A0A077ZIB7_TRITR Loading...

KH 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZIB7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 330 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	Very low	43.5	Very low	236 Å²	236	160.9 Å²	160.9	100%	1.163	85%	0.852	S	S	*	*				0	114.9	0	-147.7	80.8	171.6	0	0	108.5
2	K	42.5	Very low	43.2	Very low	173 Å²	173	157.2 Å²	157.2	75%	0.752	85%	0.848	S	S	*	*			trans	41.9	111.2	166.1	-73.2	-178.5	175.5	-177.3	0	122.1	Y4	K2-Y4 HydrophobicContact CB-CD2 4.3Å; K2-Y4 HydrophobicContact CD-CD2 4.07Å; K2-Y4 HydrophobicContact CD-CE2 3.75Å; K2-Y4 HydrophobicContact CG-CD2 4.2Å; K2-Y4 HydrophobicContact CG-CE2 3.97Å
3	R	32.5	Very low	43.1	Very low	240 Å²	240	154.8 Å²	154.8	91%	0.906	85%	0.851	S	S	*	*			trans	-77.7	142.7	137.8	-66.5	178.9	-173	168	1.9	108.6
4	Y	48.7	Very low	42.6	Very low	200 Å²	200	149.1 Å²	149.1	78%	0.784	85%	0.845	S	S	*	*			trans	-139.2	127.9	151.4	-92.6	-87.4	0	0	0	108.8	K2	K2-Y4 HydrophobicContact CB-CD2 4.3Å; K2-Y4 HydrophobicContact CD-CD2 4.07Å; K2-Y4 HydrophobicContact CD-CE2 3.75Å; K2-Y4 HydrophobicContact CG-CD2 4.2Å; K2-Y4 HydrophobicContact CG-CE2 3.97Å
5	M	44.6	Very low	42.3	Very low	163 Å²	163	144.5 Å²	144.5	80%	0.803	84%	0.844	S	S	*	*			trans	-75.5	151.9	172.9	-63.2	167.9	114.1	0	0	109.3
6	D	50.9	Low	41.8	Very low	161 Å²	161	139.9 Å²	139.9	86%	0.861	84%	0.837	S	S	*	*			trans	-137.5	131.5	145.4	-157.6	8.8	0	0	0	109
7	D	45.9	Very low	41.9	Very low	124 Å²	124	146 Å²	146	66%	0.663	84%	0.842	S	S	*	*			trans	-91.9	141.6	-173.9	-74.8	-56.8	0	0	0	109.6
8	T	47.5	Very low	41.7	Very low	146 Å²	146	148.9 Å²	148.9	90%	0.896	84%	0.843	S	S	*	*			trans	-155.7	115.1	143.7	-7.9	0	0	0	0	112.2
9	S	43.7	Very low	41.7	Very low	124 Å²	124	153.1 Å²	153.1	87%	0.867	84%	0.844	S	S	*	*			trans	-69.1	147	175.2	50.4	0	0	0	0	113.7
10	G	40.9	Very low	41.7	Very low	77 Å²	77	151.7 Å²	151.7	79%	0.794	84%	0.843	S	S	*	*			trans	-168.4	85.4	166.3	0	0	0	0	0	111.6
11	S	41.9	Very low	41.6	Very low	126 Å²	126	154.4 Å²	154.4	88%	0.881	84%	0.84	S	S	*	*			trans	-76	127.6	177.4	52.4	0	0	0	0	112
12	S	40.8	Very low	41.8	Very low	116 Å²	116	149.6 Å²	149.6	81%	0.811	83%	0.829	S	S	*	*			trans	-136.7	109.7	157.2	61.5	0	0	0	0	109.6	G14	S12-G14 PolarHBondContact O-N 3.08Å; S12-G14 VanDerWaalsContact O-N 3.08Å
13	S	41	Very low	42	Very low	126 Å²	126	146.1 Å²	146.1	88%	0.881	83%	0.827	S	S	*	*			trans	-61.1	99	176.4	45.2	0	0	0	0	111.6	G15	S13-G15 PolarHBondContact O-N 3.41Å
14	G	37.3	Very low	43.5	Very low	75 Å²	75	140.7 Å²	140.7	77%	0.773	82%	0.816	S	S	*	*			trans	-79.3	105.8	166.2	0	0	0	0	0	110.2	S12 G16	S12-G14 PolarHBondContact O-N 3.08Å; S12-G14 VanDerWaalsContact O-N 3.08Å; G14-G16 PolarHBondContact O-N 3.12Å
15	G	37.8	Very low	44.5	Very low	80 Å²	80	132.6 Å²	132.6	83%	0.825	79%	0.793	S	S	*	*			trans	-58.5	100.9	170	0	0	0	0	0	110.4	S13 R17	S13-G15 PolarHBondContact O-N 3.41Å; G15-R17 PolarHBondContact O-N 2.94Å; G15-R17 VanDerWaalsContact O-N 3.12Å
16	G	33.7	Very low	46.4	Very low	71 Å²	71	126.6 Å²	126.6	73%	0.732	77%	0.766	S	S	*	*			trans	-61.5	111.6	176.2	0	0	0	0	0	110.6	G14 K18	G14-G16 PolarHBondContact O-N 3.12Å; G16-K18 PolarHBondContact O-N 3.02Å
17	R	43.9	Very low	48.2	Very low	244 Å²	244	123.5 Å²	123.5	92%	0.921	75%	0.747	S	S	*	*			trans	-58.7	100.4	161.2	-78.7	178	167.5	177.2	-4.4	107.6	G15 R19	G15-R17 PolarHBondContact O-N 2.94Å; G15-R17 VanDerWaalsContact O-N 3.12Å; R17-R19 PolarHBondContact O-N 2.94Å; R17-R19 VanDerWaalsContact O-N 3.12Å
18	K	38.9	Very low	50.5	Low	199 Å²	199	117.8 Å²	117.8	87%	0.865	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-56.4	116.5	168.5	-79.7	-179.1	177.3	173.8	0	107.5	G16	G16-K18 PolarHBondContact O-N 3.02Å
19	R	40.8	Very low	52.7	Low	227 Å²	227	111.5 Å²	111.5	86%	0.857	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-55.7	138.5	166.8	-69.5	178.6	174.3	176.5	-2.7	108.2	R17 R21	R17-R19 PolarHBondContact O-N 2.94Å; R17-R19 VanDerWaalsContact O-N 3.12Å; R19-R21 PolarHBondContact O-N 3.04Å
20	P	41.6	Very low	55.1	Low	126 Å²	126	105.8 Å²	105.8	82%	0.818	64%	0.636	S	S	*	*	P	Polyproline II helix	trans	-58.2	133.9	174.4	23.9	-30.2	0	0	0	108.9	S22	P20-S22 PolarHBondContact O-N 3.37Å
21	R	39.2	Very low	57.7	Low	209 Å²	209	102.1 Å²	102.1	79%	0.789	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-68.5	125	176.5	-76.1	178.3	167	143.3	-7.5	107.7	R19 S23	R19-R21 PolarHBondContact O-N 3.04Å; R21-S23 PolarHBondContact O-N 3.13Å
22	S	44.5	Very low	60.1	Low	134 Å²	134	96.2 Å²	96.2	94%	0.937	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	41.1	-179.7	63.7	0	0	0	0	113.3	P20	P20-S22 PolarHBondContact O-N 3.37Å
23	S	46.1	Very low	62.6	Low	101 Å²	101	91.1 Å²	91.1	71%	0.706	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-139.6	9.4	-178.4	79.8	0	0	0	0	114.2	R21	R21-S23 PolarHBondContact O-N 3.13Å
24	D	63.1	Low	64.9	Low	126 Å²	126	86.7 Å²	86.7	67%	0.674	49%	0.49	S	S	*	.			trans	-89.6	130.7	170.8	-90.9	-34.2	0	0	0	107.9
25	G	70.8	Confident	67.4	Low	30 Å²	30	89.4 Å²	89.4	31%	0.309	48%	0.48	S	S	.	.			trans	-64.7	-165.4	178.1	0	0	0	0	0	112.8	E27 C75	G25-E27 PolarHBondContact O-N 3.35Å; G25-E27 VanDerWaalsContact O-N 3.17Å; G25-C75 WeakPolarHBondContact CA-O 3.37Å
26	P	83.9	Confident	69.9	Low	36 Å²	36	87.3 Å²	87.3	23%	0.234	45%	0.447	C	S	.	.			trans	-57.5	124.5	-175.2	23.5	-33.1	0	0	0	111.4	L78 L81	P26-L78 HydrophobicContact CG-CB 4.48Å; P26-L81 HydrophobicContact CB-CD2 4.21Å; P26-L81 HydrophobicContact CG-CD2 4.29Å
27	E	89.2	Confident	72.6	Confident	97 Å²	97	84 Å²	84	45%	0.453	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.3	171.9	-172.6	-178.2	173.9	0	0	109.6	G25 R29 M73	G25-E27 PolarHBondContact O-N 3.35Å; G25-E27 VanDerWaalsContact O-N 3.17Å; E27-R29 HydrophobicContact CG-CG 4.48Å; E27-M73 CarbonylContact C-O 3.58Å; E27-M73 WeakPolarHBondContact CA-O 3.06Å
28	L	93.3	Very high	74.7	Confident	4 Å²	4	74.8 Å²	74.8	2%	0.021	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	137	172	177.6	67.8	0	0	0	110.2	I30 M73 L81 I85 I106 V163 L167	L28-I30 HydrophobicContact CD2-CD1 3.97Å; L28-I30 HydrophobicContact CD2-CG1 3.91Å; L28-I30 HydrophobicContact CG-CD1 4.48Å; L28-I30 HydrophobicContact CG-CG1 3.97Å; L28-M73 PolarHBondContact N-O 3.24Å; L28-M73 PolarHBondContact O-N 3.41Å; L28-L81 HydrophobicContact CB-CD1 4.27Å; L28-L81 HydrophobicContact CB-CD2 3.98Å; L28-I85 HydrophobicContact CD2-CD1 3.34Å; L28-I85 HydrophobicContact CD2-CG1 4.15Å; L28-I106 HydrophobicContact CD1-CB 4.04Å; L28-I106 HydrophobicContact CD1-CG2 3.82Å; L28-V163 HydrophobicContact CD2-CG1 4.06Å; L28-L167 HydrophobicContact CD1-CD2 4.03Å
29	R	94.9	Very high	77.2	Confident	13 Å²	13	67.4 Å²	67.4	5%	0.049	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	119.9	176.4	-60.1	-175.5	66.5	-151.2	0.4	109.6	E27 V70 V71 K72 I106 L107 E147 Y182	E27-R29 HydrophobicContact CG-CG 4.48Å; R29-V70 HydrophobicContact CB-CG1 4.23Å; R29-V71 CarbonylContact C-O 3.24Å; R29-V71 VanDerWaalsContact CA-O 3.31Å; R29-V71 WeakPolarHBondContact CA-O 3.26Å; R29-K72 HydrophobicContact CG-CG 4.31Å; R29-I106 CarbonylContact O-C 3.48Å; R29-I106 WeakPolarHBondContact O-CA 3.42Å; R29-L107 HydrophobicContact CB-CB 4.14Å; R29-L107 HydrophobicContact CB-CD1 4.45Å; R29-L107 PolarHBondContact O-N 3.08Å; R29-E147 IonicContact CZ-OE1 3.49Å; R29-E147 IonicContact CZ-OE2 3.46Å; R29-E147 IonicContact NH1-OE1 2.81Å; R29-E147 PolarHBondContact NH1-OE1 2.83Å; R29-E147 IonicContact NH1-OE2 3.36Å; R29-E147 PolarHBondContact NH1-OE2 3.04Å; R29-E147 IonicContact NH2-OE2 3.18Å; R29-Y182 PolarHBondContact NH2-O 2.85Å
30	I	94.6	Very high	79.5	Confident	5 Å²	5	56.8 Å²	56.8	3%	0.026	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	131.5	-176.4	-55	168.1	0	0	0	108.2	L28 I32 V70 V71 M73 L104 R105 I106	L28-I30 HydrophobicContact CD2-CD1 3.97Å; L28-I30 HydrophobicContact CD2-CG1 3.91Å; L28-I30 HydrophobicContact CG-CD1 4.48Å; L28-I30 HydrophobicContact CG-CG1 3.97Å; I30-I32 HydrophobicContact CG2-CG2 3.75Å; I30-V70 CarbonylContact O-C 3.58Å; I30-V70 WeakPolarHBondContact O-CA 3.31Å; I30-V71 HydrophobicContact CB-CB 4.25Å; I30-V71 PolarHBondContact N-O 3.29Å; I30-V71 PolarHBondContact O-N 3.08Å; I30-M73 HydrophobicContact CD1-SD 3.63Å; I30-L104 HydrophobicContact CD1-CD1 4.16Å; I30-L104 HydrophobicContact CG1-CD1 4.43Å; I30-L104 HydrophobicContact CG2-CD1 3.5Å; I30-L104 VanDerWaalsContact CG2-CD1 3.5Å; I30-L104 HydrophobicContact CG2-CG 4.33Å; I30-R105 CarbonylContact C-O 3.58Å; I30-R105 VanDerWaalsContact CA-O 3.31Å; I30-R105 WeakPolarHBondContact CA-O 3.47Å; I30-R105 VanDerWaalsContact CG2-O 3.25Å; I30-R105 WeakPolarHBondContact CG2-O 3.43Å; I30-I106 HydrophobicContact CG1-CG2 4.48Å
31	L	94.7	Very high	81.9	Confident	0 Å²	0	53.1 Å²	53.1	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	123.8	170.2	-170.9	66.9	0	0	0	108.4	E68 V70 R105 L107 V149 Y182 Y198	L31-E68 HydrophobicContact CD1-CB 4.09Å; L31-E68 HydrophobicContact CD1-CG 4.04Å; L31-V70 HydrophobicContact CD1-CG2 3.99Å; L31-R105 HydrophobicContact CB-CB 4.17Å; L31-R105 PolarHBondContact N-O 3.33Å; L31-L107 HydrophobicContact CB-CD1 4.39Å; L31-L107 HydrophobicContact CB-CG 4.34Å; L31-V149 HydrophobicContact CD2-CG2 3.93Å; L31-Y182 HydrophobicContact CD1-CD1 4.22Å; L31-Y182 HydrophobicContact CD1-CE1 3.85Å; L31-Y198 HydrophobicContact CD2-CE2 4.41Å; L31-Y198 HydrophobicContact CG-CD2 4.28Å; L31-Y198 HydrophobicContact CG-CE2 4.02Å; L31-Y198 PolarHBondContact O-OH 3.3Å
32	I	93.1	Very high	84.2	Confident	2 Å²	2	44.1 Å²	44.1	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	155.2	178.3	63.5	170.3	0	0	0	110.8	I30 A37 I40 E68 R69 V71 L92 Y198	I30-I32 HydrophobicContact CG2-CG2 3.75Å; I32-A37 HydrophobicContact CD1-CB 3.98Å; I32-I40 HydrophobicContact CD1-CD1 3.58Å; I32-I40 HydrophobicContact CG2-CD1 4.43Å; I32-E68 CarbonylContact O-C 3.5Å; I32-E68 WeakPolarHBondContact O-CA 3.47Å; I32-E68 WeakPolarHBondContact O-CB 3.5Å; I32-R69 HydrophobicContact CG1-CB 4.1Å; I32-R69 WeakPolarHBondContact CG1-O 3.14Å; I32-R69 PolarHBondContact N-O 2.89Å; I32-R69 PolarHBondContact O-N 2.98Å; I32-V71 HydrophobicContact CD1-CG2 3.47Å; I32-V71 VanDerWaalsContact CD1-CG2 3.47Å; I32-V71 HydrophobicContact CG1-CG2 3.85Å; I32-V71 HydrophobicContact CG2-CG2 4.1Å; I32-L92 HydrophobicContact CG2-CD1 4.5Å; I32-Y198 VanDerWaalsContact C-CE2 3.46Å
33	P	92.1	Very high	86.4	Confident	9 Å²	9	47 Å²	47	6%	0.058	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.4	144	162.8	-16.5	30.8	0	0	0	110.6	K35 W36 R67 Y198	P33-K35 HydrophobicContact CB-CD 4.49Å; P33-K35 HydrophobicContact CB-CG 3.72Å; P33-K35 PolarHBondContact O-N 3.38Å; P33-K35 VanDerWaalsContact O-N 3.12Å; P33-W36 HydrophobicContact CB-CD2 4.44Å; P33-W36 HydrophobicContact CG-CD2 3.78Å; P33-W36 HydrophobicContact CG-CE3 3.79Å; P33-W36 HydrophobicContact CG-CG 4.33Å; P33-W36 HydrophobicContact CG-CH2 4.33Å; P33-W36 HydrophobicContact CG-CZ2 4.32Å; P33-W36 HydrophobicContact CG-CZ3 4.07Å; P33-W36 PolarHBondContact O-N 3.13Å; P33-R67 WeakPolarHBondContact CA-O 3.24Å; P33-Y198 HydrophobicContact CB-CD1 4.44Å; P33-Y198 HydrophobicContact CB-CG 4.33Å; P33-Y198 VanDerWaalsContact CD-CZ 3.47Å; P33-Y198 HydrophobicContact CG-CD1 3.61Å; P33-Y198 HydrophobicContact CG-CD2 4.13Å; P33-Y198 HydrophobicContact CG-CE1 3.55Å; P33-Y198 HydrophobicContact CG-CE2 4.08Å; P33-Y198 HydrophobicContact CG-CG 3.88Å
34	S	89.9	Confident	88.4	Confident	33 Å²	33	45.8 Å²	45.8	23%	0.231	28%	0.275	C	S	.	.	H	α-helix	trans	-57.7	-30.1	178	-71.7	0	0	0	0	113.1	W36 A37 T66 R67 E68	S34-W36 VanDerWaalsContact C-N 3.25Å; S34-W36 PolarHBondContact O-N 2.89Å; S34-A37 PolarHBondContact O-N 3.12Å; S34-T66 PolarHBondContact OG-O 2.89Å; S34-R67 PolarHBondContact N-O 2.82Å; S34-R67 VanDerWaalsContact OG-C 3.25Å; S34-R67 PolarHBondContact OG-O 3.22Å; S34-E68 PolarHBondContact OG-N 3.28Å; S34-E68 PolarHBondContact OG-O 2.84Å
35	K	88.8	Confident	89.7	Confident	132 Å²	132	40.3 Å²	40.3	57%	0.574	25%	0.249	S	C	*	.	H	α-helix	trans	-62.5	-27	176	58.6	174.7	-176.8	-174.6	0	114	P33 E94	P33-K35 HydrophobicContact CB-CD 4.49Å; P33-K35 HydrophobicContact CB-CG 3.72Å; P33-K35 PolarHBondContact O-N 3.38Å; P33-K35 VanDerWaalsContact O-N 3.12Å; K35-E94 WeakPolarHBondContact CE-OE1 3.31Å; K35-E94 VanDerWaalsContact NZ-CD 3.32Å; K35-E94 IonicContact NZ-OE1 3.26Å; K35-E94 PolarHBondContact NZ-OE1 3Å; K35-E94 IonicContact NZ-OE2 2.7Å
36	W	90.3	Very high	90.7	Very high	35 Å²	35	45.9 Å²	45.9	13%	0.133	27%	0.266	C	S	.	.	H	α-helix	trans	-87.7	-18.1	-178.5	-65.6	-14.6	0	0	0	113.1	P33 S34 G38 A39 I40 L92 E94	P33-W36 HydrophobicContact CB-CD2 4.44Å; P33-W36 HydrophobicContact CG-CD2 3.78Å; P33-W36 HydrophobicContact CG-CE3 3.79Å; P33-W36 HydrophobicContact CG-CG 4.33Å; P33-W36 HydrophobicContact CG-CH2 4.33Å; P33-W36 HydrophobicContact CG-CZ2 4.32Å; P33-W36 HydrophobicContact CG-CZ3 4.07Å; P33-W36 PolarHBondContact O-N 3.13Å; S34-W36 VanDerWaalsContact C-N 3.25Å; S34-W36 PolarHBondContact O-N 2.89Å; W36-G38 PolarHBondContact O-N 3.21Å; W36-A39 WeakPolarHBondContact O-CB 3.25Å; W36-A39 PolarHBondContact O-N 3.04Å; W36-I40 PolarHBondContact O-N 3.38Å; W36-L92 HydrophobicContact CB-CD2 3.82Å; W36-L92 HydrophobicContact CD2-CB 4.19Å; W36-L92 HydrophobicContact CD2-CD2 4.22Å; W36-L92 HydrophobicContact CE3-CB 3.71Å; W36-L92 HydrophobicContact CE3-CD1 4.29Å; W36-L92 HydrophobicContact CE3-CD2 3.84Å; W36-L92 HydrophobicContact CE3-CG 4.13Å; W36-L92 HydrophobicContact CG-CD2 4.26Å; W36-L92 HydrophobicContact CH2-CB 4.49Å; W36-L92 VanDerWaalsContact CH2-O 3.24Å; W36-L92 WeakPolarHBondContact CH2-O 3.33Å; W36-L92 WeakPolarHBondContact CZ2-O 3.32Å; W36-L92 HydrophobicContact CZ3-CB 3.88Å; W36-L92 HydrophobicContact CZ3-CD1 4.49Å; W36-E94 HydrophobicContact CZ2-CG 4.37Å
37	A	90.4	Very high	91.1	Very high	3 Å²	3	45 Å²	45	3%	0.025	26%	0.26	C	S	.	.	H	α-helix	trans	-57.3	-36.9	179.5	0	0	0	0	0	112.5	I32 S34 A39 I40 I41 I61	I32-A37 HydrophobicContact CD1-CB 3.98Å; S34-A37 PolarHBondContact O-N 3.12Å; A37-A39 VanDerWaalsContact C-N 3.32Å; A37-A39 PolarHBondContact O-N 2.77Å; A37-I40 PolarHBondContact O-N 2.83Å; A37-I41 WeakPolarHBondContact O-CB 3.25Å; A37-I41 VanDerWaalsContact O-CG1 3.24Å; A37-I41 WeakPolarHBondContact O-CG1 3.39Å; A37-I41 PolarHBondContact O-N 3.21Å; A37-I61 HydrophobicContact CB-CG2 4.31Å
38	G	89.6	Confident	91.3	Very high	49 Å²	49	41 Å²	41	51%	0.505	24%	0.242	S	C	.	.	H	α-helix	trans	-62.3	-35.2	176.6	0	0	0	0	0	113.7	W36 G42	W36-G38 PolarHBondContact O-N 3.21Å; G38-G42 WeakPolarHBondContact O-CA 3.48Å; G38-G42 PolarHBondContact O-N 2.87Å
39	A	89.6	Confident	91.2	Very high	45 Å²	45	46.9 Å²	46.9	37%	0.372	27%	0.267	S	S	.	.	H	α-helix	trans	-70.4	-41.9	177.6	0	0	0	0	0	111.6	W36 A37 N47	W36-A39 WeakPolarHBondContact O-CB 3.25Å; W36-A39 PolarHBondContact O-N 3.04Å; A37-A39 VanDerWaalsContact C-N 3.32Å; A37-A39 PolarHBondContact O-N 2.77Å; A39-N47 PolarHBondContact O-ND2 3.14Å
40	I	90.6	Very high	91.2	Very high	3 Å²	3	51.7 Å²	51.7	2%	0.015	29%	0.285	C	S	.	.	H	α-helix	trans	-66.7	-41.5	176.7	-52.4	178.6	0	0	0	111.2	I32 W36 A37 N47 I48 L51 I61 V71 I88 L92	I32-I40 HydrophobicContact CD1-CD1 3.58Å; I32-I40 HydrophobicContact CG2-CD1 4.43Å; W36-I40 PolarHBondContact O-N 3.38Å; A37-I40 PolarHBondContact O-N 2.83Å; I40-N47 PolarHBondContact O-ND2 3.16Å; I40-I48 PolarHBondContact O-N 2.66Å; I40-L51 HydrophobicContact CG2-CD1 4.37Å; I40-I61 HydrophobicContact CB-CD1 3.98Å; I40-I61 HydrophobicContact CD1-CD1 4.35Å; I40-I61 HydrophobicContact CG2-CD1 3.8Å; I40-V71 HydrophobicContact CD1-CG2 3.91Å; I40-I88 HydrophobicContact CD1-CG2 4.13Å; I40-I88 HydrophobicContact CG1-CG2 4.12Å; I40-I88 HydrophobicContact CG2-CD1 4.43Å; I40-L92 HydrophobicContact CD1-CD2 3.79Å; I40-L92 HydrophobicContact CG1-CD2 3.83Å
41	I	90.9	Very high	91	Very high	49 Å²	49	51.5 Å²	51.5	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-70.2	-42.4	179.4	-64.8	169.4	0	0	0	110.8	A37 G45 N47 I48 I61	A37-I41 WeakPolarHBondContact O-CB 3.25Å; A37-I41 VanDerWaalsContact O-CG1 3.24Å; A37-I41 WeakPolarHBondContact O-CG1 3.39Å; A37-I41 PolarHBondContact O-N 3.21Å; I41-G45 CarbonylContact O-C 3.54Å; I41-G45 VanDerWaalsContact O-C 3.24Å; I41-G45 VanDerWaalsContact O-CA 3.23Å; I41-G45 WeakPolarHBondContact O-CA 3.26Å; I41-N47 WeakPolarHBondContact O-CB 3.24Å; I41-N47 PolarHBondContact O-N 3.01Å; I41-N47 VanDerWaalsContact O-N 3.14Å; I41-I48 HydrophobicContact CG2-CG2 4.13Å; I41-I48 PolarHBondContact O-N 3.41Å; I41-I61 HydrophobicContact CD1-CD1 4.44Å; I41-I61 HydrophobicContact CG1-CD1 3.96Å
42	G	88.4	Confident	90.9	Very high	21 Å²	21	56.3 Å²	56.3	22%	0.216	30%	0.302	C	S	.	.			trans	76	165.3	-172.6	0	0	0	0	0	112.9	G38 G44 G45	G38-G42 WeakPolarHBondContact O-CA 3.48Å; G38-G42 PolarHBondContact O-N 2.87Å; G42-G44 PolarHBondContact O-N 3.16Å; G42-G45 PolarHBondContact O-N 3.22Å
43	K	90.1	Very high	90.8	Very high	194 Å²	194	62 Å²	62	84%	0.843	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-59.1	123.9	177.4	-64.1	179	-177.4	176.3	0	109.2	G45 E46	K43-G45 PolarHBondContact O-N 3.07Å; K43-E46 WeakPolarHBondContact O-CB 3.38Å; K43-E46 PolarHBondContact O-N 3.05Å
44	G	88.9	Confident	90.8	Very high	75 Å²	75	66.9 Å²	66.9	77%	0.773	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	64.9	15.6	-178	0	0	0	0	0	115.6	G42 E46	G42-G44 PolarHBondContact O-N 3.16Å; G44-E46 VanDerWaalsContact C-N 3.3Å
45	G	89.3	Confident	90.9	Very high	12 Å²	12	66.9 Å²	66.9	12%	0.124	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	75.1	16.5	-176.5	0	0	0	0	0	114.2	I41 G42 K43 I48 K49	I41-G45 CarbonylContact O-C 3.54Å; I41-G45 VanDerWaalsContact O-C 3.24Å; I41-G45 VanDerWaalsContact O-CA 3.23Å; I41-G45 WeakPolarHBondContact O-CA 3.26Å; G42-G45 PolarHBondContact O-N 3.22Å; K43-G45 PolarHBondContact O-N 3.07Å; G45-I48 VanDerWaalsContact O-CG2 3.23Å; G45-I48 WeakPolarHBondContact O-CG2 3.36Å; G45-K49 WeakPolarHBondContact O-CB 3.23Å; G45-K49 WeakPolarHBondContact O-CD 3.37Å; G45-K49 WeakPolarHBondContact O-CG 3.19Å; G45-K49 PolarHBondContact O-N 3.18Å; G45-K49 VanDerWaalsContact O-N 3.07Å
46	E	92.5	Very high	90.8	Very high	146 Å²	146	66.2 Å²	66.2	68%	0.682	36%	0.357	S	S	*	.	H	α-helix	trans	-62.6	-43.8	-178.5	-174.5	178.6	-177.1	0	0	112.2	K43 G44 K49 R50	K43-E46 WeakPolarHBondContact O-CB 3.38Å; K43-E46 PolarHBondContact O-N 3.05Å; G44-E46 VanDerWaalsContact C-N 3.3Å; E46-K49 PolarHBondContact O-N 3.35Å; E46-R50 WeakPolarHBondContact O-CB 3.23Å; E46-R50 PolarHBondContact O-N 3.07Å
47	N	92.6	Very high	90.7	Very high	18 Å²	18	64.9 Å²	64.9	10%	0.096	35%	0.353	C	S	.	.	H	α-helix	trans	-67.8	-47	-177	-166.5	35.7	0	0	0	111.4	A39 I40 I41 K49 R50 L51	A39-N47 PolarHBondContact O-ND2 3.14Å; I40-N47 PolarHBondContact O-ND2 3.16Å; I41-N47 WeakPolarHBondContact O-CB 3.24Å; I41-N47 PolarHBondContact O-N 3.01Å; I41-N47 VanDerWaalsContact O-N 3.14Å; N47-K49 VanDerWaalsContact C-N 3.29Å; N47-K49 PolarHBondContact O-N 3Å; N47-R50 WeakPolarHBondContact O-CB 3.47Å; N47-R50 PolarHBondContact O-N 2.78Å; N47-R50 VanDerWaalsContact O-N 3.13Å; N47-R50 PolarHBondContact OD1-NH1 3.25Å; N47-R50 PolarHBondContact OD1-NH2 2.79Å; N47-L51 WeakPolarHBondContact O-CG 3.43Å; N47-L51 PolarHBondContact O-N 3.03Å
48	I	91.9	Very high	90.7	Very high	13 Å²	13	69 Å²	69	7%	0.067	38%	0.378	C	S	.	.	H	α-helix	trans	-63.6	-34.8	175.9	-170.1	169.2	0	0	0	112.1	I40 I41 G45 R52 L59	I40-I48 PolarHBondContact O-N 2.66Å; I41-I48 HydrophobicContact CG2-CG2 4.13Å; I41-I48 PolarHBondContact O-N 3.41Å; G45-I48 VanDerWaalsContact O-CG2 3.23Å; G45-I48 WeakPolarHBondContact O-CG2 3.36Å; I48-R52 WeakPolarHBondContact O-CB 3.48Å; I48-R52 WeakPolarHBondContact O-CG 3.2Å; I48-R52 PolarHBondContact O-N 3.05Å; I48-L59 HydrophobicContact CD1-CB 3.95Å; I48-L59 HydrophobicContact CG1-CB 3.89Å
49	K	92.5	Very high	90.7	Very high	128 Å²	128	66.7 Å²	66.7	56%	0.557	35%	0.354	S	S	*	.	H	α-helix	trans	-65	-43.6	173	-76.1	171	-177.2	172.6	0	111.2	G45 E46 N47 R52 T53	G45-K49 WeakPolarHBondContact O-CB 3.23Å; G45-K49 WeakPolarHBondContact O-CD 3.37Å; G45-K49 WeakPolarHBondContact O-CG 3.19Å; G45-K49 PolarHBondContact O-N 3.18Å; G45-K49 VanDerWaalsContact O-N 3.07Å; E46-K49 PolarHBondContact O-N 3.35Å; N47-K49 VanDerWaalsContact C-N 3.29Å; N47-K49 PolarHBondContact O-N 3Å; K49-R52 PolarHBondContact O-N 3.29Å; K49-T53 PolarHBondContact O-N 2.92Å; K49-T53 PolarHBondContact O-OG1 3.04Å; K49-T53 VanDerWaalsContact O-OG1 3.13Å
50	R	93.7	Very high	90.8	Very high	114 Å²	114	67.1 Å²	67.1	43%	0.43	35%	0.354	S	S	.	.	H	α-helix	trans	-57.5	-51.3	175.3	-172.6	-172.3	76.8	-154.2	7.2	111	E46 N47 R52 T53 Q54 D87	E46-R50 WeakPolarHBondContact O-CB 3.23Å; E46-R50 PolarHBondContact O-N 3.07Å; N47-R50 WeakPolarHBondContact O-CB 3.47Å; N47-R50 PolarHBondContact O-N 2.78Å; N47-R50 VanDerWaalsContact O-N 3.13Å; N47-R50 PolarHBondContact OD1-NH1 3.25Å; N47-R50 PolarHBondContact OD1-NH2 2.79Å; R50-R52 VanDerWaalsContact C-N 3.33Å; R50-R52 PolarHBondContact O-N 2.96Å; R50-T53 PolarHBondContact O-N 3.32Å; R50-Q54 VanDerWaalsContact O-CB 3.24Å; R50-Q54 WeakPolarHBondContact O-CB 3.37Å; R50-Q54 PolarHBondContact O-N 3.41Å; R50-D87 IonicContact NH2-OD1 3.07Å; R50-D87 IonicContact NH2-OD2 2.77Å; R50-D87 PolarHBondContact NH2-OD2 2.74Å
51	L	92.2	Very high	90.8	Very high	0 Å²	0	68 Å²	68	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-58.8	-41.8	179.5	-69.2	172.5	0	0	0	112.5	I40 N47 Y55 S57 L59 D87 I88	I40-L51 HydrophobicContact CG2-CD1 4.37Å; N47-L51 WeakPolarHBondContact O-CG 3.43Å; N47-L51 PolarHBondContact O-N 3.03Å; L51-Y55 HydrophobicContact CD2-CD2 4.04Å; L51-Y55 HydrophobicContact CD2-CE2 3.75Å; L51-Y55 PolarHBondContact O-N 3.17Å; L51-Y55 VanDerWaalsContact O-N 3.16Å; L51-S57 PolarHBondContact O-OG 3.49Å; L51-L59 HydrophobicContact CB-CD1 3.61Å; L51-L59 HydrophobicContact CD1-CD2 4.31Å; L51-D87 HydrophobicContact CD2-CB 4.2Å; L51-D87 WeakPolarHBondContact CD2-OD2 3.5Å; L51-I88 HydrophobicContact CD1-CD1 3.9Å; L51-I88 HydrophobicContact CD1-CG1 3.75Å; L51-I88 HydrophobicContact CD2-CG1 4.35Å
52	R	91.3	Very high	90.7	Very high	102 Å²	102	68.7 Å²	68.7	39%	0.385	37%	0.367	S	S	.	.	H	α-helix	trans	-63.7	-43.5	176.6	-71.1	176.3	-179.5	159.2	-1.2	112.2	I48 K49 R50 N56 S57 L59	I48-R52 WeakPolarHBondContact O-CB 3.48Å; I48-R52 WeakPolarHBondContact O-CG 3.2Å; I48-R52 PolarHBondContact O-N 3.05Å; K49-R52 PolarHBondContact O-N 3.29Å; R50-R52 VanDerWaalsContact C-N 3.33Å; R50-R52 PolarHBondContact O-N 2.96Å; R52-N56 CarbonylContact O-C 3.48Å; R52-N56 VanDerWaalsContact O-CA 3.25Å; R52-N56 WeakPolarHBondContact O-CA 3.42Å; R52-N56 PolarHBondContact O-N 3.36Å; R52-S57 VanDerWaalsContact CA-O 3.32Å; R52-S57 WeakPolarHBondContact CA-O 3.42Å; R52-S57 WeakPolarHBondContact CB-O 3.34Å; R52-S57 VanDerWaalsContact CG-O 3.25Å; R52-S57 WeakPolarHBondContact CG-O 3.31Å; R52-S57 PolarHBondContact O-N 3.4Å; R52-L59 HydrophobicContact CG-CB 4.4Å; R52-L59 HydrophobicContact CG-CD1 3.9Å; R52-L59 VanDerWaalsContact CZ-O 3.23Å; R52-L59 PolarHBondContact NE-O 3.2Å; R52-L59 PolarHBondContact NH2-O 2.94Å
53	T	92	Very high	90.5	Very high	122 Å²	122	73.9 Å²	73.9	75%	0.748	39%	0.39	S	S	*	.	H	α-helix	trans	-73.2	-44.7	-180	-56.9	0	0	0	0	112.4	K49 R50	K49-T53 PolarHBondContact O-N 2.92Å; K49-T53 PolarHBondContact O-OG1 3.04Å; K49-T53 VanDerWaalsContact O-OG1 3.13Å; R50-T53 PolarHBondContact O-N 3.32Å
54	Q	91.6	Very high	90.1	Very high	111 Å²	111	65 Å²	65	52%	0.519	35%	0.352	S	S	.	.	H	α-helix	trans	-69.1	-42.4	-173.9	-178.7	173.8	-13.1	0	0	112.4	R50	R50-Q54 VanDerWaalsContact O-CB 3.24Å; R50-Q54 WeakPolarHBondContact O-CB 3.37Å; R50-Q54 PolarHBondContact O-N 3.41Å
55	Y	90.7	Very high	89.9	Confident	32 Å²	32	70 Å²	70	13%	0.125	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.5	10.3	-176.5	-58.4	-68.9	0	0	0	113.4	L51 S57 D83 C84 D87	L51-Y55 HydrophobicContact CD2-CD2 4.04Å; L51-Y55 HydrophobicContact CD2-CE2 3.75Å; L51-Y55 PolarHBondContact O-N 3.17Å; L51-Y55 VanDerWaalsContact O-N 3.16Å; Y55-S57 PolarHBondContact O-N 3.16Å; Y55-S57 VanDerWaalsContact O-N 3.16Å; Y55-D83 HydrophobicContact CD1-CB 4.03Å; Y55-D83 HydrophobicContact CE1-CB 3.61Å; Y55-C84 HydrophobicContact CD1-CB 4.32Å; Y55-C84 HydrophobicContact CD2-CB 3.67Å; Y55-C84 HydrophobicContact CE2-CB 4.18Å; Y55-C84 HydrophobicContact CG-CB 3.75Å; Y55-D87 HydrophobicContact CE2-CB 4.13Å
56	N	87.8	Confident	89.8	Confident	118 Å²	118	70.9 Å²	70.9	63%	0.631	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	45	47.2	-173.5	-169.4	38.3	0	0	0	112.1	R52	R52-N56 CarbonylContact O-C 3.48Å; R52-N56 VanDerWaalsContact O-CA 3.25Å; R52-N56 WeakPolarHBondContact O-CA 3.42Å; R52-N56 PolarHBondContact O-N 3.36Å
57	S	87.4	Confident	89.5	Confident	7 Å²	7	68.8 Å²	68.8	5%	0.049	35%	0.349	C	S	.	.			trans	-111.8	150.9	-168.7	65.8	0	0	0	0	111.6	L51 R52 Y55 L59 S74 C75	L51-S57 PolarHBondContact O-OG 3.49Å; R52-S57 VanDerWaalsContact CA-O 3.32Å; R52-S57 WeakPolarHBondContact CA-O 3.42Å; R52-S57 WeakPolarHBondContact CB-O 3.34Å; R52-S57 VanDerWaalsContact CG-O 3.25Å; R52-S57 WeakPolarHBondContact CG-O 3.31Å; R52-S57 PolarHBondContact O-N 3.4Å; Y55-S57 PolarHBondContact O-N 3.16Å; Y55-S57 VanDerWaalsContact O-N 3.16Å; S57-L59 WeakPolarHBondContact OG-CD1 3.35Å; S57-S74 CarbonylContact C-O 3.54Å; S57-S74 VanDerWaalsContact CA-O 3.26Å; S57-S74 WeakPolarHBondContact CA-O 3.32Å; S57-S74 WeakPolarHBondContact CB-O 3.12Å; S57-C75 WeakPolarHBondContact CB-SG 3.12Å
58	T	90.6	Very high	89.5	Confident	90 Å²	90	67.9 Å²	67.9	55%	0.552	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	95.9	169	-58	0	0	0	0	108.8	M73 S74	T58-M73 WeakPolarHBondContact O-CA 3.43Å; T58-S74 WeakPolarHBondContact CB-OG 3.37Å; T58-S74 PolarHBondContact N-O 3.03Å; T58-S74 PolarHBondContact O-N 3.39Å
59	L	90.8	Very high	89.5	Confident	0 Å²	0	69.2 Å²	69.2	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	135.2	169.6	-69.3	109.8	0	0	0	110.9	I48 L51 R52 S57 V71 K72 M73 I88	I48-L59 HydrophobicContact CD1-CB 3.95Å; I48-L59 HydrophobicContact CG1-CB 3.89Å; L51-L59 HydrophobicContact CB-CD1 3.61Å; L51-L59 HydrophobicContact CD1-CD2 4.31Å; R52-L59 HydrophobicContact CG-CB 4.4Å; R52-L59 HydrophobicContact CG-CD1 3.9Å; R52-L59 VanDerWaalsContact CZ-O 3.23Å; R52-L59 PolarHBondContact NE-O 3.2Å; R52-L59 PolarHBondContact NH2-O 2.94Å; S57-L59 WeakPolarHBondContact OG-CD1 3.35Å; L59-V71 HydrophobicContact CD2-CG1 4.45Å; L59-K72 CarbonylContact C-O 3.59Å; L59-K72 VanDerWaalsContact CA-O 3.32Å; L59-K72 WeakPolarHBondContact CA-O 3.3Å; L59-M73 HydrophobicContact CD2-CE 3.75Å; L59-M73 HydrophobicContact CD2-CG 3.66Å; L59-M73 HydrophobicContact CD2-SD 3.7Å; L59-M73 HydrophobicContact CG-CE 4.26Å; L59-M73 HydrophobicContact CG-CG 3.93Å; L59-M73 HydrophobicContact CG-SD 4.5Å; L59-I88 HydrophobicContact CD2-CD1 3.86Å
60	S	91.2	Very high	89.6	Confident	54 Å²	54	63.5 Å²	63.5	38%	0.378	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	128.4	173	179.3	0	0	0	0	110.5	K72	S60-K72 PolarHBondContact N-O 3.09Å; S60-K72 PolarHBondContact O-N 2.6Å
61	I	91.2	Very high	89.6	Confident	21 Å²	21	58.1 Å²	58.1	11%	0.108	30%	0.304	C	S	.	.			trans	-123.3	96.8	177.3	-53.7	179.1	0	0	0	106.9	A37 I40 I41 R69 V71	A37-I61 HydrophobicContact CB-CG2 4.31Å; I40-I61 HydrophobicContact CB-CD1 3.98Å; I40-I61 HydrophobicContact CD1-CD1 4.35Å; I40-I61 HydrophobicContact CG2-CD1 3.8Å; I41-I61 HydrophobicContact CD1-CD1 4.44Å; I41-I61 HydrophobicContact CG1-CD1 3.96Å; I61-R69 HydrophobicContact CG2-CB 4.32Å; I61-V71 HydrophobicContact CD1-CG1 4.16Å; I61-V71 HydrophobicContact CD1-CG2 3.94Å; I61-V71 HydrophobicContact CG1-CB 4.2Å; I61-V71 HydrophobicContact CG1-CG1 3.85Å; I61-V71 HydrophobicContact CG1-CG2 3.94Å
62	P	87.8	Confident	89.7	Confident	65 Å²	65	61.1 Å²	61.1	42%	0.422	32%	0.317	S	S	.	.			trans	-59.1	144.5	174.8	-21.2	34.3	0	0	0	110.6	S64 V70	P62-S64 PolarHBondContact O-N 2.83Å; P62-V70 WeakPolarHBondContact CD-O 3.38Å
63	D	84.6	Confident	89.7	Confident	130 Å²	130	56.4 Å²	56.4	70%	0.695	30%	0.299	S	S	*	.			trans	-68.5	134.1	171.4	-74.5	-45.6	0	0	0	110.4	R69	D63-R69 IonicContact OD1-CZ 2.77Å; D63-R69 IonicContact OD1-NH1 3.13Å; D63-R69 PolarHBondContact OD1-NH1 3.49Å; D63-R69 IonicContact OD1-NH2 2.88Å
64	S	82.6	Confident	89.7	Confident	8 Å²	8	51.4 Å²	51.4	6%	0.056	27%	0.269	C	S	.	.			trans	-134.2	142.9	173.4	-179.1	0	0	0	0	108.3	P62 T66 R69	P62-S64 PolarHBondContact O-N 2.83Å; S64-T66 VanDerWaalsContact C-N 3.31Å; S64-T66 PolarHBondContact OG-N 3.4Å; S64-T66 VanDerWaalsContact OG-N 3.08Å; S64-T66 PolarHBondContact OG-OG1 3.36Å; S64-R69 PolarHBondContact O-NH2 2.97Å
65	L	83.3	Confident	89.5	Confident	178 Å²	178	46.4 Å²	46.4	93%	0.932	25%	0.247	S	C	*	.	S	Bend	trans	-88.1	-3.9	171.4	-59.8	178	0	0	0	112
66	T	87.2	Confident	89.4	Confident	31 Å²	31	47.2 Å²	47.2	19%	0.19	26%	0.26	C	S	.	.	S	Bend	trans	-85.4	176.8	-178.4	72	0	0	0	0	111.7	S34 S64 E68 A184 F187	S34-T66 PolarHBondContact OG-O 2.89Å; S64-T66 VanDerWaalsContact C-N 3.31Å; S64-T66 PolarHBondContact OG-N 3.4Å; S64-T66 VanDerWaalsContact OG-N 3.08Å; S64-T66 PolarHBondContact OG-OG1 3.36Å; T66-E68 PolarHBondContact O-N 2.98Å; T66-E68 PolarHBondContact OG1-O 2.83Å; T66-A184 WeakPolarHBondContact CB-O 3.21Å; T66-A184 WeakPolarHBondContact CG2-O 3.44Å; T66-A184 PolarHBondContact OG1-O 3.03Å; T66-F187 HydrophobicContact CG2-CB 3.79Å
67	R	86.9	Confident	89.5	Confident	102 Å²	102	45.8 Å²	45.8	39%	0.385	25%	0.252	S	S	.	.	S	Bend	trans	-73.6	-10.2	-177.7	-64.2	-174.2	-176.9	-132.7	8.7	113.7	P33 S34 F187 E200	P33-R67 WeakPolarHBondContact CA-O 3.24Å; S34-R67 PolarHBondContact N-O 2.82Å; S34-R67 VanDerWaalsContact OG-C 3.25Å; S34-R67 PolarHBondContact OG-O 3.22Å; R67-F187 HydrophobicContact CB-CE1 4.27Å; R67-F187 HydrophobicContact CB-CE2 4.36Å; R67-F187 HydrophobicContact CB-CZ 4.02Å; R67-F187 HydrophobicContact CG-CE1 4.18Å; R67-F187 HydrophobicContact CG-CZ 4.27Å; R67-E200 IonicContact CZ-OE2 3.99Å; R67-E200 VanDerWaalsContact CZ-OE2 3.3Å; R67-E200 IonicContact NH1-OE2 3.6Å; R67-E200 PolarHBondContact NH1-OE2 2.97Å; R67-E200 IonicContact NH2-OE2 2.63Å; R67-E200 PolarHBondContact NH2-OE2 2.73Å
68	E	92.2	Very high	89.5	Confident	0 Å²	0	47 Å²	47	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	161.1	-179.6	62.1	-172.4	-153.5	0	0	112.1	L31 I32 S34 T66 Y182 A184 F187 Y195 G197 Y198	L31-E68 HydrophobicContact CD1-CB 4.09Å; L31-E68 HydrophobicContact CD1-CG 4.04Å; I32-E68 CarbonylContact O-C 3.5Å; I32-E68 WeakPolarHBondContact O-CA 3.47Å; I32-E68 WeakPolarHBondContact O-CB 3.5Å; S34-E68 PolarHBondContact OG-N 3.28Å; S34-E68 PolarHBondContact OG-O 2.84Å; T66-E68 PolarHBondContact O-N 2.98Å; T66-E68 PolarHBondContact OG1-O 2.83Å; E68-Y182 VanDerWaalsContact OE1-CE1 3.23Å; E68-Y182 WeakPolarHBondContact OE1-CE1 3.41Å; E68-Y182 VanDerWaalsContact OE1-CZ 3.27Å; E68-Y182 PolarHBondContact OE1-OH 2.77Å; E68-A184 WeakPolarHBondContact O-CB 3.5Å; E68-F187 VanDerWaalsContact CD-CD2 3.46Å; E68-F187 HydrophobicContact CG-CD2 3.73Å; E68-F187 HydrophobicContact CG-CE2 4.37Å; E68-F187 HydrophobicContact CG-CG 4.48Å; E68-Y195 VanDerWaalsContact CD-OH 3.28Å; E68-Y195 PolarHBondContact OE1-OH 3.21Å; E68-Y195 PolarHBondContact OE2-OH 3.49Å; E68-G197 WeakPolarHBondContact OE2-CA 3.48Å; E68-Y198 HydrophobicContact CB-CD2 3.96Å; E68-Y198 PolarHBondContact OE2-N 3.47Å
69	R	92.9	Very high	89.6	Confident	41 Å²	41	46.8 Å²	46.8	16%	0.155	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	150.3	178.4	-76.2	174.7	179.3	-133.5	-1.1	109.4	I32 I61 D63 S64	I32-R69 HydrophobicContact CG1-CB 4.1Å; I32-R69 WeakPolarHBondContact CG1-O 3.14Å; I32-R69 PolarHBondContact N-O 2.89Å; I32-R69 PolarHBondContact O-N 2.98Å; I61-R69 HydrophobicContact CG2-CB 4.32Å; D63-R69 IonicContact OD1-CZ 2.77Å; D63-R69 IonicContact OD1-NH1 3.13Å; D63-R69 PolarHBondContact OD1-NH1 3.49Å; D63-R69 IonicContact OD1-NH2 2.88Å; S64-R69 PolarHBondContact O-NH2 2.97Å
70	V	93.8	Very high	89.5	Confident	7 Å²	7	50 Å²	50	4%	0.042	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	115.9	173.9	-178	0	0	0	0	109.3	R29 I30 L31 P62 L107 Y182 A184	R29-V70 HydrophobicContact CB-CG1 4.23Å; I30-V70 CarbonylContact O-C 3.58Å; I30-V70 WeakPolarHBondContact O-CA 3.31Å; L31-V70 HydrophobicContact CD1-CG2 3.99Å; P62-V70 WeakPolarHBondContact CD-O 3.38Å; V70-L107 HydrophobicContact CB-CD1 4.44Å; V70-L107 HydrophobicContact CG1-CD1 3.78Å; V70-L107 HydrophobicContact CG2-CD1 3.78Å; V70-Y182 HydrophobicContact CG2-CD1 3.87Å; V70-Y182 HydrophobicContact CG2-CE1 4.4Å; V70-A184 HydrophobicContact CG2-CB 4.36Å
71	V	94.1	Very high	89.6	Confident	1 Å²	1	47.5 Å²	47.5	1%	0.006	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.4	169.1	-173.7	0	0	0	0	107.7	R29 I30 I32 I40 L59 I61 M73	R29-V71 CarbonylContact C-O 3.24Å; R29-V71 VanDerWaalsContact CA-O 3.31Å; R29-V71 WeakPolarHBondContact CA-O 3.26Å; I30-V71 HydrophobicContact CB-CB 4.25Å; I30-V71 PolarHBondContact N-O 3.29Å; I30-V71 PolarHBondContact O-N 3.08Å; I32-V71 HydrophobicContact CD1-CG2 3.47Å; I32-V71 VanDerWaalsContact CD1-CG2 3.47Å; I32-V71 HydrophobicContact CG1-CG2 3.85Å; I32-V71 HydrophobicContact CG2-CG2 4.1Å; I40-V71 HydrophobicContact CD1-CG2 3.91Å; L59-V71 HydrophobicContact CD2-CG1 4.45Å; I61-V71 HydrophobicContact CD1-CG1 4.16Å; I61-V71 HydrophobicContact CD1-CG2 3.94Å; I61-V71 HydrophobicContact CG1-CB 4.2Å; I61-V71 HydrophobicContact CG1-CG1 3.85Å; I61-V71 HydrophobicContact CG1-CG2 3.94Å; V71-M73 HydrophobicContact CG1-CG 3.76Å; V71-M73 HydrophobicContact CG1-SD 4.08Å
72	K	93.9	Very high	89.7	Confident	64 Å²	64	46.7 Å²	46.7	28%	0.278	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	131.6	168.8	-56.9	-168.1	175.9	-162.2	0	108.8	R29 L59 S60	R29-K72 HydrophobicContact CG-CG 4.31Å; L59-K72 CarbonylContact C-O 3.59Å; L59-K72 VanDerWaalsContact CA-O 3.32Å; L59-K72 WeakPolarHBondContact CA-O 3.3Å; S60-K72 PolarHBondContact N-O 3.09Å; S60-K72 PolarHBondContact O-N 2.6Å
73	M	91.9	Very high	89.9	Confident	2 Å²	2	47.9 Å²	47.9	1%	0.01	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	126.8	179.5	-59.9	-179	51.5	0	0	108.5	E27 L28 I30 T58 L59 V71 L81 C84 I88	E27-M73 CarbonylContact C-O 3.58Å; E27-M73 WeakPolarHBondContact CA-O 3.06Å; L28-M73 PolarHBondContact N-O 3.24Å; L28-M73 PolarHBondContact O-N 3.41Å; I30-M73 HydrophobicContact CD1-SD 3.63Å; T58-M73 WeakPolarHBondContact O-CA 3.43Å; L59-M73 HydrophobicContact CD2-CE 3.75Å; L59-M73 HydrophobicContact CD2-CG 3.66Å; L59-M73 HydrophobicContact CD2-SD 3.7Å; L59-M73 HydrophobicContact CG-CE 4.26Å; L59-M73 HydrophobicContact CG-CG 3.93Å; L59-M73 HydrophobicContact CG-SD 4.5Å; V71-M73 HydrophobicContact CG1-CG 3.76Å; V71-M73 HydrophobicContact CG1-SD 4.08Å; M73-L81 HydrophobicContact CB-CD1 4.04Å; M73-L81 HydrophobicContact CE-CD1 4.18Å; M73-C84 HydrophobicContact CE-CB 4Å; M73-C84 WeakPolarHBondContact CE-SG 3.45Å; M73-I88 HydrophobicContact CE-CD1 3.65Å; M73-I88 HydrophobicContact SD-CD1 3.8Å
74	S	91.2	Very high	90.2	Very high	18 Å²	18	41.7 Å²	41.7	13%	0.126	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	141.5	165.7	60.4	0	0	0	0	109.9	S57 T58	S57-S74 CarbonylContact C-O 3.54Å; S57-S74 VanDerWaalsContact CA-O 3.26Å; S57-S74 WeakPolarHBondContact CA-O 3.32Å; S57-S74 WeakPolarHBondContact CB-O 3.12Å; T58-S74 WeakPolarHBondContact CB-OG 3.37Å; T58-S74 PolarHBondContact N-O 3.03Å; T58-S74 PolarHBondContact O-N 3.39Å
75	C	88.4	Confident	90.7	Very high	6 Å²	6	41.4 Å²	41.4	4%	0.041	22%	0.215	C	C	.	.			trans	-127.3	167.4	175.6	-62.3	0	0	0	0	109.6	G25 S57 M80 L81	G25-C75 WeakPolarHBondContact CA-O 3.37Å; S57-C75 WeakPolarHBondContact CB-SG 3.12Å; C75-M80 HydrophobicContact CB-CB 4.26Å; C75-L81 HydrophobicContact CB-CB 3.95Å; C75-L81 VanDerWaalsContact SG-CA 3.55Å
76	A	87.9	Confident	91.1	Very high	48 Å²	48	34.4 Å²	34.4	40%	0.397	18%	0.183	S	C	.	.	S	Bend	trans	-64.4	-45.2	173.2	0	0	0	0	0	111.4
77	D	89	Confident	91.3	Very high	89 Å²	89	35.1 Å²	35.1	48%	0.476	19%	0.186	S	C	.	.	S	Bend	trans	-128.7	156.3	-174.6	-60.2	-57.2	0	0	0	111.9	D79 M80 L81	D77-D79 VanDerWaalsContact C-N 3.29Å; D77-D79 PolarHBondContact O-N 3.03Å; D77-M80 PolarHBondContact O-N 3.42Å; D77-L81 PolarHBondContact O-N 3.01Å
78	L	89.1	Confident	91.5	Very high	31 Å²	31	30.5 Å²	30.5	16%	0.162	17%	0.169	C	C	.	.	H	α-helix	trans	-62.3	-35.8	178.2	-175.6	65.7	0	0	0	112.4	P26 L81 C82 K164 L167 K168	P26-L78 HydrophobicContact CG-CB 4.48Å; L78-L81 PolarHBondContact O-N 3.03Å; L78-C82 PolarHBondContact O-N 3.17Å; L78-C82 PolarHBondContact O-SG 3.45Å; L78-K164 HydrophobicContact CD2-CG 3.78Å; L78-K164 HydrophobicContact CG-CG 4.22Å; L78-L167 HydrophobicContact CD1-CB 3.64Å; L78-L167 HydrophobicContact CD1-CD1 3.52Å; L78-L167 HydrophobicContact CD1-CG 4.25Å; L78-K168 HydrophobicContact CD2-CG 3.87Å
79	D	90.8	Very high	91.3	Very high	87 Å²	87	30.6 Å²	30.6	47%	0.465	17%	0.169	S	C	.	.	H	α-helix	trans	-67.7	-44.5	180	-66.9	-43.1	0	0	0	111.3	D77 L81 C82 D83 K164	D77-D79 VanDerWaalsContact C-N 3.29Å; D77-D79 PolarHBondContact O-N 3.03Å; D79-L81 VanDerWaalsContact C-N 3.27Å; D79-L81 PolarHBondContact O-N 3.24Å; D79-C82 WeakPolarHBondContact O-CB 3.43Å; D79-C82 PolarHBondContact O-N 3.11Å; D79-C82 VanDerWaalsContact O-N 3.09Å; D79-D83 PolarHBondContact O-N 2.94Å; D79-K164 WeakPolarHBondContact OD1-CE 3.28Å; D79-K164 IonicContact OD1-NZ 3.3Å; D79-K164 PolarHBondContact OD1-NZ 2.97Å
80	M	90.5	Very high	90.9	Very high	68 Å²	68	31.7 Å²	31.7	34%	0.335	18%	0.182	S	C	.	.	H	α-helix	trans	-61.9	-35.6	175.2	-66.3	-171.5	-174.3	0	0	112.4	C75 D77 C84	C75-M80 HydrophobicContact CB-CB 4.26Å; D77-M80 PolarHBondContact O-N 3.42Å; M80-C84 VanDerWaalsContact O-CB 3.31Å; M80-C84 WeakPolarHBondContact O-CB 3.4Å; M80-C84 PolarHBondContact O-N 3.17Å
81	L	92	Very high	90.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-65	-42.5	174.2	-176.9	64	0	0	0	111.5	P26 L28 M73 C75 D77 L78 D79 C84 I85 L167	P26-L81 HydrophobicContact CB-CD2 4.21Å; P26-L81 HydrophobicContact CG-CD2 4.29Å; L28-L81 HydrophobicContact CB-CD1 4.27Å; L28-L81 HydrophobicContact CB-CD2 3.98Å; M73-L81 HydrophobicContact CB-CD1 4.04Å; M73-L81 HydrophobicContact CE-CD1 4.18Å; C75-L81 HydrophobicContact CB-CB 3.95Å; C75-L81 VanDerWaalsContact SG-CA 3.55Å; D77-L81 PolarHBondContact O-N 3.01Å; L78-L81 PolarHBondContact O-N 3.03Å; D79-L81 VanDerWaalsContact C-N 3.27Å; D79-L81 PolarHBondContact O-N 3.24Å; L81-C84 PolarHBondContact O-N 3.44Å; L81-I85 HydrophobicContact CG-CD1 4.33Å; L81-I85 VanDerWaalsContact O-CG1 3.26Å; L81-I85 WeakPolarHBondContact O-CG1 2.81Å; L81-I85 PolarHBondContact O-N 2.93Å; L81-L167 HydrophobicContact CD2-CD1 3.41Å; L81-L167 VanDerWaalsContact CD2-CD1 3.41Å; L81-L167 HydrophobicContact CG-CD1 4.42Å
82	C	92.8	Very high	89.6	Confident	5 Å²	5	33.7 Å²	33.7	3%	0.034	20%	0.196	C	C	.	.	H	α-helix	trans	-62.5	-44.4	176.2	-69.3	0	0	0	0	111.9	L78 D79 C84 I85 A86 V160	L78-C82 PolarHBondContact O-N 3.17Å; L78-C82 PolarHBondContact O-SG 3.45Å; D79-C82 WeakPolarHBondContact O-CB 3.43Å; D79-C82 PolarHBondContact O-N 3.11Å; D79-C82 VanDerWaalsContact O-N 3.09Å; C82-C84 VanDerWaalsContact C-N 3.34Å; C82-C84 PolarHBondContact O-N 3.21Å; C82-I85 PolarHBondContact O-N 2.91Å; C82-A86 PolarHBondContact O-N 3.33Å; C82-V160 HydrophobicContact CB-CG1 3.64Å
83	D	92.5	Very high	88.7	Confident	89 Å²	89	34.3 Å²	34.3	48%	0.476	20%	0.199	S	C	.	.	H	α-helix	trans	-64.4	-39.8	176.7	-64.3	-24	0	0	0	111.5	Y55 D79 I85 A86 D87	Y55-D83 HydrophobicContact CD1-CB 4.03Å; Y55-D83 HydrophobicContact CE1-CB 3.61Å; D79-D83 PolarHBondContact O-N 2.94Å; D83-I85 VanDerWaalsContact C-N 3.31Å; D83-I85 PolarHBondContact O-N 2.95Å; D83-A86 WeakPolarHBondContact O-CB 3.43Å; D83-A86 PolarHBondContact O-N 3.02Å; D83-D87 PolarHBondContact O-N 3.4Å; D83-D87 VanDerWaalsContact O-N 3.11Å
84	C	92	Very high	87.5	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-63.3	-36.9	175.7	-170	0	0	0	0	112.3	Y55 M73 M80 L81 C82 D87 I88	Y55-C84 HydrophobicContact CD1-CB 4.32Å; Y55-C84 HydrophobicContact CD2-CB 3.67Å; Y55-C84 HydrophobicContact CE2-CB 4.18Å; Y55-C84 HydrophobicContact CG-CB 3.75Å; M73-C84 HydrophobicContact CE-CB 4Å; M73-C84 WeakPolarHBondContact CE-SG 3.45Å; M80-C84 VanDerWaalsContact O-CB 3.31Å; M80-C84 WeakPolarHBondContact O-CB 3.4Å; M80-C84 PolarHBondContact O-N 3.17Å; L81-C84 PolarHBondContact O-N 3.44Å; C82-C84 VanDerWaalsContact C-N 3.34Å; C82-C84 PolarHBondContact O-N 3.21Å; C84-D87 PolarHBondContact O-N 3.49Å; C84-I88 WeakPolarHBondContact O-CG1 3.39Å; C84-I88 PolarHBondContact O-N 2.76Å
85	I	92.5	Very high	85.8	Confident	2 Å²	2	44.7 Å²	44.7	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-68.1	-41.5	174.4	-67	165.1	0	0	0	110.7	L28 L81 C82 D83 D87 I88 L89 L104 V160 V163	L28-I85 HydrophobicContact CD2-CD1 3.34Å; L28-I85 HydrophobicContact CD2-CG1 4.15Å; L81-I85 HydrophobicContact CG-CD1 4.33Å; L81-I85 VanDerWaalsContact O-CG1 3.26Å; L81-I85 WeakPolarHBondContact O-CG1 2.81Å; L81-I85 PolarHBondContact O-N 2.93Å; C82-I85 PolarHBondContact O-N 2.91Å; D83-I85 VanDerWaalsContact C-N 3.31Å; D83-I85 PolarHBondContact O-N 2.95Å; I85-D87 PolarHBondContact O-N 2.77Å; I85-I88 PolarHBondContact O-N 3.2Å; I85-I88 VanDerWaalsContact O-N 3.08Å; I85-L89 HydrophobicContact CG2-CD1 3.82Å; I85-L89 HydrophobicContact CG2-CG 3.9Å; I85-L89 VanDerWaalsContact O-CG 3.3Å; I85-L89 WeakPolarHBondContact O-CG 3.34Å; I85-L89 PolarHBondContact O-N 3.31Å; I85-L104 HydrophobicContact CG2-CD2 4.01Å; I85-V160 HydrophobicContact CG2-CG2 4.26Å; I85-V163 HydrophobicContact CD1-CB 4.32Å; I85-V163 HydrophobicContact CD1-CG1 3.63Å; I85-V163 HydrophobicContact CD1-CG2 4.43Å
86	A	92.2	Very high	84.1	Confident	32 Å²	32	51.8 Å²	51.8	26%	0.264	30%	0.298	S	S	.	.	H	α-helix	trans	-58.5	-34.7	176.7	0	0	0	0	0	112.3	C82 D83 P90 V156 V160	C82-A86 PolarHBondContact O-N 3.33Å; D83-A86 WeakPolarHBondContact O-CB 3.43Å; D83-A86 PolarHBondContact O-N 3.02Å; A86-P90 WeakPolarHBondContact O-CD 3.34Å; A86-V156 HydrophobicContact CB-CG1 4.06Å; A86-V160 HydrophobicContact CB-CG2 3.92Å
87	D	90.8	Very high	82.6	Confident	45 Å²	45	53.7 Å²	53.7	24%	0.241	31%	0.305	C	S	.	.	H	α-helix	trans	-75.1	-32.6	174.8	-166.7	29.5	0	0	0	112.8	R50 L51 Y55 D83 C84 I85	R50-D87 IonicContact NH2-OD1 3.07Å; R50-D87 IonicContact NH2-OD2 2.77Å; R50-D87 PolarHBondContact NH2-OD2 2.74Å; L51-D87 HydrophobicContact CD2-CB 4.2Å; L51-D87 WeakPolarHBondContact CD2-OD2 3.5Å; Y55-D87 HydrophobicContact CE2-CB 4.13Å; D83-D87 PolarHBondContact O-N 3.4Å; D83-D87 VanDerWaalsContact O-N 3.11Å; C84-D87 PolarHBondContact O-N 3.49Å; I85-D87 PolarHBondContact O-N 2.77Å
88	I	90.2	Very high	81.1	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.031	33%	0.327	C	S	.	.	H	α-helix	trans	-78.6	-37.4	-179.7	-70.3	165	0	0	0	112.1	I40 L51 L59 M73 C84 I85 S91 L92	I40-I88 HydrophobicContact CD1-CG2 4.13Å; I40-I88 HydrophobicContact CG1-CG2 4.12Å; I40-I88 HydrophobicContact CG2-CD1 4.43Å; L51-I88 HydrophobicContact CD1-CD1 3.9Å; L51-I88 HydrophobicContact CD1-CG1 3.75Å; L51-I88 HydrophobicContact CD2-CG1 4.35Å; L59-I88 HydrophobicContact CD2-CD1 3.86Å; M73-I88 HydrophobicContact CE-CD1 3.65Å; M73-I88 HydrophobicContact SD-CD1 3.8Å; C84-I88 WeakPolarHBondContact O-CG1 3.39Å; C84-I88 PolarHBondContact O-N 2.76Å; I85-I88 PolarHBondContact O-N 3.2Å; I85-I88 VanDerWaalsContact O-N 3.08Å; I88-S91 WeakPolarHBondContact O-CA 3.48Å; I88-S91 VanDerWaalsContact O-CB 3.27Å; I88-S91 WeakPolarHBondContact O-CB 3.47Å; I88-S91 PolarHBondContact O-N 2.84Å; I88-L92 HydrophobicContact CG2-CD1 3.98Å; I88-L92 HydrophobicContact CG2-CD2 4.17Å; I88-L92 HydrophobicContact CG2-CG 3.95Å; I88-L92 PolarHBondContact O-N 2.82Å
89	L	89.4	Confident	79.8	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-53.9	-45.2	-174	-77.7	170.7	0	0	0	114.1	I85 S91 L92 H102 L104 V156 V159 V160	I85-L89 HydrophobicContact CG2-CD1 3.82Å; I85-L89 HydrophobicContact CG2-CG 3.9Å; I85-L89 VanDerWaalsContact O-CG 3.3Å; I85-L89 WeakPolarHBondContact O-CG 3.34Å; I85-L89 PolarHBondContact O-N 3.31Å; L89-S91 PolarHBondContact O-N 3.27Å; L89-L92 WeakPolarHBondContact O-CB 3.29Å; L89-L92 PolarHBondContact O-N 3.06Å; L89-H102 HydrophobicContact CD2-CB 4.2Å; L89-H102 PolarHBondContact O-ND1 2.79Å; L89-L104 HydrophobicContact CD2-CB 4Å; L89-L104 HydrophobicContact CD2-CD1 4.06Å; L89-L104 HydrophobicContact CD2-CD2 4.44Å; L89-L104 HydrophobicContact CD2-CG 4.4Å; L89-V156 HydrophobicContact CD1-CG1 4.07Å; L89-V159 HydrophobicContact CD1-CB 4.05Å; L89-V159 HydrophobicContact CD1-CG1 3.87Å; L89-V159 HydrophobicContact CD2-CG1 4.17Å; L89-V160 HydrophobicContact CD1-CG2 4.01Å
90	P	85.1	Confident	78.9	Confident	63 Å²	63	60.6 Å²	60.6	41%	0.409	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-62.3	-30.5	174.7	-23.9	34.4	0	0	0	113.2	A86 L92 E93	A86-P90 WeakPolarHBondContact O-CD 3.34Å; P90-L92 PolarHBondContact O-N 2.73Å; P90-E93 PolarHBondContact O-N 2.92Å
91	S	80.9	Confident	78.5	Confident	42 Å²	42	63.3 Å²	63.3	29%	0.294	37%	0.369	S	S	.	.	G	3₁₀ helix	trans	-73.6	-13.9	177	-58.1	0	0	0	0	113.1	I88 L89	I88-S91 WeakPolarHBondContact O-CA 3.48Å; I88-S91 VanDerWaalsContact O-CB 3.27Å; I88-S91 WeakPolarHBondContact O-CB 3.47Å; I88-S91 PolarHBondContact O-N 2.84Å; L89-S91 PolarHBondContact O-N 3.27Å
92	L	79.7	Confident	78.4	Confident	9 Å²	9	64 Å²	64	5%	0.047	37%	0.372	C	S	.	.	G	3₁₀ helix	trans	-92.7	2.6	177.9	-57.8	-175.2	0	0	0	112.9	I32 W36 I40 I88 L89 P90 L104	I32-L92 HydrophobicContact CG2-CD1 4.5Å; W36-L92 HydrophobicContact CB-CD2 3.82Å; W36-L92 HydrophobicContact CD2-CB 4.19Å; W36-L92 HydrophobicContact CD2-CD2 4.22Å; W36-L92 HydrophobicContact CE3-CB 3.71Å; W36-L92 HydrophobicContact CE3-CD1 4.29Å; W36-L92 HydrophobicContact CE3-CD2 3.84Å; W36-L92 HydrophobicContact CE3-CG 4.13Å; W36-L92 HydrophobicContact CG-CD2 4.26Å; W36-L92 HydrophobicContact CH2-CB 4.49Å; W36-L92 VanDerWaalsContact CH2-O 3.24Å; W36-L92 WeakPolarHBondContact CH2-O 3.33Å; W36-L92 WeakPolarHBondContact CZ2-O 3.32Å; W36-L92 HydrophobicContact CZ3-CB 3.88Å; W36-L92 HydrophobicContact CZ3-CD1 4.49Å; I40-L92 HydrophobicContact CD1-CD2 3.79Å; I40-L92 HydrophobicContact CG1-CD2 3.83Å; I88-L92 HydrophobicContact CG2-CD1 3.98Å; I88-L92 HydrophobicContact CG2-CD2 4.17Å; I88-L92 HydrophobicContact CG2-CG 3.95Å; I88-L92 PolarHBondContact O-N 2.82Å; L89-L92 WeakPolarHBondContact O-CB 3.29Å; L89-L92 PolarHBondContact O-N 3.06Å; P90-L92 PolarHBondContact O-N 2.73Å; L92-L104 HydrophobicContact CD1-CD1 4.23Å
93	E	74.2	Confident	78.3	Confident	76 Å²	76	66.2 Å²	66.2	36%	0.355	38%	0.382	S	S	.	.			trans	-77.7	137.3	177.9	-65.1	-168.3	135.9	0	0	112.1	P90 S95 H102	P90-E93 PolarHBondContact O-N 2.92Å; E93-S95 PolarHBondContact O-N 2.94Å; E93-H102 WeakPolarHBondContact CG-ND1 3.41Å; E93-H102 IonicContact OE1-CE1 3.62Å; E93-H102 PolarHBondContact OE1-CE1 2.9Å; E93-H102 IonicContact OE1-CG 2.76Å; E93-H102 IonicContact OE1-ND1 2.83Å; E93-H102 PolarHBondContact OE1-ND1 3.31Å; E93-H102 IonicContact OE1-NE2 3.55Å; E93-H102 PolarHBondContact OE1-NE2 3.41Å; E93-H102 IonicContact OE2-CE1 2.63Å
94	E	66.3	Low	78.3	Confident	105 Å²	105	62.1 Å²	62.1	49%	0.491	36%	0.36	S	S	.	.			trans	-76.4	117.6	159.2	-70.4	178	-148.8	0	0	107	K35 W36 N96 T97	K35-E94 WeakPolarHBondContact CE-OE1 3.31Å; K35-E94 VanDerWaalsContact NZ-CD 3.32Å; K35-E94 IonicContact NZ-OE1 3.26Å; K35-E94 PolarHBondContact NZ-OE1 3Å; K35-E94 IonicContact NZ-OE2 2.7Å; W36-E94 HydrophobicContact CZ2-CG 4.37Å; E94-N96 PolarHBondContact O-N 2.7Å; E94-T97 PolarHBondContact O-N 2.68Å
95	S	56	Low	78.5	Confident	133 Å²	133	63 Å²	63	93%	0.93	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	18.8	-175.2	30	0	0	0	0	116.3	E93	E93-S95 PolarHBondContact O-N 2.94Å
96	N	52.8	Low	78.6	Confident	156 Å²	156	62.9 Å²	62.9	83%	0.834	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129	1.6	-171.2	-139.5	15.6	0	0	0	115.2	E94	E94-N96 PolarHBondContact O-N 2.7Å
97	T	56	Low	78.8	Confident	87 Å²	87	61.8 Å²	61.8	53%	0.534	35%	0.352	S	S	.	.			trans	-110.7	103.4	172.2	48.6	0	0	0	0	108.5	E94 Q99	E94-T97 PolarHBondContact O-N 2.68Å; T97-Q99 PolarHBondContact O-N 2.81Å
98	G	56.5	Low	79	Confident	92 Å²	92	60 Å²	60	95%	0.948	34%	0.343	S	S	*	.			trans	-65.9	27.9	174.1	0	0	0	0	0	114.6
99	Q	63.4	Low	79.2	Confident	131 Å²	131	60 Å²	60	61%	0.612	34%	0.342	S	S	*	.	S	Bend	trans	-107.4	122.7	174.4	-66.3	179.5	-17.3	0	0	106.7	T97 Q101	T97-Q99 PolarHBondContact O-N 2.81Å; Q99-Q101 PolarHBondContact O-N 3.36Å
100	M	71.8	Confident	79.3	Confident	129 Å²	129	62 Å²	62	64%	0.635	35%	0.352	S	S	*	.			trans	-71.1	32.4	179.7	-62.4	-69.2	-177.5	0	0	113.1	E155	M100-E155 WeakPolarHBondContact CB-OE1 3.25Å; M100-E155 WeakPolarHBondContact CB-OE2 3.48Å; M100-E155 VanDerWaalsContact O-CD 3.3Å
101	Q	81.7	Confident	79.6	Confident	125 Å²	125	60.2 Å²	60.2	58%	0.584	34%	0.341	S	S	*	.			trans	-102.1	114.1	-176.9	-65.6	-170.7	10.6	0	0	110	Q99	Q99-Q101 PolarHBondContact O-N 3.36Å
102	H	88.9	Confident	80.2	Confident	15 Å²	15	59.6 Å²	59.6	7%	0.069	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	143.6	174.4	-55.2	-86.9	0	0	0	110.5	L89 E93 T153 G154 V156	L89-H102 HydrophobicContact CD2-CB 4.2Å; L89-H102 PolarHBondContact O-ND1 2.79Å; E93-H102 WeakPolarHBondContact CG-ND1 3.41Å; E93-H102 IonicContact OE1-CE1 3.62Å; E93-H102 PolarHBondContact OE1-CE1 2.9Å; E93-H102 IonicContact OE1-CG 2.76Å; E93-H102 IonicContact OE1-ND1 2.83Å; E93-H102 PolarHBondContact OE1-ND1 3.31Å; E93-H102 IonicContact OE1-NE2 3.55Å; E93-H102 PolarHBondContact OE1-NE2 3.41Å; E93-H102 IonicContact OE2-CE1 2.63Å; H102-T153 VanDerWaalsContact O-CA 3.29Å; H102-T153 WeakPolarHBondContact O-CA 3.49Å; H102-G154 PolarHBondContact N-O 3.06Å; H102-G154 PolarHBondContact O-N 3.3Å; H102-G154 VanDerWaalsContact O-N 3.07Å; H102-V156 WeakPolarHBondContact CD2-CG2 3.27Å; H102-V156 WeakPolarHBondContact NE2-CG2 3.4Å
103	E	90.8	Very high	80.9	Confident	51 Å²	51	59.1 Å²	59.1	24%	0.238	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	127.2	171.9	178.6	178.2	160	0	0	110.2	R105 Q151 L152 T153	E103-R105 IonicContact OE1-CZ 3.69Å; E103-R105 IonicContact OE1-NE 3.9Å; E103-R105 PolarHBondContact OE1-NE 3.28Å; E103-R105 IonicContact OE1-NH2 2.68Å; E103-R105 PolarHBondContact OE1-NH2 3.48Å; E103-Q151 HydrophobicContact CG-CG 4Å; E103-Q151 PolarHBondContact OE1-NE2 3.4Å; E103-Q151 PolarHBondContact OE2-NE2 3.1Å; E103-L152 CarbonylContact C-O 3.54Å; E103-L152 WeakPolarHBondContact CA-O 3.09Å; E103-T153 HydrophobicContact CB-CG2 4.03Å; E103-T153 HydrophobicContact CG-CG2 3.91Å
104	L	93.5	Very high	81.8	Confident	3 Å²	3	57.3 Å²	57.3	2%	0.016	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	135.3	174.4	-171.3	69.3	0	0	0	110.2	I30 I85 L89 L92 I106 Q151 L152 V159 V163	I30-L104 HydrophobicContact CD1-CD1 4.16Å; I30-L104 HydrophobicContact CG1-CD1 4.43Å; I30-L104 HydrophobicContact CG2-CD1 3.5Å; I30-L104 VanDerWaalsContact CG2-CD1 3.5Å; I30-L104 HydrophobicContact CG2-CG 4.33Å; I85-L104 HydrophobicContact CG2-CD2 4.01Å; L89-L104 HydrophobicContact CD2-CB 4Å; L89-L104 HydrophobicContact CD2-CD1 4.06Å; L89-L104 HydrophobicContact CD2-CD2 4.44Å; L89-L104 HydrophobicContact CD2-CG 4.4Å; L92-L104 HydrophobicContact CD1-CD1 4.23Å; L104-I106 HydrophobicContact CD2-CG2 4.06Å; L104-I106 HydrophobicContact CG-CG2 4.2Å; L104-Q151 CarbonylContact O-C 3.51Å; L104-Q151 WeakPolarHBondContact O-CA 3.41Å; L104-L152 HydrophobicContact CB-CB 4.43Å; L104-L152 PolarHBondContact N-O 3.22Å; L104-L152 PolarHBondContact O-N 2.99Å; L104-V159 HydrophobicContact CB-CG1 3.87Å; L104-V159 HydrophobicContact CD2-CG1 3.98Å; L104-V163 HydrophobicContact CD2-CG2 3.67Å
105	R	95.2	Very high	83	Confident	19 Å²	19	53.7 Å²	53.7	7%	0.072	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	121	173.9	-66.1	-171.7	-168.8	174.1	6.2	110.6	I30 L31 E103 V149 I150 Q151 G196 G197 Y198	I30-R105 CarbonylContact C-O 3.58Å; I30-R105 VanDerWaalsContact CA-O 3.31Å; I30-R105 WeakPolarHBondContact CA-O 3.47Å; I30-R105 VanDerWaalsContact CG2-O 3.25Å; I30-R105 WeakPolarHBondContact CG2-O 3.43Å; L31-R105 HydrophobicContact CB-CB 4.17Å; L31-R105 PolarHBondContact N-O 3.33Å; E103-R105 IonicContact OE1-CZ 3.69Å; E103-R105 IonicContact OE1-NE 3.9Å; E103-R105 PolarHBondContact OE1-NE 3.28Å; E103-R105 IonicContact OE1-NH2 2.68Å; E103-R105 PolarHBondContact OE1-NH2 3.48Å; R105-V149 HydrophobicContact CB-CG1 3.8Å; R105-V149 HydrophobicContact CG-CG1 4.1Å; R105-I150 CarbonylContact C-O 3.54Å; R105-I150 VanDerWaalsContact CA-O 3.29Å; R105-I150 WeakPolarHBondContact CA-O 3.36Å; R105-Q151 HydrophobicContact CG-CB 4.11Å; R105-Q151 HydrophobicContact CG-CG 4.24Å; R105-G196 WeakPolarHBondContact CD-O 3.46Å; R105-G196 VanDerWaalsContact NH1-C 3.34Å; R105-G196 PolarHBondContact NH1-O 3.17Å; R105-G197 VanDerWaalsContact NH1-C 3.29Å; R105-G197 PolarHBondContact NH1-O 3.4Å; R105-Y198 WeakPolarHBondContact CD-OH 3.19Å
106	I	95.9	Very high	84.9	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	146.5	178.8	64.8	173.2	0	0	0	110.3	L28 R29 I30 L104 V108 V149 I150 L152 I166	L28-I106 HydrophobicContact CD1-CB 4.04Å; L28-I106 HydrophobicContact CD1-CG2 3.82Å; R29-I106 CarbonylContact O-C 3.48Å; R29-I106 WeakPolarHBondContact O-CA 3.42Å; I30-I106 HydrophobicContact CG1-CG2 4.48Å; L104-I106 HydrophobicContact CD2-CG2 4.06Å; L104-I106 HydrophobicContact CG-CG2 4.2Å; I106-V108 HydrophobicContact CD1-CG1 4.29Å; I106-V108 HydrophobicContact CG1-CG1 4.48Å; I106-V149 CarbonylContact O-C 3.19Å; I106-V149 WeakPolarHBondContact O-CA 3.43Å; I106-I150 HydrophobicContact CD1-CB 4.23Å; I106-I150 HydrophobicContact CD1-CD1 4.48Å; I106-I150 HydrophobicContact CG1-CB 3.69Å; I106-I150 HydrophobicContact CG1-CG1 4.42Å; I106-I150 HydrophobicContact CG1-CG2 4.38Å; I106-I150 PolarHBondContact N-O 2.97Å; I106-I150 PolarHBondContact O-N 3.04Å; I106-L152 HydrophobicContact CD1-CD1 4.38Å; I106-I166 HydrophobicContact CD1-CB 4.42Å; I106-I166 HydrophobicContact CD1-CD1 4.07Å; I106-I166 HydrophobicContact CD1-CG2 3.69Å
107	L	96	Very high	86.9	Confident	8 Å²	8	42 Å²	42	4%	0.042	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	125	176.2	-69.6	163.2	0	0	0	108.7	R29 L31 V70 E147 V149 Y182	R29-L107 HydrophobicContact CB-CB 4.14Å; R29-L107 HydrophobicContact CB-CD1 4.45Å; R29-L107 PolarHBondContact O-N 3.08Å; L31-L107 HydrophobicContact CB-CD1 4.39Å; L31-L107 HydrophobicContact CB-CG 4.34Å; V70-L107 HydrophobicContact CB-CD1 4.44Å; V70-L107 HydrophobicContact CG1-CD1 3.78Å; V70-L107 HydrophobicContact CG2-CD1 3.78Å; L107-E147 HydrophobicContact CB-CB 4.27Å; L107-E147 HydrophobicContact CD2-CB 4.21Å; L107-V149 HydrophobicContact CD2-CG2 3.72Å; L107-Y182 HydrophobicContact CD1-CD1 4.1Å; L107-Y182 HydrophobicContact CD2-CD1 4.29Å
108	V	94.7	Very high	88.5	Confident	7 Å²	7	39 Å²	39	4%	0.042	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	150.4	176.7	-60.4	0	0	0	0	110.1	I106 Q112 A113 I116 E147 R148 I150	I106-V108 HydrophobicContact CD1-CG1 4.29Å; I106-V108 HydrophobicContact CG1-CG1 4.48Å; V108-Q112 HydrophobicContact CB-CB 4.48Å; V108-A113 HydrophobicContact CG2-CB 3.91Å; V108-I116 HydrophobicContact CG1-CD1 4.44Å; V108-I116 HydrophobicContact CG2-CD1 4.2Å; V108-E147 CarbonylContact O-C 3.15Å; V108-E147 WeakPolarHBondContact O-CA 3.24Å; V108-R148 PolarHBondContact N-O 2.84Å; V108-R148 VanDerWaalsContact N-O 3.08Å; V108-R148 PolarHBondContact O-N 3.26Å; V108-I150 HydrophobicContact CG1-CD1 4.25Å; V108-I150 HydrophobicContact CG2-CD1 3.52Å; V108-I150 HydrophobicContact CG2-CG1 3.9Å
109	H	94.3	Very high	90.2	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.028	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.4	144.4	177.3	-176.1	-97.3	0	0	0	111.2	S111 Q112 A113 T146 I175 K176 A178	H109-S111 PolarHBondContact CE1-OG 3.39Å; H109-S111 WeakPolarHBondContact ND1-CB 3.43Å; H109-S111 PolarHBondContact ND1-N 3.16Å; H109-S111 VanDerWaalsContact ND1-N 3.11Å; H109-S111 PolarHBondContact ND1-OG 2.9Å; H109-S111 PolarHBondContact O-N 3.11Å; H109-Q112 WeakPolarHBondContact O-CA 3.46Å; H109-Q112 WeakPolarHBondContact O-CB 3.43Å; H109-Q112 PolarHBondContact O-N 3.36Å; H109-A113 PolarHBondContact O-N 3.17Å; H109-T146 PolarHBondContact CD2-OG1 3.07Å; H109-T146 VanDerWaalsContact CD2-OG1 3.27Å; H109-I175 HydrophobicContact CB-CD1 4.34Å; H109-I175 HydrophobicContact CB-CG1 4.17Å; H109-K176 PolarHBondContact CE1-O 2.78Å; H109-K176 VanDerWaalsContact CE1-O 3.28Å; H109-A178 PolarHBondContact NE2-O 2.67Å; H109-A178 VanDerWaalsContact NE2-O 3.1Å
110	Q	91.3	Very high	91.5	Very high	46 Å²	46	45.2 Å²	45.2	22%	0.215	25%	0.247	C	C	.	.	H	α-helix	trans	-53.6	-31.9	-177.8	60.3	176.8	-27.1	0	0	114	G114 T146 R148	Q110-G114 PolarHBondContact O-N 3.47Å; Q110-T146 WeakPolarHBondContact CB-O 3.4Å; Q110-T146 PolarHBondContact N-O 2.77Å; Q110-R148 HydrophobicContact CB-CG 4.25Å
111	S	91.5	Very high	92.4	Very high	25 Å²	25	40 Å²	40	18%	0.175	23%	0.227	C	C	.	.	H	α-helix	trans	-70.3	-38	175.8	69.9	0	0	0	0	112.5	H109 G114 A115 K176	H109-S111 PolarHBondContact CE1-OG 3.39Å; H109-S111 WeakPolarHBondContact ND1-CB 3.43Å; H109-S111 PolarHBondContact ND1-N 3.16Å; H109-S111 VanDerWaalsContact ND1-N 3.11Å; H109-S111 PolarHBondContact ND1-OG 2.9Å; H109-S111 PolarHBondContact O-N 3.11Å; S111-G114 PolarHBondContact O-N 2.95Å; S111-A115 PolarHBondContact O-N 3.21Å; S111-K176 PolarHBondContact OG-N 2.92Å; S111-K176 VanDerWaalsContact OG-N 3.16Å
112	Q	93.6	Very high	93.1	Very high	28 Å²	28	41.1 Å²	41.1	13%	0.131	23%	0.23	C	C	.	.	H	α-helix	trans	-70.9	-41.6	174.6	-70.1	171	-32.1	0	0	110.3	V108 H109 G114 A115 I116 C170 T173	V108-Q112 HydrophobicContact CB-CB 4.48Å; H109-Q112 WeakPolarHBondContact O-CA 3.46Å; H109-Q112 WeakPolarHBondContact O-CB 3.43Å; H109-Q112 PolarHBondContact O-N 3.36Å; Q112-G114 PolarHBondContact O-N 3.38Å; Q112-A115 WeakPolarHBondContact O-CA 3.2Å; Q112-A115 WeakPolarHBondContact O-CB 3.42Å; Q112-A115 PolarHBondContact O-N 2.81Å; Q112-I116 VanDerWaalsContact O-CG1 3.3Å; Q112-I116 WeakPolarHBondContact O-CG1 3.4Å; Q112-I116 PolarHBondContact O-N 2.9Å; Q112-C170 HydrophobicContact CG-CB 4.48Å; Q112-C170 PolarHBondContact NE2-O 3.28Å; Q112-T173 HydrophobicContact CG-CG2 4.43Å
113	A	93.7	Very high	93.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-55.1	-40.5	171.4	0	0	0	0	0	111.9	V108 H109 I116 I117 V137 R148	V108-A113 HydrophobicContact CG2-CB 3.91Å; H109-A113 PolarHBondContact O-N 3.17Å; A113-I116 PolarHBondContact O-N 3.22Å; A113-I117 WeakPolarHBondContact O-CD1 3.42Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.48Å; A113-I117 PolarHBondContact O-N 2.89Å; A113-V137 HydrophobicContact CB-CG1 4.24Å; A113-R148 HydrophobicContact CB-CB 4.15Å
114	G	92.8	Very high	93.5	Very high	37 Å²	37	41.8 Å²	41.8	38%	0.381	23%	0.232	S	C	.	.	H	α-helix	trans	-62	-39.1	174	0	0	0	0	0	113.5	Q110 S111 Q112 G118	Q110-G114 PolarHBondContact O-N 3.47Å; S111-G114 PolarHBondContact O-N 2.95Å; Q112-G114 PolarHBondContact O-N 3.38Å; G114-G118 PolarHBondContact O-N 3.4Å
115	A	93.2	Very high	93.6	Very high	30 Å²	30	47.6 Å²	47.6	25%	0.248	26%	0.258	C	S	.	.	H	α-helix	trans	-70.2	-40.9	175.9	0	0	0	0	0	112.6	S111 Q112 I117 G118 I169 T173	S111-A115 PolarHBondContact O-N 3.21Å; Q112-A115 WeakPolarHBondContact O-CA 3.2Å; Q112-A115 WeakPolarHBondContact O-CB 3.42Å; Q112-A115 PolarHBondContact O-N 2.81Å; A115-I117 VanDerWaalsContact C-N 3.32Å; A115-I117 PolarHBondContact O-N 3.26Å; A115-G118 PolarHBondContact O-N 2.95Å; A115-G118 VanDerWaalsContact O-N 3.14Å; A115-I169 HydrophobicContact CB-CG2 4.18Å; A115-T173 HydrophobicContact CB-CG2 3.69Å; A115-T173 WeakPolarHBondContact CB-OG1 3.5Å
116	I	94.8	Very high	93.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.4	-40.6	175.3	-65.6	160	0	0	0	111	V108 Q112 A113 K123 I124 L127 I150 I166 I169	V108-I116 HydrophobicContact CG1-CD1 4.44Å; V108-I116 HydrophobicContact CG2-CD1 4.2Å; Q112-I116 VanDerWaalsContact O-CG1 3.3Å; Q112-I116 WeakPolarHBondContact O-CG1 3.4Å; Q112-I116 PolarHBondContact O-N 2.9Å; A113-I116 PolarHBondContact O-N 3.22Å; I116-K123 CarbonylContact O-C 3.59Å; I116-K123 WeakPolarHBondContact O-CB 3.43Å; I116-I124 WeakPolarHBondContact O-CA 3.2Å; I116-I124 PolarHBondContact O-N 3.24Å; I116-L127 HydrophobicContact CG2-CD1 3.9Å; I116-I150 HydrophobicContact CD1-CD1 3.58Å; I116-I150 HydrophobicContact CG2-CD1 4.27Å; I116-I166 HydrophobicContact CD1-CG2 3.66Å; I116-I166 HydrophobicContact CG1-CG2 4.35Å; I116-I166 HydrophobicContact CG2-CG1 4.42Å; I116-I169 HydrophobicContact CG1-CB 4.39Å; I116-I169 HydrophobicContact CG1-CG2 3.87Å
117	I	94.3	Very high	93.6	Very high	44 Å²	44	50.9 Å²	50.9	23%	0.226	27%	0.274	C	S	.	.	H	α-helix	trans	-65.6	-46.1	172.8	-65.8	164.1	0	0	0	110.2	A113 A115 G121 K123 I124 V137	A113-I117 WeakPolarHBondContact O-CD1 3.42Å; A113-I117 VanDerWaalsContact O-CG1 3.23Å; A113-I117 WeakPolarHBondContact O-CG1 3.48Å; A113-I117 PolarHBondContact O-N 2.89Å; A115-I117 VanDerWaalsContact C-N 3.32Å; A115-I117 PolarHBondContact O-N 3.26Å; I117-G121 CarbonylContact O-C 3.6Å; I117-G121 WeakPolarHBondContact O-CA 3.24Å; I117-K123 PolarHBondContact O-N 2.97Å; I117-I124 HydrophobicContact CG2-CG2 4.23Å; I117-I124 PolarHBondContact O-N 3.21Å; I117-I124 VanDerWaalsContact O-N 3.15Å; I117-V137 HydrophobicContact CD1-CB 4.32Å; I117-V137 HydrophobicContact CD1-CG1 4Å; I117-V137 HydrophobicContact CG1-CB 4.36Å; I117-V137 HydrophobicContact CG1-CG1 4.37Å; I117-V137 HydrophobicContact CG1-CG2 4.24Å
118	G	90.9	Very high	93.5	Very high	22 Å²	22	55.6 Å²	55.6	23%	0.227	29%	0.291	C	S	.	.			trans	75.4	173.8	-177.1	0	0	0	0	0	113.2	G114 A115 A120 G121	G114-G118 PolarHBondContact O-N 3.4Å; A115-G118 PolarHBondContact O-N 2.95Å; A115-G118 VanDerWaalsContact O-N 3.14Å; G118-A120 PolarHBondContact O-N 2.98Å; G118-G121 PolarHBondContact O-N 3.41Å
119	R	92.2	Very high	93.6	Very high	238 Å²	238	61.8 Å²	61.8	90%	0.898	32%	0.319	S	S	*	.	G	3₁₀ helix	trans	-62.9	128.6	177.6	-65.3	-178.3	-177.3	159.4	1.5	109.4	G121 F122	R119-G121 PolarHBondContact O-N 3.43Å; R119-G121 VanDerWaalsContact O-N 3.09Å; R119-F122 VanDerWaalsContact O-CB 3.29Å; R119-F122 WeakPolarHBondContact O-CB 3.38Å; R119-F122 PolarHBondContact O-N 3.18Å
120	A	90.9	Very high	93.6	Very high	116 Å²	116	64.6 Å²	64.6	96%	0.959	34%	0.34	S	S	*	.	G	3₁₀ helix	trans	54.7	21.9	-176.4	0	0	0	0	0	115.3	G118 F122	G118-A120 PolarHBondContact O-N 2.98Å; A120-F122 VanDerWaalsContact C-N 3.27Å; A120-F122 PolarHBondContact O-N 3.39Å
121	G	91.1	Very high	93.7	Very high	21 Å²	21	62.5 Å²	62.5	22%	0.216	33%	0.33	C	S	.	.	G	3₁₀ helix	trans	75.5	12.5	-177.1	0	0	0	0	0	114.4	I117 G118 R119 K123 I124 K125	I117-G121 CarbonylContact O-C 3.6Å; I117-G121 WeakPolarHBondContact O-CA 3.24Å; G118-G121 PolarHBondContact O-N 3.41Å; R119-G121 PolarHBondContact O-N 3.43Å; R119-G121 VanDerWaalsContact O-N 3.09Å; G121-K123 PolarHBondContact O-N 3.4Å; G121-I124 WeakPolarHBondContact O-CG2 3.4Å; G121-K125 WeakPolarHBondContact O-CB 3.26Å; G121-K125 PolarHBondContact O-N 3.48Å; G121-K125 VanDerWaalsContact O-N 3.12Å
122	F	94.6	Very high	93.8	Very high	147 Å²	147	63.3 Å²	63.3	65%	0.645	34%	0.343	S	S	*	.	H	α-helix	trans	-60	-46.3	-177	-178.9	-93.2	0	0	0	112.5	R119 A120 K125 E126	R119-F122 VanDerWaalsContact O-CB 3.29Å; R119-F122 WeakPolarHBondContact O-CB 3.38Å; R119-F122 PolarHBondContact O-N 3.18Å; A120-F122 VanDerWaalsContact C-N 3.27Å; A120-F122 PolarHBondContact O-N 3.39Å; F122-K125 PolarHBondContact O-N 2.94Å; F122-E126 PolarHBondContact O-N 3.04Å
123	K	94.4	Very high	93.7	Very high	70 Å²	70	62.2 Å²	62.2	30%	0.304	34%	0.338	S	S	.	.	H	α-helix	trans	-68.9	-41.8	-174.5	-167.2	73.7	-169.1	162.1	0	111.9	I116 I117 G121 K125 E126 L127 I169	I116-K123 CarbonylContact O-C 3.59Å; I116-K123 WeakPolarHBondContact O-CB 3.43Å; I117-K123 PolarHBondContact O-N 2.97Å; G121-K123 PolarHBondContact O-N 3.4Å; K123-K125 VanDerWaalsContact C-N 3.3Å; K123-K125 PolarHBondContact O-N 2.99Å; K123-E126 WeakPolarHBondContact CD-OE2 3.15Å; K123-E126 WeakPolarHBondContact CE-OE2 3.37Å; K123-E126 IonicContact NZ-OE1 3.97Å; K123-E126 IonicContact NZ-OE2 3.56Å; K123-E126 PolarHBondContact NZ-OE2 3.08Å; K123-E126 WeakPolarHBondContact O-CB 3.35Å; K123-E126 PolarHBondContact O-N 2.98Å; K123-L127 WeakPolarHBondContact O-CG 3.36Å; K123-L127 PolarHBondContact O-N 3.27Å; K123-I169 HydrophobicContact CG-CD1 4.16Å
124	I	95	Very high	93.8	Very high	11 Å²	11	65.6 Å²	65.6	6%	0.056	36%	0.362	C	S	.	.	H	α-helix	trans	-67.8	-32.2	175.8	-172.7	169.5	0	0	0	112.2	I116 I117 G121 L127 R128 I135 V137	I116-I124 WeakPolarHBondContact O-CA 3.2Å; I116-I124 PolarHBondContact O-N 3.24Å; I117-I124 HydrophobicContact CG2-CG2 4.23Å; I117-I124 PolarHBondContact O-N 3.21Å; I117-I124 VanDerWaalsContact O-N 3.15Å; G121-I124 WeakPolarHBondContact O-CG2 3.4Å; I124-L127 PolarHBondContact O-N 2.64Å; I124-R128 VanDerWaalsContact CD1-NH2 3.34Å; I124-R128 VanDerWaalsContact O-CG 3.26Å; I124-R128 WeakPolarHBondContact O-CG 3.32Å; I124-R128 PolarHBondContact O-N 3.3Å; I124-I135 HydrophobicContact CD1-CG2 4.17Å; I124-I135 HydrophobicContact CG1-CG2 4.29Å; I124-V137 HydrophobicContact CD1-CB 4.47Å; I124-V137 HydrophobicContact CD1-CG2 3.54Å
125	K	95.1	Very high	93.9	Very high	125 Å²	125	64 Å²	64	54%	0.543	34%	0.344	S	S	.	.	H	α-helix	trans	-64.9	-48.2	174	-175	178.8	172.8	-175.6	0	110.8	G121 F122 K123 L127 R128 E129	G121-K125 WeakPolarHBondContact O-CB 3.26Å; G121-K125 PolarHBondContact O-N 3.48Å; G121-K125 VanDerWaalsContact O-N 3.12Å; F122-K125 PolarHBondContact O-N 2.94Å; K123-K125 VanDerWaalsContact C-N 3.3Å; K123-K125 PolarHBondContact O-N 2.99Å; K125-L127 VanDerWaalsContact C-N 3.35Å; K125-L127 PolarHBondContact O-N 3.43Å; K125-R128 PolarHBondContact O-N 3.11Å; K125-E129 WeakPolarHBondContact CE-OE1 3.5Å; K125-E129 WeakPolarHBondContact O-CG 3.2Å; K125-E129 PolarHBondContact O-N 2.72Å
126	E	95.4	Very high	94	Very high	83 Å²	83	69.3 Å²	69.3	39%	0.388	36%	0.358	S	S	.	.	H	α-helix	trans	-56.3	-46.1	173.9	-178.2	-172.8	-156.4	0	0	111.8	F122 K123 R128 E129 S130	F122-E126 PolarHBondContact O-N 3.04Å; K123-E126 WeakPolarHBondContact CD-OE2 3.15Å; K123-E126 WeakPolarHBondContact CE-OE2 3.37Å; K123-E126 IonicContact NZ-OE1 3.97Å; K123-E126 IonicContact NZ-OE2 3.56Å; K123-E126 PolarHBondContact NZ-OE2 3.08Å; K123-E126 WeakPolarHBondContact O-CB 3.35Å; K123-E126 PolarHBondContact O-N 2.98Å; E126-R128 VanDerWaalsContact C-N 3.35Å; E126-R128 PolarHBondContact O-N 3.42Å; E126-E129 PolarHBondContact O-N 3.3Å; E126-S130 WeakPolarHBondContact O-CB 3.23Å; E126-S130 PolarHBondContact O-N 2.84Å; E126-S130 PolarHBondContact O-OG 3.12Å
127	L	95.3	Very high	94	Very high	4 Å²	4	70.5 Å²	70.5	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-61.7	-39.3	178.2	-74.1	170.9	0	0	0	113	I116 K123 I124 K125 S130 T131 I135 E165 I166 I169	I116-L127 HydrophobicContact CG2-CD1 3.9Å; K123-L127 WeakPolarHBondContact O-CG 3.36Å; K123-L127 PolarHBondContact O-N 3.27Å; I124-L127 PolarHBondContact O-N 2.64Å; K125-L127 VanDerWaalsContact C-N 3.35Å; K125-L127 PolarHBondContact O-N 3.43Å; L127-S130 PolarHBondContact O-OG 3.07Å; L127-T131 VanDerWaalsContact O-CB 3.28Å; L127-T131 WeakPolarHBondContact O-CB 3.39Å; L127-T131 WeakPolarHBondContact O-CG2 3.45Å; L127-T131 PolarHBondContact O-N 2.94Å; L127-T131 VanDerWaalsContact O-N 3.08Å; L127-T131 PolarHBondContact O-OG1 3.34Å; L127-I135 HydrophobicContact CB-CD1 3.83Å; L127-E165 HydrophobicContact CD2-CB 3.55Å; L127-E165 HydrophobicContact CD2-CG 4.4Å; L127-I166 HydrophobicContact CD1-CG1 4.4Å; L127-I169 HydrophobicContact CD1-CD1 3.77Å; L127-I169 HydrophobicContact CD2-CD1 4.11Å; L127-I169 HydrophobicContact CG-CD1 4.34Å
128	R	95.1	Very high	93.9	Very high	107 Å²	107	69.1 Å²	69.1	40%	0.404	36%	0.357	S	S	.	.	H	α-helix	trans	-66.5	-41.2	176.4	-71.7	167.9	-178	157.8	-0.9	111.3	I124 K125 E126 G132 I135	I124-R128 VanDerWaalsContact CD1-NH2 3.34Å; I124-R128 VanDerWaalsContact O-CG 3.26Å; I124-R128 WeakPolarHBondContact O-CG 3.32Å; I124-R128 PolarHBondContact O-N 3.3Å; K125-R128 PolarHBondContact O-N 3.11Å; E126-R128 VanDerWaalsContact C-N 3.35Å; E126-R128 PolarHBondContact O-N 3.42Å; R128-G132 WeakPolarHBondContact O-CA 3.17Å; R128-G132 PolarHBondContact O-N 2.53Å; R128-I135 HydrophobicContact CG-CB 3.9Å; R128-I135 HydrophobicContact CG-CD1 4.19Å; R128-I135 HydrophobicContact CG-CG1 3.99Å; R128-I135 PolarHBondContact NE-O 2.84Å; R128-I135 PolarHBondContact NH2-O 2.98Å
129	E	95	Very high	93.8	Very high	137 Å²	137	72.2 Å²	72.2	64%	0.64	38%	0.376	S	S	*	.	H	α-helix	trans	-68.2	-43.2	178.8	-72.1	172.6	-171.3	0	0	112	K125 E126	K125-E129 WeakPolarHBondContact CE-OE1 3.5Å; K125-E129 WeakPolarHBondContact O-CG 3.2Å; K125-E129 PolarHBondContact O-N 2.72Å; E126-E129 PolarHBondContact O-N 3.3Å
130	S	95.1	Very high	93.6	Very high	65 Å²	65	63.3 Å²	63.3	46%	0.455	34%	0.344	S	S	.	.	H	α-helix	trans	-74.3	-33.7	-177.8	66.9	0	0	0	0	113.5	E126 L127	E126-S130 WeakPolarHBondContact O-CB 3.23Å; E126-S130 PolarHBondContact O-N 2.84Å; E126-S130 PolarHBondContact O-OG 3.12Å; L127-S130 PolarHBondContact O-OG 3.07Å
131	T	94.4	Very high	93.5	Very high	2 Å²	2	58.4 Å²	58.4	1%	0.012	30%	0.303	C	S	.	.	H	α-helix	trans	-89.1	-26.7	-177.9	64.7	0	0	0	0	112.7	L127 S133 R161 A162	L127-T131 VanDerWaalsContact O-CB 3.28Å; L127-T131 WeakPolarHBondContact O-CB 3.39Å; L127-T131 WeakPolarHBondContact O-CG2 3.45Å; L127-T131 PolarHBondContact O-N 2.94Å; L127-T131 VanDerWaalsContact O-N 3.08Å; L127-T131 PolarHBondContact O-OG1 3.34Å; T131-S133 PolarHBondContact O-N 3.36Å; T131-S133 PolarHBondContact OG1-N 3.17Å; T131-S133 PolarHBondContact OG1-OG 2.63Å; T131-R161 HydrophobicContact CG2-CG 4.28Å; T131-A162 VanDerWaalsContact CG2-CA 3.5Å; T131-A162 HydrophobicContact CG2-CB 3.79Å
132	G	92.7	Very high	93.4	Very high	43 Å²	43	57.4 Å²	57.4	44%	0.443	29%	0.293	S	S	.	.			trans	70.6	5.6	-169.8	0	0	0	0	0	113.8	R128 Q158	R128-G132 WeakPolarHBondContact O-CA 3.17Å; R128-G132 PolarHBondContact O-N 2.53Å; G132-Q158 PolarHBondContact O-NE2 2.82Å
133	S	92.3	Very high	93	Very high	5 Å²	5	51.5 Å²	51.5	4%	0.035	27%	0.269	C	S	.	.			trans	-91.4	153.1	179.3	72.2	0	0	0	0	111.8	T131 I135 A162	T131-S133 PolarHBondContact O-N 3.36Å; T131-S133 PolarHBondContact OG1-N 3.17Å; T131-S133 PolarHBondContact OG1-OG 2.63Å; S133-I135 PolarHBondContact O-N 3.32Å; S133-I135 WeakPolarHBondContact OG-CG1 3.32Å; S133-A162 VanDerWaalsContact OG-CB 3.31Å; S133-A162 WeakPolarHBondContact OG-CB 3.49Å
134	S	94.3	Very high	92.5	Very high	71 Å²	71	51.9 Å²	51.9	50%	0.497	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	108.3	171	154.4	0	0	0	0	109.8	L152 T153	S134-L152 WeakPolarHBondContact O-CA 3.29Å; S134-T153 WeakPolarHBondContact CB-OG1 3.4Å; S134-T153 PolarHBondContact N-O 2.98Å; S134-T153 PolarHBondContact O-N 2.99Å; S134-T153 PolarHBondContact O-OG1 3.43Å; S134-T153 PolarHBondContact OG-OG1 2.87Å; S134-T153 VanDerWaalsContact OG-OG1 3.07Å
135	I	95.7	Very high	92.3	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	117.4	-177	-51.3	-179	0	0	0	109.5	I124 L127 R128 S133 I150 Q151 L152 A162	I124-I135 HydrophobicContact CD1-CG2 4.17Å; I124-I135 HydrophobicContact CG1-CG2 4.29Å; L127-I135 HydrophobicContact CB-CD1 3.83Å; R128-I135 HydrophobicContact CG-CB 3.9Å; R128-I135 HydrophobicContact CG-CD1 4.19Å; R128-I135 HydrophobicContact CG-CG1 3.99Å; R128-I135 PolarHBondContact NE-O 2.84Å; R128-I135 PolarHBondContact NH2-O 2.98Å; S133-I135 PolarHBondContact O-N 3.32Å; S133-I135 WeakPolarHBondContact OG-CG1 3.32Å; I135-I150 HydrophobicContact CG2-CG2 3.78Å; I135-Q151 CarbonylContact C-O 3.54Å; I135-Q151 WeakPolarHBondContact CA-O 3.46Å; I135-L152 HydrophobicContact CB-CD2 4.05Å; I135-L152 HydrophobicContact CD1-CD2 4.21Å; I135-L152 HydrophobicContact CG1-CD2 3.65Å; I135-L152 HydrophobicContact CG2-CD2 3.76Å; I135-A162 HydrophobicContact CD1-CB 4.22Å
136	R	94.9	Very high	92.1	Very high	143 Å²	143	46 Å²	46	54%	0.54	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	121.4	176	178.9	-179.7	179.9	173.7	-0	110.4	F138 I150 Q151	R136-F138 HydrophobicContact CG-CE2 4.47Å; R136-I150 CarbonylContact O-C 3.57Å; R136-I150 WeakPolarHBondContact O-CA 3.4Å; R136-Q151 HydrophobicContact CB-CB 4.32Å; R136-Q151 PolarHBondContact N-O 3.34Å; R136-Q151 PolarHBondContact O-N 3.02Å
137	V	94.9	Very high	92	Very high	24 Å²	24	42.9 Å²	42.9	15%	0.145	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	120.4	175.7	-174.5	0	0	0	0	108.8	A113 I117 I124 I150	A113-V137 HydrophobicContact CB-CG1 4.24Å; I117-V137 HydrophobicContact CD1-CB 4.32Å; I117-V137 HydrophobicContact CD1-CG1 4Å; I117-V137 HydrophobicContact CG1-CB 4.36Å; I117-V137 HydrophobicContact CG1-CG1 4.37Å; I117-V137 HydrophobicContact CG1-CG2 4.24Å; I124-V137 HydrophobicContact CD1-CB 4.47Å; I124-V137 HydrophobicContact CD1-CG2 3.54Å; V137-I150 HydrophobicContact CB-CG1 4.45Å; V137-I150 HydrophobicContact CG1-CG1 4.11Å; V137-I150 HydrophobicContact CG2-CD1 4.14Å; V137-I150 HydrophobicContact CG2-CG1 3.98Å; V137-I150 HydrophobicContact CG2-CG2 4.13Å
138	F	93.6	Very high	91.9	Very high	15 Å²	15	44.4 Å²	44.4	7%	0.066	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	137.1	178.4	-73.5	-94.4	0	0	0	110.6	R136 R148 V149 Q151 Y193 Y195 G196	R136-F138 HydrophobicContact CG-CE2 4.47Å; F138-R148 PolarHBondContact O-NE 3.41Å; F138-R148 PolarHBondContact O-NH2 2.88Å; F138-V149 HydrophobicContact CD2-CB 3.95Å; F138-V149 HydrophobicContact CD2-CG1 4.1Å; F138-V149 WeakPolarHBondContact CD2-O 3.43Å; F138-V149 HydrophobicContact CE2-CG1 4.36Å; F138-V149 PolarHBondContact N-O 2.89Å; F138-Q151 HydrophobicContact CE2-CB 3.91Å; F138-Y193 VanDerWaalsContact CE1-O 3.29Å; F138-Y193 WeakPolarHBondContact CE1-O 3.44Å; F138-Y195 WeakPolarHBondContact CB-O 3.33Å; F138-G196 VanDerWaalsContact CD1-CA 3.49Å; F138-G196 VanDerWaalsContact CD1-N 3.34Å; F138-G196 VanDerWaalsContact CE1-CA 3.41Å; F138-G196 VanDerWaalsContact CZ-CA 3.47Å
139	S	87.8	Confident	92	Very high	87 Å²	87	39.3 Å²	39.3	61%	0.608	22%	0.216	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-70.3	-36.2	-177.9	45.1	0	0	0	0	112.9
140	E	87	Confident	92.1	Very high	51 Å²	51	32.8 Å²	32.8	24%	0.238	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	141.8	-178	-62.8	-64.1	166	0	0	111.1	D194 N263 R266	E140-D194 HydrophobicContact CG-CB 4.48Å; E140-N263 PolarHBondContact OE2-OD1 2.97Å; E140-R266 VanDerWaalsContact CD-NH1 3.34Å; E140-R266 IonicContact OE1-CZ 3.17Å; E140-R266 IonicContact OE1-NH1 2.56Å; E140-R266 PolarHBondContact OE1-NH1 2.98Å; E140-R266 IonicContact OE1-NH2 2.78Å; E140-R266 PolarHBondContact OE1-NH2 2.91Å; E140-R266 IonicContact OE2-CZ 2.78Å; E140-R266 IonicContact OE2-NE 3.81Å; E140-R266 IonicContact OE2-NH1 3.98Å; E140-R266 PolarHBondContact OE2-NH1 3.4Å; E140-R266 IonicContact OE2-NH2 3.99Å; E140-R266 PolarHBondContact OE2-NH2 3.45Å
141	C	89.5	Confident	92.1	Very high	14 Å²	14	31 Å²	31	10%	0.095	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	151	169.2	-64.3	0	0	0	0	109	E147 Y195	C141-E147 CarbonylContact C-O 3.57Å; C141-E147 VanDerWaalsContact CA-O 3.32Å; C141-E147 WeakPolarHBondContact CA-O 3.15Å; C141-Y195 WeakPolarHBondContact O-CB 3.45Å
142	A	89.5	Confident	92.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.169	C	C	.	.	P	Polyproline II helix	trans	-59.5	147.9	171.6	0	0	0	0	0	110.1	Y144 S145 E147 Y182 Y195	A142-Y144 PolarHBondContact O-N 2.82Å; A142-S145 WeakPolarHBondContact O-CA 3.45Å; A142-S145 WeakPolarHBondContact O-CB 3.13Å; A142-S145 PolarHBondContact O-N 2.84Å; A142-E147 PolarHBondContact N-O 3.17Å; A142-Y182 HydrophobicContact CB-CD1 4.07Å; A142-Y182 HydrophobicContact CB-CD2 3.34Å; A142-Y182 HydrophobicContact CB-CE1 4.34Å; A142-Y182 HydrophobicContact CB-CE2 3.68Å; A142-Y182 HydrophobicContact CB-CG 3.56Å; A142-Y195 HydrophobicContact CB-CD2 3.7Å; A142-Y195 HydrophobicContact CB-CE2 4.12Å; A142-Y195 HydrophobicContact CB-CG 4.44Å
143	P	85	Confident	92.2	Very high	23 Å²	23	30.3 Å²	30.3	15%	0.149	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	133.6	-173	-25.7	31.4	0	0	0	112.6	S145 N186 D188 Y195	P143-S145 PolarHBondContact O-N 2.85Å; P143-S145 VanDerWaalsContact O-N 3.07Å; P143-N186 HydrophobicContact CB-CB 4.43Å; P143-N186 WeakPolarHBondContact CB-O 3.42Å; P143-N186 WeakPolarHBondContact CG-O 3.35Å; P143-D188 HydrophobicContact CG-CB 3.68Å; P143-Y195 HydrophobicContact CG-CD1 4Å; P143-Y195 HydrophobicContact CG-CE1 3.81Å
144	Y	85.7	Confident	92.2	Very high	78 Å²	78	30.3 Å²	30.3	31%	0.306	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	29.7	-176.1	-53.6	-84.3	0	0	0	113.4	A142 R180 N186 N267 G270	A142-Y144 PolarHBondContact O-N 2.82Å; Y144-R180 WeakPolarHBondContact O-CD 3.34Å; Y144-N186 HydrophobicContact CD2-CB 4.03Å; Y144-N267 VanDerWaalsContact CA-OD1 3.32Å; Y144-N267 WeakPolarHBondContact CA-OD1 3.2Å; Y144-N267 PolarHBondContact N-OD1 2.77Å; Y144-G270 WeakPolarHBondContact OH-CA 3.09Å; Y144-G270 PolarHBondContact OH-O 2.86Å
145	S	89.7	Confident	92.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.007	15%	0.154	C	C	.	.			trans	-126.8	165.2	178.3	-173.6	0	0	0	0	111	A142 P143 E147 R180 Y182	A142-S145 WeakPolarHBondContact O-CA 3.45Å; A142-S145 WeakPolarHBondContact O-CB 3.13Å; A142-S145 PolarHBondContact O-N 2.84Å; P143-S145 PolarHBondContact O-N 2.85Å; P143-S145 VanDerWaalsContact O-N 3.07Å; S145-E147 WeakPolarHBondContact OG-CB 3.43Å; S145-E147 PolarHBondContact OG-N 2.78Å; S145-R180 PolarHBondContact OG-O 3.24Å; S145-Y182 WeakPolarHBondContact OG-CA 3.35Å; S145-Y182 WeakPolarHBondContact OG-CB 2.99Å; S145-Y182 PolarHBondContact OG-N 3.42Å
146	T	90.3	Very high	91.9	Very high	12 Å²	12	32.9 Å²	32.9	7%	0.074	17%	0.165	C	C	.	.	S	Bend	trans	-104.7	2.9	167.2	54.7	0	0	0	0	112	H109 Q110 A178 R180	H109-T146 PolarHBondContact CD2-OG1 3.07Å; H109-T146 VanDerWaalsContact CD2-OG1 3.27Å; Q110-T146 WeakPolarHBondContact CB-O 3.4Å; Q110-T146 PolarHBondContact N-O 2.77Å; T146-A178 WeakPolarHBondContact CG2-O 2.97Å; T146-R180 HydrophobicContact CG2-CB 4.05Å; T146-R180 PolarHBondContact N-O 2.96Å; T146-R180 PolarHBondContact OG1-N 3.46Å; T146-R180 PolarHBondContact OG1-O 3.46Å
147	E	93.8	Very high	91.8	Very high	16 Å²	16	33.1 Å²	33.1	8%	0.075	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	142.2	177.9	-64.5	176.7	138	0	0	111.5	R29 L107 V108 C141 A142 S145 Y182	R29-E147 IonicContact CZ-OE1 3.49Å; R29-E147 IonicContact CZ-OE2 3.46Å; R29-E147 IonicContact NH1-OE1 2.81Å; R29-E147 PolarHBondContact NH1-OE1 2.83Å; R29-E147 IonicContact NH1-OE2 3.36Å; R29-E147 PolarHBondContact NH1-OE2 3.04Å; R29-E147 IonicContact NH2-OE2 3.18Å; L107-E147 HydrophobicContact CB-CB 4.27Å; L107-E147 HydrophobicContact CD2-CB 4.21Å; V108-E147 CarbonylContact O-C 3.15Å; V108-E147 WeakPolarHBondContact O-CA 3.24Å; C141-E147 CarbonylContact C-O 3.57Å; C141-E147 VanDerWaalsContact CA-O 3.32Å; C141-E147 WeakPolarHBondContact CA-O 3.15Å; A142-E147 PolarHBondContact N-O 3.17Å; S145-E147 WeakPolarHBondContact OG-CB 3.43Å; S145-E147 PolarHBondContact OG-N 2.78Å; E147-Y182 VanDerWaalsContact OE2-CB 3.29Å; E147-Y182 WeakPolarHBondContact OE2-CB 3.32Å; E147-Y182 PolarHBondContact OE2-N 3.4Å
148	R	94.4	Very high	91.8	Very high	36 Å²	36	35 Å²	35	14%	0.136	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	145.1	171.1	-68.8	174.6	62.7	-168.2	-0.5	108.8	V108 Q110 A113 F138	V108-R148 PolarHBondContact N-O 2.84Å; V108-R148 VanDerWaalsContact N-O 3.08Å; V108-R148 PolarHBondContact O-N 3.26Å; Q110-R148 HydrophobicContact CB-CG 4.25Å; A113-R148 HydrophobicContact CB-CB 4.15Å; F138-R148 PolarHBondContact O-NE 3.41Å; F138-R148 PolarHBondContact O-NH2 2.88Å
149	V	95.9	Very high	91.8	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.6	175.6	-177.7	0	0	0	0	109.7	L31 R105 I106 L107 F138 Y195	L31-V149 HydrophobicContact CD2-CG2 3.93Å; R105-V149 HydrophobicContact CB-CG1 3.8Å; R105-V149 HydrophobicContact CG-CG1 4.1Å; I106-V149 CarbonylContact O-C 3.19Å; I106-V149 WeakPolarHBondContact O-CA 3.43Å; L107-V149 HydrophobicContact CD2-CG2 3.72Å; F138-V149 HydrophobicContact CD2-CB 3.95Å; F138-V149 HydrophobicContact CD2-CG1 4.1Å; F138-V149 WeakPolarHBondContact CD2-O 3.43Å; F138-V149 HydrophobicContact CE2-CG1 4.36Å; F138-V149 PolarHBondContact N-O 2.89Å; V149-Y195 VanDerWaalsContact CB-O 3.26Å; V149-Y195 WeakPolarHBondContact CB-O 3.17Å; V149-Y195 HydrophobicContact CG2-CD2 4.24Å; V149-Y195 WeakPolarHBondContact CG2-O 3.29Å
150	I	96.7	Very high	92.2	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	118.5	166.6	-54.1	-176.2	0	0	0	107.7	R105 I106 V108 I116 I135 R136 V137 L152 I166	R105-I150 CarbonylContact C-O 3.54Å; R105-I150 VanDerWaalsContact CA-O 3.29Å; R105-I150 WeakPolarHBondContact CA-O 3.36Å; I106-I150 HydrophobicContact CD1-CB 4.23Å; I106-I150 HydrophobicContact CD1-CD1 4.48Å; I106-I150 HydrophobicContact CG1-CB 3.69Å; I106-I150 HydrophobicContact CG1-CG1 4.42Å; I106-I150 HydrophobicContact CG1-CG2 4.38Å; I106-I150 PolarHBondContact N-O 2.97Å; I106-I150 PolarHBondContact O-N 3.04Å; V108-I150 HydrophobicContact CG1-CD1 4.25Å; V108-I150 HydrophobicContact CG2-CD1 3.52Å; V108-I150 HydrophobicContact CG2-CG1 3.9Å; I116-I150 HydrophobicContact CD1-CD1 3.58Å; I116-I150 HydrophobicContact CG2-CD1 4.27Å; I135-I150 HydrophobicContact CG2-CG2 3.78Å; R136-I150 CarbonylContact O-C 3.57Å; R136-I150 WeakPolarHBondContact O-CA 3.4Å; V137-I150 HydrophobicContact CB-CG1 4.45Å; V137-I150 HydrophobicContact CG1-CG1 4.11Å; V137-I150 HydrophobicContact CG2-CD1 4.14Å; V137-I150 HydrophobicContact CG2-CG1 3.98Å; V137-I150 HydrophobicContact CG2-CG2 4.13Å; I150-L152 HydrophobicContact CG2-CD2 4.08Å; I150-L152 HydrophobicContact CG2-CG 4.44Å; I150-I166 HydrophobicContact CG2-CD1 4.36Å
151	Q	95.7	Very high	92.6	Very high	28 Å²	28	34.8 Å²	34.8	13%	0.131	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	126.9	173.8	177.8	-175.1	0.4	0	0	109.5	E103 L104 R105 I135 R136 F138 T153	E103-Q151 HydrophobicContact CG-CG 4Å; E103-Q151 PolarHBondContact OE1-NE2 3.4Å; E103-Q151 PolarHBondContact OE2-NE2 3.1Å; L104-Q151 CarbonylContact O-C 3.51Å; L104-Q151 WeakPolarHBondContact O-CA 3.41Å; R105-Q151 HydrophobicContact CG-CB 4.11Å; R105-Q151 HydrophobicContact CG-CG 4.24Å; I135-Q151 CarbonylContact C-O 3.54Å; I135-Q151 WeakPolarHBondContact CA-O 3.46Å; R136-Q151 HydrophobicContact CB-CB 4.32Å; R136-Q151 PolarHBondContact N-O 3.34Å; R136-Q151 PolarHBondContact O-N 3.02Å; F138-Q151 HydrophobicContact CE2-CB 3.91Å; Q151-T153 HydrophobicContact CG-CG2 4.14Å
152	L	95.1	Very high	92.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	127.8	176.6	-57.3	172.6	0	0	0	107.7	E103 L104 I106 S134 I135 I150 V159 A162 V163 I166	E103-L152 CarbonylContact C-O 3.54Å; E103-L152 WeakPolarHBondContact CA-O 3.09Å; L104-L152 HydrophobicContact CB-CB 4.43Å; L104-L152 PolarHBondContact N-O 3.22Å; L104-L152 PolarHBondContact O-N 2.99Å; I106-L152 HydrophobicContact CD1-CD1 4.38Å; S134-L152 WeakPolarHBondContact O-CA 3.29Å; I135-L152 HydrophobicContact CB-CD2 4.05Å; I135-L152 HydrophobicContact CD1-CD2 4.21Å; I135-L152 HydrophobicContact CG1-CD2 3.65Å; I135-L152 HydrophobicContact CG2-CD2 3.76Å; I150-L152 HydrophobicContact CG2-CD2 4.08Å; I150-L152 HydrophobicContact CG2-CG 4.44Å; L152-V159 HydrophobicContact CB-CG1 4.18Å; L152-V159 HydrophobicContact CD1-CG1 4.44Å; L152-A162 HydrophobicContact CD1-CB 4.43Å; L152-A162 HydrophobicContact CD2-CB 4.11Å; L152-V163 HydrophobicContact CD1-CG2 3.47Å; L152-V163 VanDerWaalsContact CD1-CG2 3.47Å; L152-I166 HydrophobicContact CD1-CD1 4.25Å; L152-I166 HydrophobicContact CD2-CD1 3.77Å
153	T	93.3	Very high	93.1	Very high	30 Å²	30	34.1 Å²	34.1	18%	0.184	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	132.6	176.6	58.6	0	0	0	0	110.9	H102 E103 S134 Q151	H102-T153 VanDerWaalsContact O-CA 3.29Å; H102-T153 WeakPolarHBondContact O-CA 3.49Å; E103-T153 HydrophobicContact CB-CG2 4.03Å; E103-T153 HydrophobicContact CG-CG2 3.91Å; S134-T153 WeakPolarHBondContact CB-OG1 3.4Å; S134-T153 PolarHBondContact N-O 2.98Å; S134-T153 PolarHBondContact O-N 2.99Å; S134-T153 PolarHBondContact O-OG1 3.43Å; S134-T153 PolarHBondContact OG-OG1 2.87Å; S134-T153 VanDerWaalsContact OG-OG1 3.07Å; Q151-T153 HydrophobicContact CG-CG2 4.14Å
154	G	92.6	Very high	93.6	Very high	6 Å²	6	36 Å²	36	6%	0.062	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	163.8	-169.8	179.1	0	0	0	0	0	112.2	H102	H102-G154 PolarHBondContact N-O 3.06Å; H102-G154 PolarHBondContact O-N 3.3Å; H102-G154 VanDerWaalsContact O-N 3.07Å
155	E	92.5	Very high	94	Very high	89 Å²	89	35.2 Å²	35.2	42%	0.416	17%	0.165	S	C	.	.			trans	-65.2	159.5	171.3	-61.9	-70.2	149.6	0	0	110.9	M100 E157 Q158 V159	M100-E155 WeakPolarHBondContact CB-OE1 3.25Å; M100-E155 WeakPolarHBondContact CB-OE2 3.48Å; M100-E155 VanDerWaalsContact O-CD 3.3Å; E155-E157 VanDerWaalsContact C-N 3.28Å; E155-E157 PolarHBondContact O-N 3.44Å; E155-Q158 HydrophobicContact CB-CB 4.5Å; E155-Q158 HydrophobicContact CB-CG 4.13Å; E155-Q158 WeakPolarHBondContact O-CB 3.47Å; E155-Q158 PolarHBondContact O-N 3.46Å; E155-V159 WeakPolarHBondContact O-CG2 3.49Å; E155-V159 PolarHBondContact O-N 3.14Å
156	V	92	Very high	94.2	Very high	38 Å²	38	35.2 Å²	35.2	23%	0.23	17%	0.165	C	C	.	.	H	α-helix	trans	-49.5	-49.9	-179.8	-177.1	0	0	0	0	111.4	A86 L89 H102 Q158 V159 V160	A86-V156 HydrophobicContact CB-CG1 4.06Å; L89-V156 HydrophobicContact CD1-CG1 4.07Å; H102-V156 WeakPolarHBondContact CD2-CG2 3.27Å; H102-V156 WeakPolarHBondContact NE2-CG2 3.4Å; V156-Q158 VanDerWaalsContact C-N 3.34Å; V156-Q158 PolarHBondContact O-N 2.99Å; V156-V159 PolarHBondContact O-N 3.05Å; V156-V160 HydrophobicContact CG1-CG2 4.25Å; V156-V160 WeakPolarHBondContact O-CB 3.5Å; V156-V160 WeakPolarHBondContact O-CG2 3.47Å; V156-V160 PolarHBondContact O-N 3.21Å
157	E	93.3	Very high	94.4	Very high	147 Å²	147	35.4 Å²	35.4	69%	0.687	17%	0.166	S	C	*	.	H	α-helix	trans	-63.4	-38.4	-178.5	-63.4	-174.9	-178.3	0	0	112.8	E155 R161	E155-E157 VanDerWaalsContact C-N 3.28Å; E155-E157 PolarHBondContact O-N 3.44Å; E157-R161 VanDerWaalsContact O-CB 3.26Å; E157-R161 WeakPolarHBondContact O-CB 3.46Å; E157-R161 PolarHBondContact O-N 3.33Å
158	Q	94.5	Very high	94.3	Very high	63 Å²	63	38.2 Å²	38.2	29%	0.294	18%	0.178	S	C	.	.	H	α-helix	trans	-68.4	-44.3	-180	-65	177.6	-32.1	0	0	110.7	G132 E155 V156 A162	G132-Q158 PolarHBondContact O-NE2 2.82Å; E155-Q158 HydrophobicContact CB-CB 4.5Å; E155-Q158 HydrophobicContact CB-CG 4.13Å; E155-Q158 WeakPolarHBondContact O-CB 3.47Å; E155-Q158 PolarHBondContact O-N 3.46Å; V156-Q158 VanDerWaalsContact C-N 3.34Å; V156-Q158 PolarHBondContact O-N 2.99Å; Q158-A162 WeakPolarHBondContact O-CB 3.3Å; Q158-A162 PolarHBondContact O-N 2.78Å
159	V	94.5	Very high	94.2	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65.2	-46.5	178.3	176.1	0	0	0	0	110.4	L89 L104 L152 E155 V156 R161 A162 V163	L89-V159 HydrophobicContact CD1-CB 4.05Å; L89-V159 HydrophobicContact CD1-CG1 3.87Å; L89-V159 HydrophobicContact CD2-CG1 4.17Å; L104-V159 HydrophobicContact CB-CG1 3.87Å; L104-V159 HydrophobicContact CD2-CG1 3.98Å; L152-V159 HydrophobicContact CB-CG1 4.18Å; L152-V159 HydrophobicContact CD1-CG1 4.44Å; E155-V159 WeakPolarHBondContact O-CG2 3.49Å; E155-V159 PolarHBondContact O-N 3.14Å; V156-V159 PolarHBondContact O-N 3.05Å; V159-R161 PolarHBondContact O-N 2.8Å; V159-A162 WeakPolarHBondContact O-CB 3.48Å; V159-A162 PolarHBondContact O-N 2.65Å; V159-A162 VanDerWaalsContact O-N 3.17Å; V159-V163 WeakPolarHBondContact O-CG2 3.5Å; V159-V163 PolarHBondContact O-N 3.44Å
160	V	94.7	Very high	94.1	Very high	22 Å²	22	37.9 Å²	37.9	13%	0.133	18%	0.179	C	C	.	.	H	α-helix	trans	-61.9	-44.3	178.7	172.8	0	0	0	0	111.1	C82 I85 A86 L89 V156 A162 V163 K164	C82-V160 HydrophobicContact CB-CG1 3.64Å; I85-V160 HydrophobicContact CG2-CG2 4.26Å; A86-V160 HydrophobicContact CB-CG2 3.92Å; L89-V160 HydrophobicContact CD1-CG2 4.01Å; V156-V160 HydrophobicContact CG1-CG2 4.25Å; V156-V160 WeakPolarHBondContact O-CB 3.5Å; V156-V160 WeakPolarHBondContact O-CG2 3.47Å; V156-V160 PolarHBondContact O-N 3.21Å; V160-A162 VanDerWaalsContact C-N 3.3Å; V160-A162 PolarHBondContact O-N 2.93Å; V160-V163 PolarHBondContact O-N 3.49Å; V160-K164 PolarHBondContact O-N 3.44Å
161	R	95.1	Very high	93.7	Very high	128 Å²	128	45.5 Å²	45.5	48%	0.483	22%	0.215	S	C	.	.	H	α-helix	trans	-60.1	-41.1	175	-168.7	-178.1	-63.7	155.7	5.6	111.6	T131 E157 V159 K164 E165	T131-R161 HydrophobicContact CG2-CG 4.28Å; E157-R161 VanDerWaalsContact O-CB 3.26Å; E157-R161 WeakPolarHBondContact O-CB 3.46Å; E157-R161 PolarHBondContact O-N 3.33Å; V159-R161 PolarHBondContact O-N 2.8Å; R161-K164 PolarHBondContact O-N 3.08Å; R161-E165 PolarHBondContact O-N 2.89Å
162	A	95.8	Very high	93.4	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-65.7	-41.9	177	0	0	0	0	0	112.9	T131 S133 I135 L152 Q158 V159 V160 K164 E165 I166	T131-A162 VanDerWaalsContact CG2-CA 3.5Å; T131-A162 HydrophobicContact CG2-CB 3.79Å; S133-A162 VanDerWaalsContact OG-CB 3.31Å; S133-A162 WeakPolarHBondContact OG-CB 3.49Å; I135-A162 HydrophobicContact CD1-CB 4.22Å; L152-A162 HydrophobicContact CD1-CB 4.43Å; L152-A162 HydrophobicContact CD2-CB 4.11Å; Q158-A162 WeakPolarHBondContact O-CB 3.3Å; Q158-A162 PolarHBondContact O-N 2.78Å; V159-A162 WeakPolarHBondContact O-CB 3.48Å; V159-A162 PolarHBondContact O-N 2.65Å; V159-A162 VanDerWaalsContact O-N 3.17Å; V160-A162 VanDerWaalsContact C-N 3.3Å; V160-A162 PolarHBondContact O-N 2.93Å; A162-K164 VanDerWaalsContact C-N 3.33Å; A162-K164 PolarHBondContact O-N 3.31Å; A162-E165 PolarHBondContact O-N 3.24Å; A162-I166 WeakPolarHBondContact O-CB 3.4Å; A162-I166 WeakPolarHBondContact O-CD1 3.34Å; A162-I166 VanDerWaalsContact O-CG1 3.24Å; A162-I166 WeakPolarHBondContact O-CG1 3.45Å; A162-I166 PolarHBondContact O-N 3.42Å
163	V	95.2	Very high	93.2	Very high	0 Å²	0	53 Å²	53	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-61.2	-44.3	174.8	175.5	0	0	0	0	110.8	L28 I85 L104 L152 V159 V160 E165 I166 L167	L28-V163 HydrophobicContact CD2-CG1 4.06Å; I85-V163 HydrophobicContact CD1-CB 4.32Å; I85-V163 HydrophobicContact CD1-CG1 3.63Å; I85-V163 HydrophobicContact CD1-CG2 4.43Å; L104-V163 HydrophobicContact CD2-CG2 3.67Å; L152-V163 HydrophobicContact CD1-CG2 3.47Å; L152-V163 VanDerWaalsContact CD1-CG2 3.47Å; V159-V163 WeakPolarHBondContact O-CG2 3.5Å; V159-V163 PolarHBondContact O-N 3.44Å; V160-V163 PolarHBondContact O-N 3.49Å; V163-E165 PolarHBondContact O-N 3.36Å; V163-I166 PolarHBondContact O-N 3.01Å; V163-L167 HydrophobicContact CG1-CD1 3.68Å; V163-L167 HydrophobicContact CG1-CG 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.14Å; V163-L167 WeakPolarHBondContact O-CG 3.28Å; V163-L167 PolarHBondContact O-N 3.14Å
164	K	94.6	Very high	93	Very high	62 Å²	62	56 Å²	56	27%	0.27	27%	0.272	S	S	.	.	H	α-helix	trans	-55.7	-49.2	178.7	-169	174.5	-171.3	162.5	0	111.9	L78 D79 V160 R161 A162 L167 K168	L78-K164 HydrophobicContact CD2-CG 3.78Å; L78-K164 HydrophobicContact CG-CG 4.22Å; D79-K164 WeakPolarHBondContact OD1-CE 3.28Å; D79-K164 IonicContact OD1-NZ 3.3Å; D79-K164 PolarHBondContact OD1-NZ 2.97Å; V160-K164 PolarHBondContact O-N 3.44Å; R161-K164 PolarHBondContact O-N 3.08Å; A162-K164 VanDerWaalsContact C-N 3.33Å; A162-K164 PolarHBondContact O-N 3.31Å; K164-L167 PolarHBondContact O-N 3.17Å; K164-K168 WeakPolarHBondContact O-CG 3.23Å; K164-K168 PolarHBondContact O-N 3.24Å
165	E	94.3	Very high	92.8	Very high	62 Å²	62	58.7 Å²	58.7	29%	0.29	28%	0.284	S	S	.	.	H	α-helix	trans	-69.6	-37	-180	-67.7	-57.6	127.4	0	0	112.6	L127 R161 A162 V163 K168 I169	L127-E165 HydrophobicContact CD2-CB 3.55Å; L127-E165 HydrophobicContact CD2-CG 4.4Å; R161-E165 PolarHBondContact O-N 2.89Å; A162-E165 PolarHBondContact O-N 3.24Å; V163-E165 PolarHBondContact O-N 3.36Å; E165-K168 IonicContact OE1-NZ 3.59Å; E165-K168 PolarHBondContact OE1-NZ 2.86Å; E165-I169 WeakPolarHBondContact O-CG1 3.31Å; E165-I169 PolarHBondContact O-N 3.28Å
166	I	94.8	Very high	92.6	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.3	-43.5	175.7	-72.3	166.6	0	0	0	111.1	I106 I116 L127 I150 L152 A162 V163 I169 C170	I106-I166 HydrophobicContact CD1-CB 4.42Å; I106-I166 HydrophobicContact CD1-CD1 4.07Å; I106-I166 HydrophobicContact CD1-CG2 3.69Å; I116-I166 HydrophobicContact CD1-CG2 3.66Å; I116-I166 HydrophobicContact CG1-CG2 4.35Å; I116-I166 HydrophobicContact CG2-CG1 4.42Å; L127-I166 HydrophobicContact CD1-CG1 4.4Å; I150-I166 HydrophobicContact CG2-CD1 4.36Å; L152-I166 HydrophobicContact CD1-CD1 4.25Å; L152-I166 HydrophobicContact CD2-CD1 3.77Å; A162-I166 WeakPolarHBondContact O-CB 3.4Å; A162-I166 WeakPolarHBondContact O-CD1 3.34Å; A162-I166 VanDerWaalsContact O-CG1 3.24Å; A162-I166 WeakPolarHBondContact O-CG1 3.45Å; A162-I166 PolarHBondContact O-N 3.42Å; V163-I166 PolarHBondContact O-N 3.01Å; I166-I169 PolarHBondContact O-N 3.25Å; I166-C170 PolarHBondContact O-N 2.85Å; I166-C170 PolarHBondContact O-SG 3.39Å; I166-C170 VanDerWaalsContact O-SG 3.36Å
167	L	93	Very high	92.3	Very high	17 Å²	17	63.1 Å²	63.1	9%	0.089	32%	0.319	C	S	.	.	H	α-helix	trans	-65.3	-39	-179.5	-75.7	177.1	0	0	0	112.4	L28 L78 L81 V163 K164 I169 C170 E171	L28-L167 HydrophobicContact CD1-CD2 4.03Å; L78-L167 HydrophobicContact CD1-CB 3.64Å; L78-L167 HydrophobicContact CD1-CD1 3.52Å; L78-L167 HydrophobicContact CD1-CG 4.25Å; L81-L167 HydrophobicContact CD2-CD1 3.41Å; L81-L167 VanDerWaalsContact CD2-CD1 3.41Å; L81-L167 HydrophobicContact CG-CD1 4.42Å; V163-L167 HydrophobicContact CG1-CD1 3.68Å; V163-L167 HydrophobicContact CG1-CG 4.06Å; V163-L167 WeakPolarHBondContact O-CB 3.14Å; V163-L167 WeakPolarHBondContact O-CG 3.28Å; V163-L167 PolarHBondContact O-N 3.14Å; K164-L167 PolarHBondContact O-N 3.17Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 2.88Å; L167-C170 WeakPolarHBondContact O-CB 3.38Å; L167-C170 PolarHBondContact O-N 3.28Å; L167-C170 VanDerWaalsContact O-N 3.17Å; L167-E171 PolarHBondContact O-N 3.24Å
168	K	92.8	Very high	91.9	Very high	75 Å²	75	59.8 Å²	59.8	33%	0.326	32%	0.317	S	S	.	.	H	α-helix	trans	-57	-46.4	171.5	-70.1	173.6	-175.8	171.4	0	111.7	L78 K164 E165 C170 E171 E172	L78-K168 HydrophobicContact CD2-CG 3.87Å; K164-K168 WeakPolarHBondContact O-CG 3.23Å; K164-K168 PolarHBondContact O-N 3.24Å; E165-K168 IonicContact OE1-NZ 3.59Å; E165-K168 PolarHBondContact OE1-NZ 2.86Å; K168-C170 VanDerWaalsContact C-N 3.3Å; K168-C170 PolarHBondContact O-N 2.86Å; K168-E171 PolarHBondContact O-N 3.39Å; K168-E172 WeakPolarHBondContact O-CG 3.46Å; K168-E172 PolarHBondContact O-N 2.86Å
169	I	92.9	Very high	91.6	Very high	14 Å²	14	62.5 Å²	62.5	7%	0.072	33%	0.33	C	S	.	.	H	α-helix	trans	-63.3	-38.3	177.7	-65.1	166	0	0	0	111.2	A115 I116 K123 L127 E165 I166 L167 T173	A115-I169 HydrophobicContact CB-CG2 4.18Å; I116-I169 HydrophobicContact CG1-CB 4.39Å; I116-I169 HydrophobicContact CG1-CG2 3.87Å; K123-I169 HydrophobicContact CG-CD1 4.16Å; L127-I169 HydrophobicContact CD1-CD1 3.77Å; L127-I169 HydrophobicContact CD2-CD1 4.11Å; L127-I169 HydrophobicContact CG-CD1 4.34Å; E165-I169 WeakPolarHBondContact O-CG1 3.31Å; E165-I169 PolarHBondContact O-N 3.28Å; I166-I169 PolarHBondContact O-N 3.25Å; L167-I169 VanDerWaalsContact C-N 3.33Å; L167-I169 PolarHBondContact O-N 2.88Å; I169-T173 WeakPolarHBondContact O-CB 3.33Å; I169-T173 PolarHBondContact O-N 3.39Å; I169-T173 PolarHBondContact O-OG1 3.5Å
170	C	92	Very high	91.4	Very high	15 Å²	15	68.4 Å²	68.4	10%	0.101	35%	0.352	C	S	.	.	H	α-helix	trans	-65.3	-37.3	176.6	-73.5	0	0	0	0	112.7	Q112 I166 L167 K168 T173	Q112-C170 HydrophobicContact CG-CB 4.48Å; Q112-C170 PolarHBondContact NE2-O 3.28Å; I166-C170 PolarHBondContact O-N 2.85Å; I166-C170 PolarHBondContact O-SG 3.39Å; I166-C170 VanDerWaalsContact O-SG 3.36Å; L167-C170 WeakPolarHBondContact O-CB 3.38Å; L167-C170 PolarHBondContact O-N 3.28Å; L167-C170 VanDerWaalsContact O-N 3.17Å; K168-C170 VanDerWaalsContact C-N 3.3Å; K168-C170 PolarHBondContact O-N 2.86Å; C170-T173 VanDerWaalsContact O-O 3.07Å
171	E	89.3	Confident	91.2	Very high	160 Å²	160	70.8 Å²	70.8	75%	0.748	36%	0.362	S	S	*	.	H	α-helix	trans	-69.7	-42.2	176.9	-171.7	175.5	-171.2	0	0	111.8	L167 K168 T173	L167-E171 PolarHBondContact O-N 3.24Å; K168-E171 PolarHBondContact O-N 3.39Å; E171-T173 VanDerWaalsContact C-N 3.29Å; E171-T173 PolarHBondContact O-N 2.86Å
172	E	89.8	Confident	91	Very high	158 Å²	158	64.9 Å²	64.9	74%	0.738	34%	0.34	S	S	*	.	H	α-helix	trans	-70	-24.9	176.3	-69.2	175.9	-176.8	0	0	113.1	K168 P174	K168-E172 WeakPolarHBondContact O-CG 3.46Å; K168-E172 PolarHBondContact O-N 2.86Å; E172-P174 VanDerWaalsContact O-CD 3.28Å; E172-P174 WeakPolarHBondContact O-CD 3.45Å
173	T	89.8	Confident	90.7	Very high	26 Å²	26	68.4 Å²	68.4	16%	0.16	36%	0.359	C	S	.	.	S	Bend	trans	-102	102.5	-175.7	-55.4	0	0	0	0	111.2	Q112 A115 I169 C170 E171	Q112-T173 HydrophobicContact CG-CG2 4.43Å; A115-T173 HydrophobicContact CB-CG2 3.69Å; A115-T173 WeakPolarHBondContact CB-OG1 3.5Å; I169-T173 WeakPolarHBondContact O-CB 3.33Å; I169-T173 PolarHBondContact O-N 3.39Å; I169-T173 PolarHBondContact O-OG1 3.5Å; C170-T173 VanDerWaalsContact O-O 3.07Å; E171-T173 VanDerWaalsContact C-N 3.29Å; E171-T173 PolarHBondContact O-N 2.86Å
174	P	88.7	Confident	90.5	Very high	93 Å²	93	68.6 Å²	68.6	60%	0.604	36%	0.361	S	S	*	.			trans	-62.5	143.8	176.5	26	-34.3	0	0	0	111.3	E172 K176	E172-P174 VanDerWaalsContact O-CD 3.28Å; E172-P174 WeakPolarHBondContact O-CD 3.45Å; P174-K176 PolarHBondContact O-N 3.45Å
175	I	90.3	Very high	90.2	Very high	63 Å²	63	69.8 Å²	69.8	32%	0.323	37%	0.37	S	S	.	.			trans	-61.9	129.2	174.7	-66.6	176.4	0	0	0	109.2	H109 E179	H109-I175 HydrophobicContact CB-CD1 4.34Å; H109-I175 HydrophobicContact CB-CG1 4.17Å; I175-E179 HydrophobicContact CD1-CG 4.27Å; I175-E179 HydrophobicContact CG2-CB 4.32Å
176	K	87.6	Confident	89.7	Confident	149 Å²	149	69.6 Å²	69.6	65%	0.648	37%	0.371	S	S	*	.			trans	-111.9	121.3	178.7	-63.3	178.7	-176.1	174	0	110	H109 S111 P174	H109-K176 PolarHBondContact CE1-O 2.78Å; H109-K176 VanDerWaalsContact CE1-O 3.28Å; S111-K176 PolarHBondContact OG-N 2.92Å; S111-K176 VanDerWaalsContact OG-N 3.16Å; P174-K176 PolarHBondContact O-N 3.45Å
177	G	84.9	Confident	89.3	Confident	72 Å²	72	71 Å²	71	74%	0.742	38%	0.377	S	S	*	.	S	Bend	trans	98.8	-156.2	175.4	0	0	0	0	0	113.2
178	A	85.4	Confident	88.8	Confident	76 Å²	76	71.8 Å²	71.8	63%	0.628	38%	0.381	S	S	*	.			trans	-68.4	136.9	177.4	0	0	0	0	0	110.2	H109 T146	H109-A178 PolarHBondContact NE2-O 2.67Å; H109-A178 VanDerWaalsContact NE2-O 3.1Å; T146-A178 WeakPolarHBondContact CG2-O 2.97Å
179	E	88.4	Confident	88.3	Confident	121 Å²	121	74.8 Å²	74.8	57%	0.565	40%	0.396	S	S	*	.			trans	-107	117.4	173.5	-172.7	-178	-175.7	0	0	109.1	I175	I175-E179 HydrophobicContact CD1-CG 4.27Å; I175-E179 HydrophobicContact CG2-CB 4.32Å
180	R	89	Confident	87.7	Confident	123 Å²	123	78.6 Å²	78.6	46%	0.464	42%	0.416	S	S	.	.			trans	-137.2	114	173.9	-166.2	-173.9	-68	174.7	1.5	109	Y144 S145 T146	Y144-R180 WeakPolarHBondContact O-CD 3.34Å; S145-R180 PolarHBondContact OG-O 3.24Å; T146-R180 HydrophobicContact CG2-CB 4.05Å; T146-R180 PolarHBondContact N-O 2.96Å; T146-R180 PolarHBondContact OG1-N 3.46Å; T146-R180 PolarHBondContact OG1-O 3.46Å
181	M	90.7	Very high	87.3	Confident	72 Å²	72	81 Å²	81	36%	0.355	42%	0.424	S	S	.	.			trans	-69.2	138.9	175.3	-74.7	-168.6	176.8	0	0	110.8
182	Y	92.6	Very high	87.1	Confident	4 Å²	4	73.6 Å²	73.6	2%	0.016	39%	0.39	C	S	.	.			trans	-67.6	137.7	174.1	-177.1	-125.5	0	0	0	110.7	R29 L31 E68 V70 L107 A142 S145 E147 N186 F187 Y195	R29-Y182 PolarHBondContact NH2-O 2.85Å; L31-Y182 HydrophobicContact CD1-CD1 4.22Å; L31-Y182 HydrophobicContact CD1-CE1 3.85Å; E68-Y182 VanDerWaalsContact OE1-CE1 3.23Å; E68-Y182 WeakPolarHBondContact OE1-CE1 3.41Å; E68-Y182 VanDerWaalsContact OE1-CZ 3.27Å; E68-Y182 PolarHBondContact OE1-OH 2.77Å; V70-Y182 HydrophobicContact CG2-CD1 3.87Å; V70-Y182 HydrophobicContact CG2-CE1 4.4Å; L107-Y182 HydrophobicContact CD1-CD1 4.1Å; L107-Y182 HydrophobicContact CD2-CD1 4.29Å; A142-Y182 HydrophobicContact CB-CD1 4.07Å; A142-Y182 HydrophobicContact CB-CD2 3.34Å; A142-Y182 HydrophobicContact CB-CE1 4.34Å; A142-Y182 HydrophobicContact CB-CE2 3.68Å; A142-Y182 HydrophobicContact CB-CG 3.56Å; S145-Y182 WeakPolarHBondContact OG-CA 3.35Å; S145-Y182 WeakPolarHBondContact OG-CB 2.99Å; S145-Y182 PolarHBondContact OG-N 3.42Å; E147-Y182 VanDerWaalsContact OE2-CB 3.29Å; E147-Y182 WeakPolarHBondContact OE2-CB 3.32Å; E147-Y182 PolarHBondContact OE2-N 3.4Å; Y182-N186 HydrophobicContact CE2-CB 4.15Å; Y182-F187 WeakPolarHBondContact OH-CA 3.48Å; Y182-Y195 HydrophobicContact CE1-CE2 4.46Å; Y182-Y195 PolarHBondContact OH-OH 2.56Å
183	D	89.1	Confident	87	Confident	75 Å²	75	70.7 Å²	70.7	40%	0.401	37%	0.373	S	S	.	.			trans	-114.3	126.7	171.3	-174.3	-20	0	0	0	107.4	N185 N186	D183-N185 PolarHBondContact O-N 3.19Å; D183-N185 VanDerWaalsContact O-N 3.11Å; D183-N185 WeakPolarHBondContact OD1-CB 3.21Å; D183-N185 PolarHBondContact OD1-N 2.68Å; D183-N185 PolarHBondContact OD1-ND2 3.22Å; D183-N186 WeakPolarHBondContact O-CB 3.41Å; D183-N186 PolarHBondContact O-N 3.44Å
184	A	90	Very high	86.9	Confident	4 Å²	4	72.5 Å²	72.5	3%	0.033	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-61.2	-19.5	-179.9	0	0	0	0	0	113.1	T66 E68 V70 N186 F187	T66-A184 WeakPolarHBondContact CB-O 3.21Å; T66-A184 WeakPolarHBondContact CG2-O 3.44Å; T66-A184 PolarHBondContact OG1-O 3.03Å; E68-A184 WeakPolarHBondContact O-CB 3.5Å; V70-A184 HydrophobicContact CG2-CB 4.36Å; A184-N186 PolarHBondContact O-N 3.02Å; A184-F187 WeakPolarHBondContact O-CB 3.42Å; A184-F187 PolarHBondContact O-N 3.46Å
185	N	87.8	Confident	86.9	Confident	87 Å²	87	68.3 Å²	68.3	47%	0.465	35%	0.354	S	S	.	.	G	3₁₀ helix	trans	-66.2	-17.9	172.8	-66.2	-57.8	0	0	0	113.2	D183 F187	D183-N185 PolarHBondContact O-N 3.19Å; D183-N185 VanDerWaalsContact O-N 3.11Å; D183-N185 WeakPolarHBondContact OD1-CB 3.21Å; D183-N185 PolarHBondContact OD1-N 2.68Å; D183-N185 PolarHBondContact OD1-ND2 3.22Å; N185-F187 VanDerWaalsContact C-N 3.27Å
186	N	85.6	Confident	86.9	Confident	58 Å²	58	65.3 Å²	65.3	31%	0.31	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-88.8	12.6	175.7	-66	-34.3	0	0	0	113.1	P143 Y144 Y182 D183 A184 D188	P143-N186 HydrophobicContact CB-CB 4.43Å; P143-N186 WeakPolarHBondContact CB-O 3.42Å; P143-N186 WeakPolarHBondContact CG-O 3.35Å; Y144-N186 HydrophobicContact CD2-CB 4.03Å; Y182-N186 HydrophobicContact CE2-CB 4.15Å; D183-N186 WeakPolarHBondContact O-CB 3.41Å; D183-N186 PolarHBondContact O-N 3.44Å; A184-N186 PolarHBondContact O-N 3.02Å; N186-D188 PolarHBondContact O-N 3.49Å
187	F	85.2	Confident	87	Confident	29 Å²	29	58.2 Å²	58.2	13%	0.127	31%	0.307	C	S	.	.			trans	-46.1	124.7	176.9	175.1	-106.8	0	0	0	112.2	T66 R67 E68 Y182 A184 N185 E189 P192 Y195 Y198	T66-F187 HydrophobicContact CG2-CB 3.79Å; R67-F187 HydrophobicContact CB-CE1 4.27Å; R67-F187 HydrophobicContact CB-CE2 4.36Å; R67-F187 HydrophobicContact CB-CZ 4.02Å; R67-F187 HydrophobicContact CG-CE1 4.18Å; R67-F187 HydrophobicContact CG-CZ 4.27Å; E68-F187 VanDerWaalsContact CD-CD2 3.46Å; E68-F187 HydrophobicContact CG-CD2 3.73Å; E68-F187 HydrophobicContact CG-CE2 4.37Å; E68-F187 HydrophobicContact CG-CG 4.48Å; Y182-F187 WeakPolarHBondContact OH-CA 3.48Å; A184-F187 WeakPolarHBondContact O-CB 3.42Å; A184-F187 PolarHBondContact O-N 3.46Å; N185-F187 VanDerWaalsContact C-N 3.27Å; F187-E189 HydrophobicContact CD1-CB 4.23Å; F187-E189 HydrophobicContact CE1-CB 3.92Å; F187-E189 HydrophobicContact CE1-CG 4.31Å; F187-E189 PolarHBondContact O-N 2.77Å; F187-P192 HydrophobicContact CE2-CB 3.63Å; F187-P192 HydrophobicContact CZ-CB 3.8Å; F187-P192 HydrophobicContact CZ-CG 4.31Å; F187-Y195 WeakPolarHBondContact CD2-OH 3.03Å; F187-Y198 WeakPolarHBondContact CE2-O 3.26Å; F187-Y198 WeakPolarHBondContact CZ-O 3.42Å
188	D	83.4	Confident	87.2	Confident	33 Å²	33	56.2 Å²	56.2	18%	0.176	28%	0.278	C	S	.	.			trans	-85.2	104.3	173	-174.2	-18.6	0	0	0	108.9	P143 N186 L190 Y191 P192 Y195 H272	P143-D188 HydrophobicContact CG-CB 3.68Å; N186-D188 PolarHBondContact O-N 3.49Å; D188-L190 VanDerWaalsContact C-N 3.28Å; D188-L190 PolarHBondContact O-N 3.46Å; D188-L190 WeakPolarHBondContact OD1-CB 3.33Å; D188-L190 PolarHBondContact OD1-N 2.7Å; D188-Y191 PolarHBondContact OD1-N 2.93Å; D188-P192 WeakPolarHBondContact O-CA 3.41Å; D188-P192 WeakPolarHBondContact O-CB 3.46Å; D188-P192 VanDerWaalsContact O-CD 3.26Å; D188-P192 WeakPolarHBondContact O-CD 3.32Å; D188-Y195 HydrophobicContact CB-CE1 4.07Å; D188-H272 IonicContact OD2-CD2 3.46Å; D188-H272 PolarHBondContact OD2-CD2 3.42Å
189	E	82.3	Confident	86.9	Confident	139 Å²	139	53.6 Å²	53.6	65%	0.65	26%	0.258	S	S	*	.	S	Bend	trans	-68.7	-26.5	-179.7	-175.3	166	-154.3	0	0	113.2	F187	F187-E189 HydrophobicContact CD1-CB 4.23Å; F187-E189 HydrophobicContact CE1-CB 3.92Å; F187-E189 HydrophobicContact CE1-CG 4.31Å; F187-E189 PolarHBondContact O-N 2.77Å
190	L	79.1	Confident	86	Confident	93 Å²	93	53 Å²	53	49%	0.487	26%	0.255	S	S	.	.	S	Bend	trans	-81.6	-40.8	-177.6	-62	171.1	0	0	0	111.2	D188 L239	D188-L190 VanDerWaalsContact C-N 3.28Å; D188-L190 PolarHBondContact O-N 3.46Å; D188-L190 WeakPolarHBondContact OD1-CB 3.33Å; D188-L190 PolarHBondContact OD1-N 2.7Å; L190-L239 HydrophobicContact CD1-CD1 3.7Å; L190-L239 HydrophobicContact CD2-CD1 4.2Å; L190-L239 HydrophobicContact CG-CD1 4.5Å
191	Y	83.2	Confident	84.5	Confident	65 Å²	65	55.9 Å²	55.9	26%	0.255	27%	0.271	S	S	.	.			trans	-130.7	51.9	-173.8	-52.8	-82	0	0	0	114	D188 Y193 D194 H272	D188-Y191 PolarHBondContact OD1-N 2.93Å; Y191-Y193 PolarHBondContact O-N 2.78Å; Y191-Y193 VanDerWaalsContact O-N 3.17Å; Y191-D194 PolarHBondContact O-N 2.77Å; Y191-H272 VanDerWaalsContact CB-NE2 3.32Å; Y191-H272 WeakPolarHBondContact CB-NE2 3.02Å; Y191-H272 AromaticContact CD1-CE1 3.75Å; Y191-H272 AromaticContact CD1-NE2 3.8Å; Y191-H272 HydrophobicContact CD2-CB 3.96Å; Y191-H272 AromaticContact CD2-CD2 3.13Å; Y191-H272 WeakPolarHBondContact CD2-CD2 3.2Å; Y191-H272 AromaticContact CD2-CE1 3.48Å; Y191-H272 VanDerWaalsContact CD2-CE1 3.48Å; Y191-H272 WeakPolarHBondContact CD2-CE1 3.46Å; Y191-H272 AromaticContact CD2-CG 3.28Å; Y191-H272 AromaticContact CD2-ND1 3.56Å; Y191-H272 AromaticContact CD2-NE2 3.27Å; Y191-H272 VanDerWaalsContact CD2-NE2 3.27Å; Y191-H272 WeakPolarHBondContact CD2-NE2 3.23Å; Y191-H272 AromaticContact CE1-CE1 3.95Å; Y191-H272 HydrophobicContact CE2-CB 3.94Å; Y191-H272 AromaticContact CE2-CD2 3.83Å; Y191-H272 AromaticContact CE2-CE1 3.67Å; Y191-H272 AromaticContact CE2-CG 3.47Å; Y191-H272 VanDerWaalsContact CE2-CG 3.47Å; Y191-H272 AromaticContact CE2-ND1 3.42Å; Y191-H272 WeakPolarHBondContact CE2-ND1 3.47Å; Y191-H272 AromaticContact CE2-NE2 3.94Å; Y191-H272 AromaticContact CG-CD2 3.53Å; Y191-H272 AromaticContact CG-CE1 3.5Å; Y191-H272 AromaticContact CG-NE2 3.16Å; Y191-H272 AromaticContact CZ-CE1 3.9Å; Y191-H272 AromaticContact CZ-ND1 3.85Å
192	P	86.1	Confident	82.3	Confident	6 Å²	6	55.3 Å²	55.3	4%	0.039	28%	0.283	C	S	.	.	H	α-helix	trans	-62.1	-31.2	-177.3	25.3	-34	0	0	0	112.4	F187 D188 D194 Y195 G196 G197	F187-P192 HydrophobicContact CE2-CB 3.63Å; F187-P192 HydrophobicContact CZ-CB 3.8Å; F187-P192 HydrophobicContact CZ-CG 4.31Å; D188-P192 WeakPolarHBondContact O-CA 3.41Å; D188-P192 WeakPolarHBondContact O-CB 3.46Å; D188-P192 VanDerWaalsContact O-CD 3.26Å; D188-P192 WeakPolarHBondContact O-CD 3.32Å; P192-D194 PolarHBondContact O-N 3.04Å; P192-Y195 WeakPolarHBondContact O-CE1 3.41Å; P192-G196 PolarHBondContact O-N 3.32Å; P192-G197 VanDerWaalsContact O-CA 3.26Å; P192-G197 WeakPolarHBondContact O-CA 3.14Å; P192-G197 PolarHBondContact O-N 2.76Å
193	Y	87.9	Confident	79.5	Confident	96 Å²	96	63.8 Å²	63.8	38%	0.376	32%	0.32	S	S	.	.	H	α-helix	trans	-75.6	-20.5	-176.3	-58.8	-69.4	0	0	0	114.4	F138 Y191 G196 G199 E200 K201	F138-Y193 VanDerWaalsContact CE1-O 3.29Å; F138-Y193 WeakPolarHBondContact CE1-O 3.44Å; Y191-Y193 PolarHBondContact O-N 2.78Å; Y191-Y193 VanDerWaalsContact O-N 3.17Å; Y193-G196 PolarHBondContact O-N 3.17Å; Y193-G199 PolarHBondContact OH-O 3.34Å; Y193-G199 VanDerWaalsContact OH-O 3.13Å; Y193-E200 PolarHBondContact OH-O 2.72Å; Y193-K201 HydrophobicContact CE1-CG 4.32Å; Y193-K201 VanDerWaalsContact OH-CA 3.24Å; Y193-K201 WeakPolarHBondContact OH-CA 3.26Å; Y193-K201 WeakPolarHBondContact OH-CG 3.26Å; Y193-K201 PolarHBondContact OH-N 2.78Å
194	D	86.8	Confident	77	Confident	64 Å²	64	71.8 Å²	71.8	34%	0.342	35%	0.345	S	S	.	.	H	α-helix	trans	-68.4	-39.5	-174.6	-74.4	0.6	0	0	0	111	E140 Y191 P192 H272	E140-D194 HydrophobicContact CG-CB 4.48Å; Y191-D194 PolarHBondContact O-N 2.77Å; P192-D194 PolarHBondContact O-N 3.04Å; D194-H272 IonicContact OD2-CE1 2.78Å; D194-H272 IonicContact OD2-NE2 2.88Å; D194-H272 PolarHBondContact OD2-NE2 3.1Å; D194-H272 VanDerWaalsContact OD2-NE2 3.13Å
195	Y	89.5	Confident	74.3	Confident	6 Å²	6	76.6 Å²	76.6	2%	0.024	38%	0.378	C	S	.	.	H	α-helix	trans	-97.5	-5.9	177.6	74	-91.3	0	0	0	114	E68 F138 C141 A142 P143 V149 Y182 F187 D188 P192	E68-Y195 VanDerWaalsContact CD-OH 3.28Å; E68-Y195 PolarHBondContact OE1-OH 3.21Å; E68-Y195 PolarHBondContact OE2-OH 3.49Å; F138-Y195 WeakPolarHBondContact CB-O 3.33Å; C141-Y195 WeakPolarHBondContact O-CB 3.45Å; A142-Y195 HydrophobicContact CB-CD2 3.7Å; A142-Y195 HydrophobicContact CB-CE2 4.12Å; A142-Y195 HydrophobicContact CB-CG 4.44Å; P143-Y195 HydrophobicContact CG-CD1 4Å; P143-Y195 HydrophobicContact CG-CE1 3.81Å; V149-Y195 VanDerWaalsContact CB-O 3.26Å; V149-Y195 WeakPolarHBondContact CB-O 3.17Å; V149-Y195 HydrophobicContact CG2-CD2 4.24Å; V149-Y195 WeakPolarHBondContact CG2-O 3.29Å; Y182-Y195 HydrophobicContact CE1-CE2 4.46Å; Y182-Y195 PolarHBondContact OH-OH 2.56Å; F187-Y195 WeakPolarHBondContact CD2-OH 3.03Å; D188-Y195 HydrophobicContact CB-CE1 4.07Å; P192-Y195 WeakPolarHBondContact O-CE1 3.41Å
196	G	89.8	Confident	71.9	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	24.8	-179.6	0	0	0	0	0	115.2	R105 F138 P192 Y193	R105-G196 WeakPolarHBondContact CD-O 3.46Å; R105-G196 VanDerWaalsContact NH1-C 3.34Å; R105-G196 PolarHBondContact NH1-O 3.17Å; F138-G196 VanDerWaalsContact CD1-CA 3.49Å; F138-G196 VanDerWaalsContact CD1-N 3.34Å; F138-G196 VanDerWaalsContact CE1-CA 3.41Å; F138-G196 VanDerWaalsContact CZ-CA 3.47Å; P192-G196 PolarHBondContact O-N 3.32Å; Y193-G196 PolarHBondContact O-N 3.17Å
197	G	90	Very high	69.7	Low	0 Å²	0	82.8 Å²	82.8	0%	0	42%	0.416	C	S	.	.			trans	-78.6	-180	169.1	0	0	0	0	0	114.6	E68 R105 P192	E68-G197 WeakPolarHBondContact OE2-CA 3.48Å; R105-G197 VanDerWaalsContact NH1-C 3.29Å; R105-G197 PolarHBondContact NH1-O 3.4Å; P192-G197 VanDerWaalsContact O-CA 3.26Å; P192-G197 WeakPolarHBondContact O-CA 3.14Å; P192-G197 PolarHBondContact O-N 2.76Å
198	Y	88.9	Confident	67.2	Low	30 Å²	30	85.6 Å²	85.6	12%	0.118	43%	0.433	C	S	.	.			trans	-102.7	94.3	-176.4	-67.1	-79.5	0	0	0	112.2	L31 I32 P33 E68 R105 F187	L31-Y198 HydrophobicContact CD2-CE2 4.41Å; L31-Y198 HydrophobicContact CG-CD2 4.28Å; L31-Y198 HydrophobicContact CG-CE2 4.02Å; L31-Y198 PolarHBondContact O-OH 3.3Å; I32-Y198 VanDerWaalsContact C-CE2 3.46Å; P33-Y198 HydrophobicContact CB-CD1 4.44Å; P33-Y198 HydrophobicContact CB-CG 4.33Å; P33-Y198 VanDerWaalsContact CD-CZ 3.47Å; P33-Y198 HydrophobicContact CG-CD1 3.61Å; P33-Y198 HydrophobicContact CG-CD2 4.13Å; P33-Y198 HydrophobicContact CG-CE1 3.55Å; P33-Y198 HydrophobicContact CG-CE2 4.08Å; P33-Y198 HydrophobicContact CG-CG 3.88Å; E68-Y198 HydrophobicContact CB-CD2 3.96Å; E68-Y198 PolarHBondContact OE2-N 3.47Å; R105-Y198 WeakPolarHBondContact CD-OH 3.19Å; F187-Y198 WeakPolarHBondContact CE2-O 3.26Å; F187-Y198 WeakPolarHBondContact CZ-O 3.42Å
199	G	79.1	Confident	65.3	Low	20 Å²	20	89.3 Å²	89.3	21%	0.206	46%	0.461	C	S	.	.			trans	-89.3	172.6	172.6	0	0	0	0	0	114.2	Y193 K201	Y193-G199 PolarHBondContact OH-O 3.34Å; Y193-G199 VanDerWaalsContact OH-O 3.13Å; G199-K201 PolarHBondContact O-N 2.83Å
200	E	70.1	Confident	63.6	Low	109 Å²	109	86.8 Å²	86.8	51%	0.509	46%	0.459	S	S	.	.			trans	-75	117.5	166.3	-147.9	165.7	144.6	0	0	109.3	R67 Y193 G202	R67-E200 IonicContact CZ-OE2 3.99Å; R67-E200 VanDerWaalsContact CZ-OE2 3.3Å; R67-E200 IonicContact NH1-OE2 3.6Å; R67-E200 PolarHBondContact NH1-OE2 2.97Å; R67-E200 IonicContact NH2-OE2 2.63Å; R67-E200 PolarHBondContact NH2-OE2 2.73Å; Y193-E200 PolarHBondContact OH-O 2.72Å; E200-G202 PolarHBondContact O-N 3.3Å
201	K	58.1	Low	61.8	Low	184 Å²	184	90.8 Å²	90.8	80%	0.8	47%	0.473	S	S	*	.	S	Bend	trans	-74.7	93.7	173.5	-75.3	-176.3	-179.4	174.2	0	107.3	Y193 G199	Y193-K201 HydrophobicContact CE1-CG 4.32Å; Y193-K201 VanDerWaalsContact OH-CA 3.24Å; Y193-K201 WeakPolarHBondContact OH-CA 3.26Å; Y193-K201 WeakPolarHBondContact OH-CG 3.26Å; Y193-K201 PolarHBondContact OH-N 2.78Å; G199-K201 PolarHBondContact O-N 2.83Å
202	G	43.4	Very low	59.6	Low	60 Å²	60	98 Å²	98	62%	0.619	51%	0.506	S	S	*	.			trans	91.1	79.2	165	0	0	0	0	0	116.4	E200	E200-G202 PolarHBondContact O-N 3.3Å
203	K	33.1	Very low	57.6	Low	182 Å²	182	106.9 Å²	106.9	79%	0.791	55%	0.549	S	S	*	.				-129.4	77.9	117.5	-76.8	-174.5	-177.5	173	0	107.5	S205	K203-S205 PolarHBondContact O-N 2.78Å
204	R	37.9	Very low	55.3	Low	243 Å²	243	105.7 Å²	105.7	92%	0.917	57%	0.566	S	S	*	*			trans	-61.6	101.8	149.8	-86.1	-175.5	170.3	171.3	-2.7	104.1	S206	R204-S206 PolarHBondContact O-N 3.18Å
205	S	33.3	Very low	53.6	Low	105 Å²	105	108.4 Å²	108.4	73%	0.734	59%	0.59	S	S	*	*			trans	-57.1	91.7	158.3	50.1	0	0	0	0	105.5	K203 M207	K203-S205 PolarHBondContact O-N 2.78Å; S205-M207 PolarHBondContact O-N 2.86Å
206	S	36.8	Very low	51.3	Low	107 Å²	107	114 Å²	114	75%	0.748	63%	0.627	S	S	*	*			trans	-55.3	101.9	152.5	-176	0	0	0	0	103.7	R204 D208	R204-S206 PolarHBondContact O-N 3.18Å; S206-D208 PolarHBondContact O-N 2.72Å
207	M	40	Very low	49.4	Very low	168 Å²	168	120.6 Å²	120.6	83%	0.828	67%	0.667	S	S	*	*			trans	-67.8	77.3	172.1	-162.8	157.1	148.1	0	0	105.1	S205 S209	S205-M207 PolarHBondContact O-N 2.86Å; M207-S209 VanDerWaalsContact C-N 3.26Å; M207-S209 PolarHBondContact O-N 3.33Å
208	D	32.3	Very low	47.4	Very low	88 Å²	88	126.5 Å²	126.5	47%	0.471	71%	0.705	S	S	.	*			trans	-74.2	88.4	170.7	-177.3	12.9	0	0	0	106.5	S206 S210	S206-D208 PolarHBondContact O-N 2.72Å; D208-S210 PolarHBondContact O-N 2.89Å; D208-S210 WeakPolarHBondContact OD1-CB 3.29Å; D208-S210 PolarHBondContact OD1-OG 3.47Å
209	S	43.1	Very low	45.2	Very low	111 Å²	111	130 Å²	130	78%	0.776	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	27.3	179	-59.8	0	0	0	0	113.5	M207	M207-S209 VanDerWaalsContact C-N 3.26Å; M207-S209 PolarHBondContact O-N 3.33Å
210	S	46.3	Very low	43.3	Very low	86 Å²	86	136.7 Å²	136.7	60%	0.601	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130	7.7	-169.4	76.9	0	0	0	0	117	D208	D208-S210 PolarHBondContact O-N 2.89Å; D208-S210 WeakPolarHBondContact OD1-CB 3.29Å; D208-S210 PolarHBondContact OD1-OG 3.47Å
211	K	42.9	Very low	41.6	Very low	177 Å²	177	140.3 Å²	140.3	77%	0.77	77%	0.77	S	S	*	*			trans	-120.8	59.4	177.8	-66.4	-177	-173.5	170.9	0	113.5
212	F	35.4	Very low	40.7	Very low	217 Å²	217	139.5 Å²	139.5	95%	0.952	77%	0.766	S	S	*	*			trans	-94	92.5	156.7	-117.6	-94.9	0	0	0	107.6
213	M	44.2	Very low	40.7	Very low	191 Å²	191	144.2 Å²	144.2	94%	0.941	77%	0.773	S	S	*	*			trans	-165	131.8	160.1	-112.6	169.3	96.8	0	0	108.8
214	G	40.9	Very low	41	Very low	72 Å²	72	147.2 Å²	147.2	74%	0.742	78%	0.779	S	S	*	*			trans	-68.9	-173.2	-168.4	0	0	0	0	0	115.3
215	S	49.7	Very low	41	Very low	120 Å²	120	141.7 Å²	141.7	84%	0.839	78%	0.777	S	S	*	*			cis	-156.4	-159.2	16.2	-62.7	0	0	0	0	108.1
216	P	42.9	Very low	41.7	Very low	123 Å²	123	145.8 Å²	145.8	80%	0.799	78%	0.782	S	S	*	*	P	Polyproline II helix		-102.9	152.5	-100.8	24.6	-4.1	0	0	0	114.8
217	V	49.9	Very low	42.1	Very low	139 Å²	139	145.8 Å²	145.8	84%	0.842	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-83.1	135	170.3	-97.4	0	0	0	0	111.2
218	P	47.8	Very low	41.9	Very low	124 Å²	124	149.4 Å²	149.4	81%	0.805	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-66.8	132.6	174.1	-15.5	29.3	0	0	0	111.6
219	V	41.4	Very low	42.6	Very low	105 Å²	105	154.1 Å²	154.1	64%	0.636	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-68.9	132.8	167.2	-85.9	0	0	0	0	109.6	W221	V219-W221 HydrophobicContact CB-CE3 4.28Å; V219-W221 HydrophobicContact CB-CH2 3.87Å; V219-W221 HydrophobicContact CB-CZ2 4.3Å; V219-W221 HydrophobicContact CB-CZ3 3.84Å; V219-W221 HydrophobicContact CG2-CE3 4.36Å; V219-W221 HydrophobicContact CG2-CH2 3.15Å; V219-W221 HydrophobicContact CG2-CZ2 3.84Å; V219-W221 HydrophobicContact CG2-CZ3 3.46Å; V219-W221 VanDerWaalsContact CG2-CZ3 3.46Å; V219-W221 WeakPolarHBondContact O-CZ3 3.43Å
220	D	39.9	Very low	42.6	Very low	159 Å²	159	157.7 Å²	157.7	85%	0.85	81%	0.807	S	S	*	*			trans	-127.6	133.1	158	-140.8	-7	0	0	0	111.2
221	W	34.7	Very low	42.8	Very low	185 Å²	185	161.9 Å²	161.9	70%	0.701	82%	0.817	S	S	*	*			trans	-92.5	125.1	-165.8	-71.9	-108.4	0	0	0	109	V219	V219-W221 HydrophobicContact CB-CE3 4.28Å; V219-W221 HydrophobicContact CB-CH2 3.87Å; V219-W221 HydrophobicContact CB-CZ2 4.3Å; V219-W221 HydrophobicContact CB-CZ3 3.84Å; V219-W221 HydrophobicContact CG2-CE3 4.36Å; V219-W221 HydrophobicContact CG2-CH2 3.15Å; V219-W221 HydrophobicContact CG2-CZ2 3.84Å; V219-W221 HydrophobicContact CG2-CZ3 3.46Å; V219-W221 VanDerWaalsContact CG2-CZ3 3.46Å; V219-W221 WeakPolarHBondContact O-CZ3 3.43Å
222	F	39.6	Very low	42.9	Very low	167 Å²	167	158.9 Å²	158.9	73%	0.732	82%	0.816	S	S	*	*				162.9	121.3	126.9	-101.6	-110.4	0	0	0	114
223	Q	42	Very low	43.3	Very low	160 Å²	160	157.5 Å²	157.5	75%	0.748	81%	0.812	S	S	*	*			trans	61.6	101.5	135.5	-74.9	177.5	-11.4	0	0	121.1
224	R	39.7	Very low	43.6	Very low	245 Å²	245	155.4 Å²	155.4	93%	0.925	80%	0.803	S	S	*	*				-166.9	111.5	101.2	-125.3	173	168.8	-167.6	-3.1	111.2	K226	R224-K226 PolarHBondContact O-N 3.07Å
225	S	37.9	Very low	43.9	Very low	126 Å²	126	157.1 Å²	157.1	88%	0.881	80%	0.802	S	S	*	*			trans	-66.2	110.9	174.4	-34	0	0	0	0	110.2
226	K	48.8	Very low	43.7	Very low	191 Å²	191	159.8 Å²	159.8	83%	0.83	80%	0.803	S	S	*	*			trans	-103.7	139.8	153.9	-82.7	-174.1	176.3	-179.3	0	107.9	R224 R228	R224-K226 PolarHBondContact O-N 3.07Å; K226-R228 PolarHBondContact O-N 2.86Å
227	P	45	Very low	44.6	Very low	108 Å²	108	163.6 Å²	163.6	70%	0.701	80%	0.801	S	S	*	*			trans	-58.3	129.5	-173.9	23.3	-30.9	0	0	0	109.4	F229	P227-F229 VanDerWaalsContact C-N 3.25Å; P227-F229 PolarHBondContact O-N 3.35Å
228	R	36.4	Very low	45.6	Very low	244 Å²	244	161.8 Å²	161.8	92%	0.921	79%	0.791	S	S	*	*			trans	-64.5	93.2	166.8	-68.7	-175.7	-163.9	-166.8	3.9	106.7	K226 M230	K226-R228 PolarHBondContact O-N 2.86Å; R228-M230 PolarHBondContact O-N 3.09Å; R228-M230 VanDerWaalsContact O-N 3.14Å
229	F	46.4	Very low	47.2	Very low	187 Å²	187	160.3 Å²	160.3	82%	0.82	78%	0.775	S	S	*	*			trans	-59.2	112.5	150.4	-94.2	-94.9	0	0	0	105.2	P227 E231	P227-F229 VanDerWaalsContact C-N 3.25Å; P227-F229 PolarHBondContact O-N 3.35Å; F229-E231 PolarHBondContact O-N 3.06Å
230	M	42.3	Very low	49.3	Very low	185 Å²	185	157.5 Å²	157.5	91%	0.911	76%	0.759	S	S	*	*			trans	-58.3	96.3	162.9	-88.8	168.6	111.8	0	0	106	R228	R228-M230 PolarHBondContact O-N 3.09Å; R228-M230 VanDerWaalsContact O-N 3.14Å
231	E	52.1	Low	51.6	Low	175 Å²	175	155.3 Å²	155.3	82%	0.818	74%	0.744	S	S	*	*			trans	-57.5	126.6	162.7	-103.2	168	165.1	0	0	106.6	F229 E233	F229-E231 PolarHBondContact O-N 3.06Å; E231-E233 PolarHBondContact O-N 3.21Å; E231-E233 VanDerWaalsContact O-N 3.09Å
232	P	45.3	Very low	54.3	Low	113 Å²	113	149.8 Å²	149.8	73%	0.734	73%	0.727	S	S	*	*			trans	-58.4	120.9	172.7	23.7	-29.8	0	0	0	107.2	I234	P232-I234 PolarHBondContact O-N 3.33Å
233	E	42.7	Very low	56.7	Low	188 Å²	188	147.5 Å²	147.5	88%	0.879	72%	0.718	S	S	*	*			trans	-56.5	105.8	171.8	-67.1	-148.6	171.6	0	0	108	E231 P235	E231-E233 PolarHBondContact O-N 3.21Å; E231-E233 VanDerWaalsContact O-N 3.09Å; E233-P235 VanDerWaalsContact O-CD 3.3Å; E233-P235 WeakPolarHBondContact O-CD 3.2Å
234	I	50.8	Low	58.9	Low	147 Å²	147	141.6 Å²	141.6	75%	0.754	69%	0.693	S	S	*	*			trans	-63.4	116.5	167.6	-58.4	171.4	0	0	0	104	P232 M236	P232-I234 PolarHBondContact O-N 3.33Å; I234-M236 PolarHBondContact O-N 3.48Å
235	P	46.2	Very low	61.1	Low	109 Å²	109	134 Å²	134	71%	0.708	67%	0.674	S	S	*	*			trans	-55.3	119.4	180	19.5	-28.8	0	0	0	107.5	E233 R237	E233-P235 VanDerWaalsContact O-CD 3.3Å; E233-P235 WeakPolarHBondContact O-CD 3.2Å; P235-R237 PolarHBondContact O-N 3.15Å
236	M	45.4	Very low	63.4	Low	175 Å²	175	128.6 Å²	128.6	86%	0.862	64%	0.635	S	S	*	*			trans	-48	116	174.9	-83.8	-179.2	73.3	0	0	106.6	I234 T238	I234-M236 PolarHBondContact O-N 3.48Å; M236-T238 VanDerWaalsContact C-N 3.26Å; M236-T238 PolarHBondContact O-N 3.21Å
237	R	61.8	Low	65.2	Low	203 Å²	203	120 Å²	120	77%	0.766	60%	0.599	S	S	*	*			trans	-63.3	95.5	172.9	-73.3	-174.7	179.6	-177.4	0.8	106.6	P235 L239 L292	P235-R237 PolarHBondContact O-N 3.15Å; R237-L239 PolarHBondContact O-N 3.45Å; R237-L239 VanDerWaalsContact O-N 3.13Å; R237-L292 HydrophobicContact CB-CD2 3.68Å; R237-L292 HydrophobicContact CG-CD2 4.36Å
238	T	70.7	Confident	67.1	Low	102 Å²	102	117.1 Å²	117.1	63%	0.626	58%	0.578	S	S	*	*			trans	-68.6	111.3	-177.1	47	0	0	0	0	108.7	M236	M236-T238 VanDerWaalsContact C-N 3.26Å; M236-T238 PolarHBondContact O-N 3.21Å
239	L	82.3	Confident	69.4	Low	92 Å²	92	111.9 Å²	111.9	48%	0.482	56%	0.564	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-71.3	135.8	169.2	-64	170.7	0	0	0	108.7	L190 R237 G291 L292	L190-L239 HydrophobicContact CD1-CD1 3.7Å; L190-L239 HydrophobicContact CD2-CD1 4.2Å; L190-L239 HydrophobicContact CG-CD1 4.5Å; R237-L239 PolarHBondContact O-N 3.45Å; R237-L239 VanDerWaalsContact O-N 3.13Å; L239-G291 CarbonylContact C-O 3.55Å; L239-G291 WeakPolarHBondContact CA-O 3.4Å; L239-L292 HydrophobicContact CD2-CD2 4.15Å
240	T	84.6	Confident	71.2	Confident	47 Å²	47	103 Å²	103	29%	0.288	53%	0.525	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	144.9	173	55.2	0	0	0	0	109.2	T290 G291 V296	T240-T290 WeakPolarHBondContact O-CA 3.47Å; T240-G291 PolarHBondContact N-O 2.94Å; T240-G291 PolarHBondContact O-N 3.12Å; T240-G291 PolarHBondContact OG1-O 3.33Å; T240-V296 WeakPolarHBondContact O-CG2 3.44Å; T240-V296 WeakPolarHBondContact OG1-CG2 3.3Å
241	E	90.1	Very high	73.2	Confident	113 Å²	113	94.4 Å²	94.4	53%	0.528	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	131.1	172.2	-178.8	176.9	151.4	0	0	108.4	T288 I289	E241-T288 HydrophobicContact CG-CG2 3.61Å; E241-T288 WeakPolarHBondContact OE1-CG2 3.1Å; E241-I289 WeakPolarHBondContact CA-O 3.46Å
242	I	90.8	Very high	74.8	Confident	68 Å²	68	88.5 Å²	88.5	35%	0.349	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	138.4	174.8	-53	179.7	0	0	0	108.4	I289 V296	I242-I289 PolarHBondContact N-O 3.01Å; I242-I289 PolarHBondContact O-N 3.01Å; I242-V296 HydrophobicContact CB-CG1 4.13Å; I242-V296 HydrophobicContact CD1-CG1 3.36Å; I242-V296 HydrophobicContact CG1-CG1 3.67Å
243	Q	90.2	Very high	76.6	Confident	119 Å²	119	84.5 Å²	84.5	56%	0.556	44%	0.442	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.3	131.9	173.6	-66.4	-178.3	-1.7	0	0	110	I286 I287 T288	Q243-I286 HydrophobicContact CB-CG2 4.03Å; Q243-I286 HydrophobicContact CG-CG2 4.15Å; Q243-I287 CarbonylContact C-O 3.44Å; Q243-I287 WeakPolarHBondContact CA-O 3.39Å; Q243-T288 HydrophobicContact CG-CG2 4.41Å
244	V	88	Confident	78.7	Confident	37 Å²	37	75.6 Å²	75.6	22%	0.224	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	125.5	176.6	-177.4	0	0	0	0	108.1	I246 I287 I289	V244-I246 HydrophobicContact CG1-CG2 4.38Å; V244-I287 PolarHBondContact N-O 2.93Å; V244-I287 PolarHBondContact O-N 3.06Å; V244-I289 HydrophobicContact CG2-CD1 4.06Å
245	T	86.2	Confident	80.3	Confident	84 Å²	84	71 Å²	71	52%	0.515	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	134.3	173.2	51.2	0	0	0	0	110.5	R285 I286	T245-R285 WeakPolarHBondContact CA-O 3.48Å; T245-I286 HydrophobicContact CG2-CG1 4.21Å
246	I	86.1	Confident	82.1	Confident	13 Å²	13	66.9 Å²	66.9	7%	0.067	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	145.4	174.9	55.2	159.3	0	0	0	110.1	V244 C251 I254 Q284 R285 I287	V244-I246 HydrophobicContact CG1-CG2 4.38Å; I246-C251 HydrophobicContact CD1-CB 4.04Å; I246-I254 HydrophobicContact CD1-CD1 3.51Å; I246-I254 HydrophobicContact CG2-CD1 4.04Å; I246-Q284 CarbonylContact O-C 3.47Å; I246-Q284 VanDerWaalsContact O-CA 3.28Å; I246-Q284 WeakPolarHBondContact O-CA 3.36Å; I246-R285 HydrophobicContact CG1-CB 4.38Å; I246-R285 WeakPolarHBondContact CG1-O 3.26Å; I246-R285 PolarHBondContact N-O 3.41Å; I246-R285 PolarHBondContact O-N 3Å; I246-I287 HydrophobicContact CD1-CD1 3.44Å; I246-I287 VanDerWaalsContact CD1-CD1 3.44Å; I246-I287 HydrophobicContact CD1-CG1 4Å; I246-I287 HydrophobicContact CG1-CD1 3.96Å; I246-I287 HydrophobicContact CG1-CG1 4.11Å; I246-I287 HydrophobicContact CG2-CD1 4.45Å
247	P	85.6	Confident	83.8	Confident	10 Å²	10	69.6 Å²	69.6	7%	0.065	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.8	142	169.1	-22.6	29.4	0	0	0	112.3	E249 L250 C251 D283 Y316	P247-E249 HydrophobicContact CB-CG 3.74Å; P247-E249 PolarHBondContact O-N 3.24Å; P247-L250 HydrophobicContact CB-CG 4.29Å; P247-L250 HydrophobicContact CG-CD1 4.04Å; P247-L250 HydrophobicContact CG-CG 4.34Å; P247-L250 PolarHBondContact O-N 3.28Å; P247-C251 PolarHBondContact O-N 3.06Å; P247-D283 CarbonylContact C-O 3.56Å; P247-D283 WeakPolarHBondContact CA-O 3.43Å; P247-Y316 HydrophobicContact CB-CE2 4.36Å; P247-Y316 HydrophobicContact CG-CD1 4.39Å; P247-Y316 HydrophobicContact CG-CD2 3.72Å; P247-Y316 HydrophobicContact CG-CE1 3.91Å; P247-Y316 HydrophobicContact CG-CE2 3.17Å; P247-Y316 HydrophobicContact CG-CG 4.28Å; P247-Y316 WeakPolarHBondContact CG-OH 3.44Å
248	N	84.7	Confident	84.5	Confident	48 Å²	48	63.9 Å²	63.9	26%	0.257	36%	0.359	S	S	.	.	H	α-helix	trans	-55	-36.2	177.5	-85.6	-38.7	0	0	0	112.3	L250 C251 S282 D283 R285	N248-L250 VanDerWaalsContact C-N 3.28Å; N248-L250 PolarHBondContact O-N 2.97Å; N248-C251 VanDerWaalsContact O-CB 3.28Å; N248-C251 WeakPolarHBondContact O-CB 3.48Å; N248-C251 PolarHBondContact O-N 2.97Å; N248-S282 PolarHBondContact ND2-O 3.09Å; N248-D283 PolarHBondContact N-O 3.23Å; N248-R285 WeakPolarHBondContact OD1-CB 3.42Å; N248-R285 PolarHBondContact OD1-NE 2.79Å
249	E	84.4	Confident	84.9	Confident	134 Å²	134	59.5 Å²	59.5	63%	0.626	34%	0.335	S	S	*	.	H	α-helix	trans	-63.8	-27.5	176.9	54.9	171.1	-160.2	0	0	114	P247	P247-E249 HydrophobicContact CB-CG 3.74Å; P247-E249 PolarHBondContact O-N 3.24Å
250	L	84.2	Confident	84.9	Confident	1 Å²	1	59.6 Å²	59.6	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-89	-16.6	179.1	-62.3	-174.5	0	0	0	112.6	P247 N248 G252 T253 I254 V307 A312 Y316	P247-L250 HydrophobicContact CB-CG 4.29Å; P247-L250 HydrophobicContact CG-CD1 4.04Å; P247-L250 HydrophobicContact CG-CG 4.34Å; P247-L250 PolarHBondContact O-N 3.28Å; N248-L250 VanDerWaalsContact C-N 3.28Å; N248-L250 PolarHBondContact O-N 2.97Å; L250-G252 VanDerWaalsContact C-N 3.32Å; L250-G252 PolarHBondContact O-N 2.94Å; L250-T253 WeakPolarHBondContact O-CB 3.37Å; L250-T253 PolarHBondContact O-N 2.88Å; L250-T253 PolarHBondContact O-OG1 2.85Å; L250-I254 PolarHBondContact O-N 2.88Å; L250-V307 HydrophobicContact CD1-CG1 4Å; L250-A312 HydrophobicContact CD2-CB 3.69Å; L250-Y316 HydrophobicContact CD1-CD1 3.69Å; L250-Y316 HydrophobicContact CD1-CD2 4.41Å; L250-Y316 HydrophobicContact CD1-CE1 4.35Å; L250-Y316 HydrophobicContact CD1-CG 3.7Å
251	C	84.8	Confident	85	Confident	4 Å²	4	61 Å²	61	3%	0.027	33%	0.332	C	S	.	.	H	α-helix	trans	-55.8	-45.2	-177.4	-177.6	0	0	0	0	112.3	I246 P247 N248 T253 I254 I255 R285	I246-C251 HydrophobicContact CD1-CB 4.04Å; P247-C251 PolarHBondContact O-N 3.06Å; N248-C251 VanDerWaalsContact O-CB 3.28Å; N248-C251 WeakPolarHBondContact O-CB 3.48Å; N248-C251 PolarHBondContact O-N 2.97Å; C251-T253 PolarHBondContact O-N 3.1Å; C251-T253 VanDerWaalsContact O-N 3.16Å; C251-I254 PolarHBondContact O-N 2.77Å; C251-I255 WeakPolarHBondContact O-CG1 3.45Å; C251-I255 PolarHBondContact O-N 3.26Å; C251-I255 WeakPolarHBondContact SG-CD1 3.4Å; C251-R285 WeakPolarHBondContact SG-CD 3.39Å
252	G	84.9	Confident	84.9	Confident	51 Å²	51	55.8 Å²	55.8	53%	0.526	31%	0.308	S	S	.	.	H	α-helix	trans	-59.4	-29.1	177.2	0	0	0	0	0	113.7	L250 G256	L250-G252 VanDerWaalsContact C-N 3.32Å; L250-G252 PolarHBondContact O-N 2.94Å; G252-G256 WeakPolarHBondContact O-CA 3.25Å; G252-G256 PolarHBondContact O-N 3.48Å
253	T	84.2	Confident	84.5	Confident	29 Å²	29	53.2 Å²	53.2	18%	0.178	30%	0.295	C	S	.	.	H	α-helix	trans	-75.6	-27.6	178.9	73.9	0	0	0	0	113	L250 C251 R261 S310 A312	L250-T253 WeakPolarHBondContact O-CB 3.37Å; L250-T253 PolarHBondContact O-N 2.88Å; L250-T253 PolarHBondContact O-OG1 2.85Å; C251-T253 PolarHBondContact O-N 3.1Å; C251-T253 VanDerWaalsContact O-N 3.16Å; T253-R261 WeakPolarHBondContact O-CD 3.43Å; T253-R261 PolarHBondContact O-NH1 3.45Å; T253-S310 WeakPolarHBondContact CG2-OG 3.48Å; T253-A312 HydrophobicContact CG2-CB 4.45Å
254	I	86.4	Confident	84.3	Confident	1 Å²	1	53.6 Å²	53.6	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-83.4	-47.9	176.5	-74.6	163.3	0	0	0	110.6	I246 L250 C251 R261 I262 I287 L303 V307	I246-I254 HydrophobicContact CD1-CD1 3.51Å; I246-I254 HydrophobicContact CG2-CD1 4.04Å; L250-I254 PolarHBondContact O-N 2.88Å; C251-I254 PolarHBondContact O-N 2.77Å; I254-R261 WeakPolarHBondContact O-CB 3.26Å; I254-I262 HydrophobicContact CG2-CD1 4.03Å; I254-I262 PolarHBondContact O-N 3.02Å; I254-I287 HydrophobicContact CD1-CD1 4.1Å; I254-I287 HydrophobicContact CG2-CD1 4.06Å; I254-L303 HydrophobicContact CG1-CD2 4.46Å; I254-L303 HydrophobicContact CG2-CD2 3.41Å; I254-L303 VanDerWaalsContact CG2-CD2 3.41Å; I254-V307 HydrophobicContact CD1-CG2 3.67Å; I254-V307 HydrophobicContact CG1-CG2 4.03Å
255	I	85.5	Confident	84.4	Confident	50 Å²	50	52 Å²	52	26%	0.256	28%	0.282	S	S	.	.	H	α-helix	trans	-62.7	-45.7	177.4	-63.4	179.1	0	0	0	109.9	C251 G259 R261 I262 V275	C251-I255 WeakPolarHBondContact O-CG1 3.45Å; C251-I255 PolarHBondContact O-N 3.26Å; C251-I255 WeakPolarHBondContact SG-CD1 3.4Å; I255-G259 CarbonylContact O-C 3.6Å; I255-G259 WeakPolarHBondContact O-CA 3.32Å; I255-R261 PolarHBondContact O-N 2.83Å; I255-I262 HydrophobicContact CB-CG2 4.4Å; I255-I262 HydrophobicContact CG2-CG2 4.13Å; I255-I262 PolarHBondContact O-N 2.92Å; I255-V275 HydrophobicContact CD1-CG1 4.18Å
256	G	83.9	Confident	84.6	Confident	23 Å²	23	49.8 Å²	49.8	24%	0.237	26%	0.264	C	S	.	.			trans	75	173.5	-173.5	0	0	0	0	0	112.7	G252 G258 G259	G252-G256 WeakPolarHBondContact O-CA 3.25Å; G252-G256 PolarHBondContact O-N 3.48Å; G256-G258 PolarHBondContact O-N 3.32Å; G256-G259 PolarHBondContact O-N 2.9Å
257	R	80	Confident	84.5	Confident	233 Å²	233	50.9 Å²	50.9	88%	0.879	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-64.1	119.4	178.1	-70.8	-174.7	-71.5	-173	-3	109.4	G259 E260	R257-G259 PolarHBondContact O-N 3.41Å; R257-E260 PolarHBondContact O-N 2.8Å
258	G	76.2	Confident	84.7	Confident	82 Å²	82	56 Å²	56	85%	0.845	29%	0.293	S	S	*	.	G	3₁₀ helix	trans	67.1	17.6	-179.4	0	0	0	0	0	115.2	G256 E260	G256-G258 PolarHBondContact O-N 3.32Å; G258-E260 VanDerWaalsContact C-N 3.3Å; G258-E260 PolarHBondContact O-N 3.23Å
259	G	80.6	Confident	84.9	Confident	11 Å²	11	54 Å²	54	11%	0.113	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	80.8	4.5	-178.4	0	0	0	0	0	114.9	I255 G256 R257 R261 I262 N263	I255-G259 CarbonylContact O-C 3.6Å; I255-G259 WeakPolarHBondContact O-CA 3.32Å; G256-G259 PolarHBondContact O-N 2.9Å; R257-G259 PolarHBondContact O-N 3.41Å; G259-R261 PolarHBondContact O-N 3.2Å; G259-R261 VanDerWaalsContact O-N 3.17Å; G259-I262 WeakPolarHBondContact O-CG2 3.47Å; G259-I262 PolarHBondContact O-N 2.94Å; G259-N263 WeakPolarHBondContact O-CB 3.44Å; G259-N263 PolarHBondContact O-N 3.23Å; G259-N263 PolarHBondContact O-ND2 3.46Å
260	E	81.2	Confident	85	Confident	94 Å²	94	48.4 Å²	48.4	44%	0.439	26%	0.261	S	S	.	.	H	α-helix	trans	-54.4	-41.2	-174.5	-168.6	-159.4	152.8	0	0	112.6	R257 G258 R264	R257-E260 PolarHBondContact O-N 2.8Å; G258-E260 VanDerWaalsContact C-N 3.3Å; G258-E260 PolarHBondContact O-N 3.23Å; E260-R264 WeakPolarHBondContact O-CB 3.27Å; E260-R264 PolarHBondContact O-N 3.44Å; E260-R264 IonicContact OE1-NH2 2.6Å; E260-R264 PolarHBondContact OE1-NH2 3.24Å
261	R	85.9	Confident	85.1	Confident	75 Å²	75	48.6 Å²	48.6	28%	0.283	26%	0.263	S	S	.	.	H	α-helix	trans	-76.2	-44.6	-174.3	-167.3	-179.1	-161.8	158.2	4.4	111.3	T253 I254 I255 G259 N263 R264 I265 C306	T253-R261 WeakPolarHBondContact O-CD 3.43Å; T253-R261 PolarHBondContact O-NH1 3.45Å; I254-R261 WeakPolarHBondContact O-CB 3.26Å; I255-R261 PolarHBondContact O-N 2.83Å; G259-R261 PolarHBondContact O-N 3.2Å; G259-R261 VanDerWaalsContact O-N 3.17Å; R261-N263 VanDerWaalsContact C-N 3.31Å; R261-N263 PolarHBondContact O-N 2.94Å; R261-R264 WeakPolarHBondContact O-CB 3.27Å; R261-R264 PolarHBondContact O-N 3.45Å; R261-I265 VanDerWaalsContact O-CG1 3.32Å; R261-I265 WeakPolarHBondContact O-CG1 3.46Å; R261-I265 PolarHBondContact O-N 3.17Å; R261-C306 PolarHBondContact NE-SG 3.27Å
262	I	88.3	Confident	85.2	Confident	4 Å²	4	49.8 Å²	49.8	2%	0.021	27%	0.268	C	S	.	.	H	α-helix	trans	-64.6	-37.8	175.8	-172.8	66	0	0	0	111.4	I254 I255 G259 R264 I265 R266 I273 V275 L303	I254-I262 HydrophobicContact CG2-CD1 4.03Å; I254-I262 PolarHBondContact O-N 3.02Å; I255-I262 HydrophobicContact CB-CG2 4.4Å; I255-I262 HydrophobicContact CG2-CG2 4.13Å; I255-I262 PolarHBondContact O-N 2.92Å; G259-I262 WeakPolarHBondContact O-CG2 3.47Å; G259-I262 PolarHBondContact O-N 2.94Å; I262-R264 VanDerWaalsContact C-N 3.33Å; I262-R264 PolarHBondContact O-N 3.13Å; I262-I265 PolarHBondContact O-N 2.73Å; I262-R266 VanDerWaalsContact CG1-CZ 3.49Å; I262-R266 WeakPolarHBondContact O-CG 3.36Å; I262-R266 PolarHBondContact O-N 3.43Å; I262-I273 HydrophobicContact CD1-CB 4.35Å; I262-I273 HydrophobicContact CD1-CG2 3.77Å; I262-V275 HydrophobicContact CD1-CG2 4.24Å; I262-V275 HydrophobicContact CG1-CG2 4.33Å; I262-L303 HydrophobicContact CD1-CD2 4.17Å
263	N	84	Confident	85.5	Confident	14 Å²	14	47.4 Å²	47.4	8%	0.075	24%	0.243	C	C	.	.	H	α-helix	trans	-62.9	-39.5	174.3	-71.9	-18.4	0	0	0	112	E140 G259 R261 R266 N267	E140-N263 PolarHBondContact OE2-OD1 2.97Å; G259-N263 WeakPolarHBondContact O-CB 3.44Å; G259-N263 PolarHBondContact O-N 3.23Å; G259-N263 PolarHBondContact O-ND2 3.46Å; R261-N263 VanDerWaalsContact C-N 3.31Å; R261-N263 PolarHBondContact O-N 2.94Å; N263-R266 PolarHBondContact O-N 2.98Å; N263-R266 PolarHBondContact OD1-NH1 3.41Å; N263-N267 WeakPolarHBondContact O-CB 3.32Å; N263-N267 PolarHBondContact O-N 3.12Å; N263-N267 PolarHBondContact O-ND2 3.04Å
264	R	85.9	Confident	85.7	Confident	128 Å²	128	52.2 Å²	52.2	48%	0.483	26%	0.258	S	S	.	.	H	α-helix	trans	-60.8	-46	172.9	-170.2	-176.7	-54.5	172.8	2.8	111.6	E260 R261 I262 R266 N267 E268	E260-R264 WeakPolarHBondContact O-CB 3.27Å; E260-R264 PolarHBondContact O-N 3.44Å; E260-R264 IonicContact OE1-NH2 2.6Å; E260-R264 PolarHBondContact OE1-NH2 3.24Å; R261-R264 WeakPolarHBondContact O-CB 3.27Å; R261-R264 PolarHBondContact O-N 3.45Å; I262-R264 VanDerWaalsContact C-N 3.33Å; I262-R264 PolarHBondContact O-N 3.13Å; R264-R266 PolarHBondContact O-N 3.13Å; R264-N267 PolarHBondContact O-N 3.46Å; R264-E268 WeakPolarHBondContact CD-OE1 3.26Å; R264-E268 HydrophobicContact CG-CG 4.32Å; R264-E268 WeakPolarHBondContact CG-OE1 3.24Å; R264-E268 WeakPolarHBondContact O-CB 3.13Å; R264-E268 WeakPolarHBondContact O-CG 3.33Å; R264-E268 PolarHBondContact O-N 2.87Å
265	I	90.2	Very high	85.8	Confident	4 Å²	4	53.5 Å²	53.5	2%	0.021	27%	0.266	C	S	.	.	H	α-helix	trans	-62	-44.9	178.8	-61.7	168.3	0	0	0	111.1	R261 I262 N267 E268 S269 I273 L302 L303 C306	R261-I265 VanDerWaalsContact O-CG1 3.32Å; R261-I265 WeakPolarHBondContact O-CG1 3.46Å; R261-I265 PolarHBondContact O-N 3.17Å; I262-I265 PolarHBondContact O-N 2.73Å; I265-N267 VanDerWaalsContact C-N 3.33Å; I265-N267 PolarHBondContact O-N 3.46Å; I265-E268 PolarHBondContact O-N 3.49Å; I265-S269 VanDerWaalsContact O-CB 3.25Å; I265-S269 WeakPolarHBondContact O-CB 3.42Å; I265-S269 PolarHBondContact O-N 2.81Å; I265-S269 PolarHBondContact O-OG 3.42Å; I265-I273 HydrophobicContact CB-CD1 4.36Å; I265-I273 HydrophobicContact CG2-CD1 3.5Å; I265-L302 HydrophobicContact CB-CB 4.46Å; I265-L302 HydrophobicContact CG1-CB 4.21Å; I265-L302 HydrophobicContact CG2-CB 3.68Å; I265-L302 HydrophobicContact CG2-CD1 4.15Å; I265-L303 HydrophobicContact CD1-CD2 3.8Å; I265-L303 HydrophobicContact CD1-CG 4.35Å; I265-L303 HydrophobicContact CG2-CG 4.3Å; I265-C306 HydrophobicContact CD1-CB 4.37Å; I265-C306 VanDerWaalsContact CD1-SG 3.54Å
266	R	89.1	Confident	85.8	Confident	36 Å²	36	52.7 Å²	52.7	14%	0.136	26%	0.262	C	S	.	.	H	α-helix	trans	-57.1	-47.1	174.4	-70.3	167.5	-175.1	150.5	-18.1	111.3	E140 I262 N263 R264 S269 G270 I273	E140-R266 VanDerWaalsContact CD-NH1 3.34Å; E140-R266 IonicContact OE1-CZ 3.17Å; E140-R266 IonicContact OE1-NH1 2.56Å; E140-R266 PolarHBondContact OE1-NH1 2.98Å; E140-R266 IonicContact OE1-NH2 2.78Å; E140-R266 PolarHBondContact OE1-NH2 2.91Å; E140-R266 IonicContact OE2-CZ 2.78Å; E140-R266 IonicContact OE2-NE 3.81Å; E140-R266 IonicContact OE2-NH1 3.98Å; E140-R266 PolarHBondContact OE2-NH1 3.4Å; E140-R266 IonicContact OE2-NH2 3.99Å; E140-R266 PolarHBondContact OE2-NH2 3.45Å; I262-R266 VanDerWaalsContact CG1-CZ 3.49Å; I262-R266 WeakPolarHBondContact O-CG 3.36Å; I262-R266 PolarHBondContact O-N 3.43Å; N263-R266 PolarHBondContact O-N 2.98Å; N263-R266 PolarHBondContact OD1-NH1 3.41Å; R264-R266 PolarHBondContact O-N 3.13Å; R266-S269 PolarHBondContact O-OG 3.4Å; R266-G270 VanDerWaalsContact O-CA 3.32Å; R266-G270 WeakPolarHBondContact O-CA 3.37Å; R266-G270 PolarHBondContact O-N 3.26Å; R266-I273 HydrophobicContact CG-CB 3.79Å; R266-I273 HydrophobicContact CG-CD1 4.07Å; R266-I273 HydrophobicContact CG-CG1 4.02Å; R266-I273 VanDerWaalsContact CZ-O 3.26Å; R266-I273 PolarHBondContact NE-O 3.11Å; R266-I273 PolarHBondContact NH2-O 3.34Å
267	N	84.9	Confident	85.8	Confident	37 Å²	37	55.6 Å²	55.6	20%	0.198	28%	0.277	C	S	.	.	H	α-helix	trans	-67	-37.4	-179.7	-74.4	-21	0	0	0	113.7	Y144 N263 R264 I265	Y144-N267 VanDerWaalsContact CA-OD1 3.32Å; Y144-N267 WeakPolarHBondContact CA-OD1 3.2Å; Y144-N267 PolarHBondContact N-OD1 2.77Å; N263-N267 WeakPolarHBondContact O-CB 3.32Å; N263-N267 PolarHBondContact O-N 3.12Å; N263-N267 PolarHBondContact O-ND2 3.04Å; R264-N267 PolarHBondContact O-N 3.46Å; I265-N267 VanDerWaalsContact C-N 3.33Å; I265-N267 PolarHBondContact O-N 3.46Å
268	E	88.5	Confident	85.8	Confident	116 Å²	116	48.1 Å²	48.1	54%	0.542	26%	0.258	S	S	.	.	H	α-helix	trans	-79.5	-37.8	-179.7	-74.4	176.9	-166.1	0	0	112.4	R264 I265 L302	R264-E268 WeakPolarHBondContact CD-OE1 3.26Å; R264-E268 HydrophobicContact CG-CG 4.32Å; R264-E268 WeakPolarHBondContact CG-OE1 3.24Å; R264-E268 WeakPolarHBondContact O-CB 3.13Å; R264-E268 WeakPolarHBondContact O-CG 3.33Å; R264-E268 PolarHBondContact O-N 2.87Å; I265-E268 PolarHBondContact O-N 3.49Å; E268-L302 HydrophobicContact CB-CD1 3.59Å
269	S	90.5	Very high	86	Confident	8 Å²	8	48 Å²	48	6%	0.056	24%	0.239	C	C	.	.	H	α-helix	trans	-78.6	-29.3	177.2	62.1	0	0	0	0	113.2	I265 R266 A271 Q295 G299	I265-S269 VanDerWaalsContact O-CB 3.25Å; I265-S269 WeakPolarHBondContact O-CB 3.42Å; I265-S269 PolarHBondContact O-N 2.81Å; I265-S269 PolarHBondContact O-OG 3.42Å; R266-S269 PolarHBondContact O-OG 3.4Å; S269-A271 PolarHBondContact O-N 2.63Å; S269-A271 PolarHBondContact OG-N 2.8Å; S269-Q295 WeakPolarHBondContact O-CA 3.35Å; S269-Q295 WeakPolarHBondContact O-CB 3.29Å; S269-Q295 WeakPolarHBondContact O-CG 3.3Å; S269-G299 VanDerWaalsContact CB-CA 3.46Å
270	G	85	Confident	85.9	Confident	15 Å²	15	52.6 Å²	52.6	16%	0.155	28%	0.275	C	S	.	.			trans	67.3	6.9	-168.3	0	0	0	0	0	114.3	Y144 R266 Q295	Y144-G270 WeakPolarHBondContact OH-CA 3.09Å; Y144-G270 PolarHBondContact OH-O 2.86Å; R266-G270 VanDerWaalsContact O-CA 3.32Å; R266-G270 WeakPolarHBondContact O-CA 3.37Å; R266-G270 PolarHBondContact O-N 3.26Å; G270-Q295 VanDerWaalsContact O-CD 3.31Å; G270-Q295 PolarHBondContact O-NE2 3.37Å
271	A	87.9	Confident	85.9	Confident	5 Å²	5	56.2 Å²	56.2	4%	0.041	30%	0.298	C	S	.	.			trans	-83.9	147.9	175.1	0	0	0	0	0	110.4	S269 I273 I289 Q295	S269-A271 PolarHBondContact O-N 2.63Å; S269-A271 PolarHBondContact OG-N 2.8Å; A271-I273 HydrophobicContact CB-CG1 4.18Å; A271-I273 PolarHBondContact O-N 3.27Å; A271-I289 HydrophobicContact CB-CG2 3.76Å; A271-Q295 HydrophobicContact CB-CB 4.08Å
272	H	86.9	Confident	85.7	Confident	30 Å²	30	54.7 Å²	54.7	14%	0.139	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	121.7	162.8	-176.3	-88.4	0	0	0	108.2	D188 Y191 D194 I289 T290	D188-H272 IonicContact OD2-CD2 3.46Å; D188-H272 PolarHBondContact OD2-CD2 3.42Å; Y191-H272 VanDerWaalsContact CB-NE2 3.32Å; Y191-H272 WeakPolarHBondContact CB-NE2 3.02Å; Y191-H272 AromaticContact CD1-CE1 3.75Å; Y191-H272 AromaticContact CD1-NE2 3.8Å; Y191-H272 HydrophobicContact CD2-CB 3.96Å; Y191-H272 AromaticContact CD2-CD2 3.13Å; Y191-H272 WeakPolarHBondContact CD2-CD2 3.2Å; Y191-H272 AromaticContact CD2-CE1 3.48Å; Y191-H272 VanDerWaalsContact CD2-CE1 3.48Å; Y191-H272 WeakPolarHBondContact CD2-CE1 3.46Å; Y191-H272 AromaticContact CD2-CG 3.28Å; Y191-H272 AromaticContact CD2-ND1 3.56Å; Y191-H272 AromaticContact CD2-NE2 3.27Å; Y191-H272 VanDerWaalsContact CD2-NE2 3.27Å; Y191-H272 WeakPolarHBondContact CD2-NE2 3.23Å; Y191-H272 AromaticContact CE1-CE1 3.95Å; Y191-H272 HydrophobicContact CE2-CB 3.94Å; Y191-H272 AromaticContact CE2-CD2 3.83Å; Y191-H272 AromaticContact CE2-CE1 3.67Å; Y191-H272 AromaticContact CE2-CG 3.47Å; Y191-H272 VanDerWaalsContact CE2-CG 3.47Å; Y191-H272 AromaticContact CE2-ND1 3.42Å; Y191-H272 WeakPolarHBondContact CE2-ND1 3.47Å; Y191-H272 AromaticContact CE2-NE2 3.94Å; Y191-H272 AromaticContact CG-CD2 3.53Å; Y191-H272 AromaticContact CG-CE1 3.5Å; Y191-H272 AromaticContact CG-NE2 3.16Å; Y191-H272 AromaticContact CZ-CE1 3.9Å; Y191-H272 AromaticContact CZ-ND1 3.85Å; D194-H272 IonicContact OD2-CE1 2.78Å; D194-H272 IonicContact OD2-NE2 2.88Å; D194-H272 PolarHBondContact OD2-NE2 3.1Å; D194-H272 VanDerWaalsContact OD2-NE2 3.13Å; H272-I289 WeakPolarHBondContact O-CA 3.32Å; H272-T290 PolarHBondContact N-O 3.01Å; H272-T290 PolarHBondContact O-N 2.88Å
273	I	90.4	Very high	85.5	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	114.3	-178.2	-52.7	175.7	0	0	0	108.6	I262 I265 R266 A271 I287 T288 I289	I262-I273 HydrophobicContact CD1-CB 4.35Å; I262-I273 HydrophobicContact CD1-CG2 3.77Å; I265-I273 HydrophobicContact CB-CD1 4.36Å; I265-I273 HydrophobicContact CG2-CD1 3.5Å; R266-I273 HydrophobicContact CG-CB 3.79Å; R266-I273 HydrophobicContact CG-CD1 4.07Å; R266-I273 HydrophobicContact CG-CG1 4.02Å; R266-I273 VanDerWaalsContact CZ-O 3.26Å; R266-I273 PolarHBondContact NE-O 3.11Å; R266-I273 PolarHBondContact NH2-O 3.34Å; A271-I273 HydrophobicContact CB-CG1 4.18Å; A271-I273 PolarHBondContact O-N 3.27Å; I273-I287 HydrophobicContact CG2-CG2 3.5Å; I273-T288 WeakPolarHBondContact CA-O 3.42Å; I273-I289 HydrophobicContact CG1-CG2 4.23Å; I273-I289 HydrophobicContact CG2-CG1 4.39Å
274	R	88.6	Confident	85.5	Confident	130 Å²	130	63 Å²	63	49%	0.491	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	133	176.8	178.9	175.9	154.7	166.2	-3.9	109.9	D276 I287 T288	R274-D276 IonicContact CZ-OD1 3.31Å; R274-D276 VanDerWaalsContact CZ-OD1 3.31Å; R274-D276 IonicContact NE-OD1 2.83Å; R274-D276 PolarHBondContact NE-OD1 3.28Å; R274-D276 IonicContact NH2-OD1 2.94Å; R274-D276 PolarHBondContact NH2-OD1 3.19Å; R274-I287 CarbonylContact O-C 3.55Å; R274-I287 WeakPolarHBondContact O-CA 3.27Å; R274-T288 PolarHBondContact N-O 2.82Å; R274-T288 PolarHBondContact O-N 3Å
275	V	87.8	Confident	85.6	Confident	28 Å²	28	59 Å²	59	17%	0.17	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	113.9	175.1	-178.6	0	0	0	0	107.4	I255 I262 R285 I287	I255-V275 HydrophobicContact CD1-CG1 4.18Å; I262-V275 HydrophobicContact CD1-CG2 4.24Å; I262-V275 HydrophobicContact CG1-CG2 4.33Å; V275-R285 HydrophobicContact CG1-CG 4.37Å; V275-I287 HydrophobicContact CG1-CG1 4.32Å; V275-I287 HydrophobicContact CG2-CD1 4.24Å; V275-I287 HydrophobicContact CG2-CG1 4.11Å; V275-I287 HydrophobicContact CG2-CG2 4.43Å
276	D	86.1	Confident	85.5	Confident	33 Å²	33	61 Å²	61	18%	0.176	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-69.4	158	-176.6	-82.2	-23.3	0	0	0	112.2	R274 R285 I286	R274-D276 IonicContact CZ-OD1 3.31Å; R274-D276 VanDerWaalsContact CZ-OD1 3.31Å; R274-D276 IonicContact NE-OD1 2.83Å; R274-D276 PolarHBondContact NE-OD1 3.28Å; R274-D276 IonicContact NH2-OD1 2.94Å; R274-D276 PolarHBondContact NH2-OD1 3.19Å; D276-R285 WeakPolarHBondContact O-CD 3.43Å; D276-R285 VanDerWaalsContact O-CG 3.25Å; D276-R285 WeakPolarHBondContact O-CG 3.4Å; D276-R285 PolarHBondContact O-NE 3.05Å; D276-R285 PolarHBondContact O-NH1 2.86Å; D276-I286 PolarHBondContact N-O 2.84Å
277	P	83.6	Confident	85.6	Confident	84 Å²	84	59.3 Å²	59.3	55%	0.545	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-58.6	158.1	172.4	25.6	-34.1	0	0	0	111.1	D279	P277-D279 PolarHBondContact O-N 3.19Å
278	P	81.2	Confident	85.9	Confident	75 Å²	75	58.1 Å²	58.1	49%	0.487	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-67.7	127.3	175.7	26.9	-25.8	0	0	0	109.5	R285	P278-R285 VanDerWaalsContact CG-NH2 3.33Å
279	D	80.1	Confident	86	Confident	81 Å²	81	52.7 Å²	52.7	43%	0.433	30%	0.298	S	S	.	.	P	Polyproline II helix	trans	-78.7	128.2	172.2	-66.1	-39.9	0	0	0	109.7	P277 N281 S282	P277-D279 PolarHBondContact O-N 3.19Å; D279-N281 PolarHBondContact O-N 2.94Å; D279-N281 VanDerWaalsContact O-N 3.11Å; D279-S282 PolarHBondContact O-N 2.91Å; D279-S282 VanDerWaalsContact O-N 3.12Å; D279-S282 VanDerWaalsContact O-O 3.06Å
280	A	77.6	Confident	86	Confident	107 Å²	107	52.8 Å²	52.8	88%	0.884	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-23.5	-175.8	0	0	0	0	0	113.8
281	N	81.4	Confident	86.2	Confident	170 Å²	170	52.2 Å²	52.2	91%	0.909	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	4.2	-177.6	-64.8	-16	0	0	0	113.2	D279	D279-N281 PolarHBondContact O-N 2.94Å; D279-N281 VanDerWaalsContact O-N 3.11Å
282	S	81.7	Confident	86.2	Confident	42 Å²	42	53.8 Å²	53.8	29%	0.294	30%	0.3	S	S	.	.			trans	-129.6	134.9	-175	-173.5	0	0	0	0	110.6	N248 D279 Q284	N248-S282 PolarHBondContact ND2-O 3.09Å; D279-S282 PolarHBondContact O-N 2.91Å; D279-S282 VanDerWaalsContact O-N 3.12Å; D279-S282 VanDerWaalsContact O-O 3.06Å; S282-Q284 PolarHBondContact O-N 2.8Å; S282-Q284 WeakPolarHBondContact OG-CB 3.35Å; S282-Q284 PolarHBondContact OG-N 2.63Å; S282-Q284 PolarHBondContact OG-O 3.13Å; S282-Q284 VanDerWaalsContact OG-O 3.11Å
283	D	83.4	Confident	86.3	Confident	120 Å²	120	57.7 Å²	57.7	64%	0.642	32%	0.318	S	S	*	.	S	Bend	trans	-78.1	-0	166.1	66.6	-31	0	0	0	112	P247 N248	P247-D283 CarbonylContact C-O 3.56Å; P247-D283 WeakPolarHBondContact CA-O 3.43Å; N248-D283 PolarHBondContact N-O 3.23Å
284	Q	85.5	Confident	86.3	Confident	73 Å²	73	62.9 Å²	62.9	34%	0.341	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	157.4	-179.8	-54.5	-179.4	13.9	0	0	112	I246 S282	I246-Q284 CarbonylContact O-C 3.47Å; I246-Q284 VanDerWaalsContact O-CA 3.28Å; I246-Q284 WeakPolarHBondContact O-CA 3.36Å; S282-Q284 PolarHBondContact O-N 2.8Å; S282-Q284 WeakPolarHBondContact OG-CB 3.35Å; S282-Q284 PolarHBondContact OG-N 2.63Å; S282-Q284 PolarHBondContact OG-O 3.13Å; S282-Q284 VanDerWaalsContact OG-O 3.11Å
285	R	86.3	Confident	86.4	Confident	43 Å²	43	58.6 Å²	58.6	16%	0.162	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.6	176.3	-169.1	-178	-80.5	-135.8	11.2	109.6	T245 I246 N248 C251 V275 D276 P278	T245-R285 WeakPolarHBondContact CA-O 3.48Å; I246-R285 HydrophobicContact CG1-CB 4.38Å; I246-R285 WeakPolarHBondContact CG1-O 3.26Å; I246-R285 PolarHBondContact N-O 3.41Å; I246-R285 PolarHBondContact O-N 3Å; N248-R285 WeakPolarHBondContact OD1-CB 3.42Å; N248-R285 PolarHBondContact OD1-NE 2.79Å; C251-R285 WeakPolarHBondContact SG-CD 3.39Å; V275-R285 HydrophobicContact CG1-CG 4.37Å; D276-R285 WeakPolarHBondContact O-CD 3.43Å; D276-R285 VanDerWaalsContact O-CG 3.25Å; D276-R285 WeakPolarHBondContact O-CG 3.4Å; D276-R285 PolarHBondContact O-NE 3.05Å; D276-R285 PolarHBondContact O-NH1 2.86Å; P278-R285 VanDerWaalsContact CG-NH2 3.33Å
286	I	88.8	Confident	86.5	Confident	46 Å²	46	57.3 Å²	57.3	24%	0.236	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.1	-179.9	-58.4	172.6	0	0	0	109.3	Q243 T245 D276	Q243-I286 HydrophobicContact CB-CG2 4.03Å; Q243-I286 HydrophobicContact CG-CG2 4.15Å; T245-I286 HydrophobicContact CG2-CG1 4.21Å; D276-I286 PolarHBondContact N-O 2.84Å
287	I	91.2	Very high	86.8	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.005	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	119.2	166.4	-59.6	-174.9	0	0	0	107.4	Q243 V244 I246 I254 I273 R274 V275 I289 L303	Q243-I287 CarbonylContact C-O 3.44Å; Q243-I287 WeakPolarHBondContact CA-O 3.39Å; V244-I287 PolarHBondContact N-O 2.93Å; V244-I287 PolarHBondContact O-N 3.06Å; I246-I287 HydrophobicContact CD1-CD1 3.44Å; I246-I287 VanDerWaalsContact CD1-CD1 3.44Å; I246-I287 HydrophobicContact CD1-CG1 4Å; I246-I287 HydrophobicContact CG1-CD1 3.96Å; I246-I287 HydrophobicContact CG1-CG1 4.11Å; I246-I287 HydrophobicContact CG2-CD1 4.45Å; I254-I287 HydrophobicContact CD1-CD1 4.1Å; I254-I287 HydrophobicContact CG2-CD1 4.06Å; I273-I287 HydrophobicContact CG2-CG2 3.5Å; R274-I287 CarbonylContact O-C 3.55Å; R274-I287 WeakPolarHBondContact O-CA 3.27Å; V275-I287 HydrophobicContact CG1-CG1 4.32Å; V275-I287 HydrophobicContact CG2-CD1 4.24Å; V275-I287 HydrophobicContact CG2-CG1 4.11Å; V275-I287 HydrophobicContact CG2-CG2 4.43Å; I287-I289 HydrophobicContact CG2-CG1 4.24Å; I287-L303 HydrophobicContact CD1-CD2 4.21Å; I287-L303 HydrophobicContact CG2-CD1 4.01Å
288	T	91.5	Very high	87.1	Confident	13 Å²	13	61.6 Å²	61.6	8%	0.08	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.3	175.1	-56.2	0	0	0	0	109.1	E241 Q243 I273 R274	E241-T288 HydrophobicContact CG-CG2 3.61Å; E241-T288 WeakPolarHBondContact OE1-CG2 3.1Å; Q243-T288 HydrophobicContact CG-CG2 4.41Å; I273-T288 WeakPolarHBondContact CA-O 3.42Å; R274-T288 PolarHBondContact N-O 2.82Å; R274-T288 PolarHBondContact O-N 3Å
289	I	91.4	Very high	87.6	Confident	1 Å²	1	58 Å²	58	1%	0.005	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	117.7	178.3	-49.9	171.2	0	0	0	107.5	E241 I242 V244 A271 H272 I273 I287 V296 Q300 L303	E241-I289 WeakPolarHBondContact CA-O 3.46Å; I242-I289 PolarHBondContact N-O 3.01Å; I242-I289 PolarHBondContact O-N 3.01Å; V244-I289 HydrophobicContact CG2-CD1 4.06Å; A271-I289 HydrophobicContact CB-CG2 3.76Å; H272-I289 WeakPolarHBondContact O-CA 3.32Å; I273-I289 HydrophobicContact CG1-CG2 4.23Å; I273-I289 HydrophobicContact CG2-CG1 4.39Å; I287-I289 HydrophobicContact CG2-CG1 4.24Å; I289-V296 HydrophobicContact CB-CG1 4.33Å; I289-V296 HydrophobicContact CG2-CB 4.23Å; I289-V296 HydrophobicContact CG2-CG1 3.96Å; I289-V296 HydrophobicContact CG2-CG2 4.17Å; I289-Q300 HydrophobicContact CD1-CB 4.19Å; I289-L303 HydrophobicContact CD1-CD1 3.45Å; I289-L303 VanDerWaalsContact CD1-CD1 3.45Å; I289-L303 HydrophobicContact CG1-CD1 4.02Å
290	T	90	Very high	88.1	Confident	10 Å²	10	57.4 Å²	57.4	6%	0.061	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	134	-178.5	-52.2	0	0	0	0	109.8	T240 H272	T240-T290 WeakPolarHBondContact O-CA 3.47Å; H272-T290 PolarHBondContact N-O 3.01Å; H272-T290 PolarHBondContact O-N 2.88Å
291	G	87.9	Confident	88.8	Confident	4 Å²	4	57.2 Å²	57.2	4%	0.041	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	167.2	-166.5	179.2	0	0	0	0	0	112.5	L239 T240	L239-G291 CarbonylContact C-O 3.55Å; L239-G291 WeakPolarHBondContact CA-O 3.4Å; T240-G291 PolarHBondContact N-O 2.94Å; T240-G291 PolarHBondContact O-N 3.12Å; T240-G291 PolarHBondContact OG1-O 3.33Å
292	L	89.1	Confident	89.3	Confident	38 Å²	38	50.2 Å²	50.2	20%	0.199	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	156.4	168.9	-59.1	177.1	0	0	0	110.6	R237 L239 N294 Q295 V296	R237-L292 HydrophobicContact CB-CD2 3.68Å; R237-L292 HydrophobicContact CG-CD2 4.36Å; L239-L292 HydrophobicContact CD2-CD2 4.15Å; L292-N294 WeakPolarHBondContact CB-OD1 3.17Å; L292-N294 PolarHBondContact O-N 3.49Å; L292-N294 VanDerWaalsContact O-N 3.1Å; L292-Q295 HydrophobicContact CB-CB 4.37Å; L292-Q295 HydrophobicContact CB-CG 4.03Å; L292-Q295 CarbonylContact O-C 3.48Å; L292-Q295 WeakPolarHBondContact O-CA 3.48Å; L292-Q295 WeakPolarHBondContact O-CB 3.31Å; L292-Q295 PolarHBondContact O-N 3.12Å; L292-V296 WeakPolarHBondContact O-CG2 3.44Å; L292-V296 PolarHBondContact O-N 3.11Å
293	E	88.5	Confident	89.8	Confident	111 Å²	111	48.7 Å²	48.7	52%	0.519	24%	0.236	S	C	.	.	H	α-helix	trans	-52.5	-40.6	-178	-170.2	-174	171.4	0	0	112.9	K297	E293-K297 HydrophobicContact CG-CD 4.35Å; E293-K297 WeakPolarHBondContact O-CB 3.4Å; E293-K297 VanDerWaalsContact O-CG 3.27Å; E293-K297 WeakPolarHBondContact O-CG 3.47Å; E293-K297 PolarHBondContact O-N 2.85Å; E293-K297 VanDerWaalsContact OE1-CE 3.23Å; E293-K297 WeakPolarHBondContact OE1-CE 3.34Å; E293-K297 IonicContact OE1-NZ 3.21Å; E293-K297 PolarHBondContact OE1-NZ 2.96Å
294	N	90.3	Very high	90	Very high	110 Å²	110	47.1 Å²	47.1	59%	0.588	23%	0.225	S	C	*	.	H	α-helix	trans	-68.6	-38.7	175.4	64.6	-34.9	0	0	0	113	L292 M298	L292-N294 WeakPolarHBondContact CB-OD1 3.17Å; L292-N294 PolarHBondContact O-N 3.49Å; L292-N294 VanDerWaalsContact O-N 3.1Å; N294-M298 VanDerWaalsContact O-CB 3.26Å; N294-M298 WeakPolarHBondContact O-CB 3.41Å; N294-M298 PolarHBondContact O-N 3.29Å
295	Q	91	Very high	90.1	Very high	41 Å²	41	47.5 Å²	47.5	19%	0.192	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-45.1	176.9	-65.7	175.9	-29.6	0	0	110.8	S269 G270 A271 L292 M298 G299	S269-Q295 WeakPolarHBondContact O-CA 3.35Å; S269-Q295 WeakPolarHBondContact O-CB 3.29Å; S269-Q295 WeakPolarHBondContact O-CG 3.3Å; G270-Q295 VanDerWaalsContact O-CD 3.31Å; G270-Q295 PolarHBondContact O-NE2 3.37Å; A271-Q295 HydrophobicContact CB-CB 4.08Å; L292-Q295 HydrophobicContact CB-CB 4.37Å; L292-Q295 HydrophobicContact CB-CG 4.03Å; L292-Q295 CarbonylContact O-C 3.48Å; L292-Q295 WeakPolarHBondContact O-CA 3.48Å; L292-Q295 WeakPolarHBondContact O-CB 3.31Å; L292-Q295 PolarHBondContact O-N 3.12Å; Q295-M298 PolarHBondContact O-N 3.3Å; Q295-G299 PolarHBondContact O-N 2.78Å
296	V	90.8	Very high	90.1	Very high	1 Å²	1	46 Å²	46	1%	0.006	22%	0.223	C	C	.	.	H	α-helix	trans	-65.9	-45.8	179.3	176.2	0	0	0	0	111.2	T240 I242 I289 L292 M298 G299 Q300	T240-V296 WeakPolarHBondContact O-CG2 3.44Å; T240-V296 WeakPolarHBondContact OG1-CG2 3.3Å; I242-V296 HydrophobicContact CB-CG1 4.13Å; I242-V296 HydrophobicContact CD1-CG1 3.36Å; I242-V296 HydrophobicContact CG1-CG1 3.67Å; I289-V296 HydrophobicContact CB-CG1 4.33Å; I289-V296 HydrophobicContact CG2-CB 4.23Å; I289-V296 HydrophobicContact CG2-CG1 3.96Å; I289-V296 HydrophobicContact CG2-CG2 4.17Å; L292-V296 WeakPolarHBondContact O-CG2 3.44Å; L292-V296 PolarHBondContact O-N 3.11Å; V296-M298 VanDerWaalsContact C-N 3.31Å; V296-M298 PolarHBondContact O-N 3.16Å; V296-G299 PolarHBondContact O-N 2.81Å; V296-Q300 WeakPolarHBondContact O-CB 3.2Å; V296-Q300 PolarHBondContact O-N 3.06Å
297	K	90.6	Very high	90	Very high	119 Å²	119	44.6 Å²	44.6	52%	0.517	22%	0.217	S	C	.	.	H	α-helix	trans	-59	-42.8	174.1	-76.7	178.4	-175	171.7	0	111.6	E293 F301	E293-K297 HydrophobicContact CG-CD 4.35Å; E293-K297 WeakPolarHBondContact O-CB 3.4Å; E293-K297 VanDerWaalsContact O-CG 3.27Å; E293-K297 WeakPolarHBondContact O-CG 3.47Å; E293-K297 PolarHBondContact O-N 2.85Å; E293-K297 VanDerWaalsContact OE1-CE 3.23Å; E293-K297 WeakPolarHBondContact OE1-CE 3.34Å; E293-K297 IonicContact OE1-NZ 3.21Å; E293-K297 PolarHBondContact OE1-NZ 2.96Å; K297-F301 WeakPolarHBondContact O-CB 3.45Å; K297-F301 PolarHBondContact O-N 2.63Å
298	M	91	Very high	89.7	Confident	87 Å²	87	51.3 Å²	51.3	43%	0.429	24%	0.242	S	C	.	.	H	α-helix	trans	-64.6	-44.6	176.2	-173.1	59.9	71.6	0	0	111.6	N294 Q295 V296 Q300 F301 L302	N294-M298 VanDerWaalsContact O-CB 3.26Å; N294-M298 WeakPolarHBondContact O-CB 3.41Å; N294-M298 PolarHBondContact O-N 3.29Å; Q295-M298 PolarHBondContact O-N 3.3Å; V296-M298 VanDerWaalsContact C-N 3.31Å; V296-M298 PolarHBondContact O-N 3.16Å; M298-Q300 PolarHBondContact O-N 3.44Å; M298-F301 PolarHBondContact O-N 2.86Å; M298-F301 HydrophobicContact SD-CD1 4.31Å; M298-L302 HydrophobicContact CG-CD1 4.01Å; M298-L302 HydrophobicContact CG-CG 4.38Å; M298-L302 WeakPolarHBondContact O-CB 3.47Å; M298-L302 WeakPolarHBondContact O-CG 3.35Å; M298-L302 PolarHBondContact O-N 2.91Å; M298-L302 HydrophobicContact SD-CD1 4.37Å; M298-L302 HydrophobicContact SD-CG 4.23Å
299	G	91.8	Very high	89.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-59.4	-46.1	176.8	0	0	0	0	0	112	S269 Q295 V296 L302 L303	S269-G299 VanDerWaalsContact CB-CA 3.46Å; Q295-G299 PolarHBondContact O-N 2.78Å; V296-G299 PolarHBondContact O-N 2.81Å; G299-L302 PolarHBondContact O-N 2.94Å; G299-L303 WeakPolarHBondContact O-CB 3.44Å; G299-L303 VanDerWaalsContact O-CG 3.27Å; G299-L303 WeakPolarHBondContact O-CG 3.34Å; G299-L303 PolarHBondContact O-N 2.83Å
300	Q	91.1	Very high	88.8	Confident	68 Å²	68	54.3 Å²	54.3	32%	0.318	27%	0.267	S	S	.	.	H	α-helix	trans	-61.1	-46.1	175.1	-170.5	-176.4	22.3	0	0	111.7	I289 V296 M298 L303 Q304	I289-Q300 HydrophobicContact CD1-CB 4.19Å; V296-Q300 WeakPolarHBondContact O-CB 3.2Å; V296-Q300 PolarHBondContact O-N 3.06Å; M298-Q300 PolarHBondContact O-N 3.44Å; Q300-L303 PolarHBondContact O-N 3.32Å; Q300-Q304 WeakPolarHBondContact O-CG 3.23Å; Q300-Q304 PolarHBondContact O-N 2.87Å
301	F	91.8	Very high	88.3	Confident	103 Å²	103	58.2 Å²	58.2	45%	0.452	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-49.7	177.7	174	-100.2	0	0	0	111.6	K297 M298 L303 Q304 Q305	K297-F301 WeakPolarHBondContact O-CB 3.45Å; K297-F301 PolarHBondContact O-N 2.63Å; M298-F301 PolarHBondContact O-N 2.86Å; M298-F301 HydrophobicContact SD-CD1 4.31Å; F301-L303 PolarHBondContact O-N 2.86Å; F301-Q304 PolarHBondContact O-N 2.8Å; F301-Q305 HydrophobicContact CD1-CG 4.23Å; F301-Q305 HydrophobicContact CE1-CG 3.82Å; F301-Q305 HydrophobicContact CE2-CG 4.16Å; F301-Q305 VanDerWaalsContact CE2-NE2 3.32Å; F301-Q305 HydrophobicContact CZ-CG 3.79Å; F301-Q305 WeakPolarHBondContact O-CG 3.45Å; F301-Q305 PolarHBondContact O-N 2.99Å
302	L	91.9	Very high	87.9	Confident	24 Å²	24	60 Å²	60	13%	0.126	31%	0.309	C	S	.	.	H	α-helix	trans	-63.9	-39.6	-179.7	-71.2	174.5	0	0	0	112.3	I265 E268 M298 G299 Q305 C306	I265-L302 HydrophobicContact CB-CB 4.46Å; I265-L302 HydrophobicContact CG1-CB 4.21Å; I265-L302 HydrophobicContact CG2-CB 3.68Å; I265-L302 HydrophobicContact CG2-CD1 4.15Å; E268-L302 HydrophobicContact CB-CD1 3.59Å; M298-L302 HydrophobicContact CG-CD1 4.01Å; M298-L302 HydrophobicContact CG-CG 4.38Å; M298-L302 WeakPolarHBondContact O-CB 3.47Å; M298-L302 WeakPolarHBondContact O-CG 3.35Å; M298-L302 PolarHBondContact O-N 2.91Å; M298-L302 HydrophobicContact SD-CD1 4.37Å; M298-L302 HydrophobicContact SD-CG 4.23Å; G299-L302 PolarHBondContact O-N 2.94Å; L302-Q305 PolarHBondContact O-N 3.4Å; L302-C306 PolarHBondContact O-N 3.34Å; L302-C306 PolarHBondContact O-SG 2.97Å
303	L	91.3	Very high	87.3	Confident	9 Å²	9	58.1 Å²	58.1	5%	0.047	30%	0.299	C	S	.	.	H	α-helix	trans	-59.9	-47.1	173	-75.2	167.5	0	0	0	111.5	I254 I262 I265 I287 I289 G299 Q300 F301 Q305 C306 V307	I254-L303 HydrophobicContact CG1-CD2 4.46Å; I254-L303 HydrophobicContact CG2-CD2 3.41Å; I254-L303 VanDerWaalsContact CG2-CD2 3.41Å; I262-L303 HydrophobicContact CD1-CD2 4.17Å; I265-L303 HydrophobicContact CD1-CD2 3.8Å; I265-L303 HydrophobicContact CD1-CG 4.35Å; I265-L303 HydrophobicContact CG2-CG 4.3Å; I287-L303 HydrophobicContact CD1-CD2 4.21Å; I287-L303 HydrophobicContact CG2-CD1 4.01Å; I289-L303 HydrophobicContact CD1-CD1 3.45Å; I289-L303 VanDerWaalsContact CD1-CD1 3.45Å; I289-L303 HydrophobicContact CG1-CD1 4.02Å; G299-L303 WeakPolarHBondContact O-CB 3.44Å; G299-L303 VanDerWaalsContact O-CG 3.27Å; G299-L303 WeakPolarHBondContact O-CG 3.34Å; G299-L303 PolarHBondContact O-N 2.83Å; Q300-L303 PolarHBondContact O-N 3.32Å; F301-L303 PolarHBondContact O-N 2.86Å; L303-Q305 PolarHBondContact O-N 3.42Å; L303-C306 WeakPolarHBondContact O-CB 3.24Å; L303-C306 PolarHBondContact O-N 2.85Å; L303-C306 VanDerWaalsContact O-N 3.11Å; L303-V307 PolarHBondContact O-N 3.19Å; L303-V307 VanDerWaalsContact O-N 3.11Å
304	Q	87.5	Confident	86.8	Confident	88 Å²	88	60.2 Å²	60.2	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-61.4	-41.9	176.9	-72.3	176.2	0.1	0	0	112.1	Q300 F301 C306 V307 R308	Q300-Q304 WeakPolarHBondContact O-CG 3.23Å; Q300-Q304 PolarHBondContact O-N 2.87Å; F301-Q304 PolarHBondContact O-N 2.8Å; Q304-C306 VanDerWaalsContact C-N 3.26Å; Q304-C306 PolarHBondContact O-N 3.19Å; Q304-V307 PolarHBondContact O-N 3.36Å; Q304-R308 WeakPolarHBondContact O-CB 3.47Å; Q304-R308 VanDerWaalsContact O-CG 3.31Å; Q304-R308 WeakPolarHBondContact O-CG 3.33Å; Q304-R308 PolarHBondContact O-N 3.26Å
305	Q	87.4	Confident	86.3	Confident	80 Å²	80	61.7 Å²	61.7	37%	0.374	30%	0.304	S	S	.	.	H	α-helix	trans	-61.1	-37.6	174.5	-69	-58.4	-27.1	0	0	111.6	F301 L302 L303 R308 A309	F301-Q305 HydrophobicContact CD1-CG 4.23Å; F301-Q305 HydrophobicContact CE1-CG 3.82Å; F301-Q305 HydrophobicContact CE2-CG 4.16Å; F301-Q305 VanDerWaalsContact CE2-NE2 3.32Å; F301-Q305 HydrophobicContact CZ-CG 3.79Å; F301-Q305 WeakPolarHBondContact O-CG 3.45Å; F301-Q305 PolarHBondContact O-N 2.99Å; L302-Q305 PolarHBondContact O-N 3.4Å; L303-Q305 PolarHBondContact O-N 3.42Å; Q305-R308 PolarHBondContact O-N 2.88Å; Q305-A309 VanDerWaalsContact O-CB 3.26Å; Q305-A309 WeakPolarHBondContact O-CB 3.45Å; Q305-A309 PolarHBondContact O-N 2.99Å
306	C	86.6	Confident	85.6	Confident	12 Å²	12	62.1 Å²	62.1	8%	0.081	30%	0.304	C	S	.	.	H	α-helix	trans	-65.1	-41.2	178.5	-68.2	0	0	0	0	112.9	R261 I265 L302 L303 Q304 S310	R261-C306 PolarHBondContact NE-SG 3.27Å; I265-C306 HydrophobicContact CD1-CB 4.37Å; I265-C306 VanDerWaalsContact CD1-SG 3.54Å; L302-C306 PolarHBondContact O-N 3.34Å; L302-C306 PolarHBondContact O-SG 2.97Å; L303-C306 WeakPolarHBondContact O-CB 3.24Å; L303-C306 PolarHBondContact O-N 2.85Å; L303-C306 VanDerWaalsContact O-N 3.11Å; Q304-C306 VanDerWaalsContact C-N 3.26Å; Q304-C306 PolarHBondContact O-N 3.19Å; C306-S310 PolarHBondContact O-N 3.4Å
307	V	86.5	Confident	84.9	Confident	17 Å²	17	64.6 Å²	64.6	10%	0.103	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-49.6	173.5	178.1	0	0	0	0	110.7	L250 I254 L303 Q304 A309 S310 G313 I317	L250-V307 HydrophobicContact CD1-CG1 4Å; I254-V307 HydrophobicContact CD1-CG2 3.67Å; I254-V307 HydrophobicContact CG1-CG2 4.03Å; L303-V307 PolarHBondContact O-N 3.19Å; L303-V307 VanDerWaalsContact O-N 3.11Å; Q304-V307 PolarHBondContact O-N 3.36Å; V307-A309 VanDerWaalsContact C-N 3.27Å; V307-A309 PolarHBondContact O-N 2.87Å; V307-S310 PolarHBondContact O-N 3.45Å; V307-S310 VanDerWaalsContact O-N 3.1Å; V307-G313 VanDerWaalsContact O-CA 3.3Å; V307-G313 WeakPolarHBondContact O-CA 3.05Å; V307-I317 HydrophobicContact CG1-CD1 4.08Å; V307-I317 HydrophobicContact CG1-CG1 4.49Å
308	R	84.6	Confident	84.1	Confident	141 Å²	141	64.8 Å²	64.8	53%	0.532	32%	0.319	S	S	.	.	H	α-helix	trans	-61.7	-31.2	-179.5	-73.6	175	-179.1	-145.5	2.7	113.7	Q304 Q305 R314 I317	Q304-R308 WeakPolarHBondContact O-CB 3.47Å; Q304-R308 VanDerWaalsContact O-CG 3.31Å; Q304-R308 WeakPolarHBondContact O-CG 3.33Å; Q304-R308 PolarHBondContact O-N 3.26Å; Q305-R308 PolarHBondContact O-N 2.88Å; R308-R314 WeakPolarHBondContact O-CG 3.25Å; R308-R314 PolarHBondContact O-NE 3.48Å; R308-I317 HydrophobicContact CB-CD1 4.37Å; R308-I317 HydrophobicContact CG-CD1 3.5Å; R308-I317 VanDerWaalsContact CG-CD1 3.5Å
309	A	83.4	Confident	83	Confident	55 Å²	55	66.1 Å²	66.1	46%	0.455	32%	0.324	S	S	.	.	H	α-helix	trans	-75.8	-24.7	177.6	0	0	0	0	0	113.2	Q305 V307	Q305-A309 VanDerWaalsContact O-CB 3.26Å; Q305-A309 WeakPolarHBondContact O-CB 3.45Å; Q305-A309 PolarHBondContact O-N 2.99Å; V307-A309 VanDerWaalsContact C-N 3.27Å; V307-A309 PolarHBondContact O-N 2.87Å
310	S	82	Confident	81.8	Confident	23 Å²	23	70.6 Å²	70.6	16%	0.161	35%	0.345	C	S	.	.	S	Bend	trans	-82.8	139	-177.3	-179.1	0	0	0	0	112.2	T253 C306 V307 A312 G313 R314	T253-S310 WeakPolarHBondContact CG2-OG 3.48Å; C306-S310 PolarHBondContact O-N 3.4Å; V307-S310 PolarHBondContact O-N 3.45Å; V307-S310 VanDerWaalsContact O-N 3.1Å; S310-A312 PolarHBondContact O-N 3.35Å; S310-A312 PolarHBondContact OG-N 2.75Å; S310-G313 PolarHBondContact O-N 2.88Å; S310-G313 VanDerWaalsContact O-N 3.12Å; S310-R314 WeakPolarHBondContact O-CG 3.15Å; S310-R314 PolarHBondContact O-N 3.01Å
311	S	79.7	Confident	80.3	Confident	92 Å²	92	73.1 Å²	73.1	64%	0.643	36%	0.36	S	S	*	.	H	α-helix	trans	-56.4	-38.9	174	-55.7	0	0	0	0	112.5	K315	S311-K315 WeakPolarHBondContact O-CG 3.28Å; S311-K315 PolarHBondContact O-N 2.98Å
312	A	78.5	Confident	78.7	Confident	40 Å²	40	74.4 Å²	74.4	33%	0.331	37%	0.371	S	S	.	.	H	α-helix	trans	-66.8	-43.8	176.1	0	0	0	0	0	111.4	L250 T253 S310 R314 K315 Y316	L250-A312 HydrophobicContact CD2-CB 3.69Å; T253-A312 HydrophobicContact CG2-CB 4.45Å; S310-A312 PolarHBondContact O-N 3.35Å; S310-A312 PolarHBondContact OG-N 2.75Å; A312-R314 PolarHBondContact O-N 3.19Å; A312-K315 PolarHBondContact O-N 3.47Å; A312-Y316 PolarHBondContact O-N 2.67Å
313	G	77	Confident	76.9	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	40%	0.399	C	S	.	.	H	α-helix	trans	-68.3	-34.4	178.8	0	0	0	0	0	113.2	V307 S310 Y316 I317	V307-G313 VanDerWaalsContact O-CA 3.3Å; V307-G313 WeakPolarHBondContact O-CA 3.05Å; S310-G313 PolarHBondContact O-N 2.88Å; S310-G313 VanDerWaalsContact O-N 3.12Å; G313-Y316 PolarHBondContact O-N 3.18Å; G313-I317 WeakPolarHBondContact O-CB 3.42Å; G313-I317 VanDerWaalsContact O-CG1 3.23Å; G313-I317 WeakPolarHBondContact O-CG1 3.49Å; G313-I317 PolarHBondContact O-N 3.14Å
314	R	78.6	Confident	74.5	Confident	155 Å²	155	82 Å²	82	59%	0.585	42%	0.423	S	S	*	.	H	α-helix	trans	-62.2	-44.4	171.4	-71	-179.9	-172.3	176.5	2	111.8	R308 S310 A312 Y316 I317 Q318	R308-R314 WeakPolarHBondContact O-CG 3.25Å; R308-R314 PolarHBondContact O-NE 3.48Å; S310-R314 WeakPolarHBondContact O-CG 3.15Å; S310-R314 PolarHBondContact O-N 3.01Å; A312-R314 PolarHBondContact O-N 3.19Å; R314-Y316 VanDerWaalsContact C-N 3.34Å; R314-I317 PolarHBondContact O-N 3.35Å; R314-Q318 VanDerWaalsContact O-CB 3.24Å; R314-Q318 WeakPolarHBondContact O-CB 3.43Å; R314-Q318 PolarHBondContact O-N 2.81Å
315	K	78.4	Confident	72.1	Confident	141 Å²	141	82.6 Å²	82.6	61%	0.613	43%	0.434	S	S	*	.	H	α-helix	trans	-60.3	-44.6	175.1	-73.6	-179.7	179.3	-174.4	0	111.3	S311 A312 Q318 Q319	S311-K315 WeakPolarHBondContact O-CG 3.28Å; S311-K315 PolarHBondContact O-N 2.98Å; A312-K315 PolarHBondContact O-N 3.47Å; K315-Q318 PolarHBondContact O-N 2.91Å; K315-Q319 WeakPolarHBondContact O-CB 3.28Å; K315-Q319 WeakPolarHBondContact O-CG 3.5Å; K315-Q319 PolarHBondContact O-N 3.38Å
316	Y	77.4	Confident	69.8	Low	50 Å²	50	83.5 Å²	83.5	20%	0.196	45%	0.449	C	S	.	.	H	α-helix	trans	-62.1	-47.7	177.2	-179.9	-103.4	0	0	0	112.6	P247 L250 A312 G313 R314 Q318 Q319 Q320	P247-Y316 HydrophobicContact CB-CE2 4.36Å; P247-Y316 HydrophobicContact CG-CD1 4.39Å; P247-Y316 HydrophobicContact CG-CD2 3.72Å; P247-Y316 HydrophobicContact CG-CE1 3.91Å; P247-Y316 HydrophobicContact CG-CE2 3.17Å; P247-Y316 HydrophobicContact CG-CG 4.28Å; P247-Y316 WeakPolarHBondContact CG-OH 3.44Å; L250-Y316 HydrophobicContact CD1-CD1 3.69Å; L250-Y316 HydrophobicContact CD1-CD2 4.41Å; L250-Y316 HydrophobicContact CD1-CE1 4.35Å; L250-Y316 HydrophobicContact CD1-CG 3.7Å; A312-Y316 PolarHBondContact O-N 2.67Å; G313-Y316 PolarHBondContact O-N 3.18Å; R314-Y316 VanDerWaalsContact C-N 3.34Å; Y316-Q318 VanDerWaalsContact C-N 3.29Å; Y316-Q318 PolarHBondContact O-N 2.91Å; Y316-Q319 PolarHBondContact O-N 3.22Å; Y316-Q320 HydrophobicContact CE1-CG 4.12Å; Y316-Q320 VanDerWaalsContact CE1-NE2 3.31Å; Y316-Q320 HydrophobicContact CE2-CG 4.46Å; Y316-Q320 PolarHBondContact O-N 2.74Å; Y316-Q320 PolarHBondContact OH-NE2 3.35Å
317	I	76.3	Confident	67.4	Low	52 Å²	52	94.7 Å²	94.7	27%	0.267	49%	0.49	S	S	.	.	H	α-helix	trans	-61.8	-40.4	176.8	-67.9	166.8	0	0	0	110.5	V307 R308 G313 R314 Q320 L321	V307-I317 HydrophobicContact CG1-CD1 4.08Å; V307-I317 HydrophobicContact CG1-CG1 4.49Å; R308-I317 HydrophobicContact CB-CD1 4.37Å; R308-I317 HydrophobicContact CG-CD1 3.5Å; R308-I317 VanDerWaalsContact CG-CD1 3.5Å; G313-I317 WeakPolarHBondContact O-CB 3.42Å; G313-I317 VanDerWaalsContact O-CG1 3.23Å; G313-I317 WeakPolarHBondContact O-CG1 3.49Å; G313-I317 PolarHBondContact O-N 3.14Å; R314-I317 PolarHBondContact O-N 3.35Å; I317-Q320 PolarHBondContact O-N 3.41Å; I317-L321 HydrophobicContact CG2-CD1 3.99Å; I317-L321 WeakPolarHBondContact O-CB 3.38Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.5Å; I317-L321 PolarHBondContact O-N 2.92Å
318	Q	72.2	Confident	64.8	Low	123 Å²	123	103.7 Å²	103.7	58%	0.575	53%	0.528	S	S	*	.	H	α-helix	trans	-65.9	-40.2	176.7	-171.4	172.7	10	0	0	112	R314 K315 Y316 L321 L322	R314-Q318 VanDerWaalsContact O-CB 3.24Å; R314-Q318 WeakPolarHBondContact O-CB 3.43Å; R314-Q318 PolarHBondContact O-N 2.81Å; K315-Q318 PolarHBondContact O-N 2.91Å; Y316-Q318 VanDerWaalsContact C-N 3.29Å; Y316-Q318 PolarHBondContact O-N 2.91Å; Q318-L321 PolarHBondContact O-N 2.91Å; Q318-L322 HydrophobicContact CG-CD1 4.18Å; Q318-L322 WeakPolarHBondContact O-CD1 3.49Å; Q318-L322 VanDerWaalsContact O-CG 3.25Å; Q318-L322 WeakPolarHBondContact O-CG 3.28Å; Q318-L322 PolarHBondContact O-N 2.59Å
319	Q	68.6	Low	62.6	Low	115 Å²	115	102.2 Å²	102.2	54%	0.537	54%	0.539	S	S	.	.	H	α-helix	trans	-64.6	-42.3	174.5	-75.5	174.7	7.8	0	0	111.8	K315 Y316 L321 L322 T323	K315-Q319 WeakPolarHBondContact O-CB 3.28Å; K315-Q319 WeakPolarHBondContact O-CG 3.5Å; K315-Q319 PolarHBondContact O-N 3.38Å; Y316-Q319 PolarHBondContact O-N 3.22Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 3.06Å; Q319-L322 PolarHBondContact O-N 3.43Å; Q319-T323 WeakPolarHBondContact O-CG2 3.25Å; Q319-T323 PolarHBondContact O-N 3.16Å; Q319-T323 PolarHBondContact O-OG1 3.12Å
320	Q	66.6	Low	60.6	Low	94 Å²	94	114.5 Å²	114.5	44%	0.439	58%	0.576	S	S	.	*	H	α-helix	trans	-63.4	-38.7	174.9	-76.2	-156.7	-9.5	0	0	112.7	Y316 I317 L322 T323 S324	Y316-Q320 HydrophobicContact CE1-CG 4.12Å; Y316-Q320 VanDerWaalsContact CE1-NE2 3.31Å; Y316-Q320 HydrophobicContact CE2-CG 4.46Å; Y316-Q320 PolarHBondContact O-N 2.74Å; Y316-Q320 PolarHBondContact OH-NE2 3.35Å; I317-Q320 PolarHBondContact O-N 3.41Å; Q320-L322 VanDerWaalsContact C-N 3.29Å; Q320-L322 PolarHBondContact O-N 2.99Å; Q320-T323 WeakPolarHBondContact CA-OG1 3.45Å; Q320-T323 PolarHBondContact O-N 3.11Å; Q320-T323 PolarHBondContact O-OG1 3.01Å; Q320-S324 PolarHBondContact O-N 3.41Å; Q320-S324 PolarHBondContact O-OG 2.8Å
321	L	60.7	Low	59.5	Low	121 Å²	121	119.1 Å²	119.1	63%	0.634	60%	0.596	S	S	*	*	H	α-helix	trans	-66.8	-31.8	175.2	-72.9	166.9	0	0	0	112.1	I317 Q318 Q319	I317-L321 HydrophobicContact CG2-CD1 3.99Å; I317-L321 WeakPolarHBondContact O-CB 3.38Å; I317-L321 VanDerWaalsContact O-CG 3.28Å; I317-L321 WeakPolarHBondContact O-CG 3.5Å; I317-L321 PolarHBondContact O-N 2.92Å; Q318-L321 PolarHBondContact O-N 2.91Å; Q319-L321 VanDerWaalsContact C-N 3.34Å; Q319-L321 PolarHBondContact O-N 3.06Å
322	L	57	Low	58.5	Low	130 Å²	130	120.5 Å²	120.5	68%	0.681	59%	0.594	S	S	*	*	H	α-helix	trans	-76.5	-27.5	175.8	-72	163.5	0	0	0	112.8	Q318 Q319 Q320	Q318-L322 HydrophobicContact CG-CD1 4.18Å; Q318-L322 WeakPolarHBondContact O-CD1 3.49Å; Q318-L322 VanDerWaalsContact O-CG 3.25Å; Q318-L322 WeakPolarHBondContact O-CG 3.28Å; Q318-L322 PolarHBondContact O-N 2.59Å; Q319-L322 PolarHBondContact O-N 3.43Å; Q320-L322 VanDerWaalsContact C-N 3.29Å; Q320-L322 PolarHBondContact O-N 2.99Å
323	T	53.9	Low	57.4	Low	115 Å²	115	125 Å²	125	71%	0.706	61%	0.609	S	S	*	*	H	α-helix	trans	-89.5	-3.8	177.1	56	0	0	0	0	113.9	Q319 Q320 P325	Q319-T323 WeakPolarHBondContact O-CG2 3.25Å; Q319-T323 PolarHBondContact O-N 3.16Å; Q319-T323 PolarHBondContact O-OG1 3.12Å; Q320-T323 WeakPolarHBondContact CA-OG1 3.45Å; Q320-T323 PolarHBondContact O-N 3.11Å; Q320-T323 PolarHBondContact O-OG1 3.01Å; T323-P325 VanDerWaalsContact C-CD 3.4Å; T323-P325 WeakPolarHBondContact O-CD 3.47Å
324	S	40.6	Very low	56.2	Low	79 Å²	79	132.4 Å²	132.4	55%	0.552	64%	0.644	S	S	*	*			trans	-122	67.9	174.8	49.3	0	0	0	0	112.9	Q320 S326	Q320-S324 PolarHBondContact O-N 3.41Å; Q320-S324 PolarHBondContact O-OG 2.8Å; S324-S326 PolarHBondContact O-N 3.11Å
325	P	38.9	Very low	54.8	Low	100 Å²	100	130.9 Å²	130.9	65%	0.649	65%	0.648	S	S	*	*			trans	-75	121.6	164.8	31.9	-29.6	0	0	0	109.1	T323	T323-P325 VanDerWaalsContact C-CD 3.4Å; T323-P325 WeakPolarHBondContact O-CD 3.47Å
326	S	37.8	Very low	53.2	Low	99 Å²	99	130.3 Å²	130.3	69%	0.692	65%	0.65	S	S	*	*			trans	58	96.1	154.3	52.1	0	0	0	0	118.6	S324	S324-S326 PolarHBondContact O-N 3.11Å
327	R	36	Very low	51.5	Low	247 Å²	247	136 Å²	136	93%	0.932	68%	0.683	S	S	*	*			trans	-104.7	72.9	135.2	-81.7	-166.7	-168	-178.7	4.8	108.9
328	F	32.6	Very low	49.6	Very low	206 Å²	206	142.5 Å²	142.5	90%	0.904	72%	0.715	S	S	*	*			trans	-132.6	93.4	154.9	-97.4	-83.7	0	0	0	105.3
329	S	38.6	Very low	47.7	Very low	109 Å²	109	144.1 Å²	144.1	76%	0.762	73%	0.727	S	S	*	*			trans	-114.9	130.8	161.4	-32.3	0	0	0	0	104.8
330	Y	41.3	Very low	45.8	Very low	314 Å²	314	146.7 Å²	146.7	100%	1.231	74%	0.744	S	S	*	*			trans	-28	0	-179.8	-72.6	-93.7	0	0	0	116.7

Retrieved 330 of 330 residues in 333.2 ms (Link to these results)

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