobicContact CD2-CE2 4.38Å; F620-F667 HydrophobicContact CD2-CG 4.18Å; F620-F667 AromaticContact CE2-CD2 3.61Å; F620-F667 HydrophobicContact CE2-CD2 3.61Å; F620-F667 HydrophobicContact CE2-CE2 4.36Å; F620-F667 HydrophobicContact CG-CB 3.94Å; F620-F667 HydrophobicContact CG-CD2 4.27Å; F620-F667 HydrophobicContact CZ-CD2 4.39Å; A663-F667 WeakPolarHBondContact O-CB 3.49Å; A663-F667 PolarHBondContact O-N 2.9Å; A665-F667 PolarHBondContact O-N 3.12Å; A665-F667 VanDerWaalsContact O-N 3.12Å; F667-D669 VanDerWaalsContact C-N 3.35Å; F667-Y670 AromaticContact CD2-CD1 3.69Å; F667-Y670 HydrophobicContact CD2-CD1 3.69Å; F667-Y670 HydrophobicContact CD2-CE1 4.17Å; F667-Y670 AromaticContact CE2-CD1 3.82Å; F667-Y670 HydrophobicContact CE2-CD1 3.82Å; F667-Y670 AromaticContact CE2-CE1 3.85Å; F667-Y670 HydrophobicContact CE2-CE1 3.85Å; F667-L671 HydrophobicContact CD1-CD1 4.06Å; F667-L671 HydrophobicContact CE1-CD1 3.69Å; F667-L671 HydrophobicContact CE2-CD1 4.26Å; F667-L671 HydrophobicContact CE2-CD2 4.46Å; F667-L671 HydrophobicContact CE2-CG 4.24Å; F667-L671 HydrophobicContact CZ-CD1 3.8Å; F667-L671 HydrophobicContact CZ-CD2 4.44Å; F667-L671 HydrophobicContact CZ-CG 4.25Å; F667-L671 VanDerWaalsContact O-CG 3.31Å; F667-L671 WeakPolarHBondContact O-CG 3.31Å; F667-L671 PolarHBondContact O-N 2.87Å
668	A	89.5	Confident	81.6	Confident	2 Å²	2	60.7 Å²	60.7	2%	0.017	30%	0.303	C	S	.	.	H	α-helix	trans	-69.1	-35	172.7	0	0	0	0	0	111.7	Y188 R664 A665 L671 Q672	Y188-A668 HydrophobicContact CE2-CB 3.88Å; R664-A668 VanDerWaalsContact O-CB 3.22Å; R664-A668 WeakPolarHBondContact O-CB 3.27Å; R664-A668 PolarHBondContact O-N 2.87Å; A665-A668 CarbonylContact O-C 3.53Å; A665-A668 WeakPolarHBondContact O-CA 3.3Å; A665-A668 WeakPolarHBondContact O-CB 3.5Å; A665-A668 PolarHBondContact O-N 3.26Å; A668-L671 PolarHBondContact O-N 3.36Å; A668-Q672 VanDerWaalsContact O-CG 3.31Å; A668-Q672 WeakPolarHBondContact O-CG 3.11Å; A668-Q672 PolarHBondContact O-N 3Å; A668-Q672 PolarHBondContact O-NE2 2.83Å
669	D	88.2	Confident	78.9	Confident	81 Å²	81	62.4 Å²	62.4	43%	0.433	32%	0.317	S	S	.	.	H	α-helix	trans	-63.3	-49.2	174.1	-57.7	-32.8	0	0	0	110	A665 F667 L671 Q672 S673	A665-D669 PolarHBondContact O-N 3.43Å; F667-D669 VanDerWaalsContact C-N 3.35Å; D669-L671 VanDerWaalsContact C-N 3.33Å; D669-L671 PolarHBondContact O-N 3.25Å; D669-Q672 CarbonylContact O-C 3.57Å; D669-Q672 WeakPolarHBondContact O-CA 3.22Å; D669-Q672 PolarHBondContact O-N 3.17Å; D669-S673 WeakPolarHBondContact O-CB 3.35Å; D669-S673 PolarHBondContact O-N 3.01Å; D669-S673 PolarHBondContact O-OG 3.18Å
670	Y	88.4	Confident	76	Confident	6 Å²	6	72.1 Å²	72.1	2%	0.024	36%	0.362	C	S	.	.	H	α-helix	trans	-58.7	-36.9	174.6	158.5	-104.4	0	0	0	114.1	L605 P606 P608 F611 P616 F620 L666 F667 Q672 S673 W676	L605-Y670 HydrophobicContact CB-CD2 3.89Å; L605-Y670 HydrophobicContact CB-CE2 3.66Å; L605-Y670 HydrophobicContact CD1-CD2 3.83Å; L605-Y670 HydrophobicContact CD1-CE2 4.39Å; P606-Y670 PolarHBondContact O-OH 2.71Å; P608-Y670 WeakPolarHBondContact CA-OH 3.13Å; P608-Y670 WeakPolarHBondContact CD-OH 3.33Å; P608-Y670 HydrophobicContact CG-CE1 4.06Å; P608-Y670 VanDerWaalsContact N-OH 3.17Å; F611-Y670 HydrophobicContact CD1-CE1 4.41Å; F611-Y670 HydrophobicContact CD1-CE2 4.23Å; F611-Y670 AromaticContact CD1-CZ 3.85Å; F611-Y670 HydrophobicContact CE1-CE2 4.41Å; P616-Y670 HydrophobicContact CB-CE1 4.31Å; F620-Y670 AromaticContact CE2-CD1 3.75Å; F620-Y670 HydrophobicContact CE2-CD1 3.75Å; F620-Y670 HydrophobicContact CE2-CE1 4.19Å; F620-Y670 HydrophobicContact CE2-CG 4.02Å; F620-Y670 VanDerWaalsContact CZ-CB 3.49Å; F620-Y670 AromaticContact CZ-CD1 3.8Å; F620-Y670 HydrophobicContact CZ-CD1 3.8Å; F620-Y670 HydrophobicContact CZ-CD2 4.22Å; F620-Y670 AromaticContact CZ-CG 3.57Å; F620-Y670 HydrophobicContact CZ-CG 3.57Å; L666-Y670 WeakPolarHBondContact O-CB 3.49Å; L666-Y670 PolarHBondContact O-N 2.58Å; L666-Y670 VanDerWaalsContact O-N 3.1Å; F667-Y670 AromaticContact CD2-CD1 3.69Å; F667-Y670 HydrophobicContact CD2-CD1 3.69Å; F667-Y670 HydrophobicContact CD2-CE1 4.17Å; F667-Y670 AromaticContact CE2-CD1 3.82Å; F667-Y670 HydrophobicContact CE2-CD1 3.82Å; F667-Y670 AromaticContact CE2-CE1 3.85Å; F667-Y670 HydrophobicContact CE2-CE1 3.85Å; Y670-Q672 PolarHBondContact O-N 3.05Å; Y670-S673 WeakPolarHBondContact CA-OG 3.46Å; Y670-S673 PolarHBondContact O-OG 3.13Å; Y670-W676 HydrophobicContact CE2-CZ2 4.34Å
671	L	85.3	Confident	73.1	Confident	15 Å²	15	75.7 Å²	75.7	8%	0.079	40%	0.399	C	S	.	.	H	α-helix	trans	-75.7	-5.3	174.4	-69.6	175.5	0	0	0	113.8	L177 L184 P608 F667 A668 D669	L177-L671 HydrophobicContact CD2-CD2 4.13Å; L184-L671 HydrophobicContact CD1-CD1 3.9Å; P608-L671 HydrophobicContact CG-CD2 3.97Å; F667-L671 HydrophobicContact CD1-CD1 4.06Å; F667-L671 HydrophobicContact CE1-CD1 3.69Å; F667-L671 HydrophobicContact CE2-CD1 4.26Å; F667-L671 HydrophobicContact CE2-CD2 4.46Å; F667-L671 HydrophobicContact CE2-CG 4.24Å; F667-L671 HydrophobicContact CZ-CD1 3.8Å; F667-L671 HydrophobicContact CZ-CD2 4.44Å; F667-L671 HydrophobicContact CZ-CG 4.25Å; F667-L671 VanDerWaalsContact O-CG 3.31Å; F667-L671 WeakPolarHBondContact O-CG 3.31Å; F667-L671 PolarHBondContact O-N 2.87Å; A668-L671 PolarHBondContact O-N 3.36Å; D669-L671 VanDerWaalsContact C-N 3.33Å; D669-L671 PolarHBondContact O-N 3.25Å
672	Q	80.8	Confident	70.1	Confident	100 Å²	100	71.4 Å²	71.4	47%	0.467	40%	0.398	S	S	.	.	H	α-helix	trans	-111.7	-28	176.1	-73.8	170.7	73.7	0	0	112.8	A668 D669 Y670	A668-Q672 VanDerWaalsContact O-CG 3.31Å; A668-Q672 WeakPolarHBondContact O-CG 3.11Å; A668-Q672 PolarHBondContact O-N 3Å; A668-Q672 PolarHBondContact O-NE2 2.83Å; D669-Q672 CarbonylContact O-C 3.57Å; D669-Q672 WeakPolarHBondContact O-CA 3.22Å; D669-Q672 PolarHBondContact O-N 3.17Å; Y670-Q672 PolarHBondContact O-N 3.05Å
673	S	70.3	Confident	67	Low	73 Å²	73	75 Å²	75	51%	0.51	42%	0.42	S	S	.	.	H	α-helix	trans	-77.5	-28.8	-174.7	61.1	0	0	0	0	114	D669 Y670	D669-S673 WeakPolarHBondContact O-CB 3.35Å; D669-S673 PolarHBondContact O-N 3.01Å; D669-S673 PolarHBondContact O-OG 3.18Å; Y670-S673 WeakPolarHBondContact CA-OG 3.46Å; Y670-S673 PolarHBondContact O-OG 3.13Å
674	E	62.1	Low	63.9	Low	40 Å²	40	79.4 Å²	79.4	19%	0.187	46%	0.456	C	S	.	.	S	Bend	trans	-117.5	119.8	-177.7	-62.7	-164.4	-137.7	0	0	110.5	G604 L605 W676	G604-E674 WeakPolarHBondContact CA-OE1 3.4Å; G604-E674 WeakPolarHBondContact CA-OE2 3.41Å; L605-E674 PolarHBondContact N-OE1 3.36Å; E674-W676 HydrophobicContact CB-CH2 4.27Å; E674-W676 HydrophobicContact CB-CZ2 3.52Å; E674-W676 HydrophobicContact CG-CZ2 4.29Å; E674-W676 PolarHBondContact O-N 3.38Å; E674-W676 PolarHBondContact O-NE1 3.48Å
675	V	52.2	Low	61.2	Low	107 Å²	107	84.3 Å²	84.3	65%	0.648	49%	0.489	S	S	*	.			trans	-82	96	-178.6	177.9	0	0	0	0	108.2	D677	V675-D677 HydrophobicContact CG1-CB 3.99Å; V675-D677 WeakPolarHBondContact CG1-OD2 3.34Å; V675-D677 PolarHBondContact O-N 3.15Å
676	W	58.3	Low	58.5	Low	85 Å²	85	86.9 Å²	86.9	32%	0.322	51%	0.511	S	S	.	.			trans	-76.6	43.8	-179.9	-60.7	108.8	0	0	0	113.3	L605 P607 Y670 E674	L605-W676 WeakPolarHBondContact O-CH2 3.34Å; L605-W676 VanDerWaalsContact O-CZ2 3.25Å; L605-W676 WeakPolarHBondContact O-CZ2 2.86Å; P607-W676 HydrophobicContact CB-CD2 4.21Å; P607-W676 HydrophobicContact CB-CE3 3.71Å; P607-W676 HydrophobicContact CB-CH2 4.1Å; P607-W676 HydrophobicContact CB-CZ3 3.66Å; P607-W676 HydrophobicContact CG-CZ3 4.21Å; Y670-W676 HydrophobicContact CE2-CZ2 4.34Å; E674-W676 HydrophobicContact CB-CH2 4.27Å; E674-W676 HydrophobicContact CB-CZ2 3.52Å; E674-W676 HydrophobicContact CG-CZ2 4.29Å; E674-W676 PolarHBondContact O-N 3.38Å; E674-W676 PolarHBondContact O-NE1 3.48Å
677	D	41.6	Very low	55.8	Low	137 Å²	137	89.1 Å²	89.1	73%	0.733	54%	0.535	S	S	*	.			trans	-71.6	132.9	178.6	-79.5	-15.5	0	0	0	110.9	V675	V675-D677 HydrophobicContact CG1-CB 3.99Å; V675-D677 WeakPolarHBondContact CG1-OD2 3.34Å; V675-D677 PolarHBondContact O-N 3.15Å
678	S	44.3	Very low	52.8	Low	112 Å²	112	97.7 Å²	97.7	78%	0.783	60%	0.598	S	S	*	*			trans	-120.3	52.4	-171.2	22.4	0	0	0	0	111.6
679	E	38.9	Very low	51	Low	166 Å²	166	102.5 Å²	102.5	78%	0.776	63%	0.627	S	S	*	*			trans	-115.4	-24.8	-178.2	-61.4	-157.5	141.8	0	0	115.4	G681 A682	E679-G681 PolarHBondContact O-N 3.16Å; E679-A682 PolarHBondContact O-N 3.5Å
680	E	34.8	Very low	49	Very low	204 Å²	204	103.6 Å²	103.6	95%	0.953	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	-9.2	-178.4	-69.9	-161.1	139.3	0	0	115
681	G	34.5	Very low	46.9	Very low	75 Å²	75	109.1 Å²	109.1	77%	0.773	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-10.9	178.4	0	0	0	0	0	115.9	E679	E679-G681 PolarHBondContact O-N 3.16Å
682	A	32.6	Very low	44.6	Very low	75 Å²	75	114.6 Å²	114.6	62%	0.62	71%	0.706	S	S	*	*	S	Bend	trans	-100.3	-29.6	-164.3	0	0	0	0	0	116.1	E679	E679-A682 PolarHBondContact O-N 3.5Å
683	E	31.8	Very low	42.3	Very low	176 Å²	176	115.5 Å²	115.5	82%	0.822	72%	0.721	S	S	*	*	S	Bend	trans	-89.5	-16.4	-172.7	-104.8	-177.3	166.6	0	0	114.7	T685 A686	E683-T685 PolarHBondContact O-N 3.43Å; E683-A686 PolarHBondContact O-N 2.96Å
684	A	32.1	Very low	40.5	Very low	93 Å²	93	118.3 Å²	118.3	77%	0.769	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-6.3	-174.1	0	0	0	0	0	115.4
685	T	36.7	Very low	38.9	Very low	131 Å²	131	123.9 Å²	123.9	80%	0.804	77%	0.774	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.6	9.8	-178.3	53	0	0	0	0	114	E683	E683-T685 PolarHBondContact O-N 3.43Å
686	A	38.7	Very low	37.9	Very low	85 Å²	85	125.2 Å²	125.2	70%	0.702	78%	0.784	S	S	*	*	S	Bend	trans	-114	12.7	-176	0	0	0	0	0	114.9	E683	E683-A686 PolarHBondContact O-N 2.96Å
687	A	36	Very low	36.2	Very low	86 Å²	86	128.6 Å²	128.6	71%	0.711	82%	0.822	S	S	*	*			trans	-153	58.6	-175	0	0	0	0	0	116.5
688	S	32.6	Very low	35.7	Very low	203 Å²	203	127.8 Å²	127.8	100%	1.42	83%	0.83	S	S	*	*			trans	-170.7	0	150.6	-80.2	0	0	0	0	111.6

Retrieved 688 of 688 residues in 522 ms (Link to these results)

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