A0A5K4FAM7_SCHMA Loading...

Reverse transcriptase domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAM7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 345 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.2	Very low	33.3	Very low	241 Å²	241	156.7 Å²	156.7	100%	1.187	84%	0.844	S	S	*	*				0	72	0	-81.4	-168	152.2	0	0	110.1	K3	M1-K3 PolarHBondContact O-N 3.44Å
2	L	33.5	Very low	33.2	Very low	172 Å²	172	157.8 Å²	157.8	90%	0.901	84%	0.84	S	S	*	*			trans	-85.4	102.6	-179.8	-79.6	149.4	0	0	0	108.5	H4	L2-H4 PolarHBondContact O-N 2.77Å; L2-H4 VanDerWaalsContact O-N 3.17Å
3	K	33	Very low	33	Very low	211 Å²	211	154.5 Å²	154.5	92%	0.917	83%	0.83	S	S	*	*			trans	-63.1	111.6	174.9	-80.3	178.8	175.1	176.4	0	108.7	M1 A5	M1-K3 PolarHBondContact O-N 3.44Å; K3-A5 PolarHBondContact O-N 3.26Å
4	H	34.5	Very low	32.9	Very low	183 Å²	183	160.1 Å²	160.1	85%	0.847	83%	0.833	S	S	*	*			trans	-60.2	118	165.9	-81.1	-78.5	0	0	0	109.1	L2 S6	L2-H4 PolarHBondContact O-N 2.77Å; L2-H4 VanDerWaalsContact O-N 3.17Å; H4-S6 PolarHBondContact O-N 3.31Å
5	A	37.1	Very low	32.8	Very low	99 Å²	99	158.7 Å²	158.7	82%	0.818	83%	0.827	S	S	*	*			trans	-62.4	107.9	167	0	0	0	0	0	108.1	K3 S7	K3-A5 PolarHBondContact O-N 3.26Å; A5-S7 PolarHBondContact O-N 2.97Å; A5-S7 VanDerWaalsContact O-N 3.11Å
6	S	33.6	Very low	33	Very low	111 Å²	111	159.4 Å²	159.4	78%	0.776	82%	0.822	S	S	*	*			trans	-57	111.9	172.6	36.3	0	0	0	0	109.4	H4 S8	H4-S6 PolarHBondContact O-N 3.31Å; S6-S8 PolarHBondContact O-N 3.44Å
7	S	34.3	Very low	33.4	Very low	105 Å²	105	155.4 Å²	155.4	73%	0.734	81%	0.811	S	S	*	*			trans	-55.9	101	167.7	-179.4	0	0	0	0	108.6	A5 K9	A5-S7 PolarHBondContact O-N 2.97Å; A5-S7 VanDerWaalsContact O-N 3.11Å; S7-K9 PolarHBondContact O-N 2.9Å
8	S	31.1	Very low	34	Very low	106 Å²	106	154.2 Å²	154.2	74%	0.741	81%	0.805	S	S	*	*			trans	-65.1	85.8	164.8	34.8	0	0	0	0	107.3	S6 V10	S6-S8 PolarHBondContact O-N 3.44Å; S8-V10 PolarHBondContact O-N 2.94Å
9	K	31.7	Very low	34.6	Very low	183 Å²	183	152 Å²	152	80%	0.796	80%	0.8	S	S	*	*			trans	-57.3	95.4	159.3	-80.9	-178.8	177	175.4	0	106.4	S7 K11	S7-K9 PolarHBondContact O-N 2.9Å; K9-K11 PolarHBondContact O-N 3.3Å
10	V	33	Very low	35.5	Very low	122 Å²	122	149 Å²	149	74%	0.739	79%	0.787	S	S	*	*			trans	-54.9	97.8	163.3	176.3	0	0	0	0	105.4	S8 Q12	S8-V10 PolarHBondContact O-N 2.94Å; V10-Q12 PolarHBondContact O-N 3.45Å
11	K	29.3	Very low	36.6	Very low	191 Å²	191	145.5 Å²	145.5	83%	0.83	77%	0.769	S	S	*	*			trans	-61	94.4	162.6	-79.6	179.4	175.8	177.3	0	104.5	K9 T13	K9-K11 PolarHBondContact O-N 3.3Å; K11-T13 PolarHBondContact O-N 3.22Å
12	Q	32	Very low	37.5	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	74%	0.737	S	S	*	*			trans	-58.3	96.7	159.4	-79.1	-176.8	3.1	0	0	105.6	V10 R14	V10-Q12 PolarHBondContact O-N 3.45Å; Q12-R14 PolarHBondContact O-N 2.94Å
13	T	30.2	Very low	38.8	Very low	115 Å²	115	136.4 Å²	136.4	71%	0.706	73%	0.725	S	S	*	*			trans	-52.6	110.3	163	36.8	0	0	0	0	105.7	K11 D15	K11-T13 PolarHBondContact O-N 3.22Å; T13-D15 PolarHBondContact O-N 3.42Å
14	R	31.7	Very low	40.8	Very low	232 Å²	232	133 Å²	133	88%	0.875	71%	0.711	S	S	*	*			trans	-73.1	55.1	170.3	-75.1	-177.7	172.8	178.9	-1.6	109.1	Q12 K16	Q12-R14 PolarHBondContact O-N 2.94Å; R14-K16 PolarHBondContact O-N 3.16Å; R14-K16 VanDerWaalsContact O-N 3.11Å
15	D	31.5	Very low	43.3	Very low	140 Å²	140	126 Å²	126	75%	0.749	68%	0.68	S	S	*	*			trans	-84.3	60.3	157.2	-74.4	-31.7	0	0	0	107.6	T13 S17	T13-D15 PolarHBondContact O-N 3.42Å; D15-S17 PolarHBondContact O-N 2.64Å; D15-S17 VanDerWaalsContact O-N 3.08Å
16	K	37.1	Very low	45.8	Very low	170 Å²	170	122.2 Å²	122.2	74%	0.739	65%	0.646	S	S	*	*			trans	-79.1	75	156.3	-75.3	-174.7	179.2	-179.6	0	106.2	R14 N18	R14-K16 PolarHBondContact O-N 3.16Å; R14-K16 VanDerWaalsContact O-N 3.11Å; K16-N18 PolarHBondContact O-N 2.9Å
17	S	39.5	Very low	48.5	Very low	91 Å²	91	118.6 Å²	118.6	64%	0.636	62%	0.62	S	S	*	*			trans	-59.8	89.3	143.4	51.8	0	0	0	0	105.1	D15 T19	D15-S17 PolarHBondContact O-N 2.64Å; D15-S17 VanDerWaalsContact O-N 3.08Å; S17-T19 PolarHBondContact O-N 3.38Å; S17-T19 PolarHBondContact O-OG1 3.48Å
18	N	43.6	Very low	51.3	Low	133 Å²	133	116.7 Å²	116.7	71%	0.711	60%	0.601	S	S	*	*			trans	-68.4	50.3	166.3	-87.1	-12.1	0	0	0	108.5	K16 V20	K16-N18 PolarHBondContact O-N 2.9Å; N18-V20 PolarHBondContact O-N 3.16Å
19	T	45.1	Very low	54.2	Low	113 Å²	113	114.9 Å²	114.9	69%	0.693	58%	0.583	S	S	*	*			trans	-68.8	77.2	157.4	50.6	0	0	0	0	105	S17 D21	S17-T19 PolarHBondContact O-N 3.38Å; S17-T19 PolarHBondContact O-OG1 3.48Å; T19-D21 PolarHBondContact O-N 2.77Å
20	V	53.1	Low	57.1	Low	92 Å²	92	106.8 Å²	106.8	56%	0.558	55%	0.549	S	S	*	.			trans	-45.1	117.3	159.2	176.5	0	0	0	0	104.3	N18 I22 V25	N18-V20 PolarHBondContact O-N 3.16Å; V20-I22 VanDerWaalsContact C-N 3.32Å; V20-I22 WeakPolarHBondContact O-CA 3.34Å; V20-I22 WeakPolarHBondContact O-CG1 3.15Å; V20-I22 PolarHBondContact O-N 3.3Å; V20-V25 HydrophobicContact CG1-CG2 3.55Å
21	D	58.7	Low	59.9	Low	75 Å²	75	107.5 Å²	107.5	40%	0.401	55%	0.549	S	S	.	.			trans	-51.7	105.3	177.5	-179.1	-11.3	0	0	0	107	T19 N23 K24	T19-D21 PolarHBondContact O-N 2.77Å; D21-N23 PolarHBondContact O-N 3.42Å; D21-N23 PolarHBondContact OD1-N 3.35Å; D21-K24 HydrophobicContact CB-CB 4.17Å; D21-K24 HydrophobicContact CB-CD 3.81Å; D21-K24 HydrophobicContact CB-CG 3.86Å; D21-K24 WeakPolarHBondContact O-CB 3.45Å; D21-K24 PolarHBondContact O-N 2.94Å; D21-K24 WeakPolarHBondContact OD2-CE 3.32Å; D21-K24 WeakPolarHBondContact OD2-CG 3.41Å; D21-K24 IonicContact OD2-NZ 3.78Å
22	I	53.5	Low	62.8	Low	101 Å²	101	100.7 Å²	100.7	52%	0.518	52%	0.518	S	S	.	.	H	α-helix	trans	-65.2	-22.1	-165.1	-63.1	178	0	0	0	109.3	V20 K43	V20-I22 VanDerWaalsContact C-N 3.32Å; V20-I22 WeakPolarHBondContact O-CA 3.34Å; V20-I22 WeakPolarHBondContact O-CG1 3.15Å; V20-I22 PolarHBondContact O-N 3.3Å; I22-K43 HydrophobicContact CG2-CD 3.68Å; I22-K43 WeakPolarHBondContact O-CE 3.35Å
23	N	60.7	Low	65.7	Low	122 Å²	122	100.2 Å²	100.2	65%	0.652	52%	0.519	S	S	*	.	H	α-helix	trans	-81.8	-16.8	176.2	-63.5	-23.1	0	0	0	112.8	D21 V25	D21-N23 PolarHBondContact O-N 3.42Å; D21-N23 PolarHBondContact OD1-N 3.35Å; N23-V25 VanDerWaalsContact C-N 3.35Å
24	K	76.4	Confident	68.6	Low	140 Å²	140	95.6 Å²	95.6	61%	0.609	49%	0.49	S	S	*	.	H	α-helix	trans	-78.9	-16.5	173.6	-72	-177.2	-175.7	164.6	0	113.6	D21 T124	D21-K24 HydrophobicContact CB-CB 4.17Å; D21-K24 HydrophobicContact CB-CD 3.81Å; D21-K24 HydrophobicContact CB-CG 3.86Å; D21-K24 WeakPolarHBondContact O-CB 3.45Å; D21-K24 PolarHBondContact O-N 2.94Å; D21-K24 WeakPolarHBondContact OD2-CE 3.32Å; D21-K24 WeakPolarHBondContact OD2-CG 3.41Å; D21-K24 IonicContact OD2-NZ 3.78Å; K24-T124 WeakPolarHBondContact O-CB 3.31Å; K24-T124 WeakPolarHBondContact O-CG2 3.31Å; K24-T124 PolarHBondContact O-OG1 2.75Å
25	V	85.5	Confident	71.5	Confident	34 Å²	34	87.2 Å²	87.2	21%	0.206	46%	0.463	C	S	.	.	H	α-helix	trans	-85	-28.6	-176.1	-171.5	0	0	0	0	112.5	V20 N23 K43 T124 T125	V20-V25 HydrophobicContact CG1-CG2 3.55Å; N23-V25 VanDerWaalsContact C-N 3.35Å; V25-K43 VanDerWaalsContact CG1-O 3.26Å; V25-K43 WeakPolarHBondContact CG1-O 3.19Å; V25-T124 WeakPolarHBondContact O-CA 3.24Å; V25-T125 PolarHBondContact O-N 2.88Å
26	L	89.7	Confident	74.3	Confident	20 Å²	20	84.8 Å²	84.8	11%	0.105	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	121.2	179	177.6	64.3	0	0	0	109.7	L34 I39 L42 K43 T125 I127	L26-L34 HydrophobicContact CD2-CD1 4.07Å; L26-I39 HydrophobicContact CD2-CB 4.38Å; L26-I39 HydrophobicContact CD2-CG1 4.34Å; L26-I39 HydrophobicContact CD2-CG2 4.12Å; L26-L42 HydrophobicContact CD1-CB 3.86Å; L26-L42 HydrophobicContact CD1-CD1 4.2Å; L26-L42 HydrophobicContact CD2-CB 4.14Å; L26-K43 HydrophobicContact CB-CG 4.08Å; L26-K43 HydrophobicContact CD2-CG 4.48Å; L26-T125 WeakPolarHBondContact CA-O 3.42Å; L26-T125 HydrophobicContact CD1-CG2 4.1Å; L26-I127 HydrophobicContact CD1-CD1 4.17Å; L26-I127 HydrophobicContact CD1-CG1 4.06Å
27	V	90.7	Very high	76.9	Confident	36 Å²	36	80.1 Å²	80.1	22%	0.218	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	120.3	173.9	177.1	0	0	0	0	108.3	L29 T124 T125 V126 I127 I200	V27-L29 HydrophobicContact CG1-CD1 4.5Å; V27-L29 HydrophobicContact CG1-CD2 3.79Å; V27-L29 HydrophobicContact CG1-CG 3.89Å; V27-T124 HydrophobicContact CB-CG2 4.25Å; V27-T124 HydrophobicContact CG2-CG2 3.67Å; V27-T125 PolarHBondContact N-O 3.25Å; V27-V126 WeakPolarHBondContact O-CA 3.47Å; V27-I127 PolarHBondContact O-N 3.42Å; V27-I200 HydrophobicContact CG2-CD1 4.14Å
28	N	92.5	Very high	79.4	Confident	65 Å²	65	76 Å²	76	35%	0.348	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	106.8	175.8	-170.5	12.4	0	0	0	109.7	S30 R32 L34	N28-S30 WeakPolarHBondContact OD1-CB 3.46Å; N28-S30 PolarHBondContact OD1-N 2.93Å; N28-S30 PolarHBondContact OD1-O 3.26Å; N28-S30 PolarHBondContact OD1-OG 3.41Å; N28-R32 PolarHBondContact ND2-O 2.99Å; N28-L34 HydrophobicContact CB-CD1 4.48Å
29	L	91.9	Very high	81.6	Confident	67 Å²	67	72.2 Å²	72.2	35%	0.351	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	18.7	172.5	-54	177.1	0	0	0	111.1	V27 V126 I127 M128 T205	V27-L29 HydrophobicContact CG1-CD1 4.5Å; V27-L29 HydrophobicContact CG1-CD2 3.79Å; V27-L29 HydrophobicContact CG1-CG 3.89Å; L29-V126 HydrophobicContact CD1-CG1 3.87Å; L29-V126 HydrophobicContact CG-CG1 4.19Å; L29-I127 CarbonylContact C-O 3.52Å; L29-I127 WeakPolarHBondContact CA-O 3.19Å; L29-I127 WeakPolarHBondContact CB-O 3.48Å; L29-I127 PolarHBondContact N-O 2.98Å; L29-M128 HydrophobicContact CB-CE 4.33Å; L29-M128 HydrophobicContact CD1-CE 3.65Å; L29-T205 HydrophobicContact CD1-CG2 4.03Å
30	S	92.8	Very high	83.8	Confident	13 Å²	13	69.6 Å²	69.6	9%	0.091	37%	0.374	C	S	.	.	S	Bend	trans	-107.6	158.3	176.2	73.8	0	0	0	0	110.7	N28 R32 I127 N129	N28-S30 WeakPolarHBondContact OD1-CB 3.46Å; N28-S30 PolarHBondContact OD1-N 2.93Å; N28-S30 PolarHBondContact OD1-O 3.26Å; N28-S30 PolarHBondContact OD1-OG 3.41Å; S30-R32 PolarHBondContact O-N 2.87Å; S30-I127 WeakPolarHBondContact OG-CG2 3.39Å; S30-N129 WeakPolarHBondContact CA-OD1 3.26Å; S30-N129 WeakPolarHBondContact CB-OD1 3.11Å
31	D	92.4	Very high	85.4	Confident	138 Å²	138	65.7 Å²	65.7	74%	0.738	35%	0.35	S	S	*	.	S	Bend	trans	-74.2	-10.4	176	-55.4	-44.7	0	0	0	112.2	I33 N129	D31-I33 PolarHBondContact O-N 3.34Å; D31-N129 PolarHBondContact N-OD1 3.4Å; D31-N129 VanDerWaalsContact N-OD1 3.1Å; D31-N129 PolarHBondContact OD2-ND2 2.82Å
32	R	91.2	Very high	87	Confident	48 Å²	48	62.7 Å²	62.7	18%	0.181	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-73.5	123.1	-180	177.9	172.2	167.9	-170	1.4	110.9	N28 S30 L34 E38 D111 I114	N28-R32 PolarHBondContact ND2-O 2.99Å; S30-R32 PolarHBondContact O-N 2.87Å; R32-L34 HydrophobicContact CG-CD2 4.5Å; R32-L34 PolarHBondContact O-N 3.08Å; R32-E38 IonicContact CZ-OE1 3.63Å; R32-E38 IonicContact NH2-OE1 3.94Å; R32-E38 PolarHBondContact NH2-OE1 3.18Å; R32-E38 IonicContact NH2-OE2 3.73Å; R32-D111 WeakPolarHBondContact CD-OD2 3.1Å; R32-D111 IonicContact CZ-OD2 3.93Å; R32-D111 IonicContact NE-OD2 3.01Å; R32-D111 IonicContact NH1-OD2 3.77Å; R32-D111 PolarHBondContact NH1-OD2 3.31Å; R32-I114 HydrophobicContact CB-CG2 4.04Å; R32-I114 VanDerWaalsContact NH1-CD1 3.31Å
33	I	91.7	Very high	88.6	Confident	159 Å²	159	61.1 Å²	61.1	82%	0.815	32%	0.323	S	S	*	.	P	Polyproline II helix	trans	-74.8	122.6	167.9	-56.5	172	0	0	0	108.7	D31	D31-I33 PolarHBondContact O-N 3.34Å
34	L	91.4	Very high	89.9	Confident	18 Å²	18	59.1 Å²	59.1	9%	0.094	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-90.2	140.8	178.5	-57.5	169.6	0	0	0	110.5	L26 N28 R32 E38 I39 L42 L108 I127	L26-L34 HydrophobicContact CD2-CD1 4.07Å; N28-L34 HydrophobicContact CB-CD1 4.48Å; R32-L34 HydrophobicContact CG-CD2 4.5Å; R32-L34 PolarHBondContact O-N 3.08Å; L34-E38 WeakPolarHBondContact CA-OE2 3.36Å; L34-E38 HydrophobicContact CB-CB 4.3Å; L34-E38 HydrophobicContact CD2-CB 4.48Å; L34-I39 HydrophobicContact CB-CD1 4.1Å; L34-I39 HydrophobicContact CB-CG1 3.63Å; L34-I39 HydrophobicContact CD1-CG1 4.06Å; L34-L42 HydrophobicContact CD1-CD1 4.44Å; L34-L108 HydrophobicContact CD2-CD2 4.06Å; L34-I127 HydrophobicContact CD1-CD1 3.32Å; L34-I127 HydrophobicContact CD2-CD1 3.69Å; L34-I127 HydrophobicContact CG-CD1 4.05Å
35	N	91.9	Very high	90.4	Very high	57 Å²	57	53 Å²	53	31%	0.305	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-78.4	166.5	171.7	71.2	53.4	0	0	0	112	H37 E38 I39	N35-H37 VanDerWaalsContact C-N 3.28Å; N35-H37 PolarHBondContact O-N 3.06Å; N35-H37 WeakPolarHBondContact OD1-CA 3.31Å; N35-H37 WeakPolarHBondContact OD1-CB 3.45Å; N35-H37 PolarHBondContact OD1-N 3.5Å; N35-E38 PolarHBondContact N-OE2 2.85Å; N35-E38 WeakPolarHBondContact ND2-CG 3.24Å; N35-E38 PolarHBondContact ND2-OE1 3.5Å; N35-E38 PolarHBondContact ND2-OE2 3.04Å; N35-E38 WeakPolarHBondContact O-CB 3.38Å; N35-E38 PolarHBondContact O-N 3.17Å; N35-E38 WeakPolarHBondContact OD1-CG 3.47Å; N35-E38 PolarHBondContact OD1-N 3.14Å; N35-I39 WeakPolarHBondContact O-CG1 3.45Å; N35-I39 PolarHBondContact O-N 3.05Å
36	S	90.7	Very high	90.5	Very high	88 Å²	88	55.6 Å²	55.6	62%	0.615	30%	0.298	S	S	*	.	H	α-helix	trans	-59.7	-34.7	-176.7	60.5	0	0	0	0	113.5	S40	S36-S40 VanDerWaalsContact O-CB 3.26Å; S36-S40 WeakPolarHBondContact O-CB 3.42Å; S36-S40 PolarHBondContact O-N 3.39Å
37	H	91.6	Very high	90.3	Very high	73 Å²	73	60.7 Å²	60.7	34%	0.338	33%	0.325	S	S	.	.	H	α-helix	trans	-73.6	-37.1	178	-64.6	-48.7	0	0	0	112.4	N35 S41 A104	N35-H37 VanDerWaalsContact C-N 3.28Å; N35-H37 PolarHBondContact O-N 3.06Å; N35-H37 WeakPolarHBondContact OD1-CA 3.31Å; N35-H37 WeakPolarHBondContact OD1-CB 3.45Å; N35-H37 PolarHBondContact OD1-N 3.5Å; H37-S41 VanDerWaalsContact O-CB 3.32Å; H37-S41 WeakPolarHBondContact O-CB 3.36Å; H37-S41 PolarHBondContact O-N 2.87Å; H37-S41 PolarHBondContact O-OG 3.09Å; H37-A104 HydrophobicContact CB-CB 3.93Å
38	E	91.9	Very high	90.1	Very high	4 Å²	4	62.7 Å²	62.7	2%	0.019	33%	0.331	C	S	.	.	H	α-helix	trans	-63.8	-49.2	173.4	-70.4	170.8	162.2	0	0	110.7	R32 L34 N35 S40 S41 L42 A104 L108	R32-E38 IonicContact CZ-OE1 3.63Å; R32-E38 IonicContact NH2-OE1 3.94Å; R32-E38 PolarHBondContact NH2-OE1 3.18Å; R32-E38 IonicContact NH2-OE2 3.73Å; L34-E38 WeakPolarHBondContact CA-OE2 3.36Å; L34-E38 HydrophobicContact CB-CB 4.3Å; L34-E38 HydrophobicContact CD2-CB 4.48Å; N35-E38 PolarHBondContact N-OE2 2.85Å; N35-E38 WeakPolarHBondContact ND2-CG 3.24Å; N35-E38 PolarHBondContact ND2-OE1 3.5Å; N35-E38 PolarHBondContact ND2-OE2 3.04Å; N35-E38 WeakPolarHBondContact O-CB 3.38Å; N35-E38 PolarHBondContact O-N 3.17Å; N35-E38 WeakPolarHBondContact OD1-CG 3.47Å; N35-E38 PolarHBondContact OD1-N 3.14Å; E38-S40 PolarHBondContact O-N 3.41Å; E38-S41 PolarHBondContact O-N 2.73Å; E38-S41 VanDerWaalsContact O-N 3.17Å; E38-L42 WeakPolarHBondContact O-CG 3.36Å; E38-L42 PolarHBondContact O-N 3.29Å; E38-A104 HydrophobicContact CG-CB 3.75Å; E38-L108 HydrophobicContact CB-CD1 4.03Å; E38-L108 HydrophobicContact CB-CD2 4.37Å; E38-L108 HydrophobicContact CB-CG 4.39Å; E38-L108 HydrophobicContact CG-CD1 3.88Å; E38-L108 HydrophobicContact CG-CD2 4.13Å; E38-L108 HydrophobicContact CG-CG 3.86Å
39	I	91.2	Very high	89.7	Confident	53 Å²	53	64.7 Å²	64.7	27%	0.272	35%	0.346	S	S	.	.	H	α-helix	trans	-57.6	-50	176.4	-67.3	168.7	0	0	0	110.3	L26 L34 N35 S41 L42 K43	L26-I39 HydrophobicContact CD2-CB 4.38Å; L26-I39 HydrophobicContact CD2-CG1 4.34Å; L26-I39 HydrophobicContact CD2-CG2 4.12Å; L34-I39 HydrophobicContact CB-CD1 4.1Å; L34-I39 HydrophobicContact CB-CG1 3.63Å; L34-I39 HydrophobicContact CD1-CG1 4.06Å; N35-I39 WeakPolarHBondContact O-CG1 3.45Å; N35-I39 PolarHBondContact O-N 3.05Å; I39-S41 VanDerWaalsContact C-N 3.27Å; I39-S41 PolarHBondContact O-N 2.91Å; I39-L42 PolarHBondContact O-N 2.95Å; I39-K43 HydrophobicContact CG2-CD 3.71Å; I39-K43 HydrophobicContact CG2-CG 4.29Å; I39-K43 VanDerWaalsContact O-CB 3.3Å; I39-K43 WeakPolarHBondContact O-CB 3.46Å; I39-K43 VanDerWaalsContact O-CG 3.23Å; I39-K43 WeakPolarHBondContact O-CG 3.32Å; I39-K43 PolarHBondContact O-N 3.25Å
40	S	89.4	Confident	89.2	Confident	59 Å²	59	65.1 Å²	65.1	41%	0.413	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-39.3	178.5	-178.7	0	0	0	0	112	S36 E38	S36-S40 VanDerWaalsContact O-CB 3.26Å; S36-S40 WeakPolarHBondContact O-CB 3.42Å; S36-S40 PolarHBondContact O-N 3.39Å; E38-S40 PolarHBondContact O-N 3.41Å
41	S	88.5	Confident	88.6	Confident	10 Å²	10	67.3 Å²	67.3	7%	0.07	36%	0.358	C	S	.	.	H	α-helix	trans	-69.3	-45.7	179.6	-57.7	0	0	0	0	112.1	H37 E38 I39 K44 V101	H37-S41 VanDerWaalsContact O-CB 3.32Å; H37-S41 WeakPolarHBondContact O-CB 3.36Å; H37-S41 PolarHBondContact O-N 2.87Å; H37-S41 PolarHBondContact O-OG 3.09Å; E38-S41 PolarHBondContact O-N 2.73Å; E38-S41 VanDerWaalsContact O-N 3.17Å; I39-S41 VanDerWaalsContact C-N 3.27Å; I39-S41 PolarHBondContact O-N 2.91Å; S41-K44 WeakPolarHBondContact O-CB 3.12Å; S41-K44 PolarHBondContact O-N 2.75Å; S41-V101 WeakPolarHBondContact OG-CG1 3.49Å
42	L	90.4	Very high	87.5	Confident	11 Å²	11	68 Å²	68	6%	0.058	35%	0.351	C	S	.	.	H	α-helix	trans	-72.3	-30.3	-178.8	-65.3	173.7	0	0	0	112.5	L26 L34 E38 I39 K44 G45 L108 I116 T125 I127	L26-L42 HydrophobicContact CD1-CB 3.86Å; L26-L42 HydrophobicContact CD1-CD1 4.2Å; L26-L42 HydrophobicContact CD2-CB 4.14Å; L34-L42 HydrophobicContact CD1-CD1 4.44Å; E38-L42 WeakPolarHBondContact O-CG 3.36Å; E38-L42 PolarHBondContact O-N 3.29Å; I39-L42 PolarHBondContact O-N 2.95Å; L42-K44 PolarHBondContact O-N 3.21Å; L42-G45 PolarHBondContact O-N 3.07Å; L42-L108 HydrophobicContact CD1-CD1 4.06Å; L42-L108 HydrophobicContact CD1-CD2 4.37Å; L42-L108 HydrophobicContact CD2-CD1 4.2Å; L42-L108 HydrophobicContact CG-CD1 4.08Å; L42-I116 HydrophobicContact CD2-CD1 4.19Å; L42-I116 HydrophobicContact CD2-CG2 4.11Å; L42-T125 HydrophobicContact CB-CG2 4.48Å; L42-T125 HydrophobicContact CD2-CG2 4.31Å; L42-T125 PolarHBondContact O-OG1 3.15Å; L42-I127 HydrophobicContact CD1-CD1 3.35Å; L42-I127 HydrophobicContact CD1-CG1 4.18Å
43	K	88.8	Confident	86.7	Confident	68 Å²	68	69.7 Å²	69.7	30%	0.296	37%	0.368	S	S	.	.	H	α-helix	trans	-63.2	-20.5	172.4	-80.1	176.2	175.7	173.9	0	113.6	I22 V25 L26 I39 G45	I22-K43 HydrophobicContact CG2-CD 3.68Å; I22-K43 WeakPolarHBondContact O-CE 3.35Å; V25-K43 VanDerWaalsContact CG1-O 3.26Å; V25-K43 WeakPolarHBondContact CG1-O 3.19Å; L26-K43 HydrophobicContact CB-CG 4.08Å; L26-K43 HydrophobicContact CD2-CG 4.48Å; I39-K43 HydrophobicContact CG2-CD 3.71Å; I39-K43 HydrophobicContact CG2-CG 4.29Å; I39-K43 VanDerWaalsContact O-CB 3.3Å; I39-K43 WeakPolarHBondContact O-CB 3.46Å; I39-K43 VanDerWaalsContact O-CG 3.23Å; I39-K43 WeakPolarHBondContact O-CG 3.32Å; I39-K43 PolarHBondContact O-N 3.25Å; K43-G45 PolarHBondContact O-N 3.46Å
44	K	87.5	Confident	86	Confident	80 Å²	80	68 Å²	68	35%	0.348	36%	0.357	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.4	172	-62.6	176.1	179.1	-173.6	0	112.6	S41 L42 F48 M97	S41-K44 WeakPolarHBondContact O-CB 3.12Å; S41-K44 PolarHBondContact O-N 2.75Å; L42-K44 PolarHBondContact O-N 3.21Å; K44-F48 HydrophobicContact CB-CB 3.76Å; K44-F48 HydrophobicContact CB-CD1 4.3Å; K44-F48 HydrophobicContact CB-CD2 3.66Å; K44-F48 HydrophobicContact CB-CE2 4.34Å; K44-F48 HydrophobicContact CB-CG 3.63Å; K44-F48 HydrophobicContact CD-CD1 3.86Å; K44-F48 HydrophobicContact CD-CD2 3.95Å; K44-F48 HydrophobicContact CD-CE1 3.77Å; K44-F48 HydrophobicContact CD-CE2 3.85Å; K44-F48 HydrophobicContact CD-CG 3.95Å; K44-F48 HydrophobicContact CD-CZ 3.76Å; K44-F48 HydrophobicContact CG-CD2 4.16Å; K44-F48 HydrophobicContact CG-CE2 4.34Å; K44-F48 HydrophobicContact CG-CG 4.34Å; K44-M97 PolarHBondContact NZ-SD 3.34Å
45	G	87.1	Confident	85.5	Confident	12 Å²	12	71.6 Å²	71.6	12%	0.124	38%	0.375	C	S	.	.			trans	83.6	158.7	-178.5	0	0	0	0	0	113.4	L42 K43 N47 F48	L42-G45 PolarHBondContact O-N 3.07Å; K43-G45 PolarHBondContact O-N 3.46Å; G45-N47 PolarHBondContact O-N 3.24Å; G45-F48 VanDerWaalsContact O-CB 3.3Å; G45-F48 WeakPolarHBondContact O-CB 3.29Å; G45-F48 PolarHBondContact O-N 3.17Å; G45-F48 VanDerWaalsContact O-N 3.1Å
46	L	87.4	Confident	85.1	Confident	89 Å²	89	71.2 Å²	71.2	47%	0.466	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-17.4	-176.3	-58.4	-179.8	0	0	0	114.1	I116 K118 T125	L46-I116 HydrophobicContact CD2-CG2 4Å; L46-K118 HydrophobicContact CD1-CB 4.19Å; L46-T125 HydrophobicContact CD2-CG2 4.02Å; L46-T125 HydrophobicContact CG-CG2 4.31Å
47	N	86.1	Confident	84.8	Confident	126 Å²	126	69.5 Å²	69.5	67%	0.674	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.6	4.8	176.3	-68.5	-14.6	0	0	0	113	G45 T49	G45-N47 PolarHBondContact O-N 3.24Å; N47-T49 PolarHBondContact O-N 2.98Å
48	F	86.4	Confident	84.5	Confident	79 Å²	79	74 Å²	74	35%	0.346	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-62.4	122.4	179.3	-176.2	-100.6	0	0	0	110.8	K44 G45 N96 M97	K44-F48 HydrophobicContact CB-CB 3.76Å; K44-F48 HydrophobicContact CB-CD1 4.3Å; K44-F48 HydrophobicContact CB-CD2 3.66Å; K44-F48 HydrophobicContact CB-CE2 4.34Å; K44-F48 HydrophobicContact CB-CG 3.63Å; K44-F48 HydrophobicContact CD-CD1 3.86Å; K44-F48 HydrophobicContact CD-CD2 3.95Å; K44-F48 HydrophobicContact CD-CE1 3.77Å; K44-F48 HydrophobicContact CD-CE2 3.85Å; K44-F48 HydrophobicContact CD-CG 3.95Å; K44-F48 HydrophobicContact CD-CZ 3.76Å; K44-F48 HydrophobicContact CG-CD2 4.16Å; K44-F48 HydrophobicContact CG-CE2 4.34Å; K44-F48 HydrophobicContact CG-CG 4.34Å; G45-F48 VanDerWaalsContact O-CB 3.3Å; G45-F48 WeakPolarHBondContact O-CB 3.29Å; G45-F48 PolarHBondContact O-N 3.17Å; G45-F48 VanDerWaalsContact O-N 3.1Å; F48-N96 VanDerWaalsContact CZ-ND2 3.31Å; F48-N96 WeakPolarHBondContact CZ-ND2 3.3Å; F48-M97 HydrophobicContact CE1-SD 3.85Å
49	T	82.8	Confident	84.1	Confident	107 Å²	107	78.5 Å²	78.5	66%	0.656	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-86.6	127	-177.8	-60.1	0	0	0	0	110.6	N47 N96	N47-T49 PolarHBondContact O-N 2.98Å; T49-N96 PolarHBondContact O-ND2 3.48Å
50	I	81.4	Confident	84	Confident	75 Å²	75	77.4 Å²	77.4	39%	0.385	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-86	131.9	171.4	-56.3	173.8	0	0	0	108.1	R52 N96 M97	I50-R52 PolarHBondContact O-N 3.17Å; I50-R52 VanDerWaalsContact O-N 3.16Å; I50-N96 WeakPolarHBondContact CA-OD1 3.47Å; I50-M97 HydrophobicContact CG1-CG 4.32Å; I50-M97 HydrophobicContact CG2-CG 4.14Å
51	N	79.9	Confident	83.9	Confident	59 Å²	59	79 Å²	79	32%	0.316	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-59.8	120.7	173.4	-71.8	-5.8	0	0	0	109.1	K94 N96	N51-K94 PolarHBondContact ND2-O 3.06Å; N51-N96 PolarHBondContact N-OD1 3.38Å
52	R	70.5	Confident	83.9	Confident	154 Å²	154	82.7 Å²	82.7	58%	0.581	43%	0.429	S	S	*	.	P	Polyproline II helix	trans	-78.6	130.3	173.3	-65.9	-177.9	-179.2	175.4	-0.8	107.8	I50 Q54	I50-R52 PolarHBondContact O-N 3.17Å; I50-R52 VanDerWaalsContact O-N 3.16Å; R52-Q54 PolarHBondContact O-N 3.16Å
53	P	73.2	Confident	83.8	Confident	83 Å²	83	85.8 Å²	85.8	54%	0.539	46%	0.457	S	S	.	.	S	Bend	trans	-62	-30.8	179.8	24	-32.5	0	0	0	111.5	S92 Q93	P53-S92 WeakPolarHBondContact O-CA 3.48Å; P53-S92 PolarHBondContact O-OG 3.26Å; P53-S92 VanDerWaalsContact O-OG 3.12Å; P53-Q93 PolarHBondContact O-N 3.08Å
54	Q	78.4	Confident	83.8	Confident	124 Å²	124	85 Å²	85	58%	0.579	46%	0.455	S	S	*	.	S	Bend	trans	-148.5	141.9	176.5	-160.2	177.8	13.3	0	0	109.5	R52 Q90	R52-Q54 PolarHBondContact O-N 3.16Å; Q54-Q90 HydrophobicContact CG-CG 3.77Å; Q54-Q90 VanDerWaalsContact CG-NE2 3.34Å
55	L	80.7	Confident	84	Confident	93 Å²	93	84 Å²	84	49%	0.487	45%	0.452	S	S	.	.			trans	-73.3	121.4	167.3	-61.4	176.3	0	0	0	109.1	I60 L87 Q90	L55-I60 HydrophobicContact CB-CD1 3.57Å; L55-I60 HydrophobicContact CD1-CD1 4.27Å; L55-I60 HydrophobicContact CG-CD1 4.49Å; L55-L87 HydrophobicContact CB-CD2 4.37Å; L55-Q90 PolarHBondContact O-NE2 3.44Å
56	S	83.9	Confident	84.1	Confident	48 Å²	48	87.3 Å²	87.3	34%	0.336	47%	0.471	S	S	.	.			trans	-75.2	127.1	175.4	174.6	0	0	0	0	110.5	F58 N59 I60	S56-F58 PolarHBondContact O-N 3.46Å; S56-F58 PolarHBondContact OG-N 3.09Å; S56-N59 PolarHBondContact O-N 2.95Å; S56-I60 PolarHBondContact O-N 2.95Å
57	S	83.3	Confident	84.2	Confident	52 Å²	52	85.9 Å²	85.9	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-53.5	-37	173.3	50.8	0	0	0	0	112	N59 I60 I61	S57-N59 PolarHBondContact O-N 3.13Å; S57-I60 PolarHBondContact O-N 3.25Å; S57-I61 WeakPolarHBondContact O-CG1 3.34Å; S57-I61 PolarHBondContact O-N 3.47Å
58	F	85.6	Confident	84.3	Confident	167 Å²	167	80.1 Å²	80.1	73%	0.732	44%	0.441	S	S	*	.	H	α-helix	trans	-59.3	-26.8	177.6	-67.7	-78.8	0	0	0	114.2	S56 P62	S56-F58 PolarHBondContact O-N 3.46Å; S56-F58 PolarHBondContact OG-N 3.09Å; F58-P62 WeakPolarHBondContact O-CD 3.49Å; F58-P62 VanDerWaalsContact O-CG 3.29Å; F58-P62 WeakPolarHBondContact O-CG 3.48Å
59	N	84.6	Confident	84.5	Confident	99 Å²	99	82 Å²	82	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-88.9	-25	177.5	-69.1	-37.6	0	0	0	112.6	S56 S57	S56-N59 PolarHBondContact O-N 2.95Å; S57-N59 PolarHBondContact O-N 3.13Å
60	I	87.3	Confident	84.8	Confident	30 Å²	30	83.7 Å²	83.7	15%	0.154	46%	0.458	C	S	.	.	H	α-helix	trans	-90.2	-45.3	-171.4	-65.6	160.9	0	0	0	110.7	L55 S56 S57 A63 I64 L87	L55-I60 HydrophobicContact CB-CD1 3.57Å; L55-I60 HydrophobicContact CD1-CD1 4.27Å; L55-I60 HydrophobicContact CG-CD1 4.49Å; S56-I60 PolarHBondContact O-N 2.95Å; S57-I60 PolarHBondContact O-N 3.25Å; I60-A63 WeakPolarHBondContact O-CB 3.25Å; I60-A63 PolarHBondContact O-N 2.99Å; I60-A63 VanDerWaalsContact O-N 3.09Å; I60-I64 HydrophobicContact CG2-CD1 3.4Å; I60-I64 VanDerWaalsContact CG2-CD1 3.4Å; I60-I64 HydrophobicContact CG2-CG1 4.15Å; I60-I64 WeakPolarHBondContact O-CG1 3.32Å; I60-I64 PolarHBondContact O-N 3.18Å; I60-I64 VanDerWaalsContact O-N 3.08Å; I60-L87 HydrophobicContact CD1-CD1 4.01Å; I60-L87 HydrophobicContact CD1-CD2 3.27Å; I60-L87 HydrophobicContact CD1-CG 4.28Å; I60-L87 HydrophobicContact CG2-CD1 4.39Å
61	I	87.5	Confident	85.3	Confident	94 Å²	94	83.7 Å²	83.7	48%	0.482	46%	0.458	S	S	.	.	H	α-helix	trans	-56.2	-50.5	-177	-64.7	164.9	0	0	0	111.1	S57 A63 I64 E65	S57-I61 WeakPolarHBondContact O-CG1 3.34Å; S57-I61 PolarHBondContact O-N 3.47Å; I61-A63 PolarHBondContact O-N 3.42Å; I61-A63 VanDerWaalsContact O-N 3.16Å; I61-I64 PolarHBondContact O-N 3.19Å; I61-E65 WeakPolarHBondContact O-CB 3.24Å; I61-E65 PolarHBondContact O-N 3.12Å
62	P	89.1	Confident	85.9	Confident	87 Å²	87	85 Å²	85	57%	0.565	47%	0.47	S	S	*	.	H	α-helix	trans	-64.9	-23.1	-179.4	-22	35.2	0	0	0	114.2	F58 P66	F58-P62 WeakPolarHBondContact O-CD 3.49Å; F58-P62 VanDerWaalsContact O-CG 3.29Å; F58-P62 WeakPolarHBondContact O-CG 3.48Å; P62-P66 VanDerWaalsContact O-CD 3.25Å; P62-P66 WeakPolarHBondContact O-CD 3.41Å
63	A	88	Confident	87	Confident	76 Å²	76	83.8 Å²	83.8	63%	0.628	48%	0.475	S	S	*	.	H	α-helix	trans	-80.4	-33.1	178.1	0	0	0	0	0	112.2	I60 I61	I60-A63 WeakPolarHBondContact O-CB 3.25Å; I60-A63 PolarHBondContact O-N 2.99Å; I60-A63 VanDerWaalsContact O-N 3.09Å; I61-A63 PolarHBondContact O-N 3.42Å; I61-A63 VanDerWaalsContact O-N 3.16Å
64	I	89.2	Confident	87.9	Confident	52 Å²	52	87.8 Å²	87.8	27%	0.267	49%	0.487	S	S	.	.	H	α-helix	trans	-93.5	-38.2	-174.3	-63.4	-178.9	0	0	0	112	I60 I61 P66 A67 L68 I83	I60-I64 HydrophobicContact CG2-CD1 3.4Å; I60-I64 VanDerWaalsContact CG2-CD1 3.4Å; I60-I64 HydrophobicContact CG2-CG1 4.15Å; I60-I64 WeakPolarHBondContact O-CG1 3.32Å; I60-I64 PolarHBondContact O-N 3.18Å; I60-I64 VanDerWaalsContact O-N 3.08Å; I61-I64 PolarHBondContact O-N 3.19Å; I64-P66 VanDerWaalsContact C-CD 3.48Å; I64-A67 WeakPolarHBondContact O-CB 3.26Å; I64-A67 PolarHBondContact O-N 3.1Å; I64-L68 HydrophobicContact CG2-CD1 3.65Å; I64-L68 HydrophobicContact CG2-CD2 4.2Å; I64-L68 HydrophobicContact CG2-CG 3.67Å; I64-L68 PolarHBondContact O-N 3.36Å; I64-L68 VanDerWaalsContact O-N 3.09Å; I64-I83 HydrophobicContact CD1-CD1 3.83Å; I64-I83 HydrophobicContact CD1-CG2 4.34Å; I64-I83 HydrophobicContact CG2-CD1 3.88Å
65	E	90.8	Very high	88.6	Confident	59 Å²	59	85.2 Å²	85.2	28%	0.276	48%	0.48	S	S	.	.	H	α-helix	trans	-56	-41.4	-172.8	-159.9	63.2	-154.4	0	0	114.2	I61 A67 L68 N69 R80	I61-E65 WeakPolarHBondContact O-CB 3.24Å; I61-E65 PolarHBondContact O-N 3.12Å; E65-A67 PolarHBondContact O-N 3.24Å; E65-L68 PolarHBondContact O-N 3.28Å; E65-L68 VanDerWaalsContact O-N 3.15Å; E65-N69 PolarHBondContact O-N 3.27Å; E65-N69 VanDerWaalsContact O-N 3.08Å; E65-R80 IonicContact OE1-CZ 3.59Å; E65-R80 IonicContact OE1-NE 3.38Å; E65-R80 PolarHBondContact OE1-NE 3.01Å; E65-R80 IonicContact OE1-NH2 2.67Å; E65-R80 PolarHBondContact OE1-NH2 3.04Å; E65-R80 IonicContact OE2-NE 3.72Å
66	P	90	Very high	89.2	Confident	81 Å²	81	80.9 Å²	80.9	53%	0.526	46%	0.457	S	S	.	.	H	α-helix	trans	-60.6	-31.6	175.9	-24.3	35.5	0	0	0	113.7	P62 I64	P62-P66 VanDerWaalsContact O-CD 3.25Å; P62-P66 WeakPolarHBondContact O-CD 3.41Å; I64-P66 VanDerWaalsContact C-CD 3.48Å
67	A	88.7	Confident	89.7	Confident	59 Å²	59	82.4 Å²	82.4	49%	0.488	46%	0.462	S	S	.	.	H	α-helix	trans	-77.9	-34.5	176.9	0	0	0	0	0	111.8	I64 E65 N69 I70	I64-A67 WeakPolarHBondContact O-CB 3.26Å; I64-A67 PolarHBondContact O-N 3.1Å; E65-A67 PolarHBondContact O-N 3.24Å; A67-N69 VanDerWaalsContact C-N 3.33Å; A67-N69 PolarHBondContact O-N 2.92Å; A67-I70 PolarHBondContact O-N 3.07Å
68	L	90	Very high	90.2	Very high	5 Å²	5	84.9 Å²	84.9	3%	0.026	47%	0.467	C	S	.	.	H	α-helix	trans	-67.9	-32	176.9	-65.8	178.6	0	0	0	112.8	I64 E65 I70 L71 A76 L79 R80	I64-L68 HydrophobicContact CG2-CD1 3.65Å; I64-L68 HydrophobicContact CG2-CD2 4.2Å; I64-L68 HydrophobicContact CG2-CG 3.67Å; I64-L68 PolarHBondContact O-N 3.36Å; I64-L68 VanDerWaalsContact O-N 3.09Å; E65-L68 PolarHBondContact O-N 3.28Å; E65-L68 VanDerWaalsContact O-N 3.15Å; L68-I70 PolarHBondContact O-N 3.21Å; L68-I70 VanDerWaalsContact O-N 3.14Å; L68-L71 HydrophobicContact CD2-CD1 4.32Å; L68-L71 PolarHBondContact O-N 2.93Å; L68-A76 HydrophobicContact CB-CB 4.37Å; L68-L79 HydrophobicContact CD2-CB 4.12Å; L68-L79 HydrophobicContact CD2-CD2 3.46Å; L68-L79 VanDerWaalsContact CD2-CD2 3.46Å; L68-L79 HydrophobicContact CD2-CG 3.92Å; L68-R80 HydrophobicContact CD1-CG 3.6Å
69	N	88.7	Confident	90.5	Very high	117 Å²	117	80.2 Å²	80.2	63%	0.626	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-13.2	178.2	-74.6	-17.9	0	0	0	114.2	E65 A67	E65-N69 PolarHBondContact O-N 3.27Å; E65-N69 VanDerWaalsContact O-N 3.08Å; A67-N69 VanDerWaalsContact C-N 3.33Å; A67-N69 PolarHBondContact O-N 2.92Å
70	I	90.8	Very high	90.9	Very high	144 Å²	144	79 Å²	79	74%	0.738	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-19.5	176.6	-54.1	171.7	0	0	0	110.7	A67 L68	A67-I70 PolarHBondContact O-N 3.07Å; L68-I70 PolarHBondContact O-N 3.21Å; L68-I70 VanDerWaalsContact O-N 3.14Å
71	L	90.9	Very high	91.2	Very high	74 Å²	74	82 Å²	82	39%	0.387	45%	0.454	S	S	.	.	S	Bend	trans	-90.7	156.9	-175.4	-61.4	176.5	0	0	0	111.8	L68 A76 L79	L68-L71 HydrophobicContact CD2-CD1 4.32Å; L68-L71 PolarHBondContact O-N 2.93Å; L71-A76 HydrophobicContact CB-CB 4.39Å; L71-L79 HydrophobicContact CD1-CD2 4.49Å
72	P	93.7	Very high	91.4	Very high	87 Å²	87	83.2 Å²	83.2	57%	0.565	46%	0.456	S	S	*	.			trans	-55.8	143.2	169.6	-23.5	34.1	0	0	0	111.9	E74 T75 A76	P72-E74 VanDerWaalsContact C-N 3.27Å; P72-E74 PolarHBondContact O-N 3.39Å; P72-E74 VanDerWaalsContact O-N 3.16Å; P72-T75 PolarHBondContact O-N 2.91Å; P72-T75 VanDerWaalsContact O-N 3.16Å; P72-A76 WeakPolarHBondContact O-CB 3.29Å; P72-A76 PolarHBondContact O-N 3.13Å
73	N	92.2	Very high	91.5	Very high	128 Å²	128	80.9 Å²	80.9	68%	0.684	44%	0.438	S	S	*	.	H	α-helix	trans	-54.4	-39.4	-173	-75.4	-24.5	0	0	0	113.6	N77	N73-N77 WeakPolarHBondContact O-CB 3.43Å; N73-N77 VanDerWaalsContact O-CG 3.23Å; N73-N77 PolarHBondContact O-N 3.07Å; N73-N77 PolarHBondContact O-ND2 3.37Å
74	E	93.1	Very high	91.6	Very high	168 Å²	168	81.9 Å²	81.9	79%	0.785	43%	0.431	S	S	*	.	H	α-helix	trans	-65.1	-51.3	179.1	-63.9	-170.4	160.5	0	0	111.8	P72 A76 N77 E78	P72-E74 VanDerWaalsContact C-N 3.27Å; P72-E74 PolarHBondContact O-N 3.39Å; P72-E74 VanDerWaalsContact O-N 3.16Å; E74-A76 VanDerWaalsContact C-N 3.32Å; E74-A76 PolarHBondContact O-N 3.31Å; E74-N77 PolarHBondContact O-N 3.23Å; E74-E78 PolarHBondContact O-N 2.77Å
75	T	93	Very high	91.7	Very high	70 Å²	70	81 Å²	81	43%	0.429	43%	0.429	S	S	.	.	H	α-helix	trans	-62.1	-40.3	177.2	-46.4	0	0	0	0	111.6	P72 E78 L79	P72-T75 PolarHBondContact O-N 2.91Å; P72-T75 VanDerWaalsContact O-N 3.16Å; T75-E78 PolarHBondContact O-N 2.81Å; T75-L79 WeakPolarHBondContact O-CB 3.19Å; T75-L79 PolarHBondContact O-N 3.15Å
76	A	93	Very high	91.7	Very high	1 Å²	1	81 Å²	81	1%	0.008	44%	0.439	C	S	.	.	H	α-helix	trans	-61.8	-45.3	175.9	0	0	0	0	0	111.3	L68 L71 P72 E74 L79 R80	L68-A76 HydrophobicContact CB-CB 4.37Å; L71-A76 HydrophobicContact CB-CB 4.39Å; P72-A76 WeakPolarHBondContact O-CB 3.29Å; P72-A76 PolarHBondContact O-N 3.13Å; E74-A76 VanDerWaalsContact C-N 3.32Å; E74-A76 PolarHBondContact O-N 3.31Å; A76-L79 PolarHBondContact O-N 3.23Å; A76-R80 VanDerWaalsContact O-CG 3.31Å; A76-R80 WeakPolarHBondContact O-CG 3.23Å; A76-R80 PolarHBondContact O-N 3.22Å
77	N	93.5	Very high	91.6	Very high	81 Å²	81	78.6 Å²	78.6	43%	0.433	42%	0.422	S	S	.	.	H	α-helix	trans	-65.8	-40.8	177.4	-76.6	-23.2	0	0	0	112.7	N73 E74 L79 R80 N81	N73-N77 WeakPolarHBondContact O-CB 3.43Å; N73-N77 VanDerWaalsContact O-CG 3.23Å; N73-N77 PolarHBondContact O-N 3.07Å; N73-N77 PolarHBondContact O-ND2 3.37Å; E74-N77 PolarHBondContact O-N 3.23Å; N77-L79 VanDerWaalsContact C-N 3.31Å; N77-L79 PolarHBondContact O-N 3.2Å; N77-R80 PolarHBondContact O-N 3.23Å; N77-R80 PolarHBondContact OD1-NH1 3.44Å; N77-N81 PolarHBondContact O-N 2.97Å; N77-N81 PolarHBondContact O-ND2 2.73Å
78	E	94	Very high	91.5	Very high	103 Å²	103	82.2 Å²	82.2	48%	0.481	43%	0.432	S	S	.	.	H	α-helix	trans	-60	-44.2	174.6	-165.9	-166.7	160.7	0	0	111	E74 T75 N81 K82	E74-E78 PolarHBondContact O-N 2.77Å; T75-E78 PolarHBondContact O-N 2.81Å; E78-N81 PolarHBondContact O-N 2.99Å; E78-K82 WeakPolarHBondContact O-CG 3.29Å; E78-K82 PolarHBondContact O-N 3.29Å; E78-K82 WeakPolarHBondContact OE1-CE 3.39Å; E78-K82 IonicContact OE1-NZ 2.64Å; E78-K82 PolarHBondContact OE1-NZ 3.21Å
79	L	92.8	Very high	91.5	Very high	69 Å²	69	90.6 Å²	90.6	36%	0.361	46%	0.463	S	S	.	.	H	α-helix	trans	-66.6	-41.1	177.2	-173.5	54.1	0	0	0	111.8	L68 L71 T75 A76 N77 N81 K82 I83	L68-L79 HydrophobicContact CD2-CB 4.12Å; L68-L79 HydrophobicContact CD2-CD2 3.46Å; L68-L79 VanDerWaalsContact CD2-CD2 3.46Å; L68-L79 HydrophobicContact CD2-CG 3.92Å; L71-L79 HydrophobicContact CD1-CD2 4.49Å; T75-L79 WeakPolarHBondContact O-CB 3.19Å; T75-L79 PolarHBondContact O-N 3.15Å; A76-L79 PolarHBondContact O-N 3.23Å; N77-L79 VanDerWaalsContact C-N 3.31Å; N77-L79 PolarHBondContact O-N 3.2Å; L79-N81 VanDerWaalsContact C-N 3.31Å; L79-N81 PolarHBondContact O-N 3.22Å; L79-K82 PolarHBondContact O-N 3.37Å; L79-I83 HydrophobicContact CD1-CD1 4.06Å; L79-I83 HydrophobicContact CD1-CG1 4.22Å; L79-I83 HydrophobicContact CG-CD1 3.82Å; L79-I83 HydrophobicContact CG-CG1 4.46Å; L79-I83 WeakPolarHBondContact O-CB 3.21Å; L79-I83 WeakPolarHBondContact O-CD1 3.37Å; L79-I83 VanDerWaalsContact O-CG1 3.24Å; L79-I83 WeakPolarHBondContact O-CG1 3.35Å; L79-I83 PolarHBondContact O-N 2.84Å
80	R	92.9	Very high	91.3	Very high	74 Å²	74	87.2 Å²	87.2	28%	0.279	44%	0.444	S	S	.	.	H	α-helix	trans	-55.4	-46.6	172	-73.8	179.2	-171.3	111.6	1.4	111.1	E65 L68 A76 N77 I83 M84	E65-R80 IonicContact OE1-CZ 3.59Å; E65-R80 IonicContact OE1-NE 3.38Å; E65-R80 PolarHBondContact OE1-NE 3.01Å; E65-R80 IonicContact OE1-NH2 2.67Å; E65-R80 PolarHBondContact OE1-NH2 3.04Å; E65-R80 IonicContact OE2-NE 3.72Å; L68-R80 HydrophobicContact CD1-CG 3.6Å; A76-R80 VanDerWaalsContact O-CG 3.31Å; A76-R80 WeakPolarHBondContact O-CG 3.23Å; A76-R80 PolarHBondContact O-N 3.22Å; N77-R80 PolarHBondContact O-N 3.23Å; N77-R80 PolarHBondContact OD1-NH1 3.44Å; R80-I83 PolarHBondContact O-N 3.45Å; R80-M84 VanDerWaalsContact O-CB 3.32Å; R80-M84 WeakPolarHBondContact O-CB 3.4Å; R80-M84 PolarHBondContact O-N 3.2Å
81	N	92.7	Very high	90.9	Very high	93 Å²	93	89.3 Å²	89.3	50%	0.497	45%	0.448	S	S	.	.	H	α-helix	trans	-64.5	-41.6	178.9	-74.7	-24.4	0	0	0	112.5	N77 E78 L79 S85	N77-N81 PolarHBondContact O-N 2.97Å; N77-N81 PolarHBondContact O-ND2 2.73Å; E78-N81 PolarHBondContact O-N 2.99Å; L79-N81 VanDerWaalsContact C-N 3.31Å; L79-N81 PolarHBondContact O-N 3.22Å; N81-S85 VanDerWaalsContact O-CB 3.24Å; N81-S85 WeakPolarHBondContact O-CB 3.34Å; N81-S85 PolarHBondContact O-N 3.39Å; N81-S85 PolarHBondContact O-OG 3.02Å
82	K	92.8	Very high	90.4	Very high	119 Å²	119	90.4 Å²	90.4	52%	0.517	46%	0.462	S	S	.	.	H	α-helix	trans	-63	-44.2	174.9	-74	176.9	-175.5	168.7	0	111.8	E78 L79 S85 A86	E78-K82 WeakPolarHBondContact O-CG 3.29Å; E78-K82 PolarHBondContact O-N 3.29Å; E78-K82 WeakPolarHBondContact OE1-CE 3.39Å; E78-K82 IonicContact OE1-NZ 2.64Å; E78-K82 PolarHBondContact OE1-NZ 3.21Å; L79-K82 PolarHBondContact O-N 3.37Å; K82-S85 PolarHBondContact O-N 3.24Å; K82-A86 WeakPolarHBondContact O-CB 3.08Å; K82-A86 PolarHBondContact O-N 3.09Å
83	I	90.8	Very high	89.7	Confident	38 Å²	38	91.8 Å²	91.8	20%	0.195	46%	0.461	C	S	.	.	H	α-helix	trans	-65.1	-49.8	177.7	-67.7	162.1	0	0	0	110.4	I64 L79 R80 S85 A86 L87	I64-I83 HydrophobicContact CD1-CD1 3.83Å; I64-I83 HydrophobicContact CD1-CG2 4.34Å; I64-I83 HydrophobicContact CG2-CD1 3.88Å; L79-I83 HydrophobicContact CD1-CD1 4.06Å; L79-I83 HydrophobicContact CD1-CG1 4.22Å; L79-I83 HydrophobicContact CG-CD1 3.82Å; L79-I83 HydrophobicContact CG-CG1 4.46Å; L79-I83 WeakPolarHBondContact O-CB 3.21Å; L79-I83 WeakPolarHBondContact O-CD1 3.37Å; L79-I83 VanDerWaalsContact O-CG1 3.24Å; L79-I83 WeakPolarHBondContact O-CG1 3.35Å; L79-I83 PolarHBondContact O-N 2.84Å; R80-I83 PolarHBondContact O-N 3.45Å; I83-S85 VanDerWaalsContact C-N 3.25Å; I83-S85 PolarHBondContact O-N 3.16Å; I83-A86 WeakPolarHBondContact O-CB 3.47Å; I83-A86 PolarHBondContact O-N 3.43Å; I83-L87 HydrophobicContact CG2-CD1 3.94Å; I83-L87 HydrophobicContact CG2-CG 4.19Å; I83-L87 WeakPolarHBondContact O-CG 3.2Å; I83-L87 PolarHBondContact O-N 2.67Å
84	M	90.1	Very high	89	Confident	98 Å²	98	94.8 Å²	94.8	48%	0.483	47%	0.468	S	S	.	.	H	α-helix	trans	-52.9	-48.2	176.2	-179.5	-174.3	73.6	0	0	110.5	R80 A86 L87 L88	R80-M84 VanDerWaalsContact O-CB 3.32Å; R80-M84 WeakPolarHBondContact O-CB 3.4Å; R80-M84 PolarHBondContact O-N 3.2Å; M84-A86 VanDerWaalsContact C-N 3.34Å; M84-A86 PolarHBondContact O-N 2.84Å; M84-L87 PolarHBondContact O-N 3.37Å; M84-L87 VanDerWaalsContact O-N 3.17Å; M84-L88 HydrophobicContact CG-CD1 4.01Å; M84-L88 HydrophobicContact CG-CG 4.46Å; M84-L88 WeakPolarHBondContact O-CG 3.46Å; M84-L88 PolarHBondContact O-N 3.04Å
85	S	91.3	Very high	88.3	Confident	33 Å²	33	90 Å²	90	23%	0.231	45%	0.452	C	S	.	.	H	α-helix	trans	-61.1	-40.2	178	-64.3	0	0	0	0	112.8	N81 K82 I83 R89	N81-S85 VanDerWaalsContact O-CB 3.24Å; N81-S85 WeakPolarHBondContact O-CB 3.34Å; N81-S85 PolarHBondContact O-N 3.39Å; N81-S85 PolarHBondContact O-OG 3.02Å; K82-S85 PolarHBondContact O-N 3.24Å; I83-S85 VanDerWaalsContact C-N 3.25Å; I83-S85 PolarHBondContact O-N 3.16Å; S85-R89 WeakPolarHBondContact O-CB 3.44Å; S85-R89 WeakPolarHBondContact O-CG 3.41Å; S85-R89 PolarHBondContact O-N 3.3Å; S85-R89 PolarHBondContact O-NE 3.49Å
86	A	89.9	Confident	87.9	Confident	58 Å²	58	89.3 Å²	89.3	48%	0.479	45%	0.446	S	S	.	.	H	α-helix	trans	-66.6	-37.6	175	0	0	0	0	0	112.3	K82 I83 M84 Q90	K82-A86 WeakPolarHBondContact O-CB 3.08Å; K82-A86 PolarHBondContact O-N 3.09Å; I83-A86 WeakPolarHBondContact O-CB 3.47Å; I83-A86 PolarHBondContact O-N 3.43Å; M84-A86 VanDerWaalsContact C-N 3.34Å; M84-A86 PolarHBondContact O-N 2.84Å; A86-Q90 PolarHBondContact O-N 3.34Å
87	L	87.9	Confident	87.4	Confident	31 Å²	31	90.1 Å²	90.1	16%	0.162	45%	0.45	C	S	.	.	H	α-helix	trans	-71.8	-35.1	177	-65.1	179.6	0	0	0	112.8	L55 I60 I83 M84 Q90	L55-L87 HydrophobicContact CB-CD2 4.37Å; I60-L87 HydrophobicContact CD1-CD1 4.01Å; I60-L87 HydrophobicContact CD1-CD2 3.27Å; I60-L87 HydrophobicContact CD1-CG 4.28Å; I60-L87 HydrophobicContact CG2-CD1 4.39Å; I83-L87 HydrophobicContact CG2-CD1 3.94Å; I83-L87 HydrophobicContact CG2-CG 4.19Å; I83-L87 WeakPolarHBondContact O-CG 3.2Å; I83-L87 PolarHBondContact O-N 2.67Å; M84-L87 PolarHBondContact O-N 3.37Å; M84-L87 VanDerWaalsContact O-N 3.17Å; L87-Q90 WeakPolarHBondContact O-CG 3.42Å; L87-Q90 PolarHBondContact O-NE2 3.17Å
88	L	88.2	Confident	87	Confident	135 Å²	135	90.3 Å²	90.3	71%	0.707	45%	0.454	S	S	*	.	H	α-helix	trans	-72.6	-36.5	175.6	-69.7	173.5	0	0	0	111.8	M84 Q90	M84-L88 HydrophobicContact CG-CD1 4.01Å; M84-L88 HydrophobicContact CG-CG 4.46Å; M84-L88 WeakPolarHBondContact O-CG 3.46Å; M84-L88 PolarHBondContact O-N 3.04Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; L88-Q90 PolarHBondContact O-N 2.95Å
89	R	88.7	Confident	86.7	Confident	181 Å²	181	94.3 Å²	94.3	68%	0.683	47%	0.47	S	S	*	.	S	Bend	trans	-86	2.5	-179.7	-68.4	-170.2	-66.5	-102.1	3.5	114.7	S85 K91	S85-R89 WeakPolarHBondContact O-CB 3.44Å; S85-R89 WeakPolarHBondContact O-CG 3.41Å; S85-R89 PolarHBondContact O-N 3.3Å; S85-R89 PolarHBondContact O-NE 3.49Å; R89-K91 PolarHBondContact O-N 2.83Å
90	Q	85.1	Confident	86.6	Confident	47 Å²	47	95.5 Å²	95.5	22%	0.22	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-62.9	129	-177.1	71.6	-174.6	-69.1	0	0	110.7	Q54 L55 A86 L87 L88	Q54-Q90 HydrophobicContact CG-CG 3.77Å; Q54-Q90 VanDerWaalsContact CG-NE2 3.34Å; L55-Q90 PolarHBondContact O-NE2 3.44Å; A86-Q90 PolarHBondContact O-N 3.34Å; L87-Q90 WeakPolarHBondContact O-CG 3.42Å; L87-Q90 PolarHBondContact O-NE2 3.17Å; L88-Q90 VanDerWaalsContact C-N 3.33Å; L88-Q90 PolarHBondContact O-N 2.95Å
91	K	82.3	Confident	86.4	Confident	188 Å²	188	92.4 Å²	92.4	82%	0.817	47%	0.466	S	S	*	.	P	Polyproline II helix	trans	-80.1	139.2	174.3	-66.4	-176.7	-179.8	-179.9	0	109.2	R89 Q93	R89-K91 PolarHBondContact O-N 2.83Å; K91-Q93 PolarHBondContact O-N 2.64Å
92	S	80.7	Confident	86.2	Confident	97 Å²	97	91.3 Å²	91.3	68%	0.678	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-63.7	123.8	176.2	-169.5	0	0	0	0	110.5	P53	P53-S92 WeakPolarHBondContact O-CA 3.48Å; P53-S92 PolarHBondContact O-OG 3.26Å; P53-S92 VanDerWaalsContact O-OG 3.12Å
93	Q	78.6	Confident	86.2	Confident	116 Å²	116	90.9 Å²	90.9	54%	0.542	46%	0.459	S	S	.	.	P	Polyproline II helix	trans	-79.7	134.2	177.2	-67.6	-168.4	-26.5	0	0	110.2	P53 K91 S95	P53-Q93 PolarHBondContact O-N 3.08Å; K91-Q93 PolarHBondContact O-N 2.64Å; Q93-S95 PolarHBondContact O-N 3.35Å
94	K	77.3	Confident	86.2	Confident	191 Å²	191	89.1 Å²	89.1	83%	0.83	45%	0.451	S	S	*	.	P	Polyproline II helix	trans	-60.1	132.5	170.6	-69.1	-175.3	-179.8	-179.9	0	109	N51 N96	N51-K94 PolarHBondContact ND2-O 3.06Å; K94-N96 PolarHBondContact O-N 3.18Å
95	S	79.2	Confident	86.3	Confident	66 Å²	66	87.2 Å²	87.2	46%	0.462	44%	0.442	S	S	.	.	P	Polyproline II helix	trans	-59.3	134	173.8	-172.8	0	0	0	0	109.4	Q93 M97	Q93-S95 PolarHBondContact O-N 3.35Å; S95-M97 PolarHBondContact O-N 3.13Å; S95-M97 PolarHBondContact OG-N 2.92Å
96	N	83.6	Confident	86.4	Confident	57 Å²	57	92.1 Å²	92.1	31%	0.305	46%	0.459	S	S	.	.	S	Bend	trans	-79.2	11.3	172.4	60.8	-20.5	0	0	0	112.7	F48 T49 I50 N51 K94	F48-N96 VanDerWaalsContact CZ-ND2 3.31Å; F48-N96 WeakPolarHBondContact CZ-ND2 3.3Å; T49-N96 PolarHBondContact O-ND2 3.48Å; I50-N96 WeakPolarHBondContact CA-OD1 3.47Å; N51-N96 PolarHBondContact N-OD1 3.38Å; K94-N96 PolarHBondContact O-N 3.18Å
97	M	82.3	Confident	86.5	Confident	18 Å²	18	93.1 Å²	93.1	9%	0.089	45%	0.454	C	S	.	.	S	Bend	trans	-124.1	133.3	-175.8	-62.6	-68.3	-97.2	0	0	110.7	K44 F48 I50 S95 V101 L102 L105	K44-M97 PolarHBondContact NZ-SD 3.34Å; F48-M97 HydrophobicContact CE1-SD 3.85Å; I50-M97 HydrophobicContact CG1-CG 4.32Å; I50-M97 HydrophobicContact CG2-CG 4.14Å; S95-M97 PolarHBondContact O-N 3.13Å; S95-M97 PolarHBondContact OG-N 2.92Å; M97-V101 HydrophobicContact CB-CG1 4.4Å; M97-V101 HydrophobicContact CE-CG1 3.1Å; M97-V101 HydrophobicContact SD-CG1 3.63Å; M97-L102 HydrophobicContact CB-CD2 4.17Å; M97-L102 HydrophobicContact CB-CG 4.2Å; M97-L105 HydrophobicContact CE-CD1 3.56Å
98	T	86.8	Confident	86.8	Confident	84 Å²	84	92 Å²	92	52%	0.515	45%	0.448	S	S	.	.			trans	-77.9	159.3	174.5	61.4	0	0	0	0	110.9	N100 V101 L102	T98-N100 PolarHBondContact O-N 3.5Å; T98-V101 PolarHBondContact O-N 3.24Å; T98-V101 VanDerWaalsContact O-N 3.17Å; T98-V101 WeakPolarHBondContact OG1-CG2 3.22Å; T98-V101 PolarHBondContact OG1-N 3.46Å; T98-L102 PolarHBondContact O-N 3.2Å
99	K	87.4	Confident	87.1	Confident	188 Å²	188	96 Å²	96	82%	0.817	45%	0.454	S	S	*	.	H	α-helix	trans	-56.2	-39.9	176.2	-69	-176.7	-179.7	178.3	0	112	V101 L102 H103	K99-V101 PolarHBondContact O-N 3.15Å; K99-L102 PolarHBondContact O-N 2.87Å; K99-H103 WeakPolarHBondContact O-CB 3.44Å; K99-H103 PolarHBondContact O-N 3.27Å
100	N	90	Very high	87.3	Confident	93 Å²	93	93.1 Å²	93.1	50%	0.497	45%	0.452	S	S	.	.	H	α-helix	trans	-63.8	-41.2	178.8	-63.1	1.3	0	0	0	112	T98 H103 A104	T98-N100 PolarHBondContact O-N 3.5Å; N100-H103 WeakPolarHBondContact O-CB 3.47Å; N100-H103 PolarHBondContact O-N 2.97Å; N100-A104 WeakPolarHBondContact O-CB 3.36Å; N100-A104 PolarHBondContact O-N 3.48Å
101	V	89.2	Confident	87.8	Confident	9 Å²	9	92.7 Å²	92.7	6%	0.055	45%	0.451	C	S	.	.	H	α-helix	trans	-66.5	-41.7	176.7	161.8	0	0	0	0	111.3	S41 M97 T98 K99 H103 A104 L105	S41-V101 WeakPolarHBondContact OG-CG1 3.49Å; M97-V101 HydrophobicContact CB-CG1 4.4Å; M97-V101 HydrophobicContact CE-CG1 3.1Å; M97-V101 HydrophobicContact SD-CG1 3.63Å; T98-V101 PolarHBondContact O-N 3.24Å; T98-V101 VanDerWaalsContact O-N 3.17Å; T98-V101 WeakPolarHBondContact OG1-CG2 3.22Å; T98-V101 PolarHBondContact OG1-N 3.46Å; K99-V101 PolarHBondContact O-N 3.15Å; V101-H103 VanDerWaalsContact C-N 3.29Å; V101-H103 PolarHBondContact O-N 3.39Å; V101-A104 PolarHBondContact O-N 2.89Å; V101-L105 HydrophobicContact CG1-CD1 4.48Å; V101-L105 WeakPolarHBondContact O-CG 3.22Å; V101-L105 PolarHBondContact O-N 3.08Å
102	L	88.3	Confident	88.3	Confident	71 Å²	71	91.9 Å²	91.9	37%	0.372	45%	0.448	S	S	.	.	H	α-helix	trans	-63.1	-37.3	174.1	-69	174.5	0	0	0	112	M97 T98 K99 K106	M97-L102 HydrophobicContact CB-CD2 4.17Å; M97-L102 HydrophobicContact CB-CG 4.2Å; T98-L102 PolarHBondContact O-N 3.2Å; K99-L102 PolarHBondContact O-N 2.87Å; L102-K106 WeakPolarHBondContact O-CG 3.28Å; L102-K106 PolarHBondContact O-N 3.46Å; L102-K106 VanDerWaalsContact O-N 3.09Å
103	H	91.8	Very high	89	Confident	109 Å²	109	91.5 Å²	91.5	51%	0.505	44%	0.442	S	S	.	.	H	α-helix	trans	-64.6	-47	174.3	-173.1	82.9	0	0	0	111.6	K99 N100 V101 L105 K106 Q107	K99-H103 WeakPolarHBondContact O-CB 3.44Å; K99-H103 PolarHBondContact O-N 3.27Å; N100-H103 WeakPolarHBondContact O-CB 3.47Å; N100-H103 PolarHBondContact O-N 2.97Å; V101-H103 VanDerWaalsContact C-N 3.29Å; V101-H103 PolarHBondContact O-N 3.39Å; H103-L105 VanDerWaalsContact C-N 3.34Å; H103-L105 PolarHBondContact O-N 3.21Å; H103-K106 WeakPolarHBondContact O-CB 3.5Å; H103-K106 PolarHBondContact O-N 3.47Å; H103-K106 VanDerWaalsContact O-N 3.08Å; H103-Q107 PolarHBondContact CD2-NE2 3.45Å; H103-Q107 PolarHBondContact NE2-NE2 3.21Å; H103-Q107 PolarHBondContact O-N 2.61Å
104	A	92.1	Very high	89.8	Confident	2 Å²	2	86.5 Å²	86.5	2%	0.017	42%	0.418	C	S	.	.	H	α-helix	trans	-56.7	-44.5	174.7	0	0	0	0	0	112.3	H37 E38 N100 V101 K106 Q107 L108	H37-A104 HydrophobicContact CB-CB 3.93Å; E38-A104 HydrophobicContact CG-CB 3.75Å; N100-A104 WeakPolarHBondContact O-CB 3.36Å; N100-A104 PolarHBondContact O-N 3.48Å; V101-A104 PolarHBondContact O-N 2.89Å; A104-K106 VanDerWaalsContact C-N 3.31Å; A104-K106 PolarHBondContact O-N 3.32Å; A104-Q107 WeakPolarHBondContact O-CB 3.44Å; A104-Q107 PolarHBondContact O-N 3.28Å; A104-L108 WeakPolarHBondContact O-CG 3.39Å; A104-L108 PolarHBondContact O-N 3.12Å
105	L	91.8	Very high	90.6	Very high	58 Å²	58	79 Å²	79	30%	0.304	39%	0.387	S	S	.	.	H	α-helix	trans	-63	-35.9	175.4	-71.3	176.9	0	0	0	112.8	M97 V101 H103 L108 R109	M97-L105 HydrophobicContact CE-CD1 3.56Å; V101-L105 HydrophobicContact CG1-CD1 4.48Å; V101-L105 WeakPolarHBondContact O-CG 3.22Å; V101-L105 PolarHBondContact O-N 3.08Å; H103-L105 VanDerWaalsContact C-N 3.34Å; H103-L105 PolarHBondContact O-N 3.21Å; L105-L108 HydrophobicContact CD2-CD1 4.38Å; L105-R109 WeakPolarHBondContact O-CB 3.41Å; L105-R109 PolarHBondContact O-N 3.45Å
106	K	92.2	Very high	91.3	Very high	136 Å²	136	78.6 Å²	78.6	59%	0.591	38%	0.379	S	S	*	.	H	α-helix	trans	-66.4	-42.3	173.5	-73.3	176.1	-179.7	-175.7	0	111.4	L102 H103 A104 R109 N110	L102-K106 WeakPolarHBondContact O-CG 3.28Å; L102-K106 PolarHBondContact O-N 3.46Å; L102-K106 VanDerWaalsContact O-N 3.09Å; H103-K106 WeakPolarHBondContact O-CB 3.5Å; H103-K106 PolarHBondContact O-N 3.47Å; H103-K106 VanDerWaalsContact O-N 3.08Å; A104-K106 VanDerWaalsContact C-N 3.31Å; A104-K106 PolarHBondContact O-N 3.32Å; K106-R109 PolarHBondContact O-N 3.08Å; K106-N110 WeakPolarHBondContact O-CB 3.27Å; K106-N110 PolarHBondContact O-N 2.95Å; K106-N110 PolarHBondContact O-ND2 3.27Å
107	Q	93.7	Very high	91.8	Very high	78 Å²	78	76.7 Å²	76.7	36%	0.364	37%	0.369	S	S	.	.	H	α-helix	trans	-60.6	-48	175.3	-70.6	178.6	-29.9	0	0	111.3	H103 A104 R109 N110 D111	H103-Q107 PolarHBondContact CD2-NE2 3.45Å; H103-Q107 PolarHBondContact NE2-NE2 3.21Å; H103-Q107 PolarHBondContact O-N 2.61Å; A104-Q107 WeakPolarHBondContact O-CB 3.44Å; A104-Q107 PolarHBondContact O-N 3.28Å; Q107-R109 VanDerWaalsContact C-N 3.33Å; Q107-R109 PolarHBondContact O-N 2.89Å; Q107-N110 PolarHBondContact O-N 2.93Å; Q107-D111 PolarHBondContact O-N 3.17Å; Q107-D111 VanDerWaalsContact O-N 3.1Å
108	L	93.8	Very high	92.3	Very high	9 Å²	9	79.5 Å²	79.5	5%	0.047	38%	0.381	C	S	.	.	H	α-helix	trans	-58.2	-42	174.7	-71.4	167.9	0	0	0	112.6	L34 E38 L42 A104 L105 I114 I116	L34-L108 HydrophobicContact CD2-CD2 4.06Å; E38-L108 HydrophobicContact CB-CD1 4.03Å; E38-L108 HydrophobicContact CB-CD2 4.37Å; E38-L108 HydrophobicContact CB-CG 4.39Å; E38-L108 HydrophobicContact CG-CD1 3.88Å; E38-L108 HydrophobicContact CG-CD2 4.13Å; E38-L108 HydrophobicContact CG-CG 3.86Å; L42-L108 HydrophobicContact CD1-CD1 4.06Å; L42-L108 HydrophobicContact CD1-CD2 4.37Å; L42-L108 HydrophobicContact CD2-CD1 4.2Å; L42-L108 HydrophobicContact CG-CD1 4.08Å; A104-L108 WeakPolarHBondContact O-CG 3.39Å; A104-L108 PolarHBondContact O-N 3.12Å; L105-L108 HydrophobicContact CD2-CD1 4.38Å; L108-I114 HydrophobicContact CD2-CD1 4.12Å; L108-I116 HydrophobicContact CB-CD1 4.2Å; L108-I116 HydrophobicContact CD2-CD1 4.19Å
109	R	93.2	Very high	92.5	Very high	217 Å²	217	75.6 Å²	75.6	82%	0.819	36%	0.357	S	S	*	.	H	α-helix	trans	-67.9	-35.5	179	-177.9	178.8	-179.9	-173.1	-0.5	113.1	L105 K106 Q107	L105-R109 WeakPolarHBondContact O-CB 3.41Å; L105-R109 PolarHBondContact O-N 3.45Å; K106-R109 PolarHBondContact O-N 3.08Å; Q107-R109 VanDerWaalsContact C-N 3.33Å; Q107-R109 PolarHBondContact O-N 2.89Å
110	N	94.6	Very high	92.7	Very high	122 Å²	122	68 Å²	68	65%	0.652	33%	0.326	S	S	*	.	H	α-helix	trans	-79.5	-23.6	-177.1	-72.1	-12.5	0	0	0	112.4	K106 Q107 K112	K106-N110 WeakPolarHBondContact O-CB 3.27Å; K106-N110 PolarHBondContact O-N 2.95Å; K106-N110 PolarHBondContact O-ND2 3.27Å; Q107-N110 PolarHBondContact O-N 2.93Å; N110-K112 PolarHBondContact O-N 3Å
111	D	94.2	Very high	92.6	Very high	37 Å²	37	69.6 Å²	69.6	20%	0.198	33%	0.328	C	S	.	.			trans	-71.6	112.8	175.2	-174.7	0.8	0	0	0	111.2	R32 Q107 T113 I114	R32-D111 WeakPolarHBondContact CD-OD2 3.1Å; R32-D111 IonicContact CZ-OD2 3.93Å; R32-D111 IonicContact NE-OD2 3.01Å; R32-D111 IonicContact NH1-OD2 3.77Å; R32-D111 PolarHBondContact NH1-OD2 3.31Å; Q107-D111 PolarHBondContact O-N 3.17Å; Q107-D111 VanDerWaalsContact O-N 3.1Å; D111-T113 VanDerWaalsContact CG-OG1 3.32Å; D111-T113 VanDerWaalsContact OD1-CB 3.31Å; D111-T113 WeakPolarHBondContact OD1-CB 3.37Å; D111-T113 WeakPolarHBondContact OD1-CG2 3.37Å; D111-T113 PolarHBondContact OD1-N 2.96Å; D111-T113 PolarHBondContact OD1-OG1 3.4Å; D111-T113 PolarHBondContact OD2-OG1 2.77Å; D111-I114 HydrophobicContact CB-CG1 4.3Å
112	K	93.9	Very high	92.3	Very high	172 Å²	172	72.5 Å²	72.5	75%	0.748	36%	0.36	S	S	*	.			trans	-92.7	-1.4	180	-62.3	179	-176.1	173.9	0	112.9	N110 K130	N110-K112 PolarHBondContact O-N 3Å; K112-K130 WeakPolarHBondContact O-CD 3.4Å
113	T	95.3	Very high	92.2	Very high	89 Å²	89	73.1 Å²	73.1	55%	0.546	36%	0.364	S	S	.	.	S	Bend	trans	-85.1	-20.9	-178.1	70.6	0	0	0	0	112.3	D111 K130	D111-T113 VanDerWaalsContact CG-OG1 3.32Å; D111-T113 VanDerWaalsContact OD1-CB 3.31Å; D111-T113 WeakPolarHBondContact OD1-CB 3.37Å; D111-T113 WeakPolarHBondContact OD1-CG2 3.37Å; D111-T113 PolarHBondContact OD1-N 2.96Å; D111-T113 PolarHBondContact OD1-OG1 3.4Å; D111-T113 PolarHBondContact OD2-OG1 2.77Å; T113-K130 WeakPolarHBondContact O-CB 3.22Å; T113-K130 PolarHBondContact O-N 2.92Å
114	I	95.4	Very high	92.1	Very high	10 Å²	10	68.4 Å²	68.4	5%	0.051	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	158.6	179.8	63.5	167.4	0	0	0	112.6	R32 L108 D111 I116 I127 M128	R32-I114 HydrophobicContact CB-CG2 4.04Å; R32-I114 VanDerWaalsContact NH1-CD1 3.31Å; L108-I114 HydrophobicContact CD2-CD1 4.12Å; D111-I114 HydrophobicContact CB-CG1 4.3Å; I114-I116 HydrophobicContact CD1-CD1 4.24Å; I114-I116 HydrophobicContact CD1-CG1 4.14Å; I114-I127 HydrophobicContact CB-CG2 3.98Å; I114-I127 HydrophobicContact CD1-CG2 3.91Å; I114-I127 HydrophobicContact CG2-CG2 4.25Å; I114-M128 CarbonylContact C-O 3.56Å; I114-M128 WeakPolarHBondContact CA-O 3.5Å
115	I	94.3	Very high	92.2	Very high	35 Å²	35	68.4 Å²	68.4	18%	0.179	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	128.1	167.1	-66.9	-67	0	0	0	107.9	I127 M128 K130 Y133	I115-I127 WeakPolarHBondContact O-CA 3.47Å; I115-M128 PolarHBondContact N-O 3.4Å; I115-M128 PolarHBondContact O-N 3.22Å; I115-K130 HydrophobicContact CD1-CG 4.2Å; I115-K130 HydrophobicContact CG1-CB 3.93Å; I115-K130 HydrophobicContact CG1-CG 3.98Å; I115-Y133 HydrophobicContact CB-CG 4.48Å; I115-Y133 HydrophobicContact CG1-CD1 4.37Å; I115-Y133 HydrophobicContact CG1-CG 4.39Å; I115-Y133 HydrophobicContact CG2-CD2 4.25Å; I115-Y133 HydrophobicContact CG2-CE2 4.46Å; I115-Y133 HydrophobicContact CG2-CG 4.3Å
116	I	94.4	Very high	92.2	Very high	57 Å²	57	65.6 Å²	65.6	29%	0.292	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	115	172.5	-55.8	172	0	0	0	106.8	L42 L46 L108 I114 T125 I127	L42-I116 HydrophobicContact CD2-CD1 4.19Å; L42-I116 HydrophobicContact CD2-CG2 4.11Å; L46-I116 HydrophobicContact CD2-CG2 4Å; L108-I116 HydrophobicContact CB-CD1 4.2Å; L108-I116 HydrophobicContact CD2-CD1 4.19Å; I114-I116 HydrophobicContact CD1-CD1 4.24Å; I114-I116 HydrophobicContact CD1-CG1 4.14Å; I116-T125 HydrophobicContact CG2-CG2 3.66Å; I116-I127 HydrophobicContact CG1-CG1 4.42Å; I116-I127 HydrophobicContact CG1-CG2 4.45Å
117	T	93	Very high	92.3	Very high	16 Å²	16	59.1 Å²	59.1	10%	0.098	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	172.7	-178	-167.8	0	0	0	0	111.1	V126 L198	T117-V126 HydrophobicContact CG2-CB 4.34Å; T117-V126 PolarHBondContact N-O 2.99Å; T117-V126 PolarHBondContact O-N 3.13Å; T117-L198 HydrophobicContact CG2-CD1 3.7Å; T117-L198 HydrophobicContact CG2-CG 4.13Å
118	K	92.2	Very high	92.4	Very high	78 Å²	78	55.7 Å²	55.7	34%	0.339	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	141.7	174.6	-165.6	179.7	170.5	166.6	0	110	L46 N123 L197	L46-K118 HydrophobicContact CD1-CB 4.19Å; K118-N123 WeakPolarHBondContact CE-OD1 3.32Å; K118-N123 PolarHBondContact NZ-OD1 2.97Å; K118-L197 HydrophobicContact CB-CD2 4.22Å
119	A	92.9	Very high	92.5	Very high	1 Å²	1	56.3 Å²	56.3	1%	0.008	29%	0.287	C	S	.	.	B	Isolated β-bridge	trans	-67.4	151.5	166.6	0	0	0	0	0	111.2	K121 T124 V126 L198 I200	A119-K121 VanDerWaalsContact C-N 3.27Å; A119-K121 WeakPolarHBondContact CB-O 3.47Å; A119-K121 PolarHBondContact O-N 2.86Å; A119-T124 PolarHBondContact N-O 3.02Å; A119-V126 HydrophobicContact CB-CG2 3.79Å; A119-L198 WeakPolarHBondContact CA-O 3.33Å; A119-I200 HydrophobicContact CB-CD1 3.94Å; A119-I200 HydrophobicContact CB-CG1 4.15Å; A119-I200 HydrophobicContact CB-CG2 4.47Å
120	D	90.3	Very high	92.7	Very high	29 Å²	29	49.1 Å²	49.1	16%	0.155	26%	0.262	C	S	.	.	S	Bend	trans	-59.9	-37.6	174.5	176.9	55.2	0	0	0	112.2	L197 L198 K199 H201 R208	D120-L197 HydrophobicContact CB-CB 4.17Å; D120-L198 PolarHBondContact N-O 3.32Å; D120-K199 HydrophobicContact CB-CG 3.95Å; D120-H201 IonicContact OD2-CE1 2.82Å; D120-R208 WeakPolarHBondContact OD1-CD 3.2Å; D120-R208 IonicContact OD1-CZ 2.67Å; D120-R208 IonicContact OD1-NE 3.59Å; D120-R208 IonicContact OD1-NH1 3.43Å; D120-R208 PolarHBondContact OD1-NH1 3.27Å
121	K	87.3	Confident	92.7	Very high	126 Å²	126	49.8 Å²	49.8	55%	0.548	26%	0.263	S	S	.	.	S	Bend	trans	-126.9	154.2	179.2	-63.2	-173.6	-175.3	168.9	0	111.2	A119 H201	A119-K121 VanDerWaalsContact C-N 3.27Å; A119-K121 WeakPolarHBondContact CB-O 3.47Å; A119-K121 PolarHBondContact O-N 2.86Å; K121-H201 VanDerWaalsContact CD-CE1 3.49Å; K121-H201 WeakPolarHBondContact CD-CE1 3.28Å; K121-H201 PolarHBondContact NZ-NE2 3.32Å
122	G	84.3	Confident	92.8	Very high	70 Å²	70	50.5 Å²	50.5	72%	0.722	27%	0.268	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.4	1.6	170	0	0	0	0	0	116.8	T124	G122-T124 PolarHBondContact O-N 3.44Å; G122-T124 VanDerWaalsContact O-N 3.09Å
123	N	85.2	Confident	92.9	Very high	85 Å²	85	42.9 Å²	42.9	46%	0.455	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	25.8	-176.3	-163.6	50.6	0	0	0	114	K118	K118-N123 WeakPolarHBondContact CE-OD1 3.32Å; K118-N123 PolarHBondContact NZ-OD1 2.97Å
124	T	90.4	Very high	92.9	Very high	9 Å²	9	40.4 Å²	40.4	6%	0.055	22%	0.216	C	C	.	.			trans	-77.5	138.2	180	-56.5	0	0	0	0	110.7	K24 V25 V27 A119 G122 V126 I200	K24-T124 WeakPolarHBondContact O-CB 3.31Å; K24-T124 WeakPolarHBondContact O-CG2 3.31Å; K24-T124 PolarHBondContact O-OG1 2.75Å; V25-T124 WeakPolarHBondContact O-CA 3.24Å; V27-T124 HydrophobicContact CB-CG2 4.25Å; V27-T124 HydrophobicContact CG2-CG2 3.67Å; A119-T124 PolarHBondContact N-O 3.02Å; G122-T124 PolarHBondContact O-N 3.44Å; G122-T124 VanDerWaalsContact O-N 3.09Å; T124-V126 HydrophobicContact CG2-CG2 4.39Å; T124-I200 HydrophobicContact CG2-CD1 3.92Å
125	T	93.1	Very high	92.9	Very high	2 Å²	2	45 Å²	45	1%	0.012	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	129.2	168.9	-56.3	0	0	0	0	108.4	V25 L26 V27 L42 L46 I116	V25-T125 PolarHBondContact O-N 2.88Å; L26-T125 WeakPolarHBondContact CA-O 3.42Å; L26-T125 HydrophobicContact CD1-CG2 4.1Å; V27-T125 PolarHBondContact N-O 3.25Å; L42-T125 HydrophobicContact CB-CG2 4.48Å; L42-T125 HydrophobicContact CD2-CG2 4.31Å; L42-T125 PolarHBondContact O-OG1 3.15Å; L46-T125 HydrophobicContact CD2-CG2 4.02Å; L46-T125 HydrophobicContact CG-CG2 4.31Å; I116-T125 HydrophobicContact CG2-CG2 3.66Å
126	V	93.3	Very high	93	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	129.8	179.4	-170.9	0	0	0	0	109	V27 L29 T117 A119 T124 L198 I200	V27-V126 WeakPolarHBondContact O-CA 3.47Å; L29-V126 HydrophobicContact CD1-CG1 3.87Å; L29-V126 HydrophobicContact CG-CG1 4.19Å; T117-V126 HydrophobicContact CG2-CB 4.34Å; T117-V126 PolarHBondContact N-O 2.99Å; T117-V126 PolarHBondContact O-N 3.13Å; A119-V126 HydrophobicContact CB-CG2 3.79Å; T124-V126 HydrophobicContact CG2-CG2 4.39Å; V126-L198 HydrophobicContact CB-CD1 3.94Å; V126-L198 HydrophobicContact CG1-CD1 3.44Å; V126-L198 VanDerWaalsContact CG1-CD1 3.44Å; V126-I200 HydrophobicContact CG1-CG2 4.4Å; V126-I200 HydrophobicContact CG2-CG2 3.75Å
127	I	94.6	Very high	93	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	133.7	169.9	-45.9	-175.8	0	0	0	107.5	L26 V27 L29 S30 L34 L42 I114 I115 I116	L26-I127 HydrophobicContact CD1-CD1 4.17Å; L26-I127 HydrophobicContact CD1-CG1 4.06Å; V27-I127 PolarHBondContact O-N 3.42Å; L29-I127 CarbonylContact C-O 3.52Å; L29-I127 WeakPolarHBondContact CA-O 3.19Å; L29-I127 WeakPolarHBondContact CB-O 3.48Å; L29-I127 PolarHBondContact N-O 2.98Å; S30-I127 WeakPolarHBondContact OG-CG2 3.39Å; L34-I127 HydrophobicContact CD1-CD1 3.32Å; L34-I127 HydrophobicContact CD2-CD1 3.69Å; L34-I127 HydrophobicContact CG-CD1 4.05Å; L42-I127 HydrophobicContact CD1-CD1 3.35Å; L42-I127 HydrophobicContact CD1-CG1 4.18Å; I114-I127 HydrophobicContact CB-CG2 3.98Å; I114-I127 HydrophobicContact CD1-CG2 3.91Å; I114-I127 HydrophobicContact CG2-CG2 4.25Å; I115-I127 WeakPolarHBondContact O-CA 3.47Å; I116-I127 HydrophobicContact CG1-CG1 4.42Å; I116-I127 HydrophobicContact CG1-CG2 4.45Å
128	M	95.3	Very high	93.1	Very high	6 Å²	6	45.9 Å²	45.9	3%	0.03	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141	149.7	179.3	-178.2	175.9	-82.3	0	0	109.1	L29 I114 I115 K130 D132 Y133 K136 L198	L29-M128 HydrophobicContact CB-CE 4.33Å; L29-M128 HydrophobicContact CD1-CE 3.65Å; I114-M128 CarbonylContact C-O 3.56Å; I114-M128 WeakPolarHBondContact CA-O 3.5Å; I115-M128 PolarHBondContact N-O 3.4Å; I115-M128 PolarHBondContact O-N 3.22Å; M128-K130 PolarHBondContact O-N 3.18Å; M128-D132 HydrophobicContact CG-CB 4.1Å; M128-D132 HydrophobicContact SD-CB 4.25Å; M128-Y133 HydrophobicContact SD-CD2 4.42Å; M128-K136 HydrophobicContact CE-CD 4.3Å; M128-K136 HydrophobicContact SD-CD 4.1Å; M128-L198 HydrophobicContact CB-CD1 4.37Å; M128-L198 HydrophobicContact CE-CD1 3.59Å; M128-L198 HydrophobicContact CE-CD2 3.61Å; M128-L198 HydrophobicContact CE-CG 4.28Å; M128-L198 HydrophobicContact SD-CD1 4.07Å; M128-L198 HydrophobicContact SD-CD2 4.08Å
129	N	96.5	Very high	93.2	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.118	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	134.9	168.2	-66.7	-31.9	0	0	0	109.8	S30 D31 I131 D132 Y133	S30-N129 WeakPolarHBondContact CA-OD1 3.26Å; S30-N129 WeakPolarHBondContact CB-OD1 3.11Å; D31-N129 PolarHBondContact N-OD1 3.4Å; D31-N129 VanDerWaalsContact N-OD1 3.1Å; D31-N129 PolarHBondContact OD2-ND2 2.82Å; N129-I131 PolarHBondContact O-N 3.1Å; N129-D132 HydrophobicContact CB-CB 4.27Å; N129-D132 WeakPolarHBondContact CB-OD2 3.49Å; N129-D132 PolarHBondContact ND2-OD2 2.94Å; N129-D132 PolarHBondContact O-N 3.36Å; N129-Y133 PolarHBondContact O-N 3.1Å
130	K	95.8	Very high	93.2	Very high	66 Å²	66	47.1 Å²	47.1	29%	0.287	24%	0.239	S	C	.	.	H	α-helix	trans	-59.2	-38.3	-179.7	179.3	-179.5	168.5	-166.5	0	111.7	K112 T113 I115 M128 Y133 E134	K112-K130 WeakPolarHBondContact O-CD 3.4Å; T113-K130 WeakPolarHBondContact O-CB 3.22Å; T113-K130 PolarHBondContact O-N 2.92Å; I115-K130 HydrophobicContact CD1-CG 4.2Å; I115-K130 HydrophobicContact CG1-CB 3.93Å; I115-K130 HydrophobicContact CG1-CG 3.98Å; M128-K130 PolarHBondContact O-N 3.18Å; K130-Y133 PolarHBondContact O-N 3.14Å; K130-E134 WeakPolarHBondContact CE-OE1 3.49Å; K130-E134 HydrophobicContact CG-CG 4.34Å; K130-E134 IonicContact NZ-OE1 3.97Å; K130-E134 WeakPolarHBondContact O-CB 3.5Å; K130-E134 VanDerWaalsContact O-CG 3.31Å; K130-E134 WeakPolarHBondContact O-CG 3.5Å; K130-E134 PolarHBondContact O-N 2.85Å
131	I	96.1	Very high	93.4	Very high	135 Å²	135	46 Å²	46	69%	0.692	23%	0.233	S	C	*	.	H	α-helix	trans	-61.4	-47.9	178.7	-62.3	172.6	0	0	0	110.2	N129 Y133 E134 R135	N129-I131 PolarHBondContact O-N 3.1Å; I131-Y133 PolarHBondContact O-N 3.1Å; I131-E134 PolarHBondContact O-N 3.5Å; I131-R135 WeakPolarHBondContact O-CB 3.34Å; I131-R135 PolarHBondContact O-N 3.09Å
132	D	95.3	Very high	93.7	Very high	53 Å²	53	47.7 Å²	47.7	28%	0.283	24%	0.243	S	C	.	.	H	α-helix	trans	-63.9	-42.3	179	-70	-45	0	0	0	112.5	M128 N129 R135 K136	M128-D132 HydrophobicContact CG-CB 4.1Å; M128-D132 HydrophobicContact SD-CB 4.25Å; N129-D132 HydrophobicContact CB-CB 4.27Å; N129-D132 WeakPolarHBondContact CB-OD2 3.49Å; N129-D132 PolarHBondContact ND2-OD2 2.94Å; N129-D132 PolarHBondContact O-N 3.36Å; D132-R135 PolarHBondContact O-N 3.41Å; D132-R135 IonicContact OD1-NH2 2.71Å; D132-K136 WeakPolarHBondContact O-CB 3.36Å; D132-K136 VanDerWaalsContact O-CG 3.3Å; D132-K136 WeakPolarHBondContact O-CG 3.11Å; D132-K136 PolarHBondContact O-N 3.4Å
133	Y	96	Very high	94	Very high	12 Å²	12	52.4 Å²	52.4	5%	0.047	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-44.7	175.8	178.8	-86.6	0	0	0	111.6	I115 M128 N129 K130 I131 A137 G196 L207 F318	I115-Y133 HydrophobicContact CB-CG 4.48Å; I115-Y133 HydrophobicContact CG1-CD1 4.37Å; I115-Y133 HydrophobicContact CG1-CG 4.39Å; I115-Y133 HydrophobicContact CG2-CD2 4.25Å; I115-Y133 HydrophobicContact CG2-CE2 4.46Å; I115-Y133 HydrophobicContact CG2-CG 4.3Å; M128-Y133 HydrophobicContact SD-CD2 4.42Å; N129-Y133 PolarHBondContact O-N 3.1Å; K130-Y133 PolarHBondContact O-N 3.14Å; I131-Y133 PolarHBondContact O-N 3.1Å; Y133-A137 WeakPolarHBondContact O-CB 3.24Å; Y133-A137 PolarHBondContact O-N 3.31Å; Y133-G196 PolarHBondContact OH-N 3.26Å; Y133-L207 HydrophobicContact CD2-CD2 3.93Å; Y133-L207 HydrophobicContact CE2-CD2 3.6Å; Y133-F318 HydrophobicContact CE1-CE2 4.33Å
134	E	95.6	Very high	94.1	Very high	36 Å²	36	49.1 Å²	49.1	17%	0.168	23%	0.232	C	C	.	.	H	α-helix	trans	-68	-38.3	178.9	-75.1	179.6	-179.6	0	0	112.4	K130 I131 A137 K138 F318 R319	K130-E134 WeakPolarHBondContact CE-OE1 3.49Å; K130-E134 HydrophobicContact CG-CG 4.34Å; K130-E134 IonicContact NZ-OE1 3.97Å; K130-E134 WeakPolarHBondContact O-CB 3.5Å; K130-E134 VanDerWaalsContact O-CG 3.31Å; K130-E134 WeakPolarHBondContact O-CG 3.5Å; K130-E134 PolarHBondContact O-N 2.85Å; I131-E134 PolarHBondContact O-N 3.5Å; E134-A137 PolarHBondContact O-N 2.86Å; E134-K138 WeakPolarHBondContact O-CB 3.49Å; E134-K138 VanDerWaalsContact O-CG 3.31Å; E134-K138 WeakPolarHBondContact O-CG 3.26Å; E134-K138 PolarHBondContact O-N 2.91Å; E134-F318 HydrophobicContact CG-CZ 4.29Å; E134-R319 HydrophobicContact CG-CG 4.45Å; E134-R319 WeakPolarHBondContact OE1-CD 3.35Å; E134-R319 IonicContact OE1-CZ 3.49Å; E134-R319 IonicContact OE1-NE 2.63Å; E134-R319 PolarHBondContact OE1-NE 3.28Å; E134-R319 IonicContact OE1-NH1 3.98Å; E134-R319 IonicContact OE1-NH2 3.43Å
135	R	95.7	Very high	94.1	Very high	107 Å²	107	50.1 Å²	50.1	40%	0.404	24%	0.239	S	C	.	.	H	α-helix	trans	-59.5	-54.1	173.6	-178	-176.3	58.7	74.6	-2.3	110.8	I131 D132 A137 K138 E139	I131-R135 WeakPolarHBondContact O-CB 3.34Å; I131-R135 PolarHBondContact O-N 3.09Å; D132-R135 PolarHBondContact O-N 3.41Å; D132-R135 IonicContact OD1-NH2 2.71Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 2.94Å; R135-K138 PolarHBondContact O-N 2.63Å; R135-K138 VanDerWaalsContact O-N 3.11Å; R135-E139 VanDerWaalsContact CG-OE1 3.27Å; R135-E139 WeakPolarHBondContact CG-OE1 3.13Å; R135-E139 IonicContact CZ-OE1 3.22Å; R135-E139 VanDerWaalsContact NH1-CD 3.25Å; R135-E139 IonicContact NH1-OE1 3.41Å; R135-E139 PolarHBondContact NH1-OE1 2.96Å; R135-E139 IonicContact NH1-OE2 3.53Å; R135-E139 PolarHBondContact NH1-OE2 2.89Å; R135-E139 WeakPolarHBondContact O-CG 3.35Å; R135-E139 PolarHBondContact O-N 2.64Å
136	K	95.4	Very high	94.2	Very high	29 Å²	29	50.9 Å²	50.9	13%	0.126	24%	0.242	C	C	.	.	H	α-helix	trans	-56.2	-40.7	176.9	-73.8	167.9	170.5	-75.1	0	112.6	M128 D132 H140 S204 T205 L207	M128-K136 HydrophobicContact CE-CD 4.3Å; M128-K136 HydrophobicContact SD-CD 4.1Å; D132-K136 WeakPolarHBondContact O-CB 3.36Å; D132-K136 VanDerWaalsContact O-CG 3.3Å; D132-K136 WeakPolarHBondContact O-CG 3.11Å; D132-K136 PolarHBondContact O-N 3.4Å; K136-H140 PolarHBondContact O-N 3.32Å; K136-H140 VanDerWaalsContact O-N 3.11Å; K136-S204 PolarHBondContact NZ-O 3.01Å; K136-T205 PolarHBondContact NZ-O 2.84Å; K136-L207 HydrophobicContact CB-CD1 3.55Å; K136-L207 HydrophobicContact CB-CG 4.05Å
137	A	95.4	Very high	94.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-67.9	-41	178.9	0	0	0	0	0	111.7	Y133 E134 R135 L141 F194 L207 F318	Y133-A137 WeakPolarHBondContact O-CB 3.24Å; Y133-A137 PolarHBondContact O-N 3.31Å; E134-A137 PolarHBondContact O-N 2.86Å; R135-A137 VanDerWaalsContact C-N 3.27Å; R135-A137 PolarHBondContact O-N 2.94Å; A137-L141 WeakPolarHBondContact O-CB 3.35Å; A137-L141 WeakPolarHBondContact O-CG 3.45Å; A137-L141 PolarHBondContact O-N 3.32Å; A137-F194 HydrophobicContact CB-CE1 4.05Å; A137-L207 HydrophobicContact CB-CD1 3.84Å; A137-L207 VanDerWaalsContact N-CD1 3.34Å; A137-F318 HydrophobicContact CB-CE1 3.69Å; A137-F318 HydrophobicContact CB-CE2 3.89Å; A137-F318 HydrophobicContact CB-CZ 3.28Å
138	K	94.9	Very high	94.3	Very high	97 Å²	97	58.8 Å²	58.8	42%	0.422	28%	0.281	S	S	.	.	H	α-helix	trans	-66.4	-43.2	176.2	-75.2	178.1	178.1	-176.1	0	112	E134 R135 H140 L141 Q142 F318	E134-K138 WeakPolarHBondContact O-CB 3.49Å; E134-K138 VanDerWaalsContact O-CG 3.31Å; E134-K138 WeakPolarHBondContact O-CG 3.26Å; E134-K138 PolarHBondContact O-N 2.91Å; R135-K138 PolarHBondContact O-N 2.63Å; R135-K138 VanDerWaalsContact O-N 3.11Å; K138-H140 PolarHBondContact O-N 3.33Å; K138-L141 PolarHBondContact O-N 2.85Å; K138-Q142 WeakPolarHBondContact O-CB 3.39Å; K138-Q142 VanDerWaalsContact O-CG 3.27Å; K138-Q142 WeakPolarHBondContact O-CG 3.25Å; K138-Q142 PolarHBondContact O-N 3.43Å; K138-F318 HydrophobicContact CG-CE1 4.25Å
139	E	94.3	Very high	94.2	Very high	77 Å²	77	59 Å²	59	36%	0.36	28%	0.283	S	S	.	.	H	α-helix	trans	-54.7	-52.1	174.2	-73.5	165.1	-179.4	0	0	110.5	R135 L141 Q142 E143	R135-E139 VanDerWaalsContact CG-OE1 3.27Å; R135-E139 WeakPolarHBondContact CG-OE1 3.13Å; R135-E139 IonicContact CZ-OE1 3.22Å; R135-E139 VanDerWaalsContact NH1-CD 3.25Å; R135-E139 IonicContact NH1-OE1 3.41Å; R135-E139 PolarHBondContact NH1-OE1 2.96Å; R135-E139 IonicContact NH1-OE2 3.53Å; R135-E139 PolarHBondContact NH1-OE2 2.89Å; R135-E139 WeakPolarHBondContact O-CG 3.35Å; R135-E139 PolarHBondContact O-N 2.64Å; E139-L141 VanDerWaalsContact C-N 3.33Å; E139-L141 PolarHBondContact O-N 3.13Å; E139-Q142 PolarHBondContact O-N 2.92Å; E139-Q142 VanDerWaalsContact O-N 3.11Å; E139-E143 WeakPolarHBondContact O-CG 3.23Å; E139-E143 PolarHBondContact O-N 3.02Å
140	H	92.6	Very high	94	Very high	29 Å²	29	65.6 Å²	65.6	13%	0.134	31%	0.31	C	S	.	.	H	α-helix	trans	-57.9	-42.6	175.9	-177.7	90.1	0	0	0	113	K136 K138 Q142 G144 Y146 P209	K136-H140 PolarHBondContact O-N 3.32Å; K136-H140 VanDerWaalsContact O-N 3.11Å; K138-H140 PolarHBondContact O-N 3.33Å; H140-Q142 VanDerWaalsContact C-N 3.29Å; H140-Q142 PolarHBondContact O-N 3.46Å; H140-G144 PolarHBondContact O-N 3.37Å; H140-Y146 AromaticContact CD2-CE2 3.58Å; H140-Y146 AromaticContact NE2-CE2 3.35Å; H140-Y146 WeakPolarHBondContact NE2-CE2 3.26Å; H140-Y146 AromaticContact NE2-CZ 3.8Å; H140-Y146 PolarHBondContact NE2-OH 3.44Å; H140-P209 WeakPolarHBondContact NE2-CG 3.47Å
141	L	94.2	Very high	93.7	Very high	6 Å²	6	68 Å²	68	3%	0.031	33%	0.326	C	S	.	.	H	α-helix	trans	-68.9	-28.3	179.5	-70.8	170.2	0	0	0	112.8	A137 K138 E139 Y146 F194 F316 F318 Y323	A137-L141 WeakPolarHBondContact O-CB 3.35Å; A137-L141 WeakPolarHBondContact O-CG 3.45Å; A137-L141 PolarHBondContact O-N 3.32Å; K138-L141 PolarHBondContact O-N 2.85Å; E139-L141 VanDerWaalsContact C-N 3.33Å; E139-L141 PolarHBondContact O-N 3.13Å; L141-Y146 HydrophobicContact CD2-CD1 4.49Å; L141-Y146 HydrophobicContact CD2-CD2 3.8Å; L141-Y146 HydrophobicContact CD2-CE2 4.24Å; L141-Y146 HydrophobicContact CD2-CG 3.93Å; L141-F194 HydrophobicContact CD2-CD2 4.4Å; L141-F194 HydrophobicContact CD2-CE2 4.15Å; L141-F194 HydrophobicContact CD2-CZ 4.34Å; L141-F194 HydrophobicContact CG-CZ 4.48Å; L141-F316 HydrophobicContact CD2-CE2 3.6Å; L141-F316 HydrophobicContact CD2-CZ 3.69Å; L141-F318 HydrophobicContact CD1-CB 4.01Å; L141-F318 HydrophobicContact CD1-CD1 3.68Å; L141-F318 HydrophobicContact CD1-CE1 4.43Å; L141-F318 HydrophobicContact CD1-CG 3.98Å; L141-Y323 HydrophobicContact CB-CE1 4.29Å; L141-Y323 HydrophobicContact CD1-CD2 4.43Å; L141-Y323 HydrophobicContact CD1-CE1 4.3Å; L141-Y323 HydrophobicContact CD1-CE2 3.98Å
142	Q	93.4	Very high	93.4	Very high	161 Å²	161	66.1 Å²	66.1	75%	0.752	33%	0.331	S	S	*	.	H	α-helix	trans	-78.9	-40.6	176.9	-74.5	172.4	-14.8	0	0	112.4	K138 E139 H140 G144	K138-Q142 WeakPolarHBondContact O-CB 3.39Å; K138-Q142 VanDerWaalsContact O-CG 3.27Å; K138-Q142 WeakPolarHBondContact O-CG 3.25Å; K138-Q142 PolarHBondContact O-N 3.43Å; E139-Q142 PolarHBondContact O-N 2.92Å; E139-Q142 VanDerWaalsContact O-N 3.11Å; H140-Q142 VanDerWaalsContact C-N 3.29Å; H140-Q142 PolarHBondContact O-N 3.46Å; Q142-G144 PolarHBondContact O-N 3.11Å
143	E	91.1	Very high	93.1	Very high	168 Å²	168	70 Å²	70	79%	0.785	35%	0.345	S	S	*	.	H	α-helix	trans	-59.2	-36.6	173.3	-72.7	175.6	-175.9	0	0	111.4	E139	E139-E143 WeakPolarHBondContact O-CG 3.23Å; E139-E143 PolarHBondContact O-N 3.02Å
144	G	86.5	Confident	92.8	Very high	17 Å²	17	70.8 Å²	70.8	18%	0.175	35%	0.352	C	S	.	.	S	Bend	trans	100.6	-167.5	168.5	0	0	0	0	0	114.3	H140 Q142 Y146	H140-G144 PolarHBondContact O-N 3.37Å; Q142-G144 PolarHBondContact O-N 3.11Å; G144-Y146 WeakPolarHBondContact O-CE2 3.23Å
145	P	92	Very high	92.5	Very high	29 Å²	29	77.7 Å²	77.7	19%	0.188	38%	0.377	C	S	.	.	S	Bend	cis	-87.9	59	7.8	36.7	-38.2	0	0	0	113	Q325 K326 E327	P145-Q325 HydrophobicContact CG-CG 4.36Å; P145-K326 PolarHBondContact O-N 2.9Å; P145-E327 HydrophobicContact CB-CB 3.94Å; P145-E327 HydrophobicContact CG-CB 4.28Å; P145-E327 WeakPolarHBondContact CG-O 3.38Å
146	Y	94.2	Very high	92.4	Very high	19 Å²	19	77 Å²	77	8%	0.075	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	154.4	-176.1	-49.3	-74.1	0	0	0	111.4	H140 L141 G144 F316 R324 Q325	H140-Y146 AromaticContact CD2-CE2 3.58Å; H140-Y146 AromaticContact NE2-CE2 3.35Å; H140-Y146 WeakPolarHBondContact NE2-CE2 3.26Å; H140-Y146 AromaticContact NE2-CZ 3.8Å; H140-Y146 PolarHBondContact NE2-OH 3.44Å; L141-Y146 HydrophobicContact CD2-CD1 4.49Å; L141-Y146 HydrophobicContact CD2-CD2 3.8Å; L141-Y146 HydrophobicContact CD2-CE2 4.24Å; L141-Y146 HydrophobicContact CD2-CG 3.93Å; G144-Y146 WeakPolarHBondContact O-CE2 3.23Å; Y146-F316 AromaticContact CD1-CE1 3.62Å; Y146-F316 HydrophobicContact CD1-CE1 3.62Å; Y146-F316 AromaticContact CD1-CZ 3.42Å; Y146-F316 HydrophobicContact CD1-CZ 3.42Å; Y146-F316 VanDerWaalsContact CD1-CZ 3.42Å; Y146-F316 AromaticContact CE1-CE1 3.78Å; Y146-F316 HydrophobicContact CE1-CE1 3.78Å; Y146-F316 AromaticContact CE1-CZ 3.75Å; Y146-F316 HydrophobicContact CE1-CZ 3.75Å; Y146-F316 HydrophobicContact CG-CZ 4.04Å; Y146-R324 CarbonylContact C-O 3.58Å; Y146-R324 WeakPolarHBondContact CA-O 3.35Å; Y146-Q325 HydrophobicContact CD1-CB 3.87Å; Y146-Q325 HydrophobicContact CD1-CG 4.09Å; Y146-Q325 HydrophobicContact CE1-CB 3.97Å; Y146-Q325 HydrophobicContact CE1-CG 3.88Å
147	E	94.2	Very high	92.2	Very high	71 Å²	71	77.4 Å²	77.4	33%	0.332	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	127.3	176.4	-177.6	-170.1	169.6	0	0	109	I149 Y323 R324 K326	E147-I149 PolarHBondContact O-N 3.02Å; E147-Y323 CarbonylContact O-C 3.53Å; E147-Y323 VanDerWaalsContact O-CA 3.25Å; E147-Y323 WeakPolarHBondContact O-CA 3.35Å; E147-R324 PolarHBondContact N-O 3.39Å; E147-R324 PolarHBondContact O-N 2.92Å; E147-R324 IonicContact OE1-NH2 2.69Å; E147-R324 IonicContact OE2-CZ 3.21Å; E147-R324 IonicContact OE2-NE 3.98Å; E147-R324 PolarHBondContact OE2-NE 3.29Å; E147-R324 IonicContact OE2-NH2 2.7Å; E147-R324 PolarHBondContact OE2-NH2 3.48Å; E147-K326 HydrophobicContact CB-CD 3.85Å; E147-K326 HydrophobicContact CB-CG 3.91Å; E147-K326 HydrophobicContact CG-CD 4.5Å
148	L	95	Very high	92	Very high	95 Å²	95	77.8 Å²	77.8	50%	0.497	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.5	171.4	178.7	64.4	0	0	0	109.9	D321 Y323	L148-D321 HydrophobicContact CD1-CB 3.74Å; L148-Y323 HydrophobicContact CB-CD1 4.22Å; L148-Y323 HydrophobicContact CB-CE1 3.94Å; L148-Y323 HydrophobicContact CD1-CD1 4.26Å; L148-Y323 HydrophobicContact CD1-CE1 3.75Å; L148-Y323 HydrophobicContact CD1-CE2 4.22Å; L148-Y323 HydrophobicContact CG-CE1 4.43Å
149	I	93.7	Very high	91.8	Very high	11 Å²	11	76.8 Å²	76.8	6%	0.056	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	122.6	174.7	-63.6	171.8	0	0	0	108.4	E147 D151 K153 T157 L315 Q322 R324	E147-I149 PolarHBondContact O-N 3.02Å; I149-D151 PolarHBondContact O-N 2.95Å; I149-K153 HydrophobicContact CG2-CB 4.2Å; I149-T157 HydrophobicContact CD1-CG2 3.94Å; I149-L315 HydrophobicContact CD1-CD2 3.65Å; I149-Q322 HydrophobicContact CB-CB 4.31Å; I149-Q322 HydrophobicContact CB-CG 4.45Å; I149-Q322 WeakPolarHBondContact CB-O 2.96Å; I149-Q322 HydrophobicContact CD1-CG 4.11Å; I149-Q322 PolarHBondContact N-O 2.84Å; I149-R324 HydrophobicContact CD1-CB 3.85Å; I149-R324 HydrophobicContact CG1-CB 4.33Å
150	K	92.6	Very high	91.7	Very high	159 Å²	159	80.2 Å²	80.2	69%	0.691	41%	0.405	S	S	*	.	P	Polyproline II helix	trans	-56	137	173.6	-61	-173.4	179.1	-172.6	0	111.2	A152 K153 S154	K150-A152 VanDerWaalsContact C-N 3.27Å; K150-A152 PolarHBondContact O-N 3.12Å; K150-A152 VanDerWaalsContact O-N 3.15Å; K150-K153 WeakPolarHBondContact O-CA 3.19Å; K150-K153 PolarHBondContact O-N 3.48Å; K150-S154 PolarHBondContact O-N 3.32Å; K150-S154 VanDerWaalsContact O-N 3.16Å
151	D	89	Confident	91.7	Very high	116 Å²	116	79.3 Å²	79.3	62%	0.62	40%	0.401	S	S	*	.	H	α-helix	trans	-52	-41.9	-177.5	-67	-25.2	0	0	0	113.7	I149 K153 S154	I149-D151 PolarHBondContact O-N 2.95Å; D151-K153 PolarHBondContact O-N 3.37Å; D151-K153 VanDerWaalsContact O-N 3.1Å; D151-S154 WeakPolarHBondContact O-CB 3.25Å; D151-S154 PolarHBondContact O-N 3.48Å
152	A	89.4	Confident	91.7	Very high	96 Å²	96	82.3 Å²	82.3	79%	0.793	41%	0.414	S	S	*	.	H	α-helix	trans	-57.9	-26.2	176.7	0	0	0	0	0	113.8	K150	K150-A152 VanDerWaalsContact C-N 3.27Å; K150-A152 PolarHBondContact O-N 3.12Å; K150-A152 VanDerWaalsContact O-N 3.15Å
153	K	90.6	Very high	91.7	Very high	134 Å²	134	77.6 Å²	77.6	58%	0.583	40%	0.402	S	S	*	.	H	α-helix	trans	-99.4	-10.9	177.8	-64.7	-173.6	178.7	-176.6	0	113	I149 K150 D151 R155 T156 T157	I149-K153 HydrophobicContact CG2-CB 4.2Å; K150-K153 WeakPolarHBondContact O-CA 3.19Å; K150-K153 PolarHBondContact O-N 3.48Å; D151-K153 PolarHBondContact O-N 3.37Å; D151-K153 VanDerWaalsContact O-N 3.1Å; K153-R155 PolarHBondContact O-N 3.45Å; K153-T156 PolarHBondContact O-N 3.38Å; K153-T157 PolarHBondContact O-N 3.4Å; K153-T157 PolarHBondContact O-OG1 3.17Å
154	S	88.7	Confident	91.9	Very high	29 Å²	29	73.9 Å²	73.9	20%	0.203	39%	0.385	C	S	.	.	H	α-helix	trans	-51.4	-57.6	-172.9	173.9	0	0	0	0	112.1	K150 D151 T156 T157 V158 Q322	K150-S154 PolarHBondContact O-N 3.32Å; K150-S154 VanDerWaalsContact O-N 3.16Å; D151-S154 WeakPolarHBondContact O-CB 3.25Å; D151-S154 PolarHBondContact O-N 3.48Å; S154-T156 PolarHBondContact O-N 3.03Å; S154-T157 PolarHBondContact O-N 2.96Å; S154-V158 WeakPolarHBondContact O-CG2 3.36Å; S154-V158 PolarHBondContact O-N 3.41Å; S154-Q322 PolarHBondContact O-NE2 3.38Å; S154-Q322 PolarHBondContact OG-OE1 2.84Å
155	R	90.1	Very high	92.3	Very high	182 Å²	182	73.1 Å²	73.1	69%	0.687	38%	0.377	S	S	*	.	H	α-helix	trans	-66.7	-36.3	-179.9	-171.7	153.5	-178.2	84.6	-2.8	113.2	K153 V158 N159	K153-R155 PolarHBondContact O-N 3.45Å; R155-V158 PolarHBondContact O-N 3.42Å; R155-N159 WeakPolarHBondContact O-CB 3.46Å; R155-N159 VanDerWaalsContact O-CG 3.25Å; R155-N159 PolarHBondContact O-N 2.83Å; R155-N159 PolarHBondContact O-ND2 3.32Å
156	T	92.3	Very high	92.4	Very high	93 Å²	93	73.2 Å²	73.2	57%	0.571	38%	0.378	S	S	*	.	H	α-helix	trans	-65.5	-42.2	178.1	-55.3	0	0	0	0	111.5	K153 S154 N159 K160	K153-T156 PolarHBondContact O-N 3.38Å; S154-T156 PolarHBondContact O-N 3.03Å; T156-N159 PolarHBondContact O-N 3.45Å; T156-K160 VanDerWaalsContact O-CB 3.26Å; T156-K160 WeakPolarHBondContact O-CB 2.99Å; T156-K160 PolarHBondContact O-N 3.31Å
157	T	91.6	Very high	92.5	Very high	37 Å²	37	80.2 Å²	80.2	23%	0.227	41%	0.409	C	S	.	.	H	α-helix	trans	-62.4	-44.4	177.4	-59.6	0	0	0	0	111.7	I149 K153 S154 K160 L161 L315	I149-T157 HydrophobicContact CD1-CG2 3.94Å; K153-T157 PolarHBondContact O-N 3.4Å; K153-T157 PolarHBondContact O-OG1 3.17Å; S154-T157 PolarHBondContact O-N 2.96Å; T157-K160 PolarHBondContact O-N 3.3Å; T157-L161 PolarHBondContact O-N 3.04Å; T157-L315 HydrophobicContact CG2-CD1 4.04Å; T157-L315 HydrophobicContact CG2-CD2 4.09Å
158	V	90.9	Very high	92.5	Very high	8 Å²	8	77.6 Å²	77.6	5%	0.048	40%	0.397	C	S	.	.	H	α-helix	trans	-61.2	-48	176	166.5	0	0	0	0	111.4	S154 R155 L161 K162 C189 P191 L315	S154-V158 WeakPolarHBondContact O-CG2 3.36Å; S154-V158 PolarHBondContact O-N 3.41Å; R155-V158 PolarHBondContact O-N 3.42Å; V158-L161 PolarHBondContact O-N 3.3Å; V158-K162 PolarHBondContact O-N 3.08Å; V158-C189 HydrophobicContact CG1-CB 3.83Å; V158-C189 WeakPolarHBondContact CG1-SG 3.47Å; V158-P191 HydrophobicContact CG2-CG 3.48Å; V158-P191 VanDerWaalsContact CG2-CG 3.48Å; V158-L315 HydrophobicContact CG2-CD1 4.2Å
159	N	91.8	Very high	92.6	Very high	76 Å²	76	73.1 Å²	73.1	41%	0.406	37%	0.374	S	S	.	.	H	α-helix	trans	-66	-39.5	178.5	-73.3	-17.8	0	0	0	112.1	R155 T156 K162 A163	R155-N159 WeakPolarHBondContact O-CB 3.46Å; R155-N159 VanDerWaalsContact O-CG 3.25Å; R155-N159 PolarHBondContact O-N 2.83Å; R155-N159 PolarHBondContact O-ND2 3.32Å; T156-N159 PolarHBondContact O-N 3.45Å; N159-K162 PolarHBondContact O-N 3.17Å; N159-A163 WeakPolarHBondContact O-CB 3.33Å; N159-A163 PolarHBondContact O-N 3.25Å
160	K	92.9	Very high	92.6	Very high	148 Å²	148	78.5 Å²	78.5	64%	0.643	40%	0.398	S	S	*	.	H	α-helix	trans	-59.6	-48	175.4	-178.4	179	176.9	-179.1	0	110.7	T156 T157 K162 A163 E164	T156-K160 VanDerWaalsContact O-CB 3.26Å; T156-K160 WeakPolarHBondContact O-CB 2.99Å; T156-K160 PolarHBondContact O-N 3.31Å; T157-K160 PolarHBondContact O-N 3.3Å; K160-K162 PolarHBondContact O-N 3.45Å; K160-A163 PolarHBondContact O-N 2.54Å; K160-E164 WeakPolarHBondContact O-CB 3.24Å; K160-E164 PolarHBondContact O-N 3.48Å
161	L	92.5	Very high	92.7	Very high	11 Å²	11	74.8 Å²	74.8	6%	0.058	39%	0.392	C	S	.	.	H	α-helix	trans	-60	-45.2	177.1	173.7	57.7	0	0	0	112	T157 V158 A163 E164 T165 P217 T218 L309 S313 L315	T157-L161 PolarHBondContact O-N 3.04Å; V158-L161 PolarHBondContact O-N 3.3Å; L161-A163 VanDerWaalsContact C-N 3.33Å; L161-A163 PolarHBondContact O-N 2.94Å; L161-E164 PolarHBondContact O-N 3.45Å; L161-T165 WeakPolarHBondContact O-CB 3.39Å; L161-T165 PolarHBondContact O-N 3.14Å; L161-T165 PolarHBondContact O-OG1 3.13Å; L161-P217 HydrophobicContact CD2-CG 3.94Å; L161-P217 HydrophobicContact CG-CB 4.23Å; L161-P217 HydrophobicContact CG-CG 3.93Å; L161-T218 HydrophobicContact CD1-CG2 4.47Å; L161-L309 HydrophobicContact CD1-CD1 4.11Å; L161-S313 WeakPolarHBondContact CD1-OG 3.37Å; L161-L315 HydrophobicContact CD2-CD1 3.76Å; L161-L315 HydrophobicContact CD2-CG 4.3Å
162	K	93.1	Very high	93	Very high	69 Å²	69	69.7 Å²	69.7	30%	0.3	37%	0.365	S	S	.	.	H	α-helix	trans	-59.3	-45	176	-177.6	-178.9	173.2	179.3	0	111.4	V158 N159 K160 S166 P186 K187 C189 P217	V158-K162 PolarHBondContact O-N 3.08Å; N159-K162 PolarHBondContact O-N 3.17Å; K160-K162 PolarHBondContact O-N 3.45Å; K162-S166 WeakPolarHBondContact O-CB 3.34Å; K162-S166 PolarHBondContact O-N 3.34Å; K162-S166 PolarHBondContact O-OG 3.22Å; K162-P186 WeakPolarHBondContact CE-O 3.32Å; K162-P186 HydrophobicContact CG-CB 4.25Å; K162-P186 HydrophobicContact CG-CG 3.97Å; K162-K187 PolarHBondContact NZ-O 3.3Å; K162-C189 HydrophobicContact CB-CB 4.24Å; K162-C189 HydrophobicContact CD-CB 4.33Å; K162-P217 HydrophobicContact CB-CG 4.39Å
163	A	94.1	Very high	93.2	Very high	61 Å²	61	68.3 Å²	68.3	50%	0.504	34%	0.341	S	S	.	.	H	α-helix	trans	-65.1	-43.4	179.7	0	0	0	0	0	111.8	N159 K160 L161 S166 K167	N159-A163 WeakPolarHBondContact O-CB 3.33Å; N159-A163 PolarHBondContact O-N 3.25Å; K160-A163 PolarHBondContact O-N 2.54Å; L161-A163 VanDerWaalsContact C-N 3.33Å; L161-A163 PolarHBondContact O-N 2.94Å; A163-S166 PolarHBondContact O-N 3.1Å; A163-K167 WeakPolarHBondContact O-CB 3.46Å; A163-K167 PolarHBondContact O-N 2.93Å
164	E	94.4	Very high	93.4	Very high	91 Å²	91	69.6 Å²	69.6	43%	0.425	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-47.1	176.9	-176	172.9	-174	0	0	111.9	K160 L161 S166 K167 I168 L309	K160-E164 WeakPolarHBondContact O-CB 3.24Å; K160-E164 PolarHBondContact O-N 3.48Å; L161-E164 PolarHBondContact O-N 3.45Å; E164-S166 VanDerWaalsContact C-N 3.32Å; E164-S166 PolarHBondContact O-N 3.21Å; E164-K167 WeakPolarHBondContact O-CB 3.47Å; E164-K167 PolarHBondContact O-N 3.38Å; E164-I168 PolarHBondContact O-N 3.01Å; E164-L309 HydrophobicContact CG-CD1 3.93Å
165	T	94.6	Very high	93.6	Very high	0 Å²	0	72.7 Å²	72.7	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-57.2	-47.1	174.4	-52.4	0	0	0	0	110.9	L161 K167 I168 L169 P186 P217 T218 L309	L161-T165 WeakPolarHBondContact O-CB 3.39Å; L161-T165 PolarHBondContact O-N 3.14Å; L161-T165 PolarHBondContact O-OG1 3.13Å; T165-K167 VanDerWaalsContact C-N 3.34Å; T165-K167 PolarHBondContact O-N 2.95Å; T165-I168 PolarHBondContact O-N 3.14Å; T165-L169 HydrophobicContact CG2-CD1 4.01Å; T165-L169 WeakPolarHBondContact O-CB 3.3Å; T165-L169 WeakPolarHBondContact O-CG 3.36Å; T165-L169 PolarHBondContact O-N 2.56Å; T165-P186 HydrophobicContact CG2-CG 3.96Å; T165-P217 HydrophobicContact CG2-CB 4.5Å; T165-T218 HydrophobicContact CG2-CG2 4.32Å; T165-L309 HydrophobicContact CG2-CD2 4.03Å
166	S	94.9	Very high	93.8	Very high	31 Å²	31	64.7 Å²	64.7	22%	0.217	33%	0.333	C	S	.	.	H	α-helix	trans	-64.6	-38.6	179.8	-54.2	0	0	0	0	111.8	K162 A163 E164 H170	K162-S166 WeakPolarHBondContact O-CB 3.34Å; K162-S166 PolarHBondContact O-N 3.34Å; K162-S166 PolarHBondContact O-OG 3.22Å; A163-S166 PolarHBondContact O-N 3.1Å; E164-S166 VanDerWaalsContact C-N 3.32Å; E164-S166 PolarHBondContact O-N 3.21Å; S166-H170 WeakPolarHBondContact O-CB 3.38Å; S166-H170 PolarHBondContact O-N 3.16Å
167	K	95.7	Very high	93.8	Very high	166 Å²	166	61.6 Å²	61.6	72%	0.722	32%	0.32	S	S	*	.	H	α-helix	trans	-63.5	-47.6	177.8	-176.2	-178	-179.8	-178.5	0	111.5	A163 E164 T165 H170 S171	A163-K167 WeakPolarHBondContact O-CB 3.46Å; A163-K167 PolarHBondContact O-N 2.93Å; E164-K167 WeakPolarHBondContact O-CB 3.47Å; E164-K167 PolarHBondContact O-N 3.38Å; T165-K167 VanDerWaalsContact C-N 3.34Å; T165-K167 PolarHBondContact O-N 2.95Å; K167-H170 PolarHBondContact O-N 2.99Å; K167-S171 PolarHBondContact O-N 3.39Å; K167-S171 VanDerWaalsContact O-N 3.09Å
168	I	95.5	Very high	93.9	Very high	17 Å²	17	64.1 Å²	64.1	9%	0.087	34%	0.335	C	S	.	.	H	α-helix	trans	-61.9	-49.6	177.6	-67.8	-179.1	0	0	0	109.9	E164 T165 H170 S171 L172 K305 L309	E164-I168 PolarHBondContact O-N 3.01Å; T165-I168 PolarHBondContact O-N 3.14Å; I168-H170 VanDerWaalsContact C-N 3.3Å; I168-H170 PolarHBondContact O-N 3.16Å; I168-S171 PolarHBondContact O-N 3.49Å; I168-S171 PolarHBondContact O-OG 2.78Å; I168-L172 HydrophobicContact CG2-CD1 4.12Å; I168-L172 WeakPolarHBondContact O-CG 3Å; I168-L172 PolarHBondContact O-N 3.24Å; I168-K305 HydrophobicContact CD1-CG 4.28Å; I168-L309 HydrophobicContact CD1-CB 4.41Å; I168-L309 HydrophobicContact CD1-CD2 4.15Å
169	L	95.6	Very high	94	Very high	1 Å²	1	69 Å²	69	1%	0.005	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-36.4	179.4	-70.3	174.4	0	0	0	112.7	T165 L172 K173 L176 L184 N185 L221	T165-L169 HydrophobicContact CG2-CD1 4.01Å; T165-L169 WeakPolarHBondContact O-CB 3.3Å; T165-L169 WeakPolarHBondContact O-CG 3.36Å; T165-L169 PolarHBondContact O-N 2.56Å; L169-L172 CarbonylContact O-C 3.56Å; L169-L172 PolarHBondContact O-N 3.08Å; L169-K173 PolarHBondContact O-N 3.38Å; L169-L176 HydrophobicContact CD2-CD1 4.06Å; L169-L184 HydrophobicContact CD1-CB 4.05Å; L169-L184 WeakPolarHBondContact CD1-O 3.48Å; L169-L184 HydrophobicContact CD2-CB 3.99Å; L169-L184 HydrophobicContact CD2-CD1 4.28Å; L169-N185 HydrophobicContact CD1-CB 4.37Å; L169-L221 HydrophobicContact CD2-CD1 4.18Å; L169-L221 HydrophobicContact CD2-CD2 4.48Å
170	H	94.9	Very high	94.1	Very high	124 Å²	124	67 Å²	67	57%	0.574	36%	0.356	S	S	*	.	H	α-helix	trans	-62.5	-43.1	175.4	-172.5	74.2	0	0	0	111.9	S166 K167 I168 L172 K173	S166-H170 WeakPolarHBondContact O-CB 3.38Å; S166-H170 PolarHBondContact O-N 3.16Å; K167-H170 PolarHBondContact O-N 2.99Å; I168-H170 VanDerWaalsContact C-N 3.3Å; I168-H170 PolarHBondContact O-N 3.16Å; H170-L172 PolarHBondContact O-N 3.17Å; H170-K173 WeakPolarHBondContact O-CB 3.43Å; H170-K173 PolarHBondContact O-N 3.45Å; H170-K173 VanDerWaalsContact O-N 3.13Å
171	S	95.5	Very high	94.2	Very high	80 Å²	80	62 Å²	62	56%	0.559	33%	0.333	S	S	*	.	H	α-helix	trans	-62.6	-25.7	175.7	69.8	0	0	0	0	113.4	K167 I168	K167-S171 PolarHBondContact O-N 3.39Å; K167-S171 VanDerWaalsContact O-N 3.09Å; I168-S171 PolarHBondContact O-N 3.49Å; I168-S171 PolarHBondContact O-OG 2.78Å
172	L	95	Very high	94.2	Very high	9 Å²	9	67.4 Å²	67.4	5%	0.047	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.8	3.4	179.6	-59.7	176.2	0	0	0	113.1	I168 L169 H170 I174 K175 L176 L298 E302 C306	I168-L172 HydrophobicContact CG2-CD1 4.12Å; I168-L172 WeakPolarHBondContact O-CG 3Å; I168-L172 PolarHBondContact O-N 3.24Å; L169-L172 CarbonylContact O-C 3.56Å; L169-L172 PolarHBondContact O-N 3.08Å; H170-L172 PolarHBondContact O-N 3.17Å; L172-I174 VanDerWaalsContact C-N 3.3Å; L172-I174 PolarHBondContact O-N 3.4Å; L172-K175 PolarHBondContact O-N 2.98Å; L172-L176 HydrophobicContact CB-CD1 3.81Å; L172-L176 HydrophobicContact CB-CG 4.2Å; L172-L176 WeakPolarHBondContact O-CG 3.36Å; L172-L176 PolarHBondContact O-N 3.48Å; L172-L298 HydrophobicContact CB-CD2 4.2Å; L172-L298 HydrophobicContact CD1-CD1 4.27Å; L172-L298 HydrophobicContact CD1-CD2 4.03Å; L172-L298 HydrophobicContact CD2-CD2 4.16Å; L172-L298 HydrophobicContact CG-CD2 4.36Å; L172-E302 HydrophobicContact CD2-CB 4.03Å; L172-E302 HydrophobicContact CD2-CG 3.74Å; L172-C306 WeakPolarHBondContact CD1-SG 3.31Å
173	K	93.6	Very high	94.2	Very high	67 Å²	67	68.7 Å²	68.7	29%	0.291	37%	0.366	S	S	.	.	H	α-helix	trans	-58.7	-39.3	-171.2	-178.2	176.7	179	-174.2	0	112.9	L169 H170 G177 W181	L169-K173 PolarHBondContact O-N 3.38Å; H170-K173 WeakPolarHBondContact O-CB 3.43Å; H170-K173 PolarHBondContact O-N 3.45Å; H170-K173 VanDerWaalsContact O-N 3.13Å; K173-G177 PolarHBondContact O-N 3.35Å; K173-W181 HydrophobicContact CB-CG 4.15Å; K173-W181 HydrophobicContact CD-CD2 3.92Å; K173-W181 HydrophobicContact CD-CE3 4.27Å; K173-W181 HydrophobicContact CD-CG 4.22Å; K173-W181 HydrophobicContact CD-CZ2 4.42Å; K173-W181 HydrophobicContact CG-CB 4.16Å; K173-W181 HydrophobicContact CG-CD2 3.99Å; K173-W181 HydrophobicContact CG-CG 3.75Å
174	I	94	Very high	94.2	Very high	162 Å²	162	66 Å²	66	83%	0.831	34%	0.343	S	S	*	.	H	α-helix	trans	-62.8	-45.6	-180	-60	-59.1	0	0	0	110.9	L172	L172-I174 VanDerWaalsContact C-N 3.3Å; L172-I174 PolarHBondContact O-N 3.4Å
175	K	93.6	Very high	94.1	Very high	94 Å²	94	63.3 Å²	63.3	41%	0.409	33%	0.332	S	S	.	.	H	α-helix	trans	-70.9	-43.2	179.9	-69.1	-178.4	169.6	179.9	0	112.6	L172 G177 P297 L298 E302	L172-K175 PolarHBondContact O-N 2.98Å; K175-G177 VanDerWaalsContact C-N 3.27Å; K175-G177 PolarHBondContact O-N 3.29Å; K175-P297 VanDerWaalsContact O-CB 3.24Å; K175-P297 WeakPolarHBondContact O-CB 3.37Å; K175-L298 HydrophobicContact CB-CD2 4.36Å; K175-E302 WeakPolarHBondContact CD-OE2 3.35Å; K175-E302 IonicContact NZ-OE1 3.33Å; K175-E302 PolarHBondContact NZ-OE1 3.02Å; K175-E302 IonicContact NZ-OE2 2.73Å; K175-E302 PolarHBondContact NZ-OE2 3.34Å
176	L	93.4	Very high	93.9	Very high	14 Å²	14	63.8 Å²	63.8	7%	0.073	34%	0.335	C	S	.	.	H	α-helix	trans	-68.3	-29.7	-179.6	-67.9	169.1	0	0	0	112.2	L169 L172 L180 W181 L184 P297 L298	L169-L176 HydrophobicContact CD2-CD1 4.06Å; L172-L176 HydrophobicContact CB-CD1 3.81Å; L172-L176 HydrophobicContact CB-CG 4.2Å; L172-L176 WeakPolarHBondContact O-CG 3.36Å; L172-L176 PolarHBondContact O-N 3.48Å; L176-L180 HydrophobicContact CB-CB 4.46Å; L176-L180 HydrophobicContact CB-CD2 4.3Å; L176-L180 HydrophobicContact CB-CG 4.43Å; L176-L180 HydrophobicContact CD2-CD2 3.66Å; L176-L180 HydrophobicContact CD2-CG 4.2Å; L176-L180 WeakPolarHBondContact O-CB 3.3Å; L176-W181 HydrophobicContact CB-CB 4.4Å; L176-L184 HydrophobicContact CD1-CD1 4.24Å; L176-L184 HydrophobicContact CD2-CD1 4.12Å; L176-P297 HydrophobicContact CD2-CG 4.15Å; L176-L298 HydrophobicContact CD2-CD1 4.29Å; L176-L298 HydrophobicContact CD2-CD2 3.9Å; L176-L298 HydrophobicContact CD2-CG 4.15Å; L176-L298 HydrophobicContact CG-CD2 4.14Å
177	G	92.9	Very high	93.5	Very high	28 Å²	28	69.1 Å²	69.1	29%	0.289	35%	0.354	S	S	.	.			trans	74.8	155.8	-167.3	0	0	0	0	0	112.3	K173 K175 L180 W181	K173-G177 PolarHBondContact O-N 3.35Å; K175-G177 VanDerWaalsContact C-N 3.27Å; K175-G177 PolarHBondContact O-N 3.29Å; G177-L180 PolarHBondContact O-N 3.35Å; G177-W181 VanDerWaalsContact O-CB 3.26Å; G177-W181 WeakPolarHBondContact O-CB 3.43Å; G177-W181 PolarHBondContact O-N 2.92Å
178	T	93	Very high	92.7	Very high	90 Å²	90	64.6 Å²	64.6	55%	0.552	34%	0.344	S	S	*	.	H	α-helix	trans	-57.4	-44.5	-174.2	-56.8	0	0	0	0	114.2	F182	T178-F182 WeakPolarHBondContact O-CB 3.47Å; T178-F182 PolarHBondContact O-N 2.81Å
179	P	93.3	Very high	91.9	Very high	109 Å²	109	64.9 Å²	64.9	71%	0.708	35%	0.347	S	S	*	.	H	α-helix	trans	-64.5	-45.4	-177.5	-22.9	34.8	0	0	0	113	F182 L183	P179-F182 PolarHBondContact O-N 3.42Å; P179-L183 PolarHBondContact O-N 3.29Å; P179-L183 VanDerWaalsContact O-N 3.13Å
180	L	93.3	Very high	91.2	Very high	35 Å²	35	69.4 Å²	69.4	18%	0.183	37%	0.371	C	S	.	.	H	α-helix	trans	-69.8	-45.4	179.4	-177.7	58.9	0	0	0	110.5	L176 G177 F182 L183 L184 Y224	L176-L180 HydrophobicContact CB-CB 4.46Å; L176-L180 HydrophobicContact CB-CD2 4.3Å; L176-L180 HydrophobicContact CB-CG 4.43Å; L176-L180 HydrophobicContact CD2-CD2 3.66Å; L176-L180 HydrophobicContact CD2-CG 4.2Å; L176-L180 WeakPolarHBondContact O-CB 3.3Å; G177-L180 PolarHBondContact O-N 3.35Å; L180-F182 VanDerWaalsContact C-N 3.29Å; L180-F182 PolarHBondContact O-N 3.07Å; L180-L183 HydrophobicContact CD1-CD2 4.49Å; L180-L183 WeakPolarHBondContact O-CB 3.35Å; L180-L183 PolarHBondContact O-N 3.12Å; L180-L183 VanDerWaalsContact O-N 3.07Å; L180-L184 HydrophobicContact CD1-CD1 4.02Å; L180-L184 HydrophobicContact CD1-CD2 4.17Å; L180-L184 HydrophobicContact CD1-CG 3.95Å; L180-L184 HydrophobicContact CG-CD1 3.91Å; L180-L184 HydrophobicContact CG-CG 4.2Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 3.29Å; L180-Y224 HydrophobicContact CD1-CD2 3.93Å; L180-Y224 HydrophobicContact CD1-CE2 3.94Å; L180-Y224 HydrophobicContact CD2-CE2 3.83Å; L180-Y224 HydrophobicContact CG-CE2 4.5Å
181	W	95.1	Very high	90.5	Very high	42 Å²	42	64 Å²	64	16%	0.159	35%	0.347	C	S	.	.	H	α-helix	trans	-53.3	-46.4	174.3	171.5	81	0	0	0	111.9	K173 L176 G177 L183 L184 N185	K173-W181 HydrophobicContact CB-CG 4.15Å; K173-W181 HydrophobicContact CD-CD2 3.92Å; K173-W181 HydrophobicContact CD-CE3 4.27Å; K173-W181 HydrophobicContact CD-CG 4.22Å; K173-W181 HydrophobicContact CD-CZ2 4.42Å; K173-W181 HydrophobicContact CG-CB 4.16Å; K173-W181 HydrophobicContact CG-CD2 3.99Å; K173-W181 HydrophobicContact CG-CG 3.75Å; L176-W181 HydrophobicContact CB-CB 4.4Å; G177-W181 VanDerWaalsContact O-CB 3.26Å; G177-W181 WeakPolarHBondContact O-CB 3.43Å; G177-W181 PolarHBondContact O-N 2.92Å; W181-L183 VanDerWaalsContact C-N 3.31Å; W181-L183 PolarHBondContact O-N 2.85Å; W181-L184 PolarHBondContact O-N 3.08Å; W181-N185 VanDerWaalsContact O-CB 3.29Å; W181-N185 WeakPolarHBondContact O-CB 3.38Å; W181-N185 PolarHBondContact O-N 3.49Å
182	F	93.7	Very high	89.9	Confident	125 Å²	125	64.5 Å²	64.5	55%	0.548	34%	0.337	S	S	.	.	H	α-helix	trans	-63.8	-34.8	178.5	-177.4	-98.7	0	0	0	113.1	T178 P179 L180	T178-F182 WeakPolarHBondContact O-CB 3.47Å; T178-F182 PolarHBondContact O-N 2.81Å; P179-F182 PolarHBondContact O-N 3.42Å; L180-F182 VanDerWaalsContact C-N 3.29Å; L180-F182 PolarHBondContact O-N 3.07Å
183	L	92.8	Very high	89.8	Confident	97 Å²	97	73.3 Å²	73.3	51%	0.508	37%	0.369	S	S	.	.	H	α-helix	trans	-69.2	-41.5	175.4	178.3	63.8	0	0	0	112.2	P179 L180 W181 N220	P179-L183 PolarHBondContact O-N 3.29Å; P179-L183 VanDerWaalsContact O-N 3.13Å; L180-L183 HydrophobicContact CD1-CD2 4.49Å; L180-L183 WeakPolarHBondContact O-CB 3.35Å; L180-L183 PolarHBondContact O-N 3.12Å; L180-L183 VanDerWaalsContact O-N 3.07Å; W181-L183 VanDerWaalsContact C-N 3.31Å; W181-L183 PolarHBondContact O-N 2.85Å; L183-N220 PolarHBondContact O-ND2 3.29Å
184	L	94.3	Very high	89.8	Confident	3 Å²	3	70.5 Å²	70.5	2%	0.016	36%	0.357	C	S	.	.	H	α-helix	trans	-78.5	-29.2	-176.8	-59.8	-176.2	0	0	0	112.6	L169 L176 L180 W181 N220 L221 Y224	L169-L184 HydrophobicContact CD1-CB 4.05Å; L169-L184 WeakPolarHBondContact CD1-O 3.48Å; L169-L184 HydrophobicContact CD2-CB 3.99Å; L169-L184 HydrophobicContact CD2-CD1 4.28Å; L176-L184 HydrophobicContact CD1-CD1 4.24Å; L176-L184 HydrophobicContact CD2-CD1 4.12Å; L180-L184 HydrophobicContact CD1-CD1 4.02Å; L180-L184 HydrophobicContact CD1-CD2 4.17Å; L180-L184 HydrophobicContact CD1-CG 3.95Å; L180-L184 HydrophobicContact CG-CD1 3.91Å; L180-L184 HydrophobicContact CG-CG 4.2Å; L180-L184 VanDerWaalsContact O-CG 3.29Å; L180-L184 WeakPolarHBondContact O-CG 3.46Å; L180-L184 PolarHBondContact O-N 3.29Å; W181-L184 PolarHBondContact O-N 3.08Å; L184-N220 HydrophobicContact CD2-CB 4.49Å; L184-L221 HydrophobicContact CD1-CD1 4.17Å; L184-Y224 HydrophobicContact CD1-CD1 4.15Å; L184-Y224 HydrophobicContact CD1-CG 4.27Å; L184-Y224 HydrophobicContact CD2-CD2 4.48Å; L184-Y224 HydrophobicContact CD2-CG 3.96Å
185	N	92.4	Very high	89.7	Confident	36 Å²	36	67.6 Å²	67.6	19%	0.193	34%	0.336	C	S	.	.	S	Bend	trans	-65.5	131.1	-175.6	-162.5	48.2	0	0	0	112	L169 W181 K187	L169-N185 HydrophobicContact CD1-CB 4.37Å; W181-N185 VanDerWaalsContact O-CB 3.29Å; W181-N185 WeakPolarHBondContact O-CB 3.38Å; W181-N185 PolarHBondContact O-N 3.49Å; N185-K187 PolarHBondContact O-N 2.75Å
186	P	90.4	Very high	89.7	Confident	10 Å²	10	63.1 Å²	63.1	7%	0.065	32%	0.317	C	S	.	.			trans	-68.4	118.2	-178.2	26.4	-36.9	0	0	0	112.5	K162 T165 P217	K162-P186 WeakPolarHBondContact CE-O 3.32Å; K162-P186 HydrophobicContact CG-CB 4.25Å; K162-P186 HydrophobicContact CG-CG 3.97Å; T165-P186 HydrophobicContact CG2-CG 3.96Å; P186-P217 HydrophobicContact CB-CB 3.83Å; P186-P217 HydrophobicContact CG-CB 4.22Å
187	K	84.7	Confident	89.7	Confident	142 Å²	142	64.1 Å²	64.1	62%	0.617	32%	0.322	S	S	*	.	S	Bend	trans	-78.2	-50.3	176.4	-58.9	179.8	-177.6	-179.4	0	111.2	K162 N185	K162-K187 PolarHBondContact NZ-O 3.3Å; N185-K187 PolarHBondContact O-N 2.75Å
188	S	80.6	Confident	89.7	Confident	72 Å²	72	62.8 Å²	62.8	50%	0.503	31%	0.308	S	S	.	.			trans	-130.1	149.6	177.4	58	0	0	0	0	110
189	C	77.8	Confident	89.7	Confident	23 Å²	23	61 Å²	61	16%	0.155	29%	0.293	C	S	.	.			trans	-122.8	113.7	171.5	-176.5	0	0	0	0	108.2	V158 K162 P217	V158-C189 HydrophobicContact CG1-CB 3.83Å; V158-C189 WeakPolarHBondContact CG1-SG 3.47Å; K162-C189 HydrophobicContact CB-CB 4.24Å; K162-C189 HydrophobicContact CD-CB 4.33Å; C189-P217 HydrophobicContact CB-CG 3.67Å; C189-P217 WeakPolarHBondContact SG-CD 3.45Å; C189-P217 WeakPolarHBondContact SG-CG 3.35Å
190	N	81.6	Confident	89.6	Confident	95 Å²	95	58.2 Å²	58.2	51%	0.508	27%	0.272	S	S	.	.			trans	-140.7	101.2	169.2	-166.9	6.6	0	0	0	108.3	R192 N215	N190-R192 WeakPolarHBondContact O-CG 3.47Å; N190-R192 PolarHBondContact O-N 3.43Å; N190-N215 PolarHBondContact N-O 3.35Å
191	P	79.8	Confident	89.3	Confident	11 Å²	11	61 Å²	61	7%	0.071	28%	0.284	C	S	.	.			trans	-50.7	131.3	173.1	-24.6	34	0	0	0	109.7	V158 L315 I317	V158-P191 HydrophobicContact CG2-CG 3.48Å; V158-P191 VanDerWaalsContact CG2-CG 3.48Å; P191-L315 HydrophobicContact CB-CB 4.11Å; P191-L315 HydrophobicContact CG-CB 4.02Å; P191-I317 HydrophobicContact CB-CD1 4.38Å; P191-I317 HydrophobicContact CB-CG1 4.19Å; P191-I317 WeakPolarHBondContact O-CD1 3.49Å
192	R	83.5	Confident	89	Confident	90 Å²	90	63.4 Å²	63.4	34%	0.34	30%	0.295	S	S	.	.			trans	-101.8	-165.9	-175.8	-71.8	-159.7	-173.8	-165.8	12.5	111.3	N190 D212 S214 N215 F316 I317	N190-R192 WeakPolarHBondContact O-CG 3.47Å; N190-R192 PolarHBondContact O-N 3.43Å; R192-D212 HydrophobicContact CB-CB 3.78Å; R192-D212 WeakPolarHBondContact CB-O 3.17Å; R192-D212 WeakPolarHBondContact CD-OD2 3.47Å; R192-D212 IonicContact NE-OD2 3.55Å; R192-D212 IonicContact NH1-OD2 2.89Å; R192-D212 PolarHBondContact NH1-OD2 2.94Å; R192-S214 WeakPolarHBondContact CD-O 3.44Å; R192-S214 VanDerWaalsContact CD-OG 3.23Å; R192-S214 WeakPolarHBondContact CD-OG 3.38Å; R192-S214 VanDerWaalsContact CG-O 3.25Å; R192-S214 WeakPolarHBondContact CG-O 3.34Å; R192-S214 PolarHBondContact NE-O 2.93Å; R192-S214 PolarHBondContact NE-OG 3.3Å; R192-S214 VanDerWaalsContact NE-OG 3.17Å; R192-S214 PolarHBondContact NH1-OG 3.29Å; R192-S214 VanDerWaalsContact NH1-OG 3.08Å; R192-N215 HydrophobicContact CG-CB 4.48Å; R192-N215 VanDerWaalsContact NE-CG 3.29Å; R192-N215 PolarHBondContact NE-ND2 2.93Å; R192-N215 PolarHBondContact NH2-ND2 3.08Å; R192-N215 PolarHBondContact NH2-OD1 3.4Å; R192-F316 CarbonylContact O-C 3.5Å; R192-F316 WeakPolarHBondContact O-CA 3.44Å; R192-I317 PolarHBondContact O-N 2.99Å
193	R	91.4	Very high	88.7	Confident	195 Å²	195	64.8 Å²	64.8	74%	0.736	31%	0.308	S	S	*	.	B	Isolated β-bridge	trans	-81.1	136	-163.9	-61.5	176	-177.5	155.2	0.3	110.9	D212 I317	R193-D212 WeakPolarHBondContact O-CB 3.38Å; R193-D212 PolarHBondContact O-N 3.22Å; R193-I317 WeakPolarHBondContact CA-O 3.33Å
194	F	93.6	Very high	88.5	Confident	8 Å²	8	64.8 Å²	64.8	4%	0.035	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	137.7	155.2	171.1	-86.3	0	0	0	109.7	A137 L141 P209 V211 F316 I317 F318	A137-F194 HydrophobicContact CB-CE1 4.05Å; L141-F194 HydrophobicContact CD2-CD2 4.4Å; L141-F194 HydrophobicContact CD2-CE2 4.15Å; L141-F194 HydrophobicContact CD2-CZ 4.34Å; L141-F194 HydrophobicContact CG-CZ 4.48Å; F194-P209 HydrophobicContact CE2-CB 3.46Å; F194-P209 VanDerWaalsContact CE2-CB 3.46Å; F194-P209 HydrophobicContact CZ-CB 3.85Å; F194-V211 HydrophobicContact CD2-CG2 4.31Å; F194-F316 HydrophobicContact CB-CD2 3.5Å; F194-F316 HydrophobicContact CB-CE2 3.9Å; F194-F316 HydrophobicContact CB-CG 4.26Å; F194-F316 HydrophobicContact CD2-CD2 4.23Å; F194-F316 AromaticContact CD2-CE2 3.88Å; F194-F316 HydrophobicContact CD2-CE2 3.88Å; F194-F316 HydrophobicContact CD2-CZ 4.3Å; F194-F316 HydrophobicContact CG-CD2 4.2Å; F194-F316 HydrophobicContact CG-CE2 4.1Å; F194-I317 PolarHBondContact N-O 2.78Å; F194-F318 HydrophobicContact CB-CB 4.19Å; F194-F318 HydrophobicContact CB-CD2 4.42Å; F194-F318 HydrophobicContact CD1-CB 4.32Å; F194-F318 AromaticContact CD1-CD2 3.55Å; F194-F318 HydrophobicContact CD1-CD2 3.55Å; F194-F318 HydrophobicContact CD1-CE2 4.07Å; F194-F318 HydrophobicContact CD1-CG 4.04Å; F194-F318 HydrophobicContact CE1-CD2 4.32Å; F194-F318 HydrophobicContact CE1-CE2 4.49Å; F194-F318 HydrophobicContact CG-CD2 4.44Å
195	Y	93.1	Very high	88.3	Confident	100 Å²	100	65.8 Å²	65.8	39%	0.392	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	158	170.1	62.6	-84.7	0	0	0	110.1	L197 V210 D212	Y195-L197 HydrophobicContact CD2-CD2 4.44Å; Y195-L197 HydrophobicContact CE2-CD2 4.27Å; Y195-V210 HydrophobicContact CD2-CB 4.24Å; Y195-V210 HydrophobicContact CE1-CB 4.24Å; Y195-V210 HydrophobicContact CE1-CG1 4.01Å; Y195-V210 HydrophobicContact CE2-CB 3.81Å; Y195-V210 HydrophobicContact CE2-CG1 4.03Å; Y195-V210 HydrophobicContact CE2-CG2 4.28Å; Y195-V210 PolarHBondContact N-O 3.05Å; Y195-V210 WeakPolarHBondContact O-CA 3.5Å; Y195-V210 PolarHBondContact O-N 3.11Å; Y195-V210 WeakPolarHBondContact OH-CG1 3.42Å; Y195-D212 HydrophobicContact CE1-CB 4.49Å
196	G	92.6	Very high	88.3	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	137.4	-179.1	0	0	0	0	0	111.7	Y133 R208	Y133-G196 PolarHBondContact OH-N 3.26Å; G196-R208 CarbonylContact C-O 3.6Å; G196-R208 VanDerWaalsContact CA-O 3.25Å; G196-R208 WeakPolarHBondContact CA-O 3.17Å
197	L	93.7	Very high	88.4	Confident	36 Å²	36	66.3 Å²	66.3	19%	0.188	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	135.5	169.1	-55.9	177.4	0	0	0	109	K118 D120 Y195 L207 R208 V210	K118-L197 HydrophobicContact CB-CD2 4.22Å; D120-L197 HydrophobicContact CB-CB 4.17Å; Y195-L197 HydrophobicContact CD2-CD2 4.44Å; Y195-L197 HydrophobicContact CE2-CD2 4.27Å; L197-L207 CarbonylContact O-C 3.56Å; L197-R208 HydrophobicContact CB-CB 4.29Å; L197-R208 PolarHBondContact N-O 3.35Å; L197-R208 PolarHBondContact O-N 3.38Å; L197-V210 HydrophobicContact CD1-CG2 4.29Å; L197-V210 HydrophobicContact CG-CG2 4.3Å
198	L	93.8	Very high	88.8	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	127.5	-175.2	-71.2	167.6	0	0	0	111.4	T117 A119 D120 V126 M128 I200 T205 L207	T117-L198 HydrophobicContact CG2-CD1 3.7Å; T117-L198 HydrophobicContact CG2-CG 4.13Å; A119-L198 WeakPolarHBondContact CA-O 3.33Å; D120-L198 PolarHBondContact N-O 3.32Å; V126-L198 HydrophobicContact CB-CD1 3.94Å; V126-L198 HydrophobicContact CG1-CD1 3.44Å; V126-L198 VanDerWaalsContact CG1-CD1 3.44Å; M128-L198 HydrophobicContact CB-CD1 4.37Å; M128-L198 HydrophobicContact CE-CD1 3.59Å; M128-L198 HydrophobicContact CE-CD2 3.61Å; M128-L198 HydrophobicContact CE-CG 4.28Å; M128-L198 HydrophobicContact SD-CD1 4.07Å; M128-L198 HydrophobicContact SD-CD2 4.08Å; L198-I200 VanDerWaalsContact C-N 3.33Å; L198-I200 HydrophobicContact CB-CG2 4.2Å; L198-I200 PolarHBondContact O-N 2.92Å; L198-I200 VanDerWaalsContact O-N 3.15Å; L198-T205 HydrophobicContact CB-CG2 3.88Å; L198-T205 HydrophobicContact CD2-CG2 3.95Å; L198-T205 HydrophobicContact CG-CG2 4.4Å; L198-L207 HydrophobicContact CD2-CD2 3.4Å; L198-L207 HydrophobicContact CD2-CG 4.2Å; L198-L207 HydrophobicContact CG-CD2 4.03Å
199	K	92.4	Very high	89.3	Confident	51 Å²	51	60.8 Å²	60.8	22%	0.222	29%	0.293	C	S	.	.			trans	-85.9	72.9	173.5	-62.8	-175.1	-177.1	176.4	0	110.4	D120 H201 K202 P206 R208	D120-K199 HydrophobicContact CB-CG 3.95Å; K199-H201 PolarHBondContact O-N 3.35Å; K199-K202 HydrophobicContact CB-CB 4.46Å; K199-K202 HydrophobicContact CB-CG 4.44Å; K199-K202 HydrophobicContact CD-CD 4.2Å; K199-K202 PolarHBondContact O-N 3.46Å; K199-P206 HydrophobicContact CB-CG 4.12Å; K199-P206 WeakPolarHBondContact CB-O 3.47Å; K199-P206 HydrophobicContact CD-CG 4.28Å; K199-P206 PolarHBondContact N-O 2.92Å; K199-R208 HydrophobicContact CG-CB 4.48Å
200	I	90	Very high	90	Very high	52 Å²	52	60.6 Å²	60.6	27%	0.267	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-9.6	-177.1	62.2	170.8	0	0	0	115.4	V27 A119 T124 V126 L198 T205	V27-I200 HydrophobicContact CG2-CD1 4.14Å; A119-I200 HydrophobicContact CB-CD1 3.94Å; A119-I200 HydrophobicContact CB-CG1 4.15Å; A119-I200 HydrophobicContact CB-CG2 4.47Å; T124-I200 HydrophobicContact CG2-CD1 3.92Å; V126-I200 HydrophobicContact CG1-CG2 4.4Å; V126-I200 HydrophobicContact CG2-CG2 3.75Å; L198-I200 VanDerWaalsContact C-N 3.33Å; L198-I200 HydrophobicContact CB-CG2 4.2Å; L198-I200 PolarHBondContact O-N 2.92Å; L198-I200 VanDerWaalsContact O-N 3.15Å; I200-T205 HydrophobicContact CG2-CG2 3.94Å
201	H	87.7	Confident	90.5	Very high	93 Å²	93	56.2 Å²	56.2	43%	0.431	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.3	4	178.7	63.1	-82.1	0	0	0	112.9	D120 K121 K199	D120-H201 IonicContact OD2-CE1 2.82Å; K121-H201 VanDerWaalsContact CD-CE1 3.49Å; K121-H201 WeakPolarHBondContact CD-CE1 3.28Å; K121-H201 PolarHBondContact NZ-NE2 3.32Å; K199-H201 PolarHBondContact O-N 3.35Å
202	K	89.3	Confident	91	Very high	92 Å²	92	57.9 Å²	57.9	40%	0.4	28%	0.276	S	S	.	.	S	Bend	trans	-116.5	149.6	174.9	-66.7	-161.7	176.7	-156.6	0	109.5	K199 T205 P206	K199-K202 HydrophobicContact CB-CB 4.46Å; K199-K202 HydrophobicContact CB-CG 4.44Å; K199-K202 HydrophobicContact CD-CD 4.2Å; K199-K202 PolarHBondContact O-N 3.46Å; K202-T205 PolarHBondContact O-N 3.32Å; K202-P206 HydrophobicContact CB-CG 4.18Å; K202-P206 HydrophobicContact CD-CG 4.47Å
203	D	86.8	Confident	91.1	Very high	155 Å²	155	53.8 Å²	53.8	83%	0.829	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	147.1	174.4	-60.7	-32.3	0	0	0	110.8	T205 P206	D203-T205 PolarHBondContact O-N 3.48Å; D203-P206 WeakPolarHBondContact O-CD 3.3Å
204	S	88.5	Confident	90.7	Very high	96 Å²	96	45.8 Å²	45.8	67%	0.671	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.7	-7.1	-170.1	80.8	0	0	0	0	116.1	K136	K136-S204 PolarHBondContact NZ-O 3.01Å
205	T	91.6	Very high	90.1	Very high	25 Å²	25	48.5 Å²	48.5	15%	0.153	25%	0.25	C	C	.	.			trans	51.1	66.9	-175.4	-52.5	0	0	0	0	112.5	L29 K136 L198 I200 K202 D203	L29-T205 HydrophobicContact CD1-CG2 4.03Å; K136-T205 PolarHBondContact NZ-O 2.84Å; L198-T205 HydrophobicContact CB-CG2 3.88Å; L198-T205 HydrophobicContact CD2-CG2 3.95Å; L198-T205 HydrophobicContact CG-CG2 4.4Å; I200-T205 HydrophobicContact CG2-CG2 3.94Å; K202-T205 PolarHBondContact O-N 3.32Å; D203-T205 PolarHBondContact O-N 3.48Å
206	P	92.3	Very high	89.9	Confident	42 Å²	42	44.5 Å²	44.5	27%	0.273	24%	0.236	S	C	.	.			trans	-68.5	158.4	180	27.3	-33.7	0	0	0	112	K199 K202 D203	K199-P206 HydrophobicContact CB-CG 4.12Å; K199-P206 WeakPolarHBondContact CB-O 3.47Å; K199-P206 HydrophobicContact CD-CG 4.28Å; K199-P206 PolarHBondContact N-O 2.92Å; K202-P206 HydrophobicContact CB-CG 4.18Å; K202-P206 HydrophobicContact CD-CG 4.47Å; D203-P206 WeakPolarHBondContact O-CD 3.3Å
207	L	92.2	Very high	89.7	Confident	14 Å²	14	44.8 Å²	44.8	7%	0.073	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	139.3	174.4	-69	168	0	0	0	110.4	Y133 K136 A137 L197 L198	Y133-L207 HydrophobicContact CD2-CD2 3.93Å; Y133-L207 HydrophobicContact CE2-CD2 3.6Å; K136-L207 HydrophobicContact CB-CD1 3.55Å; K136-L207 HydrophobicContact CB-CG 4.05Å; A137-L207 HydrophobicContact CB-CD1 3.84Å; A137-L207 VanDerWaalsContact N-CD1 3.34Å; L197-L207 CarbonylContact O-C 3.56Å; L198-L207 HydrophobicContact CD2-CD2 3.4Å; L198-L207 HydrophobicContact CD2-CG 4.2Å; L198-L207 HydrophobicContact CG-CD2 4.03Å
208	R	92.4	Very high	89.6	Confident	85 Å²	85	43 Å²	43	32%	0.321	23%	0.229	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	109.8	159.2	-178.7	177.3	-178	167.2	3.2	107.8	D120 G196 L197 K199 M331	D120-R208 WeakPolarHBondContact OD1-CD 3.2Å; D120-R208 IonicContact OD1-CZ 2.67Å; D120-R208 IonicContact OD1-NE 3.59Å; D120-R208 IonicContact OD1-NH1 3.43Å; D120-R208 PolarHBondContact OD1-NH1 3.27Å; G196-R208 CarbonylContact C-O 3.6Å; G196-R208 VanDerWaalsContact CA-O 3.25Å; G196-R208 WeakPolarHBondContact CA-O 3.17Å; L197-R208 HydrophobicContact CB-CB 4.29Å; L197-R208 PolarHBondContact N-O 3.35Å; L197-R208 PolarHBondContact O-N 3.38Å; K199-R208 HydrophobicContact CG-CB 4.48Å; R208-M331 HydrophobicContact CG-CE 4.03Å; R208-M331 HydrophobicContact CG-SD 3.74Å; R208-M331 PolarHBondContact NE-SD 2.99Å
209	P	92.1	Very high	89.6	Confident	14 Å²	14	46.4 Å²	46.4	9%	0.091	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	135.6	-180	30.9	-39.7	0	0	0	111	H140 F194	H140-P209 WeakPolarHBondContact NE2-CG 3.47Å; F194-P209 HydrophobicContact CE2-CB 3.46Å; F194-P209 VanDerWaalsContact CE2-CB 3.46Å; F194-P209 HydrophobicContact CZ-CB 3.85Å
210	V	92.2	Very high	89.6	Confident	18 Å²	18	46.8 Å²	46.8	11%	0.109	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	131.8	171.4	-174.3	0	0	0	0	108.8	Y195 L197 M331	Y195-V210 HydrophobicContact CD2-CB 4.24Å; Y195-V210 HydrophobicContact CE1-CB 4.24Å; Y195-V210 HydrophobicContact CE1-CG1 4.01Å; Y195-V210 HydrophobicContact CE2-CB 3.81Å; Y195-V210 HydrophobicContact CE2-CG1 4.03Å; Y195-V210 HydrophobicContact CE2-CG2 4.28Å; Y195-V210 PolarHBondContact N-O 3.05Å; Y195-V210 WeakPolarHBondContact O-CA 3.5Å; Y195-V210 PolarHBondContact O-N 3.11Å; Y195-V210 WeakPolarHBondContact OH-CG1 3.42Å; L197-V210 HydrophobicContact CD1-CG2 4.29Å; L197-V210 HydrophobicContact CG-CG2 4.3Å; V210-M331 HydrophobicContact CG2-SD 4.26Å
211	V	91.6	Very high	89.8	Confident	4 Å²	4	44.3 Å²	44.3	2%	0.024	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	123	176.2	174.2	0	0	0	0	108.6	F194 F213 T314 F316 M331	F194-V211 HydrophobicContact CD2-CG2 4.31Å; V211-F213 PolarHBondContact O-N 3.17Å; V211-T314 HydrophobicContact CG1-CG2 4.41Å; V211-F316 HydrophobicContact CB-CD1 4.47Å; V211-F316 HydrophobicContact CG1-CB 3.73Å; V211-F316 HydrophobicContact CG1-CD1 4.03Å; V211-F316 HydrophobicContact CG1-CG 4.19Å; V211-F316 HydrophobicContact CG2-CB 4.42Å; V211-F316 HydrophobicContact CG2-CD1 3.57Å; V211-F316 HydrophobicContact CG2-CE1 3.93Å; V211-F316 HydrophobicContact CG2-CG 4.01Å; V211-M331 PolarHBondContact N-O 3.05Å
212	D	89.4	Confident	90.2	Very high	45 Å²	45	39.9 Å²	39.9	24%	0.241	21%	0.213	C	C	.	.			trans	-69	101.3	167.8	-175.9	1	0	0	0	109.2	R192 R193 Y195 S214	R192-D212 HydrophobicContact CB-CB 3.78Å; R192-D212 WeakPolarHBondContact CB-O 3.17Å; R192-D212 WeakPolarHBondContact CD-OD2 3.47Å; R192-D212 IonicContact NE-OD2 3.55Å; R192-D212 IonicContact NH1-OD2 2.89Å; R192-D212 PolarHBondContact NH1-OD2 2.94Å; R193-D212 WeakPolarHBondContact O-CB 3.38Å; R193-D212 PolarHBondContact O-N 3.22Å; Y195-D212 HydrophobicContact CE1-CB 4.49Å; D212-S214 VanDerWaalsContact C-N 3.25Å; D212-S214 VanDerWaalsContact CG-OG 3.25Å; D212-S214 PolarHBondContact O-N 3.3Å; D212-S214 WeakPolarHBondContact OD1-CB 3.34Å; D212-S214 PolarHBondContact OD1-N 3.38Å; D212-S214 PolarHBondContact OD1-OG 3.17Å; D212-S214 PolarHBondContact OD2-OG 3.45Å
213	F	85.9	Confident	90.5	Very high	5 Å²	5	41.3 Å²	41.3	2%	0.022	22%	0.219	C	C	.	.			trans	-82.4	-3.8	179.1	-148.6	-107.9	0	0	0	112.7	V211 S216 T218 Y219 A222 G332	V211-F213 PolarHBondContact O-N 3.17Å; F213-S216 VanDerWaalsContact O-CB 3.24Å; F213-S216 WeakPolarHBondContact O-CB 3.38Å; F213-S216 PolarHBondContact O-N 2.94Å; F213-T218 WeakPolarHBondContact CE1-OG1 3.44Å; F213-T218 WeakPolarHBondContact CZ-OG1 3.43Å; F213-Y219 HydrophobicContact CB-CD2 4.46Å; F213-Y219 HydrophobicContact CD1-CD2 4.04Å; F213-Y219 VanDerWaalsContact O-CD2 3.28Å; F213-Y219 WeakPolarHBondContact O-CD2 3.33Å; F213-A222 HydrophobicContact CE1-CB 4.29Å; F213-G332 WeakPolarHBondContact CB-O 3.4Å
214	S	83	Confident	91	Very high	26 Å²	26	34.7 Å²	34.7	18%	0.182	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	141.8	178.8	70.1	0	0	0	0	110.5	R192 D212 S216	R192-S214 WeakPolarHBondContact CD-O 3.44Å; R192-S214 VanDerWaalsContact CD-OG 3.23Å; R192-S214 WeakPolarHBondContact CD-OG 3.38Å; R192-S214 VanDerWaalsContact CG-O 3.25Å; R192-S214 WeakPolarHBondContact CG-O 3.34Å; R192-S214 PolarHBondContact NE-O 2.93Å; R192-S214 PolarHBondContact NE-OG 3.3Å; R192-S214 VanDerWaalsContact NE-OG 3.17Å; R192-S214 PolarHBondContact NH1-OG 3.29Å; R192-S214 VanDerWaalsContact NH1-OG 3.08Å; D212-S214 VanDerWaalsContact C-N 3.25Å; D212-S214 VanDerWaalsContact CG-OG 3.25Å; D212-S214 PolarHBondContact O-N 3.3Å; D212-S214 WeakPolarHBondContact OD1-CB 3.34Å; D212-S214 PolarHBondContact OD1-N 3.38Å; D212-S214 PolarHBondContact OD1-OG 3.17Å; D212-S214 PolarHBondContact OD2-OG 3.45Å; S214-S216 PolarHBondContact O-N 3.27Å
215	N	82.7	Confident	91.4	Very high	66 Å²	66	30.1 Å²	30.1	35%	0.353	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	7.4	-170.2	-55.1	-3.5	0	0	0	116.6	N190 R192	N190-N215 PolarHBondContact N-O 3.35Å; R192-N215 HydrophobicContact CG-CB 4.48Å; R192-N215 VanDerWaalsContact NE-CG 3.29Å; R192-N215 PolarHBondContact NE-ND2 2.93Å; R192-N215 PolarHBondContact NH2-ND2 3.08Å; R192-N215 PolarHBondContact NH2-OD1 3.4Å
216	S	87.7	Confident	91.6	Very high	16 Å²	16	29.4 Å²	29.4	11%	0.112	15%	0.148	C	C	.	.			trans	-61.4	144.5	164.3	175.8	0	0	0	0	110	F213 S214 T218 Y219	F213-S216 VanDerWaalsContact O-CB 3.24Å; F213-S216 WeakPolarHBondContact O-CB 3.38Å; F213-S216 PolarHBondContact O-N 2.94Å; S214-S216 PolarHBondContact O-N 3.27Å; S216-T218 PolarHBondContact O-N 3.24Å; S216-T218 VanDerWaalsContact O-N 3.13Å; S216-T218 PolarHBondContact OG-N 3.38Å; S216-T218 PolarHBondContact OG-OG1 2.87Å; S216-Y219 WeakPolarHBondContact O-CB 3.4Å; S216-Y219 PolarHBondContact O-N 3.28Å
217	P	88.8	Confident	91.8	Very high	5 Å²	5	35.5 Å²	35.5	3%	0.032	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54	-31.7	174.5	-29.8	39.1	0	0	0	113.5	L161 K162 T165 P186 C189	L161-P217 HydrophobicContact CD2-CG 3.94Å; L161-P217 HydrophobicContact CG-CB 4.23Å; L161-P217 HydrophobicContact CG-CG 3.93Å; K162-P217 HydrophobicContact CB-CG 4.39Å; T165-P217 HydrophobicContact CG2-CB 4.5Å; P186-P217 HydrophobicContact CB-CB 3.83Å; P186-P217 HydrophobicContact CG-CB 4.22Å; C189-P217 HydrophobicContact CB-CG 3.67Å; C189-P217 WeakPolarHBondContact SG-CD 3.45Å; C189-P217 WeakPolarHBondContact SG-CG 3.35Å
218	T	91.8	Very high	92	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	1.7	-177.2	57.1	0	0	0	0	112.8	L161 T165 F213 S216 N220 L221 A222 L309	L161-T218 HydrophobicContact CD1-CG2 4.47Å; T165-T218 HydrophobicContact CG2-CG2 4.32Å; F213-T218 WeakPolarHBondContact CE1-OG1 3.44Å; F213-T218 WeakPolarHBondContact CZ-OG1 3.43Å; S216-T218 PolarHBondContact O-N 3.24Å; S216-T218 VanDerWaalsContact O-N 3.13Å; S216-T218 PolarHBondContact OG-N 3.38Å; S216-T218 PolarHBondContact OG-OG1 2.87Å; T218-N220 PolarHBondContact O-N 3.31Å; T218-L221 PolarHBondContact O-N 3.01Å; T218-A222 VanDerWaalsContact O-CB 3.31Å; T218-A222 WeakPolarHBondContact O-CB 3.39Å; T218-A222 PolarHBondContact O-N 2.99Å; T218-L309 HydrophobicContact CG2-CD2 3.93Å; T218-L309 HydrophobicContact CG2-CG 3.93Å
219	Y	92.5	Very high	92.1	Very high	70 Å²	70	31 Å²	31	28%	0.275	15%	0.148	S	C	.	.	H	α-helix	trans	-59.1	-50.7	-174	177.5	-97.8	0	0	0	113.2	F213 S216 L221 A222 K223 P334	F213-Y219 HydrophobicContact CB-CD2 4.46Å; F213-Y219 HydrophobicContact CD1-CD2 4.04Å; F213-Y219 VanDerWaalsContact O-CD2 3.28Å; F213-Y219 WeakPolarHBondContact O-CD2 3.33Å; S216-Y219 WeakPolarHBondContact O-CB 3.4Å; S216-Y219 PolarHBondContact O-N 3.28Å; Y219-L221 VanDerWaalsContact C-N 3.32Å; Y219-L221 PolarHBondContact O-N 3.42Å; Y219-A222 PolarHBondContact O-N 2.92Å; Y219-K223 WeakPolarHBondContact O-CB 3.4Å; Y219-K223 PolarHBondContact O-N 3.43Å; Y219-P334 HydrophobicContact CD2-CG 4.03Å; Y219-P334 HydrophobicContact CE2-CG 3.68Å
220	N	93.4	Very high	92.2	Very high	59 Å²	59	36.1 Å²	36.1	32%	0.316	17%	0.169	S	C	.	.	H	α-helix	trans	-66.8	-37.3	179.5	-73.3	-17.4	0	0	0	111.5	L183 L184 T218 K223 Y224	L183-N220 PolarHBondContact O-ND2 3.29Å; L184-N220 HydrophobicContact CD2-CB 4.49Å; T218-N220 PolarHBondContact O-N 3.31Å; N220-K223 PolarHBondContact O-N 3.49Å; N220-Y224 WeakPolarHBondContact O-CB 3.49Å; N220-Y224 PolarHBondContact O-N 3.39Å
221	L	94.9	Very high	92.2	Very high	1 Å²	1	37.5 Å²	37.5	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-62.1	-52	174	-176.5	57.3	0	0	0	110.8	L169 L184 T218 Y219 K223 Y224 L225 C306 L309	L169-L221 HydrophobicContact CD2-CD1 4.18Å; L169-L221 HydrophobicContact CD2-CD2 4.48Å; L184-L221 HydrophobicContact CD1-CD1 4.17Å; T218-L221 PolarHBondContact O-N 3.01Å; Y219-L221 VanDerWaalsContact C-N 3.32Å; Y219-L221 PolarHBondContact O-N 3.42Å; L221-K223 VanDerWaalsContact C-N 3.29Å; L221-K223 PolarHBondContact O-N 2.88Å; L221-Y224 WeakPolarHBondContact O-CA 3.32Å; L221-Y224 WeakPolarHBondContact O-CB 3.31Å; L221-Y224 PolarHBondContact O-N 2.94Å; L221-L225 HydrophobicContact CD1-CD1 4.3Å; L221-L225 HydrophobicContact CD1-CD2 4.32Å; L221-L225 HydrophobicContact CD1-CG 4.13Å; L221-L225 HydrophobicContact CG-CD1 4.07Å; L221-L225 HydrophobicContact CG-CG 4.32Å; L221-L225 VanDerWaalsContact O-CG 3.3Å; L221-L225 WeakPolarHBondContact O-CG 3.4Å; L221-L225 PolarHBondContact O-N 3.09Å; L221-C306 HydrophobicContact CD1-CB 4.19Å; L221-C306 HydrophobicContact CD2-CB 4.07Å; L221-C306 HydrophobicContact CG-CB 4.42Å; L221-L309 HydrophobicContact CD2-CD2 4.35Å
222	A	95.5	Very high	92.2	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-57.2	-41.4	176.8	0	0	0	0	0	112	F213 T218 Y219 L225 A226 C310 P334 V335	F213-A222 HydrophobicContact CE1-CB 4.29Å; T218-A222 VanDerWaalsContact O-CB 3.31Å; T218-A222 WeakPolarHBondContact O-CB 3.39Å; T218-A222 PolarHBondContact O-N 2.99Å; Y219-A222 PolarHBondContact O-N 2.92Å; A222-L225 PolarHBondContact O-N 2.78Å; A222-A226 WeakPolarHBondContact O-CB 3.48Å; A222-A226 PolarHBondContact O-N 3Å; A222-C310 HydrophobicContact CB-CB 4.24Å; A222-P334 HydrophobicContact CB-CG 4.47Å; A222-V335 HydrophobicContact CB-CB 4.37Å; A222-V335 HydrophobicContact CB-CG1 4.19Å
223	K	95.7	Very high	92.1	Very high	121 Å²	121	37.3 Å²	37.3	53%	0.526	18%	0.176	S	C	.	.	H	α-helix	trans	-63.7	-40.6	175.3	-171.3	177.5	-177.7	179	0	112.2	Y219 N220 L221 R227 P334	Y219-K223 WeakPolarHBondContact O-CB 3.4Å; Y219-K223 PolarHBondContact O-N 3.43Å; N220-K223 PolarHBondContact O-N 3.49Å; L221-K223 VanDerWaalsContact C-N 3.29Å; L221-K223 PolarHBondContact O-N 2.88Å; K223-R227 PolarHBondContact O-N 2.99Å; K223-P334 HydrophobicContact CB-CB 4.29Å; K223-P334 HydrophobicContact CB-CG 4.32Å
224	Y	96.3	Very high	92	Very high	16 Å²	16	45.8 Å²	45.8	6%	0.063	21%	0.212	C	C	.	.	H	α-helix	trans	-65.5	-50.6	175.5	172.1	-97.7	0	0	0	111.5	L180 L184 N220 L221 A226 R227 I228 P297	L180-Y224 HydrophobicContact CD1-CD2 3.93Å; L180-Y224 HydrophobicContact CD1-CE2 3.94Å; L180-Y224 HydrophobicContact CD2-CE2 3.83Å; L180-Y224 HydrophobicContact CG-CE2 4.5Å; L184-Y224 HydrophobicContact CD1-CD1 4.15Å; L184-Y224 HydrophobicContact CD1-CG 4.27Å; L184-Y224 HydrophobicContact CD2-CD2 4.48Å; L184-Y224 HydrophobicContact CD2-CG 3.96Å; N220-Y224 WeakPolarHBondContact O-CB 3.49Å; N220-Y224 PolarHBondContact O-N 3.39Å; L221-Y224 WeakPolarHBondContact O-CA 3.32Å; L221-Y224 WeakPolarHBondContact O-CB 3.31Å; L221-Y224 PolarHBondContact O-N 2.94Å; Y224-A226 VanDerWaalsContact C-N 3.31Å; Y224-A226 PolarHBondContact O-N 3.32Å; Y224-R227 WeakPolarHBondContact O-CB 3.19Å; Y224-R227 PolarHBondContact O-N 3.07Å; Y224-I228 HydrophobicContact CD1-CG1 4.47Å; Y224-I228 HydrophobicContact CE1-CG1 3.99Å; Y224-I228 HydrophobicContact CE2-CD1 4.22Å; Y224-I228 HydrophobicContact CE2-CG1 4.34Å; Y224-I228 WeakPolarHBondContact O-CG1 3.42Å; Y224-I228 PolarHBondContact O-N 2.97Å; Y224-I228 VanDerWaalsContact O-N 3.13Å; Y224-P297 VanDerWaalsContact OH-CD 3.23Å; Y224-P297 WeakPolarHBondContact OH-CD 3.38Å
225	L	96.9	Very high	92	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-59.7	-41.6	178	-61.6	176.8	0	0	0	111.5	L221 A222 R227 I228 L229 F303 C306 L307 V335	L221-L225 HydrophobicContact CD1-CD1 4.3Å; L221-L225 HydrophobicContact CD1-CD2 4.32Å; L221-L225 HydrophobicContact CD1-CG 4.13Å; L221-L225 HydrophobicContact CG-CD1 4.07Å; L221-L225 HydrophobicContact CG-CG 4.32Å; L221-L225 VanDerWaalsContact O-CG 3.3Å; L221-L225 WeakPolarHBondContact O-CG 3.4Å; L221-L225 PolarHBondContact O-N 3.09Å; A222-L225 PolarHBondContact O-N 2.78Å; L225-R227 VanDerWaalsContact C-N 3.28Å; L225-R227 PolarHBondContact O-N 3.28Å; L225-I228 PolarHBondContact O-N 3.06Å; L225-I228 VanDerWaalsContact O-N 3.09Å; L225-L229 PolarHBondContact O-N 2.66Å; L225-F303 HydrophobicContact CB-CE1 4.49Å; L225-F303 HydrophobicContact CB-CE2 4.24Å; L225-F303 HydrophobicContact CB-CZ 3.76Å; L225-F303 HydrophobicContact CD2-CD1 4.49Å; L225-F303 HydrophobicContact CD2-CD2 3.71Å; L225-F303 HydrophobicContact CD2-CE1 4.15Å; L225-F303 HydrophobicContact CD2-CE2 3.3Å; L225-F303 HydrophobicContact CD2-CG 4.28Å; L225-F303 HydrophobicContact CD2-CZ 3.53Å; L225-F303 HydrophobicContact CG-CE2 4.33Å; L225-F303 HydrophobicContact CG-CZ 4.16Å; L225-C306 HydrophobicContact CD1-CB 3.94Å; L225-C306 HydrophobicContact CD2-CB 4.12Å; L225-L307 HydrophobicContact CD1-CB 4.16Å; L225-L307 HydrophobicContact CD1-CD1 4.27Å; L225-V335 HydrophobicContact CB-CG2 4.37Å
226	A	96.7	Very high	92	Very high	11 Å²	11	47.2 Å²	47.2	9%	0.091	22%	0.217	C	C	.	.	H	α-helix	trans	-57.8	-41.2	174.6	0	0	0	0	0	112.2	A222 Y224 I228 L229 K230 P334 V335 I338	A222-A226 WeakPolarHBondContact O-CB 3.48Å; A222-A226 PolarHBondContact O-N 3Å; Y224-A226 VanDerWaalsContact C-N 3.31Å; Y224-A226 PolarHBondContact O-N 3.32Å; A226-I228 VanDerWaalsContact C-N 3.32Å; A226-I228 PolarHBondContact O-N 3.27Å; A226-L229 PolarHBondContact O-N 3.36Å; A226-K230 PolarHBondContact O-N 3.34Å; A226-P334 WeakPolarHBondContact CB-O 3.31Å; A226-V335 HydrophobicContact CB-CB 4.15Å; A226-V335 HydrophobicContact CB-CG2 4.24Å; A226-I338 HydrophobicContact CB-CD1 3.87Å; A226-I338 WeakPolarHBondContact O-CD1 3.46Å
227	R	96.3	Very high	91.7	Very high	169 Å²	169	52.7 Å²	52.7	64%	0.638	25%	0.245	S	C	*	.	H	α-helix	trans	-64.4	-37.5	176.3	-174.2	176.8	64.8	166.7	2.9	112.1	K223 Y224 L225	K223-R227 PolarHBondContact O-N 2.99Å; Y224-R227 WeakPolarHBondContact O-CB 3.19Å; Y224-R227 PolarHBondContact O-N 3.07Å; L225-R227 VanDerWaalsContact C-N 3.28Å; L225-R227 PolarHBondContact O-N 3.28Å
228	I	95.8	Very high	91.4	Very high	6 Å²	6	60.4 Å²	60.4	3%	0.031	28%	0.28	C	S	.	.	H	α-helix	trans	-70.4	-39.2	177.1	-59.3	-52	0	0	0	111.7	Y224 L225 A226 P231 L292 R295 C296 F303	Y224-I228 HydrophobicContact CD1-CG1 4.47Å; Y224-I228 HydrophobicContact CE1-CG1 3.99Å; Y224-I228 HydrophobicContact CE2-CD1 4.22Å; Y224-I228 HydrophobicContact CE2-CG1 4.34Å; Y224-I228 WeakPolarHBondContact O-CG1 3.42Å; Y224-I228 PolarHBondContact O-N 2.97Å; Y224-I228 VanDerWaalsContact O-N 3.13Å; L225-I228 PolarHBondContact O-N 3.06Å; L225-I228 VanDerWaalsContact O-N 3.09Å; A226-I228 VanDerWaalsContact C-N 3.32Å; A226-I228 PolarHBondContact O-N 3.27Å; I228-P231 VanDerWaalsContact O-CD 3.22Å; I228-P231 WeakPolarHBondContact O-CD 3.26Å; I228-L292 HydrophobicContact CG2-CD1 4.05Å; I228-R295 HydrophobicContact CD1-CB 4.35Å; I228-R295 WeakPolarHBondContact CD1-O 2.86Å; I228-R295 PolarHBondContact O-NH1 3.25Å; I228-C296 HydrophobicContact CD1-CB 4.15Å; I228-C296 HydrophobicContact CG1-CB 4.29Å; I228-C296 HydrophobicContact CG2-CB 3.82Å; I228-F303 HydrophobicContact CB-CE2 3.74Å; I228-F303 HydrophobicContact CB-CZ 4.27Å; I228-F303 HydrophobicContact CG1-CE2 4.25Å; I228-F303 HydrophobicContact CG2-CD2 4.31Å; I228-F303 HydrophobicContact CG2-CE2 3.6Å; I228-F303 HydrophobicContact CG2-CZ 4.28Å
229	L	95.7	Very high	91.1	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-76.8	-21.6	179.3	-68.3	173	0	0	0	113.4	L225 A226 P231 H232 I282 L286 F303 L307 V335 I338	L225-L229 PolarHBondContact O-N 2.66Å; A226-L229 PolarHBondContact O-N 3.36Å; L229-P231 VanDerWaalsContact C-N 3.32Å; L229-P231 VanDerWaalsContact O-N 3.12Å; L229-H232 WeakPolarHBondContact O-CA 3.41Å; L229-H232 VanDerWaalsContact O-CB 3.26Å; L229-H232 WeakPolarHBondContact O-CB 3.13Å; L229-H232 PolarHBondContact O-N 3.33Å; L229-H232 PolarHBondContact O-ND1 2.87Å; L229-I282 HydrophobicContact CD1-CG2 4.48Å; L229-I282 HydrophobicContact CD2-CG2 3.76Å; L229-L286 HydrophobicContact CD2-CD2 4.17Å; L229-F303 HydrophobicContact CD1-CE1 3.99Å; L229-F303 HydrophobicContact CD1-CZ 4.07Å; L229-F303 HydrophobicContact CD2-CE1 3.82Å; L229-F303 HydrophobicContact CD2-CZ 3.92Å; L229-F303 HydrophobicContact CG-CE1 3.9Å; L229-F303 HydrophobicContact CG-CZ 3.66Å; L229-L307 HydrophobicContact CD1-CD2 4.35Å; L229-V335 HydrophobicContact CD1-CG2 3.98Å; L229-I338 HydrophobicContact CB-CG2 3.69Å; L229-I338 HydrophobicContact CD1-CG2 4.45Å
230	K	93.7	Very high	90.8	Very high	120 Å²	120	63.1 Å²	63.1	52%	0.522	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-48.4	-41.9	-175.5	-170.1	67.8	-176.9	169.8	0	114.9	A226 H232 E233 I338	A226-K230 PolarHBondContact O-N 3.34Å; K230-H232 VanDerWaalsContact C-N 3.26Å; K230-H232 PolarHBondContact O-N 3.46Å; K230-E233 VanDerWaalsContact CD-OE2 3.26Å; K230-E233 WeakPolarHBondContact CD-OE2 3.26Å; K230-E233 VanDerWaalsContact CE-OE2 3.24Å; K230-E233 WeakPolarHBondContact CE-OE2 3.4Å; K230-E233 IonicContact NZ-OE2 3.64Å; K230-E233 PolarHBondContact NZ-OE2 3.37Å; K230-E233 PolarHBondContact O-N 2.95Å; K230-I338 HydrophobicContact CB-CD1 4.47Å; K230-I338 HydrophobicContact CD-CD1 4.23Å
231	P	92.2	Very high	90.5	Very high	48 Å²	48	68.6 Å²	68.6	31%	0.312	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-63	-29.4	176.4	-22.8	36.2	0	0	0	114	I228 L229 E233 K234	I228-P231 VanDerWaalsContact O-CD 3.22Å; I228-P231 WeakPolarHBondContact O-CD 3.26Å; L229-P231 VanDerWaalsContact C-N 3.32Å; L229-P231 VanDerWaalsContact O-N 3.12Å; P231-E233 PolarHBondContact O-N 3.48Å; P231-K234 VanDerWaalsContact O-CB 3.27Å; P231-K234 WeakPolarHBondContact O-CB 3.31Å; P231-K234 WeakPolarHBondContact O-CG 3.42Å; P231-K234 PolarHBondContact O-N 2.97Å; P231-K234 VanDerWaalsContact O-N 3.08Å
232	H	91.1	Very high	90.2	Very high	7 Å²	7	72.5 Å²	72.5	3%	0.032	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-69.2	-20.7	-180	-62.4	82.4	0	0	0	112.6	L229 K230 K234 L235 D289 L342	L229-H232 WeakPolarHBondContact O-CA 3.41Å; L229-H232 VanDerWaalsContact O-CB 3.26Å; L229-H232 WeakPolarHBondContact O-CB 3.13Å; L229-H232 PolarHBondContact O-N 3.33Å; L229-H232 PolarHBondContact O-ND1 2.87Å; K230-H232 VanDerWaalsContact C-N 3.26Å; K230-H232 PolarHBondContact O-N 3.46Å; H232-K234 PolarHBondContact O-N 3.21Å; H232-K234 VanDerWaalsContact O-N 3.12Å; H232-L235 HydrophobicContact CB-CD1 4.12Å; H232-L235 VanDerWaalsContact O-CB 3.23Å; H232-L235 WeakPolarHBondContact O-CB 3.26Å; H232-L235 WeakPolarHBondContact O-CG 3.35Å; H232-L235 PolarHBondContact O-N 2.7Å; H232-D289 IonicContact CE1-OD2 3.62Å; H232-D289 PolarHBondContact CE1-OD2 2.85Å; H232-D289 IonicContact NE2-OD2 2.78Å; H232-D289 PolarHBondContact NE2-OD2 2.96Å; H232-D289 VanDerWaalsContact NE2-OD2 3.12Å; H232-L342 HydrophobicContact CB-CD1 4.39Å; H232-L342 HydrophobicContact CB-CD2 4.19Å
233	E	87.3	Confident	90	Very high	38 Å²	38	77.1 Å²	77.1	18%	0.178	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-61.4	-19.9	171	-67.3	-170.9	131.8	0	0	112.4	K230 P231 L235 I236 I338 N341	K230-E233 VanDerWaalsContact CD-OE2 3.26Å; K230-E233 WeakPolarHBondContact CD-OE2 3.26Å; K230-E233 VanDerWaalsContact CE-OE2 3.24Å; K230-E233 WeakPolarHBondContact CE-OE2 3.4Å; K230-E233 IonicContact NZ-OE2 3.64Å; K230-E233 PolarHBondContact NZ-OE2 3.37Å; K230-E233 PolarHBondContact O-N 2.95Å; P231-E233 PolarHBondContact O-N 3.48Å; E233-L235 VanDerWaalsContact C-N 3.25Å; E233-L235 PolarHBondContact O-N 2.96Å; E233-I236 HydrophobicContact CB-CD1 4.36Å; E233-I236 WeakPolarHBondContact O-CB 3.48Å; E233-I236 WeakPolarHBondContact O-CG1 3.29Å; E233-I236 PolarHBondContact O-N 3.11Å; E233-I338 HydrophobicContact CG-CG1 4.42Å; E233-I338 HydrophobicContact CG-CG2 3.89Å; E233-N341 PolarHBondContact OE1-ND2 3.2Å
234	K	84.9	Confident	89.9	Confident	183 Å²	183	76.7 Å²	76.7	80%	0.796	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-73.3	-17.8	173.9	-60.6	-179.9	179	-179.3	0	113.2	P231 H232 I236	P231-K234 VanDerWaalsContact O-CB 3.27Å; P231-K234 WeakPolarHBondContact O-CB 3.31Å; P231-K234 WeakPolarHBondContact O-CG 3.42Å; P231-K234 PolarHBondContact O-N 2.97Å; P231-K234 VanDerWaalsContact O-N 3.08Å; H232-K234 PolarHBondContact O-N 3.21Å; H232-K234 VanDerWaalsContact O-N 3.12Å; K234-I236 PolarHBondContact O-N 2.66Å
235	L	81.4	Confident	89.6	Confident	88 Å²	88	78.7 Å²	78.7	46%	0.461	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-72.2	-12.3	174.2	-57.6	172.3	0	0	0	111.5	H232 E233 N237 H345	H232-L235 HydrophobicContact CB-CD1 4.12Å; H232-L235 VanDerWaalsContact O-CB 3.23Å; H232-L235 WeakPolarHBondContact O-CB 3.26Å; H232-L235 WeakPolarHBondContact O-CG 3.35Å; H232-L235 PolarHBondContact O-N 2.7Å; E233-L235 VanDerWaalsContact C-N 3.25Å; E233-L235 PolarHBondContact O-N 2.96Å; L235-N237 PolarHBondContact O-N 3.37Å; L235-N237 PolarHBondContact O-OD1 2.94Å; L235-H345 PolarHBondContact O-NE2 3.01Å
236	I	84.4	Confident	89.4	Confident	33 Å²	33	83.5 Å²	83.5	17%	0.169	41%	0.414	C	S	.	.			trans	-74.5	93.8	-179.5	-55.4	176.1	0	0	0	109	E233 K234 H238 G239 N341 L342 H345	E233-I236 HydrophobicContact CB-CD1 4.36Å; E233-I236 WeakPolarHBondContact O-CB 3.48Å; E233-I236 WeakPolarHBondContact O-CG1 3.29Å; E233-I236 PolarHBondContact O-N 3.11Å; K234-I236 PolarHBondContact O-N 2.66Å; I236-H238 VanDerWaalsContact C-N 3.29Å; I236-H238 PolarHBondContact O-N 3.24Å; I236-G239 PolarHBondContact O-N 3.37Å; I236-N341 HydrophobicContact CD1-CB 3.71Å; I236-L342 HydrophobicContact CD1-CD2 4.41Å; I236-L342 HydrophobicContact CG1-CD2 4.39Å; I236-H345 WeakPolarHBondContact CA-CD2 3.27Å; I236-H345 HydrophobicContact CG1-CB 4.02Å; I236-H345 HydrophobicContact CG2-CB 4.15Å
237	N	81.3	Confident	89.3	Confident	131 Å²	131	87.9 Å²	87.9	70%	0.701	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.1	-27.7	-174.8	-68.5	-27.5	0	0	0	113	L235 H345	L235-N237 PolarHBondContact O-N 3.37Å; L235-N237 PolarHBondContact O-OD1 2.94Å; N237-H345 PolarHBondContact N-NE2 2.71Å
238	H	82.8	Confident	89.2	Confident	167 Å²	167	84 Å²	84	77%	0.773	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	14.9	-178.9	-55.6	-67.3	0	0	0	113.2	I236	I236-H238 VanDerWaalsContact C-N 3.29Å; I236-H238 PolarHBondContact O-N 3.24Å
239	G	83.8	Confident	88.9	Confident	37 Å²	37	87.4 Å²	87.4	38%	0.381	44%	0.44	S	S	.	.			trans	-85.2	123.9	179.7	0	0	0	0	0	111.9	I236	I236-G239 PolarHBondContact O-N 3.37Å
240	I	87.2	Confident	88.7	Confident	90 Å²	90	90.1 Å²	90.1	46%	0.462	45%	0.454	S	S	.	.			trans	-88.8	126.4	175	-62.5	162.6	0	0	0	109.5	N242 F246	I240-N242 WeakPolarHBondContact CG2-O 3.45Å; I240-F246 HydrophobicContact CD1-CB 4.2Å; I240-F246 HydrophobicContact CD1-CD2 3.41Å; I240-F246 VanDerWaalsContact CD1-CD2 3.41Å; I240-F246 HydrophobicContact CD1-CE2 4.07Å; I240-F246 HydrophobicContact CD1-CG 4.14Å; I240-F246 HydrophobicContact CG2-CB 3.87Å
241	K	85.9	Confident	88.7	Confident	175 Å²	175	89.2 Å²	89.2	76%	0.761	46%	0.455	S	S	*	.			trans	-81	-37.3	179.5	-59.8	165.6	-175.4	149.2	0	112.6	E245	K241-E245 WeakPolarHBondContact CA-OE2 3.43Å; K241-E245 WeakPolarHBondContact CB-OE2 3.5Å; K241-E245 WeakPolarHBondContact CG-OE2 3.2Å; K241-E245 PolarHBondContact N-OE2 2.89Å; K241-E245 IonicContact NZ-OE1 2.61Å
242	N	89	Confident	88.7	Confident	83 Å²	83	92.2 Å²	92.2	44%	0.444	47%	0.472	S	S	.	.	S	Bend	trans	-155.2	169.3	-177	64.6	63.9	0	0	0	112.5	I240 M244 E245 F246	I240-N242 WeakPolarHBondContact CG2-O 3.45Å; N242-M244 VanDerWaalsContact C-N 3.26Å; N242-M244 PolarHBondContact O-N 2.97Å; N242-M244 WeakPolarHBondContact OD1-CA 3.4Å; N242-M244 WeakPolarHBondContact OD1-CB 3.48Å; N242-M244 PolarHBondContact OD1-N 3.5Å; N242-E245 PolarHBondContact O-N 3.04Å; N242-E245 PolarHBondContact OD1-N 3.26Å; N242-F246 PolarHBondContact O-N 2.95Å
243	S	91.1	Very high	88.8	Confident	97 Å²	97	95.8 Å²	95.8	68%	0.678	49%	0.491	S	S	*	.	H	α-helix	trans	-65.1	-24.8	-178.1	57.5	0	0	0	0	114.3	K247	S243-K247 WeakPolarHBondContact O-CB 3.48Å; S243-K247 PolarHBondContact O-N 3.36Å
244	M	93.7	Very high	89	Confident	111 Å²	111	100.6 Å²	100.6	55%	0.547	52%	0.518	S	S	.	.	H	α-helix	trans	-74.9	-39.6	177.2	-69.7	-60.4	-60.3	0	0	111.4	N242 F246 K247 N248	N242-M244 VanDerWaalsContact C-N 3.26Å; N242-M244 PolarHBondContact O-N 2.97Å; N242-M244 WeakPolarHBondContact OD1-CA 3.4Å; N242-M244 WeakPolarHBondContact OD1-CB 3.48Å; N242-M244 PolarHBondContact OD1-N 3.5Å; M244-F246 VanDerWaalsContact C-N 3.34Å; M244-K247 HydrophobicContact CE-CD 4.41Å; M244-K247 PolarHBondContact O-N 3.13Å; M244-N248 WeakPolarHBondContact O-CB 3.3Å; M244-N248 PolarHBondContact O-N 3.41Å; M244-N248 PolarHBondContact O-ND2 3.08Å; M244-N248 PolarHBondContact O-OD1 3.11Å
245	E	91.4	Very high	89.4	Confident	58 Å²	58	95.9 Å²	95.9	27%	0.271	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-45.2	173.3	-175.3	172.4	-144.7	0	0	110.7	K241 N242 K247 N248 I249	K241-E245 WeakPolarHBondContact CA-OE2 3.43Å; K241-E245 WeakPolarHBondContact CB-OE2 3.5Å; K241-E245 WeakPolarHBondContact CG-OE2 3.2Å; K241-E245 PolarHBondContact N-OE2 2.89Å; K241-E245 IonicContact NZ-OE1 2.61Å; N242-E245 PolarHBondContact O-N 3.04Å; N242-E245 PolarHBondContact OD1-N 3.26Å; E245-K247 PolarHBondContact O-N 2.74Å; E245-N248 PolarHBondContact O-N 2.81Å; E245-I249 HydrophobicContact CG-CD1 4.18Å; E245-I249 VanDerWaalsContact O-CG1 3.3Å; E245-I249 WeakPolarHBondContact O-CG1 3.48Å; E245-I249 PolarHBondContact O-N 2.82Å
246	F	92.4	Very high	90	Very high	102 Å²	102	97.3 Å²	97.3	45%	0.447	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-47.2	174	-178.2	-122.4	0	0	0	113	I240 N242 M244 N248 I249 I250	I240-F246 HydrophobicContact CD1-CB 4.2Å; I240-F246 HydrophobicContact CD1-CD2 3.41Å; I240-F246 VanDerWaalsContact CD1-CD2 3.41Å; I240-F246 HydrophobicContact CD1-CE2 4.07Å; I240-F246 HydrophobicContact CD1-CG 4.14Å; I240-F246 HydrophobicContact CG2-CB 3.87Å; N242-F246 PolarHBondContact O-N 2.95Å; M244-F246 VanDerWaalsContact C-N 3.34Å; F246-N248 VanDerWaalsContact C-N 3.32Å; F246-N248 PolarHBondContact O-N 3.32Å; F246-I249 PolarHBondContact O-N 2.84Å; F246-I250 HydrophobicContact CD1-CD1 3.96Å; F246-I250 HydrophobicContact CD2-CD1 4.07Å; F246-I250 HydrophobicContact CD2-CG1 4.35Å; F246-I250 HydrophobicContact CE1-CD1 3.36Å; F246-I250 HydrophobicContact CE2-CD1 3.5Å; F246-I250 VanDerWaalsContact CE2-CD1 3.5Å; F246-I250 HydrophobicContact CE2-CG1 4.05Å; F246-I250 HydrophobicContact CG-CD1 4.31Å; F246-I250 HydrophobicContact CZ-CD1 3.14Å; F246-I250 HydrophobicContact CZ-CG1 4.18Å; F246-I250 PolarHBondContact O-N 3Å
247	K	93.8	Very high	90.5	Very high	102 Å²	102	105.5 Å²	105.5	44%	0.443	54%	0.543	S	S	.	.	H	α-helix	trans	-58.1	-46.4	177.8	-171.2	-143.1	177.7	-112.1	0	111	S243 M244 E245 I249 I250 D251	S243-K247 WeakPolarHBondContact O-CB 3.48Å; S243-K247 PolarHBondContact O-N 3.36Å; M244-K247 HydrophobicContact CE-CD 4.41Å; M244-K247 PolarHBondContact O-N 3.13Å; E245-K247 PolarHBondContact O-N 2.74Å; K247-I249 VanDerWaalsContact C-N 3.29Å; K247-I249 PolarHBondContact O-N 3.35Å; K247-I250 PolarHBondContact O-N 3.01Å; K247-D251 IonicContact NZ-OD1 3.45Å; K247-D251 IonicContact NZ-OD2 3.99Å; K247-D251 PolarHBondContact NZ-OD2 3.48Å; K247-D251 WeakPolarHBondContact O-CB 3.41Å; K247-D251 PolarHBondContact O-N 3.19Å
248	N	93.8	Very high	91.2	Very high	89 Å²	89	106.3 Å²	106.3	48%	0.476	55%	0.547	S	S	.	.	H	α-helix	trans	-64	-34	179.2	-66.5	-10.9	0	0	0	112.4	M244 E245 F246 T252	M244-N248 WeakPolarHBondContact O-CB 3.3Å; M244-N248 PolarHBondContact O-N 3.41Å; M244-N248 PolarHBondContact O-ND2 3.08Å; M244-N248 PolarHBondContact O-OD1 3.11Å; E245-N248 PolarHBondContact O-N 2.81Å; F246-N248 VanDerWaalsContact C-N 3.32Å; F246-N248 PolarHBondContact O-N 3.32Å; N248-T252 WeakPolarHBondContact O-CG2 3.47Å
249	I	91.1	Very high	91.7	Very high	77 Å²	77	103.3 Å²	103.3	40%	0.395	53%	0.533	S	S	.	.	H	α-helix	trans	-68.5	-47.8	174.9	-68.2	163.7	0	0	0	110.2	E245 F246 K247 D251 T252 I253	E245-I249 HydrophobicContact CG-CD1 4.18Å; E245-I249 VanDerWaalsContact O-CG1 3.3Å; E245-I249 WeakPolarHBondContact O-CG1 3.48Å; E245-I249 PolarHBondContact O-N 2.82Å; F246-I249 PolarHBondContact O-N 2.84Å; K247-I249 VanDerWaalsContact C-N 3.29Å; K247-I249 PolarHBondContact O-N 3.35Å; I249-D251 VanDerWaalsContact C-N 3.32Å; I249-D251 PolarHBondContact O-N 3.04Å; I249-T252 PolarHBondContact O-N 2.81Å; I249-T252 VanDerWaalsContact O-N 3.1Å; I249-T252 PolarHBondContact O-OG1 3.43Å; I249-I253 HydrophobicContact CG2-CD1 4.08Å; I249-I253 WeakPolarHBondContact O-CG1 3.44Å
250	I	91.2	Very high	92.2	Very high	56 Å²	56	108 Å²	108	29%	0.287	55%	0.554	S	S	.	*	H	α-helix	trans	-64	-38	179.1	-72.2	179.8	0	0	0	111.9	F246 K247 T252 I253	F246-I250 HydrophobicContact CD1-CD1 3.96Å; F246-I250 HydrophobicContact CD2-CD1 4.07Å; F246-I250 HydrophobicContact CD2-CG1 4.35Å; F246-I250 HydrophobicContact CE1-CD1 3.36Å; F246-I250 HydrophobicContact CE2-CD1 3.5Å; F246-I250 VanDerWaalsContact CE2-CD1 3.5Å; F246-I250 HydrophobicContact CE2-CG1 4.05Å; F246-I250 HydrophobicContact CG-CD1 4.31Å; F246-I250 HydrophobicContact CZ-CD1 3.14Å; F246-I250 HydrophobicContact CZ-CG1 4.18Å; F246-I250 PolarHBondContact O-N 3Å; K247-I250 PolarHBondContact O-N 3.01Å; I250-T252 PolarHBondContact O-N 2.85Å; I250-I253 PolarHBondContact O-N 2.88Å
251	D	92.6	Very high	92.4	Very high	102 Å²	102	109.1 Å²	109.1	55%	0.545	56%	0.559	S	S	.	*	T	Hydrogen-bonded Turn	trans	-61.6	-14.5	177.3	-73.2	-13.4	0	0	0	112.5	K247 I249	K247-D251 IonicContact NZ-OD1 3.45Å; K247-D251 IonicContact NZ-OD2 3.99Å; K247-D251 PolarHBondContact NZ-OD2 3.48Å; K247-D251 WeakPolarHBondContact O-CB 3.41Å; K247-D251 PolarHBondContact O-N 3.19Å; I249-D251 VanDerWaalsContact C-N 3.32Å; I249-D251 PolarHBondContact O-N 3.04Å
252	T	92.7	Very high	92.7	Very high	110 Å²	110	104 Å²	104	68%	0.675	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.3	-2.3	177.2	61.8	0	0	0	0	114.7	N248 I249 I250	N248-T252 WeakPolarHBondContact O-CG2 3.47Å; I249-T252 PolarHBondContact O-N 2.81Å; I249-T252 VanDerWaalsContact O-N 3.1Å; I249-T252 PolarHBondContact O-OG1 3.43Å; I250-T252 PolarHBondContact O-N 2.85Å
253	I	92.2	Very high	92.8	Very high	83 Å²	83	105.7 Å²	105.7	43%	0.426	57%	0.567	S	S	.	*			trans	-104.6	112	-178	-62.1	167.8	0	0	0	108.3	I249 I250 I255	I249-I253 HydrophobicContact CG2-CD1 4.08Å; I249-I253 WeakPolarHBondContact O-CG1 3.44Å; I250-I253 PolarHBondContact O-N 2.88Å; I253-I255 HydrophobicContact CG2-CG1 4.39Å
254	D	92.9	Very high	92.9	Very high	138 Å²	138	110.2 Å²	110.2	74%	0.738	58%	0.575	S	S	*	*			trans	-87.3	134	164.5	-65.2	-49.4	0	0	0	108.3
255	I	91.8	Very high	92.7	Very high	84 Å²	84	111.1 Å²	111.1	43%	0.431	58%	0.582	S	S	.	*			trans	-104.2	119.6	-179.4	-55.6	170.3	0	0	0	107.2	I253 E259 M261	I253-I255 HydrophobicContact CG2-CG1 4.39Å; I255-E259 HydrophobicContact CG2-CB 3.69Å; I255-E259 WeakPolarHBondContact CG2-O 3.41Å; I255-M261 HydrophobicContact CD1-CB 3.93Å; I255-M261 HydrophobicContact CD1-CE 3.84Å; I255-M261 HydrophobicContact CG1-CE 4.48Å
256	E	94.9	Very high	92.6	Very high	118 Å²	118	111.8 Å²	111.8	55%	0.551	59%	0.59	S	S	*	*			trans	-72.1	165.3	177.9	-60.7	-61.2	150.2	0	0	112	D258 E259	E256-D258 PolarHBondContact O-N 3.29Å; E256-E259 HydrophobicContact CB-CB 4.46Å; E256-E259 HydrophobicContact CB-CG 4.09Å; E256-E259 PolarHBondContact N-OE2 2.95Å; E256-E259 PolarHBondContact O-N 3.39Å
257	E	94.1	Very high	92.3	Very high	206 Å²	206	111.2 Å²	111.2	96%	0.963	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	-25.4	-175.9	-66.1	-171.8	170.9	0	0	113.8
258	D	95.9	Very high	92	Very high	147 Å²	147	109.8 Å²	109.8	79%	0.786	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.9	-0.1	176.6	67.2	-44.5	0	0	0	113.8	E256	E256-D258 PolarHBondContact O-N 3.29Å
259	E	94.2	Very high	91.9	Very high	105 Å²	105	107.4 Å²	107.4	49%	0.491	59%	0.589	S	S	.	*			trans	-98.7	150.1	179	-69.3	-173.2	154.3	0	0	112.6	I255 E256	I255-E259 HydrophobicContact CG2-CB 3.69Å; I255-E259 WeakPolarHBondContact CG2-O 3.41Å; E256-E259 HydrophobicContact CB-CB 4.46Å; E256-E259 HydrophobicContact CB-CG 4.09Å; E256-E259 PolarHBondContact N-OE2 2.95Å; E256-E259 PolarHBondContact O-N 3.39Å
260	V	93.4	Very high	92	Very high	134 Å²	134	105.6 Å²	105.6	81%	0.812	58%	0.578	S	S	*	*			trans	-131.9	131.9	176.1	-66.6	0	0	0	0	111
261	M	91.8	Very high	92	Very high	114 Å²	114	103.7 Å²	103.7	56%	0.562	57%	0.569	S	S	*	*			trans	-85.1	118.1	169.5	-175.2	178.2	-75.3	0	0	109.8	I255	I255-M261 HydrophobicContact CD1-CB 3.93Å; I255-M261 HydrophobicContact CD1-CE 3.84Å; I255-M261 HydrophobicContact CG1-CE 4.48Å
262	A	92.5	Very high	91.9	Very high	67 Å²	67	103.5 Å²	103.5	55%	0.554	57%	0.568	S	S	*	*			trans	-114.7	152.6	176	0	0	0	0	0	111.3	F264	A262-F264 HydrophobicContact CB-CE2 3.92Å; A262-F264 HydrophobicContact CB-CZ 4.1Å
263	S	91.8	Very high	92	Very high	119 Å²	119	98.3 Å²	98.3	83%	0.832	54%	0.536	S	S	*	.			trans	-126	136.5	172.7	68.6	0	0	0	0	110.2
264	F	91.9	Very high	92.2	Very high	193 Å²	193	97.2 Å²	97.2	85%	0.846	53%	0.534	S	S	*	.			trans	-120	133.5	-179.1	-60.8	-82.7	0	0	0	109.8	A262	A262-F264 HydrophobicContact CB-CE2 3.92Å; A262-F264 HydrophobicContact CB-CZ 4.1Å
265	D	89.6	Confident	92.3	Very high	130 Å²	130	90.8 Å²	90.8	70%	0.695	50%	0.5	S	S	*	.			trans	-103.6	130.6	173	-174.9	36.6	0	0	0	109.4	S267	D265-S267 PolarHBondContact O-N 3.19Å
266	V	89.7	Confident	92.6	Very high	71 Å²	71	91.4 Å²	91.4	43%	0.43	50%	0.504	S	S	.	.			trans	-79.4	112.8	176.6	-175.5	0	0	0	0	109.3	S268 L269 M344	V266-S268 PolarHBondContact O-N 2.8Å; V266-L269 HydrophobicContact CB-CB 4.31Å; V266-L269 HydrophobicContact CG1-CB 3.85Å; V266-L269 HydrophobicContact CG1-CD1 3.95Å; V266-L269 HydrophobicContact CG1-CG 4.45Å; V266-M344 HydrophobicContact CG2-CE 3.77Å; V266-M344 HydrophobicContact CG2-SD 4.27Å
267	S	86.5	Confident	92.7	Very high	90 Å²	90	93 Å²	93	63%	0.629	51%	0.505	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	120.1	174.6	-71.8	0	0	0	0	111.2	D265 L269 N272	D265-S267 PolarHBondContact O-N 3.19Å; S267-L269 VanDerWaalsContact C-N 3.25Å; S267-L269 PolarHBondContact O-N 3.43Å; S267-L269 VanDerWaalsContact O-N 3.14Å; S267-N272 PolarHBondContact O-ND2 2.79Å
268	S	87.6	Confident	92.8	Very high	73 Å²	73	83.2 Å²	83.2	51%	0.51	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	41.5	171.8	-56.3	0	0	0	0	114.2	V266 F270 T271 N272	V266-S268 PolarHBondContact O-N 2.8Å; S268-F270 VanDerWaalsContact C-N 3.31Å; S268-F270 PolarHBondContact O-N 2.69Å; S268-T271 VanDerWaalsContact CB-OG1 3.29Å; S268-T271 WeakPolarHBondContact CB-OG1 3.37Å; S268-T271 PolarHBondContact O-N 2.68Å; S268-T271 PolarHBondContact O-OG1 3.04Å; S268-N272 PolarHBondContact O-N 3.44Å
269	L	92.1	Very high	92.9	Very high	39 Å²	39	76.8 Å²	76.8	20%	0.204	43%	0.425	C	S	.	.	H	α-helix	trans	-34.5	-58.7	-175.4	174.5	58.9	0	0	0	113.6	V266 S267 T271 N272 V273 A340 M344	V266-L269 HydrophobicContact CB-CB 4.31Å; V266-L269 HydrophobicContact CG1-CB 3.85Å; V266-L269 HydrophobicContact CG1-CD1 3.95Å; V266-L269 HydrophobicContact CG1-CG 4.45Å; S267-L269 VanDerWaalsContact C-N 3.25Å; S267-L269 PolarHBondContact O-N 3.43Å; S267-L269 VanDerWaalsContact O-N 3.14Å; L269-T271 PolarHBondContact O-N 3.1Å; L269-N272 CarbonylContact O-C 3.59Å; L269-N272 PolarHBondContact O-N 2.99Å; L269-V273 HydrophobicContact CD1-CG2 3.95Å; L269-V273 HydrophobicContact CG-CG2 4.4Å; L269-V273 VanDerWaalsContact O-CG2 3.25Å; L269-V273 WeakPolarHBondContact O-CG2 3.25Å; L269-V273 PolarHBondContact O-N 3.15Å; L269-A340 HydrophobicContact CD2-CB 4.11Å; L269-A340 HydrophobicContact CG-CB 4.39Å; L269-M344 HydrophobicContact CD1-CG 3.86Å; L269-M344 HydrophobicContact CD1-SD 3.58Å; L269-M344 VanDerWaalsContact CD1-SD 3.58Å; L269-M344 HydrophobicContact CD2-CG 4.17Å
270	F	92.2	Very high	93	Very high	38 Å²	38	76.2 Å²	76.2	17%	0.167	43%	0.426	C	S	.	.	H	α-helix	trans	-56.6	-42.9	-176.8	-71.3	-88.6	0	0	0	113.8	S268 N272 G328 I329 M331 A340	S268-F270 VanDerWaalsContact C-N 3.31Å; S268-F270 PolarHBondContact O-N 2.69Å; F270-N272 PolarHBondContact O-N 3.16Å; F270-G328 CarbonylContact O-C 3.53Å; F270-G328 WeakPolarHBondContact O-CA 3.29Å; F270-I329 CarbonylContact C-O 3.57Å; F270-I329 HydrophobicContact CB-CG1 4.27Å; F270-I329 HydrophobicContact CD1-CD1 3.89Å; F270-I329 HydrophobicContact CD1-CG1 3.89Å; F270-I329 HydrophobicContact CE1-CD1 4.37Å; F270-I329 VanDerWaalsContact O-CG1 3.31Å; F270-I329 WeakPolarHBondContact O-CG1 3.5Å; F270-I329 PolarHBondContact O-N 2.65Å; F270-I329 VanDerWaalsContact O-O 3.08Å; F270-M331 HydrophobicContact CB-CE 4.41Å; F270-M331 HydrophobicContact CD2-CE 3.88Å; F270-M331 HydrophobicContact CD2-CG 4.48Å; F270-M331 HydrophobicContact CG-CB 4.44Å; F270-M331 HydrophobicContact CG-CE 4.35Å; F270-A340 HydrophobicContact CE1-CB 4.18Å; F270-A340 HydrophobicContact CZ-CB 4.43Å
271	T	90.5	Very high	93.1	Very high	16 Å²	16	71.8 Å²	71.8	10%	0.098	40%	0.397	C	S	.	.	H	α-helix	trans	-76	-14.7	-179.1	57.2	0	0	0	0	112.9	S268 L269 G328	S268-T271 VanDerWaalsContact CB-OG1 3.29Å; S268-T271 WeakPolarHBondContact CB-OG1 3.37Å; S268-T271 PolarHBondContact O-N 2.68Å; S268-T271 PolarHBondContact O-OG1 3.04Å; L269-T271 PolarHBondContact O-N 3.1Å; T271-G328 WeakPolarHBondContact O-CA 3.45Å
272	N	92.5	Very high	93.4	Very high	98 Å²	98	66.4 Å²	66.4	52%	0.524	37%	0.37	S	S	.	.	H	α-helix	trans	-110.1	-3.9	-172.6	-65.8	-14.7	0	0	0	113.7	S267 S268 L269 F270 P274	S267-N272 PolarHBondContact O-ND2 2.79Å; S268-N272 PolarHBondContact O-N 3.44Å; L269-N272 CarbonylContact O-C 3.59Å; L269-N272 PolarHBondContact O-N 2.99Å; F270-N272 PolarHBondContact O-N 3.16Å; N272-P274 WeakPolarHBondContact O-CD 3.45Å
273	V	94.5	Very high	93.6	Very high	1 Å²	1	67 Å²	67	1%	0.006	36%	0.359	C	S	.	.			trans	-63.7	117	174.6	178.4	0	0	0	0	110	L269 I275 A278 G328 I329 F343	L269-V273 HydrophobicContact CD1-CG2 3.95Å; L269-V273 HydrophobicContact CG-CG2 4.4Å; L269-V273 VanDerWaalsContact O-CG2 3.25Å; L269-V273 WeakPolarHBondContact O-CG2 3.25Å; L269-V273 PolarHBondContact O-N 3.15Å; V273-I275 PolarHBondContact O-N 3.1Å; V273-A278 HydrophobicContact CG1-CB 3.86Å; V273-G328 VanDerWaalsContact O-CA 3.3Å; V273-G328 WeakPolarHBondContact O-CA 3.12Å; V273-I329 HydrophobicContact CB-CD1 4.28Å; V273-I329 HydrophobicContact CB-CG1 4.17Å; V273-I329 HydrophobicContact CG2-CD1 3.94Å; V273-I329 HydrophobicContact CG2-CG1 4.12Å; V273-F343 HydrophobicContact CG1-CB 4.15Å; V273-F343 HydrophobicContact CG1-CD1 3.99Å; V273-F343 HydrophobicContact CG1-CD2 4.18Å; V273-F343 HydrophobicContact CG1-CG 3.81Å; V273-F343 HydrophobicContact CG2-CD1 4.16Å
274	P	95.7	Very high	93.8	Very high	60 Å²	60	64 Å²	64	39%	0.39	34%	0.341	S	S	.	.			trans	-68.5	114.2	174.5	-15	30.6	0	0	0	110	N272 N276 R277 A278 F343	N272-P274 WeakPolarHBondContact O-CD 3.45Å; P274-N276 PolarHBondContact O-N 3.47Å; P274-R277 HydrophobicContact CB-CB 4.13Å; P274-R277 PolarHBondContact O-N 3.2Å; P274-A278 PolarHBondContact O-N 3.1Å; P274-F343 HydrophobicContact CG-CE2 4.3Å; P274-F343 HydrophobicContact CG-CZ 4.06Å
275	I	95.9	Very high	93.9	Very high	3 Å²	3	56 Å²	56	2%	0.015	31%	0.309	C	S	.	.	H	α-helix	trans	-58.4	-48.8	-171.9	-63.3	175.8	0	0	0	111.1	V273 R277 A278 L279 L311 R312 G328 I329	V273-I275 PolarHBondContact O-N 3.1Å; I275-R277 VanDerWaalsContact C-N 3.33Å; I275-R277 PolarHBondContact O-N 3.48Å; I275-A278 PolarHBondContact O-N 2.83Å; I275-L279 HydrophobicContact CG2-CD1 3.87Å; I275-L279 HydrophobicContact CG2-CG 4.27Å; I275-L279 VanDerWaalsContact O-CG 3.3Å; I275-L279 WeakPolarHBondContact O-CG 3.34Å; I275-L279 PolarHBondContact O-N 3.03Å; I275-L311 HydrophobicContact CG2-CB 4.19Å; I275-L311 HydrophobicContact CG2-CD1 4.16Å; I275-R312 HydrophobicContact CD1-CG 4Å; I275-R312 HydrophobicContact CG2-CG 4.44Å; I275-G328 WeakPolarHBondContact CD1-O 3.48Å; I275-I329 HydrophobicContact CG1-CG2 4.5Å
276	N	96.8	Very high	94.1	Very high	98 Å²	98	50 Å²	50	52%	0.524	28%	0.277	S	S	.	.	H	α-helix	trans	-56.5	-48.1	-179.2	-67.2	-17.5	0	0	0	111.5	P274 A278 L279 D280 R312	P274-N276 PolarHBondContact O-N 3.47Å; N276-A278 VanDerWaalsContact C-N 3.34Å; N276-A278 PolarHBondContact O-N 3.26Å; N276-L279 WeakPolarHBondContact O-CB 3.34Å; N276-L279 PolarHBondContact O-N 3.27Å; N276-L279 VanDerWaalsContact O-N 3.13Å; N276-D280 VanDerWaalsContact O-CG 3.29Å; N276-D280 PolarHBondContact O-N 3.4Å; N276-R312 PolarHBondContact OD1-NH2 3.04Å
277	R	96.7	Very high	94.4	Very high	151 Å²	151	52.2 Å²	52.2	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-64.8	-40.1	-178.2	-171.3	60	175.1	177.3	1.2	111.8	P274 I275 L279 D280 I281 F343	P274-R277 HydrophobicContact CB-CB 4.13Å; P274-R277 PolarHBondContact O-N 3.2Å; I275-R277 VanDerWaalsContact C-N 3.33Å; I275-R277 PolarHBondContact O-N 3.48Å; R277-L279 VanDerWaalsContact C-N 3.32Å; R277-L279 PolarHBondContact O-N 2.97Å; R277-D280 PolarHBondContact O-N 3.3Å; R277-I281 HydrophobicContact CG-CD1 4.31Å; R277-I281 WeakPolarHBondContact O-CG1 3.34Å; R277-I281 PolarHBondContact O-N 3.04Å; R277-I281 VanDerWaalsContact O-N 3.12Å; R277-F343 HydrophobicContact CB-CE2 4.16Å; R277-F343 HydrophobicContact CG-CE2 3.92Å
278	A	96.5	Very high	94.7	Very high	1 Å²	1	52 Å²	52	1%	0.008	28%	0.281	C	S	.	.	H	α-helix	trans	-64.2	-37.6	175.3	0	0	0	0	0	112	V273 P274 I275 N276 I282 V339 F343	V273-A278 HydrophobicContact CG1-CB 3.86Å; P274-A278 PolarHBondContact O-N 3.1Å; I275-A278 PolarHBondContact O-N 2.83Å; N276-A278 VanDerWaalsContact C-N 3.34Å; N276-A278 PolarHBondContact O-N 3.26Å; A278-I282 WeakPolarHBondContact O-CB 3.26Å; A278-I282 WeakPolarHBondContact O-CD1 3.4Å; A278-I282 WeakPolarHBondContact O-CG1 3.3Å; A278-I282 PolarHBondContact O-N 2.98Å; A278-V339 HydrophobicContact CB-CG1 3.83Å; A278-F343 HydrophobicContact CB-CB 4.33Å; A278-F343 HydrophobicContact CB-CD2 4.13Å
279	L	97.8	Very high	95	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.063	26%	0.264	C	S	.	.	H	α-helix	trans	-66.2	-40.6	175.2	-67	171.5	0	0	0	112.1	I275 N276 R277 I282 Y283 I304 L307 D308 L311	I275-L279 HydrophobicContact CG2-CD1 3.87Å; I275-L279 HydrophobicContact CG2-CG 4.27Å; I275-L279 VanDerWaalsContact O-CG 3.3Å; I275-L279 WeakPolarHBondContact O-CG 3.34Å; I275-L279 PolarHBondContact O-N 3.03Å; N276-L279 WeakPolarHBondContact O-CB 3.34Å; N276-L279 PolarHBondContact O-N 3.27Å; N276-L279 VanDerWaalsContact O-N 3.13Å; R277-L279 VanDerWaalsContact C-N 3.32Å; R277-L279 PolarHBondContact O-N 2.97Å; L279-I282 PolarHBondContact O-N 2.9Å; L279-Y283 WeakPolarHBondContact O-CB 3.5Å; L279-Y283 PolarHBondContact O-N 2.63Å; L279-I304 HydrophobicContact CB-CG2 4.32Å; L279-I304 HydrophobicContact CD2-CD1 4.2Å; L279-I304 HydrophobicContact CD2-CG2 4.31Å; L279-I304 WeakPolarHBondContact O-CD1 3.25Å; L279-L307 HydrophobicContact CD2-CB 4.03Å; L279-L307 HydrophobicContact CD2-CD2 3.68Å; L279-L307 HydrophobicContact CD2-CG 3.68Å; L279-D308 HydrophobicContact CD1-CB 3.7Å; L279-D308 WeakPolarHBondContact CD1-OD1 3.32Å; L279-D308 HydrophobicContact CD2-CB 4.39Å; L279-L311 HydrophobicContact CD2-CD1 4.1Å
280	D	97.8	Very high	94.9	Very high	93 Å²	93	55.8 Å²	55.8	50%	0.497	30%	0.295	S	S	.	.	H	α-helix	trans	-62.2	-45.6	177.4	-62.6	-27	0	0	0	111.7	N276 R277 I282 Y283 A284	N276-D280 VanDerWaalsContact O-CG 3.29Å; N276-D280 PolarHBondContact O-N 3.4Å; R277-D280 PolarHBondContact O-N 3.3Å; D280-I282 VanDerWaalsContact C-N 3.35Å; D280-I282 PolarHBondContact O-N 3.39Å; D280-Y283 WeakPolarHBondContact O-CB 3.25Å; D280-Y283 PolarHBondContact O-N 2.97Å; D280-A284 PolarHBondContact O-N 2.67Å; D280-A284 VanDerWaalsContact O-N 3.08Å
281	I	95.6	Very high	94.9	Very high	40 Å²	40	58.6 Å²	58.6	21%	0.205	31%	0.311	C	S	.	.	H	α-helix	trans	-60.1	-48.1	176.7	-67.4	165.6	0	0	0	110	R277 Y283 A284 C285 F343	R277-I281 HydrophobicContact CG-CD1 4.31Å; R277-I281 WeakPolarHBondContact O-CG1 3.34Å; R277-I281 PolarHBondContact O-N 3.04Å; R277-I281 VanDerWaalsContact O-N 3.12Å; I281-Y283 VanDerWaalsContact C-N 3.31Å; I281-Y283 PolarHBondContact O-N 2.81Å; I281-A284 PolarHBondContact O-N 3.33Å; I281-C285 PolarHBondContact O-N 3.03Å; I281-C285 PolarHBondContact O-SG 2.98Å; I281-F343 HydrophobicContact CD1-CD2 4.03Å
282	I	96.5	Very high	95	Very high	1 Å²	1	58 Å²	58	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-66	-35.8	-179.6	-67.2	168.1	0	0	0	111.1	L229 A278 L279 D280 C285 L286 I304 L307 V339 L342	L229-I282 HydrophobicContact CD1-CG2 4.48Å; L229-I282 HydrophobicContact CD2-CG2 3.76Å; A278-I282 WeakPolarHBondContact O-CB 3.26Å; A278-I282 WeakPolarHBondContact O-CD1 3.4Å; A278-I282 WeakPolarHBondContact O-CG1 3.3Å; A278-I282 PolarHBondContact O-N 2.98Å; L279-I282 PolarHBondContact O-N 2.9Å; D280-I282 VanDerWaalsContact C-N 3.35Å; D280-I282 PolarHBondContact O-N 3.39Å; I282-C285 WeakPolarHBondContact O-CB 3.23Å; I282-C285 PolarHBondContact O-N 3.31Å; I282-L286 HydrophobicContact CG2-CD1 3.85Å; I282-L286 HydrophobicContact CG2-CG 4.25Å; I282-L286 WeakPolarHBondContact O-CB 3.49Å; I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 2.91Å; I282-I304 HydrophobicContact CB-CD1 4.1Å; I282-I304 HydrophobicContact CG2-CD1 3.81Å; I282-L307 HydrophobicContact CB-CD2 4.46Å; I282-L307 HydrophobicContact CD1-CD2 3.69Å; I282-L307 HydrophobicContact CG2-CD2 3.96Å; I282-V339 HydrophobicContact CD1-CB 4.32Å; I282-V339 HydrophobicContact CD1-CG1 4.14Å; I282-V339 HydrophobicContact CD1-CG2 3.84Å; I282-L342 HydrophobicContact CD1-CD1 4.37Å; I282-L342 HydrophobicContact CG1-CB 4.38Å; I282-L342 HydrophobicContact CG1-CD1 3.93Å
283	Y	97.2	Very high	94.9	Very high	80 Å²	80	59.5 Å²	59.5	31%	0.314	32%	0.316	S	S	.	.	H	α-helix	trans	-59.9	-48.2	175.5	-176	-93.4	0	0	0	110.9	L279 D280 I281 C285 L286 E287 P300 I304	L279-Y283 WeakPolarHBondContact O-CB 3.5Å; L279-Y283 PolarHBondContact O-N 2.63Å; D280-Y283 WeakPolarHBondContact O-CB 3.25Å; D280-Y283 PolarHBondContact O-N 2.97Å; I281-Y283 VanDerWaalsContact C-N 3.31Å; I281-Y283 PolarHBondContact O-N 2.81Å; Y283-C285 VanDerWaalsContact C-N 3.34Å; Y283-C285 PolarHBondContact O-N 3.25Å; Y283-L286 PolarHBondContact O-N 3.45Å; Y283-L286 VanDerWaalsContact O-N 3.11Å; Y283-E287 HydrophobicContact CD1-CG 4.18Å; Y283-E287 HydrophobicContact CE1-CG 3.68Å; Y283-E287 WeakPolarHBondContact CE1-OE1 3.39Å; Y283-E287 WeakPolarHBondContact CE1-OE2 3.11Å; Y283-E287 PolarHBondContact O-N 3.17Å; Y283-E287 PolarHBondContact OH-OE1 2.9Å; Y283-P300 HydrophobicContact CD2-CB 4.09Å; Y283-P300 HydrophobicContact CE2-CB 3.84Å; Y283-I304 HydrophobicContact CD2-CB 4.47Å; Y283-I304 HydrophobicContact CD2-CG1 3.72Å; Y283-I304 HydrophobicContact CG-CG1 4.3Å
284	A	95.4	Very high	94.8	Very high	56 Å²	56	66.4 Å²	66.4	46%	0.463	35%	0.352	S	S	.	.	H	α-helix	trans	-62.2	-39.7	176.9	0	0	0	0	0	112.5	D280 I281 L286 E287 S288	D280-A284 PolarHBondContact O-N 2.67Å; D280-A284 VanDerWaalsContact O-N 3.08Å; I281-A284 PolarHBondContact O-N 3.33Å; A284-L286 VanDerWaalsContact C-N 3.32Å; A284-L286 PolarHBondContact O-N 2.89Å; A284-E287 PolarHBondContact O-N 3.18Å; A284-S288 PolarHBondContact O-N 2.89Å; A284-S288 VanDerWaalsContact O-N 3.13Å; A284-S288 PolarHBondContact O-OG 2.94Å
285	C	93.9	Very high	94.6	Very high	26 Å²	26	67.5 Å²	67.5	18%	0.176	35%	0.348	C	S	.	.	H	α-helix	trans	-60.5	-40.8	172.5	-67	0	0	0	0	112.3	I281 I282 Y283 S288 D289	I281-C285 PolarHBondContact O-N 3.03Å; I281-C285 PolarHBondContact O-SG 2.98Å; I282-C285 WeakPolarHBondContact O-CB 3.23Å; I282-C285 PolarHBondContact O-N 3.31Å; Y283-C285 VanDerWaalsContact C-N 3.34Å; Y283-C285 PolarHBondContact O-N 3.25Å; C285-S288 WeakPolarHBondContact CA-OG 3.11Å; C285-S288 PolarHBondContact O-OG 2.84Å; C285-D289 WeakPolarHBondContact O-CB 3.17Å; C285-D289 PolarHBondContact O-N 2.83Å
286	L	95.5	Very high	94.5	Very high	2 Å²	2	67.4 Å²	67.4	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-73.4	-32.9	180	-69.1	168.3	0	0	0	112.8	L229 I282 Y283 A284 S288 D289 L292 P300 F303 I304	L229-L286 HydrophobicContact CD2-CD2 4.17Å; I282-L286 HydrophobicContact CG2-CD1 3.85Å; I282-L286 HydrophobicContact CG2-CG 4.25Å; I282-L286 WeakPolarHBondContact O-CB 3.49Å; I282-L286 WeakPolarHBondContact O-CG 3.47Å; I282-L286 PolarHBondContact O-N 2.91Å; Y283-L286 PolarHBondContact O-N 3.45Å; Y283-L286 VanDerWaalsContact O-N 3.11Å; A284-L286 VanDerWaalsContact C-N 3.32Å; A284-L286 PolarHBondContact O-N 2.89Å; L286-S288 VanDerWaalsContact C-N 3.35Å; L286-D289 PolarHBondContact O-N 2.82Å; L286-L292 HydrophobicContact CB-CD2 4.16Å; L286-L292 HydrophobicContact CD2-CD1 3.77Å; L286-L292 HydrophobicContact CD2-CD2 4.06Å; L286-P300 HydrophobicContact CB-CB 3.89Å; L286-P300 HydrophobicContact CB-CG 4.07Å; L286-F303 HydrophobicContact CD1-CB 4.04Å; L286-F303 HydrophobicContact CD1-CD1 3.33Å; L286-F303 HydrophobicContact CD1-CE1 3.98Å; L286-F303 HydrophobicContact CD1-CG 3.77Å; L286-I304 HydrophobicContact CD1-CD1 4.2Å; L286-I304 HydrophobicContact CD1-CG1 4.43Å
287	E	95.3	Very high	94.4	Very high	119 Å²	119	65.3 Å²	65.3	56%	0.556	34%	0.34	S	S	*	.	H	α-helix	trans	-70.1	-32.7	175	-78.3	-163.8	147.8	0	0	112.7	Y283 A284 D289 P300	Y283-E287 HydrophobicContact CD1-CG 4.18Å; Y283-E287 HydrophobicContact CE1-CG 3.68Å; Y283-E287 WeakPolarHBondContact CE1-OE1 3.39Å; Y283-E287 WeakPolarHBondContact CE1-OE2 3.11Å; Y283-E287 PolarHBondContact O-N 3.17Å; Y283-E287 PolarHBondContact OH-OE1 2.9Å; A284-E287 PolarHBondContact O-N 3.18Å; E287-D289 VanDerWaalsContact C-N 3.29Å; E287-P300 HydrophobicContact CG-CB 4.19Å; E287-P300 HydrophobicContact CG-CG 4.16Å
288	S	93	Very high	94.3	Very high	84 Å²	84	58.2 Å²	58.2	59%	0.587	31%	0.313	S	S	*	.	S	Bend	trans	-79.9	-9.9	176.8	49.4	0	0	0	0	113.7	A284 C285 L286 L290	A284-S288 PolarHBondContact O-N 2.89Å; A284-S288 VanDerWaalsContact O-N 3.13Å; A284-S288 PolarHBondContact O-OG 2.94Å; C285-S288 WeakPolarHBondContact CA-OG 3.11Å; C285-S288 PolarHBondContact O-OG 2.84Å; L286-S288 VanDerWaalsContact C-N 3.35Å; S288-L290 PolarHBondContact O-N 2.91Å
289	D	93.1	Very high	94.2	Very high	29 Å²	29	61.1 Å²	61.1	16%	0.155	33%	0.328	C	S	.	.			trans	-86.5	93.4	-176.5	179.1	12.4	0	0	0	112	H232 C285 L286 E287 D291 L292 R295	H232-D289 IonicContact CE1-OD2 3.62Å; H232-D289 PolarHBondContact CE1-OD2 2.85Å; H232-D289 IonicContact NE2-OD2 2.78Å; H232-D289 PolarHBondContact NE2-OD2 2.96Å; H232-D289 VanDerWaalsContact NE2-OD2 3.12Å; C285-D289 WeakPolarHBondContact O-CB 3.17Å; C285-D289 PolarHBondContact O-N 2.83Å; L286-D289 PolarHBondContact O-N 2.82Å; E287-D289 VanDerWaalsContact C-N 3.29Å; D289-D291 PolarHBondContact O-N 2.83Å; D289-D291 PolarHBondContact OD1-N 2.93Å; D289-L292 HydrophobicContact CB-CB 4.15Å; D289-L292 VanDerWaalsContact O-CB 3.28Å; D289-L292 WeakPolarHBondContact O-CB 3.36Å; D289-L292 PolarHBondContact O-N 2.96Å; D289-L292 VanDerWaalsContact O-N 3.15Å; D289-L292 PolarHBondContact OD1-N 2.8Å; D289-L292 WeakPolarHBondContact OD2-CB 3.46Å; D289-R295 IonicContact OD1-NH2 3.51Å; D289-R295 PolarHBondContact OD1-NH2 2.72Å; D289-R295 IonicContact OD2-CZ 3.47Å; D289-R295 IonicContact OD2-NH1 2.64Å; D289-R295 IonicContact OD2-NH2 2.77Å; D289-R295 PolarHBondContact OD2-NH2 2.89Å
290	L	90.5	Very high	94.1	Very high	163 Å²	163	61.7 Å²	61.7	85%	0.853	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-26.9	178.9	-62.7	176.3	0	0	0	113.3	S288	S288-L290 PolarHBondContact O-N 2.91Å
291	D	92	Very high	94.1	Very high	97 Å²	97	60.8 Å²	60.8	52%	0.519	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	5.5	-178.1	-69.3	-32.8	0	0	0	112.8	D289 N293 L294	D289-D291 PolarHBondContact O-N 2.83Å; D289-D291 PolarHBondContact OD1-N 2.93Å; D291-N293 VanDerWaalsContact C-N 3.28Å; D291-N293 PolarHBondContact O-N 3.37Å; D291-L294 HydrophobicContact CB-CD1 4.26Å; D291-L294 WeakPolarHBondContact O-CB 3.42Å; D291-L294 PolarHBondContact O-N 2.92Å; D291-L294 VanDerWaalsContact O-N 3.1Å
292	L	92.7	Very high	94.2	Very high	5 Å²	5	60.7 Å²	60.7	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-56	-44.9	-177.2	179.8	59.2	0	0	0	111.6	I228 L286 D289 L294 R295 C296 P300	I228-L292 HydrophobicContact CG2-CD1 4.05Å; L286-L292 HydrophobicContact CB-CD2 4.16Å; L286-L292 HydrophobicContact CD2-CD1 3.77Å; L286-L292 HydrophobicContact CD2-CD2 4.06Å; D289-L292 HydrophobicContact CB-CB 4.15Å; D289-L292 VanDerWaalsContact O-CB 3.28Å; D289-L292 WeakPolarHBondContact O-CB 3.36Å; D289-L292 PolarHBondContact O-N 2.96Å; D289-L292 VanDerWaalsContact O-N 3.15Å; D289-L292 PolarHBondContact OD1-N 2.8Å; D289-L292 WeakPolarHBondContact OD2-CB 3.46Å; L292-L294 PolarHBondContact O-N 3.23Å; L292-R295 PolarHBondContact O-N 2.89Å; L292-C296 HydrophobicContact CD1-CB 3.83Å; L292-C296 HydrophobicContact CG-CB 4.4Å; L292-C296 PolarHBondContact O-N 3.09Å; L292-P300 HydrophobicContact CD2-CG 3.95Å
293	N	91.3	Very high	94.2	Very high	128 Å²	128	60.7 Å²	60.7	68%	0.684	33%	0.332	S	S	*	.	H	α-helix	trans	-62.5	-24.4	-178.1	-69.3	-33.3	0	0	0	113.3	D291 R295	D291-N293 VanDerWaalsContact C-N 3.28Å; D291-N293 PolarHBondContact O-N 3.37Å; N293-R295 VanDerWaalsContact C-N 3.31Å
294	L	91.7	Very high	94.2	Very high	146 Å²	146	58.1 Å²	58.1	76%	0.764	32%	0.324	S	S	*	.	H	α-helix	trans	-74.5	-25.6	176.5	-59.2	178.6	0	0	0	112.1	D291 L292	D291-L294 HydrophobicContact CB-CD1 4.26Å; D291-L294 WeakPolarHBondContact O-CB 3.42Å; D291-L294 PolarHBondContact O-N 2.92Å; D291-L294 VanDerWaalsContact O-N 3.1Å; L292-L294 PolarHBondContact O-N 3.23Å
295	R	92	Very high	94.3	Very high	83 Å²	83	61 Å²	61	31%	0.313	33%	0.326	S	S	.	.	H	α-helix	trans	-106.7	-27.4	-176.1	-70.7	-178.4	-78.3	99.1	1.7	113.2	I228 D289 L292 N293	I228-R295 HydrophobicContact CD1-CB 4.35Å; I228-R295 WeakPolarHBondContact CD1-O 2.86Å; I228-R295 PolarHBondContact O-NH1 3.25Å; D289-R295 IonicContact OD1-NH2 3.51Å; D289-R295 PolarHBondContact OD1-NH2 2.72Å; D289-R295 IonicContact OD2-CZ 3.47Å; D289-R295 IonicContact OD2-NH1 2.64Å; D289-R295 IonicContact OD2-NH2 2.77Å; D289-R295 PolarHBondContact OD2-NH2 2.89Å; L292-R295 PolarHBondContact O-N 2.89Å; N293-R295 VanDerWaalsContact C-N 3.31Å
296	C	93.1	Very high	94.5	Very high	1 Å²	1	59.7 Å²	59.7	1%	0.007	32%	0.317	C	S	.	.			trans	-138.4	127.5	-171.6	-173.3	0	0	0	0	110.6	I228 L292 L298	I228-C296 HydrophobicContact CD1-CB 4.15Å; I228-C296 HydrophobicContact CG1-CB 4.29Å; I228-C296 HydrophobicContact CG2-CB 3.82Å; L292-C296 HydrophobicContact CD1-CB 3.83Å; L292-C296 HydrophobicContact CG-CB 4.4Å; L292-C296 PolarHBondContact O-N 3.09Å; C296-L298 PolarHBondContact O-N 2.88Å; C296-L298 PolarHBondContact SG-N 3.39Å; C296-L298 VanDerWaalsContact SG-N 3.44Å
297	P	94	Very high	94.6	Very high	55 Å²	55	59.6 Å²	59.6	36%	0.357	32%	0.317	S	S	.	.	S	Bend	trans	-79.6	-3.2	175.8	34.7	-35.5	0	0	0	113.3	K175 L176 Y224	K175-P297 VanDerWaalsContact O-CB 3.24Å; K175-P297 WeakPolarHBondContact O-CB 3.37Å; L176-P297 HydrophobicContact CD2-CG 4.15Å; Y224-P297 VanDerWaalsContact OH-CD 3.23Å; Y224-P297 WeakPolarHBondContact OH-CD 3.38Å
298	L	95.1	Very high	94.7	Very high	1 Å²	1	56.1 Å²	56.1	1%	0.005	30%	0.302	C	S	.	.	S	Bend	trans	-95.4	139.4	-179.7	-53.3	-179	0	0	0	109.5	L172 K175 L176 C296 E302	L172-L298 HydrophobicContact CB-CD2 4.2Å; L172-L298 HydrophobicContact CD1-CD1 4.27Å; L172-L298 HydrophobicContact CD1-CD2 4.03Å; L172-L298 HydrophobicContact CD2-CD2 4.16Å; L172-L298 HydrophobicContact CG-CD2 4.36Å; K175-L298 HydrophobicContact CB-CD2 4.36Å; L176-L298 HydrophobicContact CD2-CD1 4.29Å; L176-L298 HydrophobicContact CD2-CD2 3.9Å; L176-L298 HydrophobicContact CD2-CG 4.15Å; L176-L298 HydrophobicContact CG-CD2 4.14Å; C296-L298 PolarHBondContact O-N 2.88Å; C296-L298 PolarHBondContact SG-N 3.39Å; C296-L298 VanDerWaalsContact SG-N 3.44Å; L298-E302 HydrophobicContact CB-CB 4.08Å
299	N	95.1	Very high	94.8	Very high	63 Å²	63	52.4 Å²	52.4	34%	0.337	28%	0.276	S	S	.	.			trans	-73.7	166.6	170.8	68.9	33.1	0	0	0	111.1	S301 E302 F303	N299-S301 VanDerWaalsContact C-N 3.3Å; N299-S301 PolarHBondContact O-N 2.78Å; N299-S301 PolarHBondContact OD1-N 2.75Å; N299-E302 PolarHBondContact N-OE2 3.31Å; N299-E302 VanDerWaalsContact N-OE2 3.15Å; N299-E302 PolarHBondContact ND2-OE2 3.3Å; N299-E302 PolarHBondContact O-N 3.09Å; N299-E302 WeakPolarHBondContact OD1-CB 3.4Å; N299-E302 WeakPolarHBondContact OD1-CG 3.3Å; N299-E302 PolarHBondContact OD1-N 3.05Å; N299-E302 PolarHBondContact OD1-OE2 2.94Å; N299-F303 WeakPolarHBondContact O-CB 3.22Å; N299-F303 PolarHBondContact O-N 3.18Å
300	P	96.4	Very high	94.9	Very high	24 Å²	24	51 Å²	51	16%	0.156	27%	0.268	C	S	.	.	H	α-helix	trans	-52.9	-42.2	-178.5	-30.6	37.2	0	0	0	114.2	Y283 L286 E287 L292 F303 I304	Y283-P300 HydrophobicContact CD2-CB 4.09Å; Y283-P300 HydrophobicContact CE2-CB 3.84Å; L286-P300 HydrophobicContact CB-CB 3.89Å; L286-P300 HydrophobicContact CB-CG 4.07Å; E287-P300 HydrophobicContact CG-CB 4.19Å; E287-P300 HydrophobicContact CG-CG 4.16Å; L292-P300 HydrophobicContact CD2-CG 3.95Å; P300-F303 WeakPolarHBondContact O-CB 3.46Å; P300-F303 PolarHBondContact O-N 2.75Å; P300-I304 WeakPolarHBondContact O-CB 3.42Å; P300-I304 WeakPolarHBondContact O-CG1 3.49Å; P300-I304 PolarHBondContact O-N 2.85Å
301	S	97.1	Very high	95.1	Very high	73 Å²	73	43.5 Å²	43.5	51%	0.51	23%	0.228	S	C	.	.	H	α-helix	trans	-64.4	-44.9	179.6	-175.7	0	0	0	0	112.7	N299 F303 I304 K305	N299-S301 VanDerWaalsContact C-N 3.3Å; N299-S301 PolarHBondContact O-N 2.78Å; N299-S301 PolarHBondContact OD1-N 2.75Å; S301-F303 VanDerWaalsContact C-N 3.33Å; S301-F303 PolarHBondContact O-N 3.07Å; S301-I304 PolarHBondContact O-N 3.14Å; S301-K305 WeakPolarHBondContact O-CB 3.19Å; S301-K305 PolarHBondContact O-N 3.4Å
302	E	96.7	Very high	95.2	Very high	39 Å²	39	43.3 Å²	43.3	18%	0.182	22%	0.221	C	C	.	.	H	α-helix	trans	-66.2	-37.4	176.6	-70.3	169.8	153	0	0	111.9	L172 K175 L298 N299 K305 C306	L172-E302 HydrophobicContact CD2-CB 4.03Å; L172-E302 HydrophobicContact CD2-CG 3.74Å; K175-E302 WeakPolarHBondContact CD-OE2 3.35Å; K175-E302 IonicContact NZ-OE1 3.33Å; K175-E302 PolarHBondContact NZ-OE1 3.02Å; K175-E302 IonicContact NZ-OE2 2.73Å; K175-E302 PolarHBondContact NZ-OE2 3.34Å; L298-E302 HydrophobicContact CB-CB 4.08Å; N299-E302 PolarHBondContact N-OE2 3.31Å; N299-E302 VanDerWaalsContact N-OE2 3.15Å; N299-E302 PolarHBondContact ND2-OE2 3.3Å; N299-E302 PolarHBondContact O-N 3.09Å; N299-E302 WeakPolarHBondContact OD1-CB 3.4Å; N299-E302 WeakPolarHBondContact OD1-CG 3.3Å; N299-E302 PolarHBondContact OD1-N 3.05Å; N299-E302 PolarHBondContact OD1-OE2 2.94Å; E302-K305 PolarHBondContact O-N 3.37Å; E302-C306 PolarHBondContact O-N 2.62Å; E302-C306 VanDerWaalsContact O-N 3.1Å; E302-C306 PolarHBondContact O-SG 2.9Å
303	F	97.4	Very high	95	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-62.4	-50.5	174.7	-170.8	-78.9	0	0	0	110.9	L225 I228 L229 L286 N299 P300 S301 K305 C306 L307	L225-F303 HydrophobicContact CB-CE1 4.49Å; L225-F303 HydrophobicContact CB-CE2 4.24Å; L225-F303 HydrophobicContact CB-CZ 3.76Å; L225-F303 HydrophobicContact CD2-CD1 4.49Å; L225-F303 HydrophobicContact CD2-CD2 3.71Å; L225-F303 HydrophobicContact CD2-CE1 4.15Å; L225-F303 HydrophobicContact CD2-CE2 3.3Å; L225-F303 HydrophobicContact CD2-CG 4.28Å; L225-F303 HydrophobicContact CD2-CZ 3.53Å; L225-F303 HydrophobicContact CG-CE2 4.33Å; L225-F303 HydrophobicContact CG-CZ 4.16Å; I228-F303 HydrophobicContact CB-CE2 3.74Å; I228-F303 HydrophobicContact CB-CZ 4.27Å; I228-F303 HydrophobicContact CG1-CE2 4.25Å; I228-F303 HydrophobicContact CG2-CD2 4.31Å; I228-F303 HydrophobicContact CG2-CE2 3.6Å; I228-F303 HydrophobicContact CG2-CZ 4.28Å; L229-F303 HydrophobicContact CD1-CE1 3.99Å; L229-F303 HydrophobicContact CD1-CZ 4.07Å; L229-F303 HydrophobicContact CD2-CE1 3.82Å; L229-F303 HydrophobicContact CD2-CZ 3.92Å; L229-F303 HydrophobicContact CG-CE1 3.9Å; L229-F303 HydrophobicContact CG-CZ 3.66Å; L286-F303 HydrophobicContact CD1-CB 4.04Å; L286-F303 HydrophobicContact CD1-CD1 3.33Å; L286-F303 HydrophobicContact CD1-CE1 3.98Å; L286-F303 HydrophobicContact CD1-CG 3.77Å; N299-F303 WeakPolarHBondContact O-CB 3.22Å; N299-F303 PolarHBondContact O-N 3.18Å; P300-F303 WeakPolarHBondContact O-CB 3.46Å; P300-F303 PolarHBondContact O-N 2.75Å; S301-F303 VanDerWaalsContact C-N 3.33Å; S301-F303 PolarHBondContact O-N 3.07Å; F303-K305 VanDerWaalsContact C-N 3.31Å; F303-K305 PolarHBondContact O-N 2.98Å; F303-C306 WeakPolarHBondContact O-CB 3.47Å; F303-C306 PolarHBondContact O-N 2.84Å; F303-C306 VanDerWaalsContact O-N 3.1Å; F303-L307 HydrophobicContact CE1-CB 4.4Å; F303-L307 HydrophobicContact CE1-CD2 4.25Å; F303-L307 WeakPolarHBondContact O-CB 3.08Å; F303-L307 PolarHBondContact O-N 2.67Å
304	I	97.9	Very high	95.1	Very high	27 Å²	27	37.6 Å²	37.6	14%	0.138	19%	0.191	C	C	.	.	H	α-helix	trans	-61	-40.4	178.2	-73.5	-53.1	0	0	0	111.5	L279 I282 Y283 L286 P300 S301 C306 L307 D308	L279-I304 HydrophobicContact CB-CG2 4.32Å; L279-I304 HydrophobicContact CD2-CD1 4.2Å; L279-I304 HydrophobicContact CD2-CG2 4.31Å; L279-I304 WeakPolarHBondContact O-CD1 3.25Å; I282-I304 HydrophobicContact CB-CD1 4.1Å; I282-I304 HydrophobicContact CG2-CD1 3.81Å; Y283-I304 HydrophobicContact CD2-CB 4.47Å; Y283-I304 HydrophobicContact CD2-CG1 3.72Å; Y283-I304 HydrophobicContact CG-CG1 4.3Å; L286-I304 HydrophobicContact CD1-CD1 4.2Å; L286-I304 HydrophobicContact CD1-CG1 4.43Å; P300-I304 WeakPolarHBondContact O-CB 3.42Å; P300-I304 WeakPolarHBondContact O-CG1 3.49Å; P300-I304 PolarHBondContact O-N 2.85Å; S301-I304 PolarHBondContact O-N 3.14Å; I304-C306 VanDerWaalsContact C-N 3.3Å; I304-C306 PolarHBondContact O-N 3.45Å; I304-L307 HydrophobicContact CD1-CD2 4.19Å; I304-L307 PolarHBondContact O-N 3.3Å; I304-L307 VanDerWaalsContact O-N 3.14Å; I304-D308 WeakPolarHBondContact O-CB 3.33Å; I304-D308 PolarHBondContact O-N 2.82Å
305	K	97.5	Very high	95.1	Very high	115 Å²	115	31.3 Å²	31.3	50%	0.5	16%	0.158	S	C	.	.	H	α-helix	trans	-59.4	-40.7	174.2	-174	177.7	-176.8	177	0	112.4	I168 S301 E302 F303 L309	I168-K305 HydrophobicContact CD1-CG 4.28Å; S301-K305 WeakPolarHBondContact O-CB 3.19Å; S301-K305 PolarHBondContact O-N 3.4Å; E302-K305 PolarHBondContact O-N 3.37Å; F303-K305 VanDerWaalsContact C-N 3.31Å; F303-K305 PolarHBondContact O-N 2.98Å; K305-L309 PolarHBondContact O-N 3.06Å
306	C	97.4	Very high	95.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-68.9	-38.4	175.1	-68.1	0	0	0	0	112.1	L172 L221 L225 E302 F303 I304 C310	L172-C306 WeakPolarHBondContact CD1-SG 3.31Å; L221-C306 HydrophobicContact CD1-CB 4.19Å; L221-C306 HydrophobicContact CD2-CB 4.07Å; L221-C306 HydrophobicContact CG-CB 4.42Å; L225-C306 HydrophobicContact CD1-CB 3.94Å; L225-C306 HydrophobicContact CD2-CB 4.12Å; E302-C306 PolarHBondContact O-N 2.62Å; E302-C306 VanDerWaalsContact O-N 3.1Å; E302-C306 PolarHBondContact O-SG 2.9Å; F303-C306 WeakPolarHBondContact O-CB 3.47Å; F303-C306 PolarHBondContact O-N 2.84Å; F303-C306 VanDerWaalsContact O-N 3.1Å; I304-C306 VanDerWaalsContact C-N 3.3Å; I304-C306 PolarHBondContact O-N 3.45Å; C306-C310 PolarHBondContact O-N 2.8Å; C306-C310 VanDerWaalsContact O-N 3.1Å; C306-C310 PolarHBondContact O-SG 2.73Å
307	L	97.6	Very high	95.2	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-68.1	-46.6	179.4	-176.7	59.6	0	0	0	111.5	L225 L229 L279 I282 F303 I304 L309 C310 L311 V335 V339	L225-L307 HydrophobicContact CD1-CB 4.16Å; L225-L307 HydrophobicContact CD1-CD1 4.27Å; L229-L307 HydrophobicContact CD1-CD2 4.35Å; L279-L307 HydrophobicContact CD2-CB 4.03Å; L279-L307 HydrophobicContact CD2-CD2 3.68Å; L279-L307 HydrophobicContact CD2-CG 3.68Å; I282-L307 HydrophobicContact CB-CD2 4.46Å; I282-L307 HydrophobicContact CD1-CD2 3.69Å; I282-L307 HydrophobicContact CG2-CD2 3.96Å; F303-L307 HydrophobicContact CE1-CB 4.4Å; F303-L307 HydrophobicContact CE1-CD2 4.25Å; F303-L307 WeakPolarHBondContact O-CB 3.08Å; F303-L307 PolarHBondContact O-N 2.67Å; I304-L307 HydrophobicContact CD1-CD2 4.19Å; I304-L307 PolarHBondContact O-N 3.3Å; I304-L307 VanDerWaalsContact O-N 3.14Å; L307-L309 VanDerWaalsContact C-N 3.32Å; L307-L309 PolarHBondContact O-N 2.79Å; L307-C310 WeakPolarHBondContact O-CA 3.08Å; L307-C310 WeakPolarHBondContact O-CB 3.42Å; L307-C310 PolarHBondContact O-N 2.75Å; L307-L311 HydrophobicContact CD1-CD1 4.3Å; L307-L311 HydrophobicContact CD1-CD2 4.4Å; L307-L311 HydrophobicContact CD1-CG 4.16Å; L307-L311 HydrophobicContact CG-CD1 4.1Å; L307-L311 HydrophobicContact CG-CG 4.33Å; L307-L311 WeakPolarHBondContact O-CG 2.84Å; L307-L311 PolarHBondContact O-N 3.15Å; L307-V335 HydrophobicContact CD1-CB 4.48Å; L307-V335 HydrophobicContact CD1-CG1 4.03Å; L307-V335 HydrophobicContact CD1-CG2 3.65Å; L307-V339 HydrophobicContact CD1-CG2 4.21Å
308	D	97.3	Very high	95.3	Very high	46 Å²	46	27.5 Å²	27.5	25%	0.246	14%	0.14	C	C	.	.	H	α-helix	trans	-54.8	-47.9	176.3	-176.8	58.4	0	0	0	111.2	L279 I304 C310 L311 R312	L279-D308 HydrophobicContact CD1-CB 3.7Å; L279-D308 WeakPolarHBondContact CD1-OD1 3.32Å; L279-D308 HydrophobicContact CD2-CB 4.39Å; I304-D308 WeakPolarHBondContact O-CB 3.33Å; I304-D308 PolarHBondContact O-N 2.82Å; D308-C310 VanDerWaalsContact C-N 3.33Å; D308-C310 PolarHBondContact O-N 2.93Å; D308-L311 PolarHBondContact O-N 2.91Å; D308-R312 PolarHBondContact O-N 3.47Å; D308-R312 IonicContact OD1-CZ 3.12Å; D308-R312 IonicContact OD1-NE 2.64Å; D308-R312 PolarHBondContact OD1-NE 2.94Å; D308-R312 IonicContact OD1-NH2 3.08Å; D308-R312 PolarHBondContact OD1-NH2 3.26Å; D308-R312 IonicContact OD2-NE 3.94Å; D308-R312 PolarHBondContact OD2-NE 2.98Å
309	L	95.4	Very high	95.1	Very high	6 Å²	6	33.5 Å²	33.5	3%	0.031	16%	0.162	C	C	.	.	H	α-helix	trans	-54.7	-49.5	171.9	179.9	74.6	0	0	0	110.7	L161 E164 T165 I168 T218 L221 K305 L307 L311 S313	L161-L309 HydrophobicContact CD1-CD1 4.11Å; E164-L309 HydrophobicContact CG-CD1 3.93Å; T165-L309 HydrophobicContact CG2-CD2 4.03Å; I168-L309 HydrophobicContact CD1-CB 4.41Å; I168-L309 HydrophobicContact CD1-CD2 4.15Å; T218-L309 HydrophobicContact CG2-CD2 3.93Å; T218-L309 HydrophobicContact CG2-CG 3.93Å; L221-L309 HydrophobicContact CD2-CD2 4.35Å; K305-L309 PolarHBondContact O-N 3.06Å; L307-L309 VanDerWaalsContact C-N 3.32Å; L307-L309 PolarHBondContact O-N 2.79Å; L309-L311 VanDerWaalsContact C-N 3.31Å; L309-L311 PolarHBondContact O-N 3Å; L309-S313 WeakPolarHBondContact CD1-OG 3.31Å; L309-S313 WeakPolarHBondContact O-CB 3.2Å; L309-S313 PolarHBondContact O-N 3.01Å; L309-S313 VanDerWaalsContact O-N 3.13Å; L309-S313 PolarHBondContact O-OG 3.23Å
310	C	94.9	Very high	95	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.9	-37.6	-178.7	-68.9	0	0	0	0	113.2	A222 C306 L307 D308	A222-C310 HydrophobicContact CB-CB 4.24Å; C306-C310 PolarHBondContact O-N 2.8Å; C306-C310 VanDerWaalsContact O-N 3.1Å; C306-C310 PolarHBondContact O-SG 2.73Å; L307-C310 WeakPolarHBondContact O-CA 3.08Å; L307-C310 WeakPolarHBondContact O-CB 3.42Å; L307-C310 PolarHBondContact O-N 2.75Å; D308-C310 VanDerWaalsContact C-N 3.33Å; D308-C310 PolarHBondContact O-N 2.93Å
311	L	95.2	Very high	94.8	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-76.6	-42.4	-176.8	-62.9	-177.7	0	0	0	112.3	I275 L279 L307 D308 L309 T314 I329 V335 V339	I275-L311 HydrophobicContact CG2-CB 4.19Å; I275-L311 HydrophobicContact CG2-CD1 4.16Å; L279-L311 HydrophobicContact CD2-CD1 4.1Å; L307-L311 HydrophobicContact CD1-CD1 4.3Å; L307-L311 HydrophobicContact CD1-CD2 4.4Å; L307-L311 HydrophobicContact CD1-CG 4.16Å; L307-L311 HydrophobicContact CG-CD1 4.1Å; L307-L311 HydrophobicContact CG-CG 4.33Å; L307-L311 WeakPolarHBondContact O-CG 2.84Å; L307-L311 PolarHBondContact O-N 3.15Å; D308-L311 PolarHBondContact O-N 2.91Å; L309-L311 VanDerWaalsContact C-N 3.31Å; L309-L311 PolarHBondContact O-N 3Å; L311-T314 PolarHBondContact O-OG1 3.35Å; L311-I329 HydrophobicContact CB-CG2 4.48Å; L311-I329 HydrophobicContact CD1-CG2 4.21Å; L311-I329 HydrophobicContact CD2-CB 4.35Å; L311-I329 HydrophobicContact CD2-CG2 3.77Å; L311-I329 HydrophobicContact CG-CG2 4.36Å; L311-V335 HydrophobicContact CD2-CG1 3.87Å; L311-V339 HydrophobicContact CD1-CG1 4.16Å; L311-V339 HydrophobicContact CD1-CG2 4.44Å; L311-V339 HydrophobicContact CD2-CG2 4.3Å
312	R	93.4	Very high	94.7	Very high	94 Å²	94	31.4 Å²	31.4	36%	0.355	16%	0.158	S	C	.	.	H	α-helix	trans	-81.3	-12.8	-178.4	-64	-173.3	-166.8	-98	-3.3	114.9	I275 N276 D308 T314	I275-R312 HydrophobicContact CD1-CG 4Å; I275-R312 HydrophobicContact CG2-CG 4.44Å; N276-R312 PolarHBondContact OD1-NH2 3.04Å; D308-R312 PolarHBondContact O-N 3.47Å; D308-R312 IonicContact OD1-CZ 3.12Å; D308-R312 IonicContact OD1-NE 2.64Å; D308-R312 PolarHBondContact OD1-NE 2.94Å; D308-R312 IonicContact OD1-NH2 3.08Å; D308-R312 PolarHBondContact OD1-NH2 3.26Å; D308-R312 IonicContact OD2-NE 3.94Å; D308-R312 PolarHBondContact OD2-NE 2.98Å; R312-T314 VanDerWaalsContact C-N 3.26Å; R312-T314 PolarHBondContact O-N 2.97Å
313	S	89.6	Confident	94.6	Very high	11 Å²	11	30.6 Å²	30.6	8%	0.077	15%	0.153	C	C	.	.			trans	-91.4	26.1	-172.8	-62.9	0	0	0	0	114.4	L161 L309 L315	L161-S313 WeakPolarHBondContact CD1-OG 3.37Å; L309-S313 WeakPolarHBondContact CD1-OG 3.31Å; L309-S313 WeakPolarHBondContact O-CB 3.2Å; L309-S313 PolarHBondContact O-N 3.01Å; L309-S313 VanDerWaalsContact O-N 3.13Å; L309-S313 PolarHBondContact O-OG 3.23Å; S313-L315 PolarHBondContact O-N 3.38Å; S313-L315 VanDerWaalsContact O-N 3.14Å
314	T	91.7	Very high	94.4	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.006	17%	0.171	C	C	.	.			trans	-78.5	104.1	-176.5	-60.2	0	0	0	0	110.4	V211 L311 R312 F316 R324 Q325 A330	V211-T314 HydrophobicContact CG1-CG2 4.41Å; L311-T314 PolarHBondContact O-OG1 3.35Å; R312-T314 VanDerWaalsContact C-N 3.26Å; R312-T314 PolarHBondContact O-N 2.97Å; T314-F316 HydrophobicContact CG2-CD1 4.2Å; T314-R324 WeakPolarHBondContact O-CA 3.33Å; T314-Q325 HydrophobicContact CG2-CB 3.84Å; T314-Q325 PolarHBondContact O-N 3.28Å; T314-A330 HydrophobicContact CG2-CB 3.45Å; T314-A330 VanDerWaalsContact CG2-CB 3.45Å; T314-A330 WeakPolarHBondContact OG1-CB 3.39Å
315	L	92.8	Very high	94.2	Very high	15 Å²	15	34.2 Å²	34.2	8%	0.079	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	138	173.9	-61.1	177.2	0	0	0	110.2	I149 T157 V158 L161 P191 S313 Y323 R324	I149-L315 HydrophobicContact CD1-CD2 3.65Å; T157-L315 HydrophobicContact CG2-CD1 4.04Å; T157-L315 HydrophobicContact CG2-CD2 4.09Å; V158-L315 HydrophobicContact CG2-CD1 4.2Å; L161-L315 HydrophobicContact CD2-CD1 3.76Å; L161-L315 HydrophobicContact CD2-CG 4.3Å; P191-L315 HydrophobicContact CB-CB 4.11Å; P191-L315 HydrophobicContact CG-CB 4.02Å; S313-L315 PolarHBondContact O-N 3.38Å; S313-L315 VanDerWaalsContact O-N 3.14Å; L315-Y323 WeakPolarHBondContact CA-O 3.35Å; L315-R324 HydrophobicContact CD2-CB 3.75Å; L315-R324 HydrophobicContact CD2-CG 4.09Å
316	F	93.6	Very high	93.9	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	165.4	177	59.2	-97.1	0	0	0	112	L141 Y146 R192 F194 V211 T314 Q322 Y323	L141-F316 HydrophobicContact CD2-CE2 3.6Å; L141-F316 HydrophobicContact CD2-CZ 3.69Å; Y146-F316 AromaticContact CD1-CE1 3.62Å; Y146-F316 HydrophobicContact CD1-CE1 3.62Å; Y146-F316 AromaticContact CD1-CZ 3.42Å; Y146-F316 HydrophobicContact CD1-CZ 3.42Å; Y146-F316 VanDerWaalsContact CD1-CZ 3.42Å; Y146-F316 AromaticContact CE1-CE1 3.78Å; Y146-F316 HydrophobicContact CE1-CE1 3.78Å; Y146-F316 AromaticContact CE1-CZ 3.75Å; Y146-F316 HydrophobicContact CE1-CZ 3.75Å; Y146-F316 HydrophobicContact CG-CZ 4.04Å; R192-F316 CarbonylContact O-C 3.5Å; R192-F316 WeakPolarHBondContact O-CA 3.44Å; F194-F316 HydrophobicContact CB-CD2 3.5Å; F194-F316 HydrophobicContact CB-CE2 3.9Å; F194-F316 HydrophobicContact CB-CG 4.26Å; F194-F316 HydrophobicContact CD2-CD2 4.23Å; F194-F316 AromaticContact CD2-CE2 3.88Å; F194-F316 HydrophobicContact CD2-CE2 3.88Å; F194-F316 HydrophobicContact CD2-CZ 4.3Å; F194-F316 HydrophobicContact CG-CD2 4.2Å; F194-F316 HydrophobicContact CG-CE2 4.1Å; V211-F316 HydrophobicContact CB-CD1 4.47Å; V211-F316 HydrophobicContact CG1-CB 3.73Å; V211-F316 HydrophobicContact CG1-CD1 4.03Å; V211-F316 HydrophobicContact CG1-CG 4.19Å; V211-F316 HydrophobicContact CG2-CB 4.42Å; V211-F316 HydrophobicContact CG2-CD1 3.57Å; V211-F316 HydrophobicContact CG2-CE1 3.93Å; V211-F316 HydrophobicContact CG2-CG 4.01Å; T314-F316 HydrophobicContact CG2-CD1 4.2Å; F316-Q322 WeakPolarHBondContact O-CA 3.4Å; F316-Y323 HydrophobicContact CD2-CD2 4.34Å; F316-Y323 VanDerWaalsContact CE2-CB 3.43Å; F316-Y323 AromaticContact CE2-CD2 3.97Å; F316-Y323 HydrophobicContact CE2-CD2 3.97Å; F316-Y323 AromaticContact CE2-CG 3.88Å; F316-Y323 HydrophobicContact CE2-CG 3.88Å; F316-Y323 HydrophobicContact CZ-CG 4.32Å; F316-Y323 PolarHBondContact N-O 3.1Å; F316-Y323 PolarHBondContact O-N 3.45Å
317	I	94	Very high	93.7	Very high	52 Å²	52	38.5 Å²	38.5	27%	0.267	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	131.2	-179.3	-61	174	0	0	0	109.3	P191 R192 R193 F194 D321	P191-I317 HydrophobicContact CB-CD1 4.38Å; P191-I317 HydrophobicContact CB-CG1 4.19Å; P191-I317 WeakPolarHBondContact O-CD1 3.49Å; R192-I317 PolarHBondContact O-N 2.99Å; R193-I317 WeakPolarHBondContact CA-O 3.33Å; F194-I317 PolarHBondContact N-O 2.78Å; I317-D321 CarbonylContact C-O 3.51Å; I317-D321 VanDerWaalsContact CA-O 3.3Å; I317-D321 WeakPolarHBondContact CA-O 3.21Å
318	F	94.6	Very high	93.4	Very high	6 Å²	6	38.6 Å²	38.6	3%	0.026	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	120	168.5	-176.6	-112.7	0	0	0	109.5	Y133 E134 A137 K138 L141 F194 G320 D321 Y323	Y133-F318 HydrophobicContact CE1-CE2 4.33Å; E134-F318 HydrophobicContact CG-CZ 4.29Å; A137-F318 HydrophobicContact CB-CE1 3.69Å; A137-F318 HydrophobicContact CB-CE2 3.89Å; A137-F318 HydrophobicContact CB-CZ 3.28Å; K138-F318 HydrophobicContact CG-CE1 4.25Å; L141-F318 HydrophobicContact CD1-CB 4.01Å; L141-F318 HydrophobicContact CD1-CD1 3.68Å; L141-F318 HydrophobicContact CD1-CE1 4.43Å; L141-F318 HydrophobicContact CD1-CG 3.98Å; F194-F318 HydrophobicContact CB-CB 4.19Å; F194-F318 HydrophobicContact CB-CD2 4.42Å; F194-F318 HydrophobicContact CD1-CB 4.32Å; F194-F318 AromaticContact CD1-CD2 3.55Å; F194-F318 HydrophobicContact CD1-CD2 3.55Å; F194-F318 HydrophobicContact CD1-CE2 4.07Å; F194-F318 HydrophobicContact CD1-CG 4.04Å; F194-F318 HydrophobicContact CE1-CD2 4.32Å; F194-F318 HydrophobicContact CE1-CE2 4.49Å; F194-F318 HydrophobicContact CG-CD2 4.44Å; F318-G320 PolarHBondContact O-N 3.43Å; F318-D321 PolarHBondContact N-O 2.9Å; F318-D321 WeakPolarHBondContact O-CB 3.4Å; F318-D321 PolarHBondContact O-N 3.21Å; F318-Y323 HydrophobicContact CB-CD2 4.29Å; F318-Y323 HydrophobicContact CB-CE2 3.96Å
319	R	92.1	Very high	93.3	Very high	127 Å²	127	36.4 Å²	36.4	48%	0.479	18%	0.175	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.8	29.5	177.1	-59.7	-62.6	174.7	-166.1	2.4	116.2	E134	E134-R319 HydrophobicContact CG-CG 4.45Å; E134-R319 WeakPolarHBondContact OE1-CD 3.35Å; E134-R319 IonicContact OE1-CZ 3.49Å; E134-R319 IonicContact OE1-NE 2.63Å; E134-R319 PolarHBondContact OE1-NE 3.28Å; E134-R319 IonicContact OE1-NH1 3.98Å; E134-R319 IonicContact OE1-NH2 3.43Å
320	G	91.6	Very high	93.2	Very high	58 Å²	58	36.1 Å²	36.1	60%	0.598	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	104.4	-26.1	178.7	0	0	0	0	0	112.5	F318	F318-G320 PolarHBondContact O-N 3.43Å
321	D	93.7	Very high	92.8	Very high	55 Å²	55	38 Å²	38	29%	0.294	18%	0.183	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82	132.8	-179.4	-62.2	-38.8	0	0	0	111	L148 I317 F318 Y323	L148-D321 HydrophobicContact CD1-CB 3.74Å; I317-D321 CarbonylContact C-O 3.51Å; I317-D321 VanDerWaalsContact CA-O 3.3Å; I317-D321 WeakPolarHBondContact CA-O 3.21Å; F318-D321 PolarHBondContact N-O 2.9Å; F318-D321 WeakPolarHBondContact O-CB 3.4Å; F318-D321 PolarHBondContact O-N 3.21Å; D321-Y323 HydrophobicContact CB-CD2 4.38Å; D321-Y323 HydrophobicContact CB-CE2 3.54Å; D321-Y323 WeakPolarHBondContact O-CD2 3.47Å
322	Q	94.4	Very high	92.5	Very high	4 Å²	4	39.8 Å²	39.8	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	134.9	176.2	-171	175.2	-76.9	0	0	110.4	I149 S154 F316	I149-Q322 HydrophobicContact CB-CB 4.31Å; I149-Q322 HydrophobicContact CB-CG 4.45Å; I149-Q322 WeakPolarHBondContact CB-O 2.96Å; I149-Q322 HydrophobicContact CD1-CG 4.11Å; I149-Q322 PolarHBondContact N-O 2.84Å; S154-Q322 PolarHBondContact O-NE2 3.38Å; S154-Q322 PolarHBondContact OG-OE1 2.84Å; F316-Q322 WeakPolarHBondContact O-CA 3.4Å
323	Y	94.6	Very high	92.4	Very high	22 Å²	22	35.4 Å²	35.4	9%	0.086	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	154.2	178.2	-64.3	-94.5	0	0	0	111.4	L141 E147 L148 L315 F316 F318 D321	L141-Y323 HydrophobicContact CB-CE1 4.29Å; L141-Y323 HydrophobicContact CD1-CD2 4.43Å; L141-Y323 HydrophobicContact CD1-CE1 4.3Å; L141-Y323 HydrophobicContact CD1-CE2 3.98Å; E147-Y323 CarbonylContact O-C 3.53Å; E147-Y323 VanDerWaalsContact O-CA 3.25Å; E147-Y323 WeakPolarHBondContact O-CA 3.35Å; L148-Y323 HydrophobicContact CB-CD1 4.22Å; L148-Y323 HydrophobicContact CB-CE1 3.94Å; L148-Y323 HydrophobicContact CD1-CD1 4.26Å; L148-Y323 HydrophobicContact CD1-CE1 3.75Å; L148-Y323 HydrophobicContact CD1-CE2 4.22Å; L148-Y323 HydrophobicContact CG-CE1 4.43Å; L315-Y323 WeakPolarHBondContact CA-O 3.35Å; F316-Y323 HydrophobicContact CD2-CD2 4.34Å; F316-Y323 VanDerWaalsContact CE2-CB 3.43Å; F316-Y323 AromaticContact CE2-CD2 3.97Å; F316-Y323 HydrophobicContact CE2-CD2 3.97Å; F316-Y323 AromaticContact CE2-CG 3.88Å; F316-Y323 HydrophobicContact CE2-CG 3.88Å; F316-Y323 HydrophobicContact CZ-CG 4.32Å; F316-Y323 PolarHBondContact N-O 3.1Å; F316-Y323 PolarHBondContact O-N 3.45Å; F318-Y323 HydrophobicContact CB-CD2 4.29Å; F318-Y323 HydrophobicContact CB-CE2 3.96Å; D321-Y323 HydrophobicContact CB-CD2 4.38Å; D321-Y323 HydrophobicContact CB-CE2 3.54Å; D321-Y323 WeakPolarHBondContact O-CD2 3.47Å
324	R	93.1	Very high	92.7	Very high	97 Å²	97	36.7 Å²	36.7	37%	0.366	19%	0.194	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	136.2	167.4	175.4	172.2	62.1	173.7	0.7	109.7	Y146 E147 I149 T314 L315	Y146-R324 CarbonylContact C-O 3.58Å; Y146-R324 WeakPolarHBondContact CA-O 3.35Å; E147-R324 PolarHBondContact N-O 3.39Å; E147-R324 PolarHBondContact O-N 2.92Å; E147-R324 IonicContact OE1-NH2 2.69Å; E147-R324 IonicContact OE2-CZ 3.21Å; E147-R324 IonicContact OE2-NE 3.98Å; E147-R324 PolarHBondContact OE2-NE 3.29Å; E147-R324 IonicContact OE2-NH2 2.7Å; E147-R324 PolarHBondContact OE2-NH2 3.48Å; I149-R324 HydrophobicContact CD1-CB 3.85Å; I149-R324 HydrophobicContact CG1-CB 4.33Å; T314-R324 WeakPolarHBondContact O-CA 3.33Å; L315-R324 HydrophobicContact CD2-CB 3.75Å; L315-R324 HydrophobicContact CD2-CG 4.09Å
325	Q	93.3	Very high	92.8	Very high	5 Å²	5	36.6 Å²	36.6	2%	0.023	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	120.7	166.4	-175.6	171.6	-9.1	0	0	108.6	P145 Y146 T314 E327 I329	P145-Q325 HydrophobicContact CG-CG 4.36Å; Y146-Q325 HydrophobicContact CD1-CB 3.87Å; Y146-Q325 HydrophobicContact CD1-CG 4.09Å; Y146-Q325 HydrophobicContact CE1-CB 3.97Å; Y146-Q325 HydrophobicContact CE1-CG 3.88Å; T314-Q325 HydrophobicContact CG2-CB 3.84Å; T314-Q325 PolarHBondContact O-N 3.28Å; Q325-E327 WeakPolarHBondContact CG-O 3.47Å; Q325-E327 PolarHBondContact NE2-O 3.3Å; Q325-I329 PolarHBondContact NE2-O 3.38Å
326	K	91.8	Very high	93	Very high	110 Å²	110	36 Å²	36	48%	0.478	19%	0.19	S	C	.	.			trans	-84.4	-40.3	-176.4	-67.9	-175.5	-70.3	178.1	0	112.2	P145 E147	P145-K326 PolarHBondContact O-N 2.9Å; E147-K326 HydrophobicContact CB-CD 3.85Å; E147-K326 HydrophobicContact CB-CG 3.91Å; E147-K326 HydrophobicContact CG-CD 4.5Å
327	E	92.1	Very high	93	Very high	95 Å²	95	38.9 Å²	38.9	44%	0.444	21%	0.209	S	C	.	.	S	Bend	trans	-133.1	162	-176.9	-71.3	-60.1	153.2	0	0	110.9	P145 Q325	P145-E327 HydrophobicContact CB-CB 3.94Å; P145-E327 HydrophobicContact CG-CB 4.28Å; P145-E327 WeakPolarHBondContact CG-O 3.38Å; Q325-E327 WeakPolarHBondContact CG-O 3.47Å; Q325-E327 PolarHBondContact NE2-O 3.3Å
328	G	93.2	Very high	93	Very high	2 Å²	2	36.9 Å²	36.9	2%	0.021	20%	0.199	C	C	.	.	S	Bend	trans	70.6	-179.7	-171.6	0	0	0	0	0	112.8	F270 T271 V273 I275	F270-G328 CarbonylContact O-C 3.53Å; F270-G328 WeakPolarHBondContact O-CA 3.29Å; T271-G328 WeakPolarHBondContact O-CA 3.45Å; V273-G328 VanDerWaalsContact O-CA 3.3Å; V273-G328 WeakPolarHBondContact O-CA 3.12Å; I275-G328 WeakPolarHBondContact CD1-O 3.48Å
329	I	94.7	Very high	93.1	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.198	C	C	.	.			trans	-112.1	149	-177.8	59	173	0	0	0	110.1	F270 V273 I275 L311 Q325 M331 S336 V339 A340	F270-I329 CarbonylContact C-O 3.57Å; F270-I329 HydrophobicContact CB-CG1 4.27Å; F270-I329 HydrophobicContact CD1-CD1 3.89Å; F270-I329 HydrophobicContact CD1-CG1 3.89Å; F270-I329 HydrophobicContact CE1-CD1 4.37Å; F270-I329 VanDerWaalsContact O-CG1 3.31Å; F270-I329 WeakPolarHBondContact O-CG1 3.5Å; F270-I329 PolarHBondContact O-N 2.65Å; F270-I329 VanDerWaalsContact O-O 3.08Å; V273-I329 HydrophobicContact CB-CD1 4.28Å; V273-I329 HydrophobicContact CB-CG1 4.17Å; V273-I329 HydrophobicContact CG2-CD1 3.94Å; V273-I329 HydrophobicContact CG2-CG1 4.12Å; I275-I329 HydrophobicContact CG1-CG2 4.5Å; L311-I329 HydrophobicContact CB-CG2 4.48Å; L311-I329 HydrophobicContact CD1-CG2 4.21Å; L311-I329 HydrophobicContact CD2-CB 4.35Å; L311-I329 HydrophobicContact CD2-CG2 3.77Å; L311-I329 HydrophobicContact CG-CG2 4.36Å; Q325-I329 PolarHBondContact NE2-O 3.38Å; I329-M331 PolarHBondContact O-N 3.04Å; I329-S336 VanDerWaalsContact CD1-O 3.26Å; I329-S336 WeakPolarHBondContact CD1-O 3.34Å; I329-V339 HydrophobicContact CD1-CB 4.27Å; I329-V339 HydrophobicContact CD1-CG1 4.22Å; I329-V339 HydrophobicContact CG2-CG1 4.35Å; I329-A340 HydrophobicContact CD1-CB 3.99Å
330	A	92.1	Very high	93.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.008	18%	0.176	C	C	.	.			trans	-77.7	125.9	-173.1	0	0	0	0	0	112.8	T314 G332 S333 S336	T314-A330 HydrophobicContact CG2-CB 3.45Å; T314-A330 VanDerWaalsContact CG2-CB 3.45Å; T314-A330 WeakPolarHBondContact OG1-CB 3.39Å; A330-G332 PolarHBondContact O-N 3.11Å; A330-S333 PolarHBondContact O-N 3.49Å; A330-S333 VanDerWaalsContact O-N 3.16Å; A330-S336 VanDerWaalsContact O-CB 3.31Å; A330-S336 WeakPolarHBondContact O-CB 3.34Å; A330-S336 PolarHBondContact O-OG 3.46Å; A330-S336 VanDerWaalsContact O-OG 3.11Å
331	M	87.2	Confident	93.3	Very high	38 Å²	38	31.2 Å²	31.2	19%	0.187	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.3	98.6	168.9	-162.5	-177.8	-52.3	0	0	109.7	R208 V210 V211 F270 I329	R208-M331 HydrophobicContact CG-CE 4.03Å; R208-M331 HydrophobicContact CG-SD 3.74Å; R208-M331 PolarHBondContact NE-SD 2.99Å; V210-M331 HydrophobicContact CG2-SD 4.26Å; V211-M331 PolarHBondContact N-O 3.05Å; F270-M331 HydrophobicContact CB-CE 4.41Å; F270-M331 HydrophobicContact CD2-CE 3.88Å; F270-M331 HydrophobicContact CD2-CG 4.48Å; F270-M331 HydrophobicContact CG-CB 4.44Å; F270-M331 HydrophobicContact CG-CE 4.35Å; I329-M331 PolarHBondContact O-N 3.04Å
332	G	88.4	Confident	93.3	Very high	42 Å²	42	28.9 Å²	28.9	43%	0.433	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	134.3	-15.2	-175.8	0	0	0	0	0	114	F213 A330	F213-G332 WeakPolarHBondContact CB-O 3.4Å; A330-G332 PolarHBondContact O-N 3.11Å
333	S	92.4	Very high	93.3	Very high	3 Å²	3	31.1 Å²	31.1	2%	0.021	16%	0.162	C	C	.	.			trans	-71.7	135.4	169.9	172.5	0	0	0	0	110.5	A330 V335 S336 P337	A330-S333 PolarHBondContact O-N 3.49Å; A330-S333 VanDerWaalsContact O-N 3.16Å; S333-V335 PolarHBondContact O-N 3.11Å; S333-V335 VanDerWaalsContact O-N 3.16Å; S333-S336 WeakPolarHBondContact CB-OG 3.37Å; S333-S336 PolarHBondContact O-N 2.89Å; S333-P337 WeakPolarHBondContact O-CD 3.33Å
334	P	94.6	Very high	93.1	Very high	37 Å²	37	34.9 Å²	34.9	24%	0.24	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-27.5	-178.5	-26.3	34.1	0	0	0	114.9	Y219 A222 K223 A226	Y219-P334 HydrophobicContact CD2-CG 4.03Å; Y219-P334 HydrophobicContact CE2-CG 3.68Å; A222-P334 HydrophobicContact CB-CG 4.47Å; K223-P334 HydrophobicContact CB-CB 4.29Å; K223-P334 HydrophobicContact CB-CG 4.32Å; A226-P334 WeakPolarHBondContact CB-O 3.31Å
335	V	95.4	Very high	92.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-22.2	-176.6	75.5	0	0	0	0	112.7	A222 L225 A226 L229 L307 L311 S333 I338 V339	A222-V335 HydrophobicContact CB-CB 4.37Å; A222-V335 HydrophobicContact CB-CG1 4.19Å; L225-V335 HydrophobicContact CB-CG2 4.37Å; A226-V335 HydrophobicContact CB-CB 4.15Å; A226-V335 HydrophobicContact CB-CG2 4.24Å; L229-V335 HydrophobicContact CD1-CG2 3.98Å; L307-V335 HydrophobicContact CD1-CB 4.48Å; L307-V335 HydrophobicContact CD1-CG1 4.03Å; L307-V335 HydrophobicContact CD1-CG2 3.65Å; L311-V335 HydrophobicContact CD2-CG1 3.87Å; S333-V335 PolarHBondContact O-N 3.11Å; S333-V335 VanDerWaalsContact O-N 3.16Å; V335-I338 PolarHBondContact O-N 3.28Å; V335-I338 VanDerWaalsContact O-N 3.17Å; V335-V339 HydrophobicContact CG2-CG2 4.04Å; V335-V339 WeakPolarHBondContact O-CG2 3.38Å; V335-V339 PolarHBondContact O-N 2.95Å; V335-V339 VanDerWaalsContact O-N 3.08Å
336	S	95.4	Very high	92.5	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.007	20%	0.196	C	C	.	.	H	α-helix	trans	-59.6	-40.6	-173.4	-68.1	0	0	0	0	114.9	I329 A330 S333 I338 V339 A340	I329-S336 VanDerWaalsContact CD1-O 3.26Å; I329-S336 WeakPolarHBondContact CD1-O 3.34Å; A330-S336 VanDerWaalsContact O-CB 3.31Å; A330-S336 WeakPolarHBondContact O-CB 3.34Å; A330-S336 PolarHBondContact O-OG 3.46Å; A330-S336 VanDerWaalsContact O-OG 3.11Å; S333-S336 WeakPolarHBondContact CB-OG 3.37Å; S333-S336 PolarHBondContact O-N 2.89Å; S336-I338 VanDerWaalsContact C-N 3.31Å; S336-I338 PolarHBondContact O-N 3.19Å; S336-V339 PolarHBondContact O-N 3.22Å; S336-A340 WeakPolarHBondContact O-CB 3.44Å; S336-A340 PolarHBondContact O-N 3.04Å
337	P	94.5	Very high	92.6	Very high	61 Å²	61	32.9 Å²	32.9	40%	0.396	18%	0.181	S	C	.	.	H	α-helix	trans	-58.8	-41.8	176.2	-25.9	35.5	0	0	0	113	S333 A340 N341	S333-P337 WeakPolarHBondContact O-CD 3.33Å; P337-A340 PolarHBondContact O-N 3.11Å; P337-N341 WeakPolarHBondContact O-CB 3.44Å; P337-N341 PolarHBondContact O-N 2.91Å; P337-N341 PolarHBondContact O-ND2 3.45Å; P337-N341 PolarHBondContact O-OD1 3.34Å
338	I	94.8	Very high	92.6	Very high	11 Å²	11	29.4 Å²	29.4	6%	0.056	17%	0.166	C	C	.	.	H	α-helix	trans	-69.6	-42.1	-179.1	-58.6	172.5	0	0	0	110.1	A226 L229 K230 E233 V335 S336 A340 N341 L342	A226-I338 HydrophobicContact CB-CD1 3.87Å; A226-I338 WeakPolarHBondContact O-CD1 3.46Å; L229-I338 HydrophobicContact CB-CG2 3.69Å; L229-I338 HydrophobicContact CD1-CG2 4.45Å; K230-I338 HydrophobicContact CB-CD1 4.47Å; K230-I338 HydrophobicContact CD-CD1 4.23Å; E233-I338 HydrophobicContact CG-CG1 4.42Å; E233-I338 HydrophobicContact CG-CG2 3.89Å; V335-I338 PolarHBondContact O-N 3.28Å; V335-I338 VanDerWaalsContact O-N 3.17Å; S336-I338 VanDerWaalsContact C-N 3.31Å; S336-I338 PolarHBondContact O-N 3.19Å; I338-A340 VanDerWaalsContact C-N 3.34Å; I338-A340 PolarHBondContact O-N 3.37Å; I338-N341 PolarHBondContact O-N 2.84Å; I338-L342 HydrophobicContact CG2-CD1 3.92Å; I338-L342 HydrophobicContact CG2-CG 4.32Å; I338-L342 WeakPolarHBondContact O-CB 3.27Å; I338-L342 WeakPolarHBondContact O-CG 3.47Å; I338-L342 PolarHBondContact O-N 2.61Å
339	V	96.1	Very high	92.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62	-42.5	175.8	175.1	0	0	0	0	111.3	A278 I282 L307 L311 I329 V335 S336 F343	A278-V339 HydrophobicContact CB-CG1 3.83Å; I282-V339 HydrophobicContact CD1-CB 4.32Å; I282-V339 HydrophobicContact CD1-CG1 4.14Å; I282-V339 HydrophobicContact CD1-CG2 3.84Å; L307-V339 HydrophobicContact CD1-CG2 4.21Å; L311-V339 HydrophobicContact CD1-CG1 4.16Å; L311-V339 HydrophobicContact CD1-CG2 4.44Å; L311-V339 HydrophobicContact CD2-CG2 4.3Å; I329-V339 HydrophobicContact CD1-CB 4.27Å; I329-V339 HydrophobicContact CD1-CG1 4.22Å; I329-V339 HydrophobicContact CG2-CG1 4.35Å; V335-V339 HydrophobicContact CG2-CG2 4.04Å; V335-V339 WeakPolarHBondContact O-CG2 3.38Å; V335-V339 PolarHBondContact O-N 2.95Å; V335-V339 VanDerWaalsContact O-N 3.08Å; S336-V339 PolarHBondContact O-N 3.22Å; V339-F343 VanDerWaalsContact O-CB 3.26Å; V339-F343 WeakPolarHBondContact O-CB 3.3Å; V339-F343 PolarHBondContact O-N 3.03Å
340	A	94.8	Very high	92.4	Very high	1 Å²	1	33 Å²	33	1%	0.008	19%	0.186	C	C	.	.	H	α-helix	trans	-61.4	-45.4	175.6	0	0	0	0	0	111.6	L269 F270 I329 S336 P337 I338 F343 M344	L269-A340 HydrophobicContact CD2-CB 4.11Å; L269-A340 HydrophobicContact CG-CB 4.39Å; F270-A340 HydrophobicContact CE1-CB 4.18Å; F270-A340 HydrophobicContact CZ-CB 4.43Å; I329-A340 HydrophobicContact CD1-CB 3.99Å; S336-A340 WeakPolarHBondContact O-CB 3.44Å; S336-A340 PolarHBondContact O-N 3.04Å; P337-A340 PolarHBondContact O-N 3.11Å; I338-A340 VanDerWaalsContact C-N 3.34Å; I338-A340 PolarHBondContact O-N 3.37Å; A340-F343 PolarHBondContact O-N 3.07Å; A340-M344 WeakPolarHBondContact O-CB 3.36Å; A340-M344 VanDerWaalsContact O-CG 3.29Å; A340-M344 WeakPolarHBondContact O-CG 3.45Å; A340-M344 PolarHBondContact O-N 2.77Å
341	N	92.9	Very high	92.5	Very high	71 Å²	71	35.1 Å²	35.1	38%	0.38	20%	0.197	S	C	.	.	H	α-helix	trans	-63.3	-45.2	179.7	-70.3	-14.4	0	0	0	111.9	E233 I236 P337 I338 F343 M344 H345	E233-N341 PolarHBondContact OE1-ND2 3.2Å; I236-N341 HydrophobicContact CD1-CB 3.71Å; P337-N341 WeakPolarHBondContact O-CB 3.44Å; P337-N341 PolarHBondContact O-N 2.91Å; P337-N341 PolarHBondContact O-ND2 3.45Å; P337-N341 PolarHBondContact O-OD1 3.34Å; I338-N341 PolarHBondContact O-N 2.84Å; N341-F343 VanDerWaalsContact C-N 3.31Å; N341-F343 PolarHBondContact O-N 3.01Å; N341-M344 PolarHBondContact O-N 3.17Å; N341-H345 PolarHBondContact O-N 3.04Å
342	L	93.1	Very high	92.8	Very high	5 Å²	5	34.9 Å²	34.9	3%	0.026	20%	0.198	C	C	.	.	H	α-helix	trans	-69	-28.1	177.7	-68.3	174.6	0	0	0	112.9	H232 I236 I282 I338	H232-L342 HydrophobicContact CB-CD1 4.39Å; H232-L342 HydrophobicContact CB-CD2 4.19Å; I236-L342 HydrophobicContact CD1-CD2 4.41Å; I236-L342 HydrophobicContact CG1-CD2 4.39Å; I282-L342 HydrophobicContact CD1-CD1 4.37Å; I282-L342 HydrophobicContact CG1-CB 4.38Å; I282-L342 HydrophobicContact CG1-CD1 3.93Å; I338-L342 HydrophobicContact CG2-CD1 3.92Å; I338-L342 HydrophobicContact CG2-CG 4.32Å; I338-L342 WeakPolarHBondContact O-CB 3.27Å; I338-L342 WeakPolarHBondContact O-CG 3.47Å; I338-L342 PolarHBondContact O-N 2.61Å
343	F	93.8	Very high	93.2	Very high	52 Å²	52	34.4 Å²	34.4	23%	0.228	18%	0.18	C	C	.	.	H	α-helix	trans	-75.4	-32.7	174.6	174.3	-99.3	0	0	0	112.8	V273 P274 R277 A278 I281 V339 A340 N341 H345	V273-F343 HydrophobicContact CG1-CB 4.15Å; V273-F343 HydrophobicContact CG1-CD1 3.99Å; V273-F343 HydrophobicContact CG1-CD2 4.18Å; V273-F343 HydrophobicContact CG1-CG 3.81Å; V273-F343 HydrophobicContact CG2-CD1 4.16Å; P274-F343 HydrophobicContact CG-CE2 4.3Å; P274-F343 HydrophobicContact CG-CZ 4.06Å; R277-F343 HydrophobicContact CB-CE2 4.16Å; R277-F343 HydrophobicContact CG-CE2 3.92Å; A278-F343 HydrophobicContact CB-CB 4.33Å; A278-F343 HydrophobicContact CB-CD2 4.13Å; I281-F343 HydrophobicContact CD1-CD2 4.03Å; V339-F343 VanDerWaalsContact O-CB 3.26Å; V339-F343 WeakPolarHBondContact O-CB 3.3Å; V339-F343 PolarHBondContact O-N 3.03Å; A340-F343 PolarHBondContact O-N 3.07Å; N341-F343 VanDerWaalsContact C-N 3.31Å; N341-F343 PolarHBondContact O-N 3.01Å; F343-H345 VanDerWaalsContact C-N 3.32Å
344	M	91.2	Very high	93.2	Very high	100 Å²	100	37 Å²	37	49%	0.493	19%	0.193	S	C	.	.	H	α-helix	trans	-79.8	-16.3	178.6	-73.3	-57.9	-51.8	0	0	113.5	V266 L269 A340 N341	V266-M344 HydrophobicContact CG2-CE 3.77Å; V266-M344 HydrophobicContact CG2-SD 4.27Å; L269-M344 HydrophobicContact CD1-CG 3.86Å; L269-M344 HydrophobicContact CD1-SD 3.58Å; L269-M344 VanDerWaalsContact CD1-SD 3.58Å; L269-M344 HydrophobicContact CD2-CG 4.17Å; A340-M344 WeakPolarHBondContact O-CB 3.36Å; A340-M344 VanDerWaalsContact O-CG 3.29Å; A340-M344 WeakPolarHBondContact O-CG 3.45Å; A340-M344 PolarHBondContact O-N 2.77Å; N341-M344 PolarHBondContact O-N 3.17Å
345	H	82.3	Confident	93.1	Very high	105 Å²	105	37 Å²	37	49%	0.486	19%	0.189	S	C	.	.			trans	-83.2	0	171.8	-179.8	-91.7	0	0	0	110.1	L235 I236 N237 N341 F343	L235-H345 PolarHBondContact O-NE2 3.01Å; I236-H345 WeakPolarHBondContact CA-CD2 3.27Å; I236-H345 HydrophobicContact CG1-CB 4.02Å; I236-H345 HydrophobicContact CG2-CB 4.15Å; N237-H345 PolarHBondContact N-NE2 2.71Å; N341-H345 PolarHBondContact O-N 3.04Å; F343-H345 VanDerWaalsContact C-N 3.32Å

Retrieved 345 of 345 residues in 98.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).