A0A5K4F718_SCHMA Loading...

Large ribosomal subunit protein uL30 AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F718, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 252 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters 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	44.8	Very low	52.4	Low	248 Å²	248	163.6 Å²	163.6	100%	1.222	88%	0.88	S	S	*	*				0	113.8	0	-60.8	-176.4	171.4	0	0	105.4
2	S	48.7	Very low	52.8	Low	112 Å²	112	158.6 Å²	158.6	78%	0.783	88%	0.878	S	S	*	*			cis	-160.3	128	24.7	40	0	0	0	0	108.4
3	D	51.3	Low	53.7	Low	171 Å²	171	156.2 Å²	156.2	91%	0.914	87%	0.871	S	S	*	*			trans	-80.2	126	176.1	-94.2	-49.8	0	0	0	111.8
4	V	58.8	Low	54.3	Low	134 Å²	134	153.4 Å²	153.4	81%	0.812	86%	0.862	S	S	*	*			trans	-91.8	105.6	174.7	177.1	0	0	0	0	109.1	K6	V4-K6 PolarHBondContact O-N 3.4Å
5	K	56	Low	54.7	Low	199 Å²	199	157.5 Å²	157.5	87%	0.865	87%	0.867	S	S	*	*			trans	-74.7	113.6	171	-88.4	179.3	174.8	175.1	0	110.6
6	K	54.3	Low	55.5	Low	197 Å²	197	161.6 Å²	161.6	86%	0.857	87%	0.866	S	S	*	*			trans	-70.3	125.8	163.7	-77.4	176.6	174.9	175.4	0	109.9	V4	V4-K6 PolarHBondContact O-N 3.4Å
7	T	49.9	Very low	56.3	Low	133 Å²	133	159.5 Å²	159.5	82%	0.816	86%	0.863	S	S	*	*			trans	-93.2	115.1	170.1	47.3	0	0	0	0	109.8	T9	T7-T9 PolarHBondContact O-N 3.29Å
8	D	53.5	Low	57.1	Low	156 Å²	156	162.9 Å²	162.9	83%	0.834	86%	0.861	S	S	*	*			trans	-74.9	111.8	173.1	-77.8	-34.3	0	0	0	111.2	Q10	D8-Q10 PolarHBondContact O-N 3.06Å
9	T	51.2	Low	57.9	Low	145 Å²	145	159.9 Å²	159.9	89%	0.89	84%	0.84	S	S	*	*			trans	-72.6	104.3	166.8	8.3	0	0	0	0	110.4	T7 S11	T7-T9 PolarHBondContact O-N 3.29Å; T9-S11 PolarHBondContact O-N 3.37Å
10	Q	54.4	Low	59	Low	190 Å²	190	156.2 Å²	156.2	89%	0.888	83%	0.826	S	S	*	*			trans	-76.6	113.1	168	-67.2	-177.7	12.3	0	0	109.9	D8	D8-Q10 PolarHBondContact O-N 3.06Å
11	S	53.4	Low	60.1	Low	115 Å²	115	156.4 Å²	156.4	80%	0.804	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-71.5	126.4	174.7	47.7	0	0	0	0	111.4	T9 T13	T9-S11 PolarHBondContact O-N 3.37Å; S11-T13 PolarHBondContact O-N 3.41Å
12	A	57	Low	61.9	Low	103 Å²	103	146.9 Å²	146.9	85%	0.851	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-72.8	119.1	179.6	0	0	0	0	0	111.2
13	T	65.2	Low	63.5	Low	128 Å²	128	145.9 Å²	145.9	79%	0.785	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-71.8	141.8	174.1	45.1	0	0	0	0	111.5	S11 K15	S11-T13 PolarHBondContact O-N 3.41Å; T13-K15 PolarHBondContact O-N 3.42Å
14	P	61.3	Low	65	Low	116 Å²	116	144.2 Å²	144.2	75%	0.753	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66.3	126.7	-174.9	23.8	-31.9	0	0	0	112.2	R16	P14-R16 PolarHBondContact O-N 3.29Å
15	K	60.8	Low	66.4	Low	215 Å²	215	141.9 Å²	141.9	94%	0.935	74%	0.74	S	S	*	*			trans	-65.6	101.4	176.4	-75.3	177.3	179.9	170.9	0	110.3	T13	T13-K15 PolarHBondContact O-N 3.42Å
16	R	67	Low	68	Low	224 Å²	224	139.5 Å²	139.5	85%	0.845	73%	0.729	S	S	*	*	P	Polyproline II helix	trans	-65.8	145.1	170.4	-63.6	-178.5	-177.5	-171.4	-0.4	110.7	P14 R18	P14-R16 PolarHBondContact O-N 3.29Å; R16-R18 PolarHBondContact O-N 3.22Å
17	P	70.4	Confident	69.7	Low	125 Å²	125	134.6 Å²	134.6	81%	0.812	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-58.1	134.3	178.3	22.4	-31.9	0	0	0	110.9	K19	P17-K19 PolarHBondContact O-N 3.41Å
18	R	69.5	Low	71.6	Confident	222 Å²	222	134.3 Å²	134.3	84%	0.838	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-66.1	123	179.1	-75.7	-178.7	174	-174.7	-0.6	108.8	R16	R16-R18 PolarHBondContact O-N 3.22Å
19	K	73.1	Confident	73.4	Confident	106 Å²	106	130.7 Å²	130.7	46%	0.461	68%	0.677	S	S	.	*	P	Polyproline II helix	trans	-53.6	137.3	172.2	-72.1	-175	179.4	-176.8	0	110.1	P17 E21 R24 E27	P17-K19 PolarHBondContact O-N 3.41Å; K19-E21 PolarHBondContact O-N 2.98Å; K19-R24 HydrophobicContact CB-CG 3.9Å; K19-R24 WeakPolarHBondContact O-CD 3.48Å; K19-E27 VanDerWaalsContact NZ-CD 3.27Å; K19-E27 IonicContact NZ-OE1 3.71Å; K19-E27 PolarHBondContact NZ-OE1 3.44Å; K19-E27 IonicContact NZ-OE2 3.89Å; K19-E27 PolarHBondContact NZ-OE2 2.88Å
20	P	80.3	Confident	75.4	Confident	84 Å²	84	132.7 Å²	132.7	55%	0.545	67%	0.668	S	S	.	*	P	Polyproline II helix	trans	-47.7	137.9	172.8	-28.6	32.1	0	0	0	112.3	G22 L23 R24	P20-G22 VanDerWaalsContact C-N 3.27Å; P20-G22 PolarHBondContact O-N 3.41Å; P20-L23 HydrophobicContact CB-CD1 4.32Å; P20-L23 HydrophobicContact CB-CG 4.46Å; P20-L23 HydrophobicContact CG-CD1 4.06Å; P20-L23 WeakPolarHBondContact O-CB 3.5Å; P20-L23 PolarHBondContact O-N 3.49Å; P20-R24 PolarHBondContact O-N 3.18Å
21	E	80.4	Confident	77.2	Confident	162 Å²	162	132.3 Å²	132.3	76%	0.757	66%	0.658	S	S	*	*	H	α-helix	trans	-56.4	-40.4	-174.5	-64.8	-166.2	154.2	0	0	112.6	K19 L23 R24 V25	K19-E21 PolarHBondContact O-N 2.98Å; E21-L23 VanDerWaalsContact C-N 3.29Å; E21-L23 PolarHBondContact O-N 3.32Å; E21-R24 WeakPolarHBondContact O-CB 3.49Å; E21-R24 PolarHBondContact O-N 2.95Å; E21-R24 VanDerWaalsContact O-N 3.11Å; E21-V25 WeakPolarHBondContact O-CG2 3.4Å; E21-V25 PolarHBondContact O-N 3.11Å
22	G	84.2	Confident	79.1	Confident	48 Å²	48	134.1 Å²	134.1	50%	0.495	65%	0.648	S	S	.	*	H	α-helix	trans	-58.5	-36.1	175.9	0	0	0	0	0	113.8	P20 K26	P20-G22 VanDerWaalsContact C-N 3.27Å; P20-G22 PolarHBondContact O-N 3.41Å; G22-K26 VanDerWaalsContact O-CG 3.32Å; G22-K26 WeakPolarHBondContact O-CG 3.34Å; G22-K26 PolarHBondContact O-N 2.88Å; G22-K26 VanDerWaalsContact O-N 3.13Å
23	L	82.7	Confident	80.8	Confident	90 Å²	90	135.9 Å²	135.9	47%	0.471	64%	0.636	S	S	.	*	H	α-helix	trans	-72.3	-39.9	175.2	-71.1	174	0	0	0	111.5	P20 E21 V25 K26 E27	P20-L23 HydrophobicContact CB-CD1 4.32Å; P20-L23 HydrophobicContact CB-CG 4.46Å; P20-L23 HydrophobicContact CG-CD1 4.06Å; P20-L23 WeakPolarHBondContact O-CB 3.5Å; P20-L23 PolarHBondContact O-N 3.49Å; E21-L23 VanDerWaalsContact C-N 3.29Å; E21-L23 PolarHBondContact O-N 3.32Å; L23-V25 VanDerWaalsContact C-N 3.35Å; L23-V25 PolarHBondContact O-N 3.46Å; L23-K26 PolarHBondContact O-N 3.3Å; L23-E27 WeakPolarHBondContact O-CB 3.42Å; L23-E27 WeakPolarHBondContact O-CG 3.32Å; L23-E27 PolarHBondContact O-N 3.13Å
24	R	82.8	Confident	82.2	Confident	137 Å²	137	135 Å²	135	52%	0.517	63%	0.626	S	S	.	*	H	α-helix	trans	-62.1	-41.5	176.2	-66.6	179.5	123.2	-177	-0.8	111.9	K19 P20 E21 E27 K28	K19-R24 HydrophobicContact CB-CG 3.9Å; K19-R24 WeakPolarHBondContact O-CD 3.48Å; P20-R24 PolarHBondContact O-N 3.18Å; E21-R24 WeakPolarHBondContact O-CB 3.49Å; E21-R24 PolarHBondContact O-N 2.95Å; E21-R24 VanDerWaalsContact O-N 3.11Å; R24-E27 PolarHBondContact O-N 3.41Å; R24-K28 WeakPolarHBondContact O-CB 3.44Å; R24-K28 PolarHBondContact O-N 3.22Å
25	V	87.1	Confident	83.8	Confident	85 Å²	85	133 Å²	133	52%	0.515	61%	0.608	S	S	.	*	H	α-helix	trans	-64.9	-46.1	176.1	175.3	0	0	0	0	110.8	E21 L23 E27 K28 I29	E21-V25 WeakPolarHBondContact O-CG2 3.4Å; E21-V25 PolarHBondContact O-N 3.11Å; L23-V25 VanDerWaalsContact C-N 3.35Å; L23-V25 PolarHBondContact O-N 3.46Å; V25-E27 PolarHBondContact O-N 2.92Å; V25-K28 PolarHBondContact O-N 2.67Å; V25-I29 HydrophobicContact CG1-CD1 3.86Å; V25-I29 HydrophobicContact CG1-CG1 4.46Å; V25-I29 WeakPolarHBondContact O-CG1 3.37Å; V25-I29 PolarHBondContact O-N 2.89Å
26	K	89.5	Confident	85.4	Confident	148 Å²	148	126 Å²	126	64%	0.643	58%	0.583	S	S	*	*	H	α-helix	trans	-58.8	-43.5	175.1	-75	178.2	-176.6	-178.9	0	112.2	G22 L23 I29 R30	G22-K26 VanDerWaalsContact O-CG 3.32Å; G22-K26 WeakPolarHBondContact O-CG 3.34Å; G22-K26 PolarHBondContact O-N 2.88Å; G22-K26 VanDerWaalsContact O-N 3.13Å; L23-K26 PolarHBondContact O-N 3.3Å; K26-I29 PolarHBondContact O-N 3.27Å; K26-R30 WeakPolarHBondContact O-CB 3.49Å; K26-R30 PolarHBondContact O-N 3.06Å
27	E	89.3	Confident	86.7	Confident	95 Å²	95	119.9 Å²	119.9	44%	0.444	57%	0.571	S	S	.	*	H	α-helix	trans	-62.2	-43.6	175.3	-76.4	179.5	-179.5	0	0	112	K19 L23 R24 V25 R30 R31	K19-E27 VanDerWaalsContact NZ-CD 3.27Å; K19-E27 IonicContact NZ-OE1 3.71Å; K19-E27 PolarHBondContact NZ-OE1 3.44Å; K19-E27 IonicContact NZ-OE2 3.89Å; K19-E27 PolarHBondContact NZ-OE2 2.88Å; L23-E27 WeakPolarHBondContact O-CB 3.42Å; L23-E27 WeakPolarHBondContact O-CG 3.32Å; L23-E27 PolarHBondContact O-N 3.13Å; R24-E27 PolarHBondContact O-N 3.41Å; V25-E27 PolarHBondContact O-N 2.92Å; E27-R30 PolarHBondContact O-N 3.34Å; E27-R31 WeakPolarHBondContact O-CB 3.37Å; E27-R31 PolarHBondContact O-N 3.44Å
28	K	90.4	Very high	87.8	Confident	127 Å²	127	116.6 Å²	116.6	55%	0.552	55%	0.554	S	S	*	*	H	α-helix	trans	-63	-43.3	176.7	-168.9	176.8	-176.4	177.9	0	111.8	R24 V25 R31 R32	R24-K28 WeakPolarHBondContact O-CB 3.44Å; R24-K28 PolarHBondContact O-N 3.22Å; V25-K28 PolarHBondContact O-N 2.67Å; K28-R31 PolarHBondContact O-N 2.95Å; K28-R32 WeakPolarHBondContact O-CB 3.32Å; K28-R32 VanDerWaalsContact O-CG 3.32Å; K28-R32 WeakPolarHBondContact O-CG 3.44Å; K28-R32 PolarHBondContact O-N 2.83Å
29	I	92.2	Very high	89	Confident	80 Å²	80	114.4 Å²	114.4	41%	0.41	55%	0.546	S	S	.	.	H	α-helix	trans	-63.4	-45.4	175.1	-67.4	167.9	0	0	0	110.5	V25 K26 R32 K33	V25-I29 HydrophobicContact CG1-CD1 3.86Å; V25-I29 HydrophobicContact CG1-CG1 4.46Å; V25-I29 WeakPolarHBondContact O-CG1 3.37Å; V25-I29 PolarHBondContact O-N 2.89Å; K26-I29 PolarHBondContact O-N 3.27Å; I29-R32 PolarHBondContact O-N 3.32Å; I29-K33 HydrophobicContact CG2-CD 4.23Å; I29-K33 HydrophobicContact CG2-CG 4.49Å; I29-K33 WeakPolarHBondContact O-CG 3.32Å; I29-K33 PolarHBondContact O-N 2.91Å
30	R	92.4	Very high	90	Very high	186 Å²	186	116.2 Å²	116.2	70%	0.702	55%	0.554	S	S	*	*	H	α-helix	trans	-60.9	-47.1	177.1	-172.8	179.4	179	-177.1	0.5	111.3	K26 E27 R32 K33 L34	K26-R30 WeakPolarHBondContact O-CB 3.49Å; K26-R30 PolarHBondContact O-N 3.06Å; E27-R30 PolarHBondContact O-N 3.34Å; R30-R32 PolarHBondContact O-N 2.95Å; R30-K33 PolarHBondContact O-N 3.47Å; R30-L34 HydrophobicContact CG-CD1 4.28Å; R30-L34 VanDerWaalsContact O-CG 3.32Å; R30-L34 WeakPolarHBondContact O-CG 3.25Å; R30-L34 PolarHBondContact O-N 3.49Å
31	R	92.3	Very high	90.7	Very high	182 Å²	182	120 Å²	120	69%	0.687	56%	0.562	S	S	*	*	H	α-helix	trans	-60.2	-44.1	176.7	-172.4	177.6	178.3	-173.1	-0.3	111.6	E27 K28 L34 I35	E27-R31 WeakPolarHBondContact O-CB 3.37Å; E27-R31 PolarHBondContact O-N 3.44Å; K28-R31 PolarHBondContact O-N 2.95Å; R31-L34 PolarHBondContact O-N 3.01Å; R31-I35 HydrophobicContact CG-CD1 4.07Å; R31-I35 VanDerWaalsContact O-CG1 3.31Å; R31-I35 WeakPolarHBondContact O-CG1 3.41Å; R31-I35 PolarHBondContact O-N 3.37Å
32	R	92.9	Very high	91.4	Very high	154 Å²	154	116.3 Å²	116.3	58%	0.581	55%	0.55	S	S	*	.	H	α-helix	trans	-59.9	-49.3	174.3	-76.7	176	173.5	-177.7	-4	111.6	K28 I29 R30 L34 I35 T36	K28-R32 WeakPolarHBondContact O-CB 3.32Å; K28-R32 VanDerWaalsContact O-CG 3.32Å; K28-R32 WeakPolarHBondContact O-CG 3.44Å; K28-R32 PolarHBondContact O-N 2.83Å; I29-R32 PolarHBondContact O-N 3.32Å; R30-R32 PolarHBondContact O-N 2.95Å; R32-L34 VanDerWaalsContact C-N 3.33Å; R32-L34 PolarHBondContact O-N 3.5Å; R32-I35 PolarHBondContact O-N 3.25Å; R32-T36 PolarHBondContact O-N 2.93Å; R32-T36 PolarHBondContact O-OG1 2.88Å; R32-T36 VanDerWaalsContact O-OG1 3.05Å
33	K	94.3	Very high	91.9	Very high	140 Å²	140	118.7 Å²	118.7	61%	0.609	55%	0.55	S	S	*	*	H	α-helix	trans	-56.7	-45.4	176.5	-75.6	-179.4	177.8	-176.9	0	111.6	I29 R30 T36 V37	I29-K33 HydrophobicContact CG2-CD 4.23Å; I29-K33 HydrophobicContact CG2-CG 4.49Å; I29-K33 WeakPolarHBondContact O-CG 3.32Å; I29-K33 PolarHBondContact O-N 2.91Å; R30-K33 PolarHBondContact O-N 3.47Å; K33-T36 PolarHBondContact O-N 3.4Å; K33-V37 WeakPolarHBondContact O-CB 3.37Å; K33-V37 VanDerWaalsContact O-CG2 3.25Å; K33-V37 WeakPolarHBondContact O-CG2 3.45Å; K33-V37 PolarHBondContact O-N 3.05Å
34	L	94.1	Very high	92.4	Very high	110 Å²	110	122 Å²	122	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-60.6	-46.7	177.5	-71.4	171.1	0	0	0	112.2	R30 R31 R32 T36 V37 A38	R30-L34 HydrophobicContact CG-CD1 4.28Å; R30-L34 VanDerWaalsContact O-CG 3.32Å; R30-L34 WeakPolarHBondContact O-CG 3.25Å; R30-L34 PolarHBondContact O-N 3.49Å; R31-L34 PolarHBondContact O-N 3.01Å; R32-L34 VanDerWaalsContact C-N 3.33Å; R32-L34 PolarHBondContact O-N 3.5Å; L34-T36 PolarHBondContact O-N 3.4Å; L34-V37 PolarHBondContact O-N 3.34Å; L34-A38 WeakPolarHBondContact O-CB 3.31Å; L34-A38 PolarHBondContact O-N 2.91Å
35	I	93.4	Very high	92.9	Very high	74 Å²	74	124 Å²	124	38%	0.379	56%	0.564	S	S	.	*	H	α-helix	trans	-61.8	-44.9	176.9	-66.5	165.7	0	0	0	110.7	R31 R32 A38 R39	R31-I35 HydrophobicContact CG-CD1 4.07Å; R31-I35 VanDerWaalsContact O-CG1 3.31Å; R31-I35 WeakPolarHBondContact O-CG1 3.41Å; R31-I35 PolarHBondContact O-N 3.37Å; R32-I35 PolarHBondContact O-N 3.25Å; I35-A38 PolarHBondContact O-N 2.92Å; I35-R39 HydrophobicContact CG2-CG 4.45Å; I35-R39 WeakPolarHBondContact O-CB 3.46Å; I35-R39 WeakPolarHBondContact O-CG 3.44Å; I35-R39 PolarHBondContact O-N 3.43Å
36	T	94.5	Very high	93.3	Very high	67 Å²	67	125.6 Å²	125.6	41%	0.411	57%	0.566	S	S	.	*	H	α-helix	trans	-63.5	-43.6	178.6	-58.5	0	0	0	0	111.9	R32 K33 L34 R39 K40	R32-T36 PolarHBondContact O-N 2.93Å; R32-T36 PolarHBondContact O-OG1 2.88Å; R32-T36 VanDerWaalsContact O-OG1 3.05Å; K33-T36 PolarHBondContact O-N 3.4Å; L34-T36 PolarHBondContact O-N 3.4Å; T36-R39 PolarHBondContact O-N 2.91Å; T36-K40 HydrophobicContact CG2-CD 4.33Å; T36-K40 WeakPolarHBondContact O-CB 3.34Å; T36-K40 WeakPolarHBondContact O-CG 3.48Å; T36-K40 PolarHBondContact O-N 3.09Å
37	V	94.8	Very high	93.5	Very high	96 Å²	96	121.8 Å²	121.8	58%	0.582	56%	0.555	S	S	*	*	H	α-helix	trans	-63.6	-43.8	176.8	170.4	0	0	0	0	110.9	K33 L34 K40 K41	K33-V37 WeakPolarHBondContact O-CB 3.37Å; K33-V37 VanDerWaalsContact O-CG2 3.25Å; K33-V37 WeakPolarHBondContact O-CG2 3.45Å; K33-V37 PolarHBondContact O-N 3.05Å; L34-V37 PolarHBondContact O-N 3.34Å; V37-K40 PolarHBondContact O-N 2.94Å; V37-K41 WeakPolarHBondContact O-CB 3.35Å; V37-K41 PolarHBondContact O-N 3.35Å
38	A	94.3	Very high	93.6	Very high	56 Å²	56	123.3 Å²	123.3	46%	0.463	56%	0.558	S	S	.	*	H	α-helix	trans	-60.7	-47.4	175.9	0	0	0	0	0	111.7	L34 I35 K40 K41 V42	L34-A38 WeakPolarHBondContact O-CB 3.31Å; L34-A38 PolarHBondContact O-N 2.91Å; I35-A38 PolarHBondContact O-N 2.92Å; A38-K40 PolarHBondContact O-N 2.91Å; A38-K41 WeakPolarHBondContact O-CB 3.48Å; A38-K41 PolarHBondContact O-N 2.89Å; A38-V42 WeakPolarHBondContact O-CG2 3.48Å; A38-V42 PolarHBondContact O-N 3.47Å; A38-V42 VanDerWaalsContact O-N 3.09Å
39	R	94.3	Very high	93.8	Very high	176 Å²	176	122.1 Å²	122.1	66%	0.664	56%	0.555	S	S	*	*	H	α-helix	trans	-58.3	-47	175.1	-74.4	178.6	178.1	-173.8	-1.4	111.9	I35 T36 K41 V42 I43	I35-R39 HydrophobicContact CG2-CG 4.45Å; I35-R39 WeakPolarHBondContact O-CB 3.46Å; I35-R39 WeakPolarHBondContact O-CG 3.44Å; I35-R39 PolarHBondContact O-N 3.43Å; T36-R39 PolarHBondContact O-N 2.91Å; R39-K41 VanDerWaalsContact C-N 3.31Å; R39-K41 PolarHBondContact O-N 3.47Å; R39-V42 PolarHBondContact O-N 3.38Å; R39-I43 WeakPolarHBondContact O-CG1 3.42Å; R39-I43 PolarHBondContact O-N 3.26Å
40	K	94.6	Very high	94	Very high	144 Å²	144	126 Å²	126	63%	0.626	57%	0.569	S	S	*	*	H	α-helix	trans	-60.1	-38.8	176.5	-76.1	-178.3	177.5	-173.6	0	112.4	T36 V37 A38 I43 R44	T36-K40 HydrophobicContact CG2-CD 4.33Å; T36-K40 WeakPolarHBondContact O-CB 3.34Å; T36-K40 WeakPolarHBondContact O-CG 3.48Å; T36-K40 PolarHBondContact O-N 3.09Å; V37-K40 PolarHBondContact O-N 2.94Å; A38-K40 PolarHBondContact O-N 2.91Å; K40-I43 PolarHBondContact O-N 3.2Å; K40-R44 WeakPolarHBondContact O-CB 3.46Å; K40-R44 PolarHBondContact O-N 3.39Å
41	K	94.3	Very high	94	Very high	163 Å²	163	119 Å²	119	71%	0.709	55%	0.546	S	S	*	.	H	α-helix	trans	-64.5	-42	177.4	-172.1	176.5	-179.4	179.3	0	112	V37 A38 R39 R45	V37-K41 WeakPolarHBondContact O-CB 3.35Å; V37-K41 PolarHBondContact O-N 3.35Å; A38-K41 WeakPolarHBondContact O-CB 3.48Å; A38-K41 PolarHBondContact O-N 2.89Å; R39-K41 VanDerWaalsContact C-N 3.31Å; R39-K41 PolarHBondContact O-N 3.47Å; K41-R45 WeakPolarHBondContact O-CB 3.34Å; K41-R45 PolarHBondContact O-N 3.06Å
42	V	95.2	Very high	94.1	Very high	84 Å²	84	115.8 Å²	115.8	51%	0.509	54%	0.537	S	S	.	.	H	α-helix	trans	-62.9	-48.9	176	175.5	0	0	0	0	110.7	A38 R39 R44 R45 Q46	A38-V42 WeakPolarHBondContact O-CG2 3.48Å; A38-V42 PolarHBondContact O-N 3.47Å; A38-V42 VanDerWaalsContact O-N 3.09Å; R39-V42 PolarHBondContact O-N 3.38Å; V42-R44 PolarHBondContact O-N 2.73Å; V42-R45 PolarHBondContact O-N 3.1Å; V42-Q46 WeakPolarHBondContact O-CG 3.28Å; V42-Q46 PolarHBondContact O-N 2.99Å
43	I	94.5	Very high	94.3	Very high	99 Å²	99	111.4 Å²	111.4	51%	0.508	53%	0.53	S	S	.	.	H	α-helix	trans	-60.2	-47.3	178.1	-64.8	167.9	0	0	0	110.6	R39 K40 R45 Q46 T47	R39-I43 WeakPolarHBondContact O-CG1 3.42Å; R39-I43 PolarHBondContact O-N 3.26Å; K40-I43 PolarHBondContact O-N 3.2Å; I43-R45 VanDerWaalsContact C-N 3.28Å; I43-R45 PolarHBondContact O-N 2.99Å; I43-Q46 PolarHBondContact O-N 3.12Å; I43-T47 HydrophobicContact CG2-CG2 4.33Å; I43-T47 WeakPolarHBondContact O-CG2 3.46Å; I43-T47 PolarHBondContact O-N 3.18Å; I43-T47 PolarHBondContact O-OG1 3.47Å
44	R	93.1	Very high	94.3	Very high	160 Å²	160	107.7 Å²	107.7	60%	0.604	52%	0.516	S	S	*	.	H	α-helix	trans	-58.3	-39.2	177	-174.9	-179.8	-179.8	-175.8	2.1	112.1	K40 V42 T47 Y48 E177	K40-R44 WeakPolarHBondContact O-CB 3.46Å; K40-R44 PolarHBondContact O-N 3.39Å; V42-R44 PolarHBondContact O-N 2.73Å; R44-T47 WeakPolarHBondContact CA-OG1 3.44Å; R44-T47 PolarHBondContact O-OG1 2.9Å; R44-Y48 VanDerWaalsContact O-CB 3.24Å; R44-Y48 WeakPolarHBondContact O-CB 3.24Å; R44-Y48 PolarHBondContact O-N 3.01Å; R44-E177 IonicContact NH2-OE1 2.67Å; R44-E177 PolarHBondContact NH2-OE1 2.87Å
45	R	93.9	Very high	94.4	Very high	179 Å²	179	103.9 Å²	103.9	68%	0.675	50%	0.496	S	S	*	.	H	α-helix	trans	-66.9	-45.7	176.8	-173.5	176.8	-179.4	177.2	0.9	111	K41 V42 I43 Y48 M49	K41-R45 WeakPolarHBondContact O-CB 3.34Å; K41-R45 PolarHBondContact O-N 3.06Å; V42-R45 PolarHBondContact O-N 3.1Å; I43-R45 VanDerWaalsContact C-N 3.28Å; I43-R45 PolarHBondContact O-N 2.99Å; R45-Y48 PolarHBondContact O-N 3.1Å; R45-M49 HydrophobicContact CG-CG 4.49Å; R45-M49 VanDerWaalsContact O-CG 3.24Å; R45-M49 WeakPolarHBondContact O-CG 3.45Å; R45-M49 PolarHBondContact O-N 3.1Å
46	Q	94.7	Very high	94.5	Very high	117 Å²	117	106.9 Å²	106.9	55%	0.547	51%	0.506	S	S	.	.	H	α-helix	trans	-61.9	-45.2	178.2	-72.3	177.3	-12.1	0	0	111.9	V42 I43 M49 K50	V42-Q46 WeakPolarHBondContact O-CG 3.28Å; V42-Q46 PolarHBondContact O-N 2.99Å; I43-Q46 PolarHBondContact O-N 3.12Å; Q46-M49 PolarHBondContact O-N 2.94Å; Q46-K50 WeakPolarHBondContact O-CG 3.46Å; Q46-K50 PolarHBondContact O-N 2.95Å; Q46-K50 VanDerWaalsContact O-N 3.09Å
47	T	93.3	Very high	94.7	Very high	69 Å²	69	109 Å²	109	42%	0.423	51%	0.512	S	S	.	.	H	α-helix	trans	-63.7	-43	176.7	56.9	0	0	0	0	111.5	I43 R44 M49 K50 L51	I43-T47 HydrophobicContact CG2-CG2 4.33Å; I43-T47 WeakPolarHBondContact O-CG2 3.46Å; I43-T47 PolarHBondContact O-N 3.18Å; I43-T47 PolarHBondContact O-OG1 3.47Å; R44-T47 WeakPolarHBondContact CA-OG1 3.44Å; R44-T47 PolarHBondContact O-OG1 2.9Å; T47-M49 PolarHBondContact O-N 3.36Å; T47-K50 PolarHBondContact O-N 2.84Å; T47-L51 WeakPolarHBondContact O-CB 3.45Å; T47-L51 VanDerWaalsContact O-CG 3.31Å; T47-L51 WeakPolarHBondContact O-CG 3.48Å; T47-L51 PolarHBondContact O-N 3.22Å
48	Y	93	Very high	94.8	Very high	126 Å²	126	107.5 Å²	107.5	49%	0.494	50%	0.495	S	S	.	.	H	α-helix	trans	-59.7	-43.5	175.1	174.5	-97.7	0	0	0	112.5	R44 R45 L51 K52	R44-Y48 VanDerWaalsContact O-CB 3.24Å; R44-Y48 WeakPolarHBondContact O-CB 3.24Å; R44-Y48 PolarHBondContact O-N 3.01Å; R45-Y48 PolarHBondContact O-N 3.1Å; Y48-L51 PolarHBondContact O-N 3.17Å; Y48-K52 HydrophobicContact CE1-CD 4.09Å; Y48-K52 VanDerWaalsContact O-CB 3.29Å; Y48-K52 WeakPolarHBondContact O-CB 3.24Å; Y48-K52 PolarHBondContact O-N 3.32Å
49	M	94.6	Very high	94.9	Very high	102 Å²	102	105.9 Å²	105.9	50%	0.502	48%	0.482	S	S	.	.	H	α-helix	trans	-65	-41.5	179.3	-67.1	-63.3	-105.5	0	0	111.9	R45 Q46 T47 K52 S53	R45-M49 HydrophobicContact CG-CG 4.49Å; R45-M49 VanDerWaalsContact O-CG 3.24Å; R45-M49 WeakPolarHBondContact O-CG 3.45Å; R45-M49 PolarHBondContact O-N 3.1Å; Q46-M49 PolarHBondContact O-N 2.94Å; T47-M49 PolarHBondContact O-N 3.36Å; M49-K52 PolarHBondContact O-N 3.19Å; M49-S53 PolarHBondContact O-N 2.98Å
50	K	94.8	Very high	95	Very high	161 Å²	161	101.7 Å²	101.7	70%	0.7	47%	0.47	S	S	*	.	H	α-helix	trans	-60.4	-48.7	173.6	-70.4	-178.1	-178.8	-174	0	111.2	Q46 T47 K52 S53 L54	Q46-K50 WeakPolarHBondContact O-CG 3.46Å; Q46-K50 PolarHBondContact O-N 2.95Å; Q46-K50 VanDerWaalsContact O-N 3.09Å; T47-K50 PolarHBondContact O-N 2.84Å; K50-K52 VanDerWaalsContact C-N 3.35Å; K50-K52 PolarHBondContact O-N 2.82Å; K50-S53 PolarHBondContact O-N 3.24Å; K50-L54 PolarHBondContact O-N 3.37Å; K50-L54 VanDerWaalsContact O-N 3.08Å
51	L	93.8	Very high	95.2	Very high	41 Å²	41	101.7 Å²	101.7	22%	0.215	47%	0.469	C	S	.	.	H	α-helix	trans	-62.2	-41.2	177.8	-71.7	172	0	0	0	111.9	T47 Y48 S53 L54 M55 I189	T47-L51 WeakPolarHBondContact O-CB 3.45Å; T47-L51 VanDerWaalsContact O-CG 3.31Å; T47-L51 WeakPolarHBondContact O-CG 3.48Å; T47-L51 PolarHBondContact O-N 3.22Å; Y48-L51 PolarHBondContact O-N 3.17Å; L51-S53 VanDerWaalsContact C-N 3.34Å; L51-S53 PolarHBondContact O-N 3.05Å; L51-L54 PolarHBondContact O-N 3.49Å; L51-M55 HydrophobicContact CB-CE 3.71Å; L51-M55 WeakPolarHBondContact O-CB 3.45Å; L51-M55 VanDerWaalsContact O-CG 3.25Å; L51-M55 WeakPolarHBondContact O-CG 3.42Å; L51-M55 PolarHBondContact O-N 3.47Å; L51-I189 HydrophobicContact CD2-CG2 4.28Å
52	K	94.3	Very high	95.3	Very high	114 Å²	114	95.3 Å²	95.3	50%	0.496	44%	0.441	S	S	.	.	H	α-helix	trans	-61.3	-42.9	178.1	-177	178.7	179.3	-179.8	0	111.5	Y48 M49 K50 M55 K56	Y48-K52 HydrophobicContact CE1-CD 4.09Å; Y48-K52 VanDerWaalsContact O-CB 3.29Å; Y48-K52 WeakPolarHBondContact O-CB 3.24Å; Y48-K52 PolarHBondContact O-N 3.32Å; M49-K52 PolarHBondContact O-N 3.19Å; K50-K52 VanDerWaalsContact C-N 3.35Å; K50-K52 PolarHBondContact O-N 2.82Å; K52-M55 PolarHBondContact O-N 3.36Å; K52-K56 PolarHBondContact O-N 2.95Å
53	S	95.9	Very high	95.4	Very high	62 Å²	62	94.9 Å²	94.9	43%	0.434	44%	0.435	S	S	.	.	H	α-helix	trans	-62.5	-46.3	176.1	-168.4	0	0	0	0	111.2	M49 K50 L51 M55 K56 Q57	M49-S53 PolarHBondContact O-N 2.98Å; K50-S53 PolarHBondContact O-N 3.24Å; L51-S53 VanDerWaalsContact C-N 3.34Å; L51-S53 PolarHBondContact O-N 3.05Å; S53-M55 PolarHBondContact O-N 3.15Å; S53-K56 PolarHBondContact O-N 3.5Å; S53-Q57 WeakPolarHBondContact O-CG 3.35Å; S53-Q57 PolarHBondContact O-N 3.36Å
54	L	95.7	Very high	95.6	Very high	61 Å²	61	96 Å²	96	32%	0.319	44%	0.437	S	S	.	.	H	α-helix	trans	-59.8	-45.4	175.5	179.8	63.2	0	0	0	112.5	K50 L51 K56 Q57 R58 I189	K50-L54 PolarHBondContact O-N 3.37Å; K50-L54 VanDerWaalsContact O-N 3.08Å; L51-L54 PolarHBondContact O-N 3.49Å; L54-K56 VanDerWaalsContact C-N 3.31Å; L54-K56 PolarHBondContact O-N 3.35Å; L54-Q57 PolarHBondContact O-N 3.04Å; L54-R58 HydrophobicContact CD1-CG 4.46Å; L54-R58 WeakPolarHBondContact O-CG 3.33Å; L54-R58 PolarHBondContact O-N 3.35Å; L54-I189 HydrophobicContact CD2-CD1 3.68Å
55	M	95.5	Very high	95.8	Very high	31 Å²	31	90.7 Å²	90.7	15%	0.153	42%	0.419	C	S	.	.	H	α-helix	trans	-59.9	-41	177.2	-73.8	-177.4	-114.8	0	0	111.8	L51 K52 S53 R58 A59 I189 C190	L51-M55 HydrophobicContact CB-CE 3.71Å; L51-M55 WeakPolarHBondContact O-CB 3.45Å; L51-M55 VanDerWaalsContact O-CG 3.25Å; L51-M55 WeakPolarHBondContact O-CG 3.42Å; L51-M55 PolarHBondContact O-N 3.47Å; K52-M55 PolarHBondContact O-N 3.36Å; S53-M55 PolarHBondContact O-N 3.15Å; M55-R58 PolarHBondContact O-N 3.09Å; M55-A59 WeakPolarHBondContact O-CB 3.29Å; M55-A59 PolarHBondContact O-N 3.34Å; M55-I189 HydrophobicContact CG-CG2 4.38Å; M55-C190 HydrophobicContact CB-CB 4.47Å; M55-C190 HydrophobicContact CG-CB 3.67Å; M55-C190 HydrophobicContact SD-CB 3.48Å; M55-C190 WeakPolarHBondContact SD-CB 3.44Å
56	K	96.5	Very high	95.9	Very high	136 Å²	136	83 Å²	83	59%	0.591	39%	0.391	S	S	*	.	H	α-helix	trans	-63.9	-48.9	177.3	-177.6	-179.9	171.8	-175.7	0	111.2	K52 S53 L54 R58 A59 E60	K52-K56 PolarHBondContact O-N 2.95Å; S53-K56 PolarHBondContact O-N 3.5Å; L54-K56 VanDerWaalsContact C-N 3.31Å; L54-K56 PolarHBondContact O-N 3.35Å; K56-R58 VanDerWaalsContact C-N 3.31Å; K56-R58 PolarHBondContact O-N 3.38Å; K56-A59 PolarHBondContact O-N 2.79Å; K56-E60 WeakPolarHBondContact CE-OE1 3.44Å; K56-E60 IonicContact NZ-OE1 3.38Å; K56-E60 WeakPolarHBondContact O-CG 3.36Å; K56-E60 PolarHBondContact O-N 3.24Å
57	Q	97.3	Very high	96	Very high	113 Å²	113	85 Å²	85	53%	0.528	39%	0.393	S	S	.	.	H	α-helix	trans	-58.8	-42.3	177.8	-70.4	174.4	-7	0	0	112	S53 L54 E60 K61	S53-Q57 WeakPolarHBondContact O-CG 3.35Å; S53-Q57 PolarHBondContact O-N 3.36Å; L54-Q57 PolarHBondContact O-N 3.04Å; Q57-E60 PolarHBondContact O-N 3.3Å; Q57-K61 WeakPolarHBondContact O-CB 3.31Å; Q57-K61 PolarHBondContact O-N 3.3Å
58	R	96.9	Very high	96.2	Very high	64 Å²	64	90.3 Å²	90.3	24%	0.242	41%	0.405	C	S	.	.	H	α-helix	trans	-64.3	-46.1	175.6	-73.6	-176.2	177.8	-163.5	-5.4	112.3	L54 M55 K56 E60 K61 Y62 G187 D193	L54-R58 HydrophobicContact CD1-CG 4.46Å; L54-R58 WeakPolarHBondContact O-CG 3.33Å; L54-R58 PolarHBondContact O-N 3.35Å; M55-R58 PolarHBondContact O-N 3.09Å; K56-R58 VanDerWaalsContact C-N 3.31Å; K56-R58 PolarHBondContact O-N 3.38Å; R58-E60 VanDerWaalsContact C-N 3.32Å; R58-E60 PolarHBondContact O-N 3.06Å; R58-K61 WeakPolarHBondContact O-CB 3.45Å; R58-K61 PolarHBondContact O-N 3.45Å; R58-Y62 HydrophobicContact CB-CE2 3.99Å; R58-Y62 WeakPolarHBondContact O-CD2 3.29Å; R58-Y62 VanDerWaalsContact O-CG 3.27Å; R58-Y62 PolarHBondContact O-N 3.34Å; R58-G187 PolarHBondContact NH1-O 2.93Å; R58-D193 WeakPolarHBondContact CD-OD1 3.23Å; R58-D193 IonicContact CZ-OD2 3.98Å; R58-D193 IonicContact NH1-OD1 3.48Å; R58-D193 IonicContact NH1-OD2 2.8Å; R58-D193 PolarHBondContact NH1-OD2 2.94Å
59	A	96.4	Very high	96.3	Very high	21 Å²	21	88.8 Å²	88.8	17%	0.174	40%	0.404	C	S	.	.	H	α-helix	trans	-59.4	-43.5	177.8	0	0	0	0	0	111.8	M55 K56 Y62 M63 E192	M55-A59 WeakPolarHBondContact O-CB 3.29Å; M55-A59 PolarHBondContact O-N 3.34Å; K56-A59 PolarHBondContact O-N 2.79Å; A59-Y62 PolarHBondContact O-N 2.88Å; A59-M63 WeakPolarHBondContact O-CG 3.15Å; A59-M63 PolarHBondContact O-N 3.04Å; A59-E192 HydrophobicContact CB-CB 4.29Å; A59-E192 HydrophobicContact CB-CG 4.08Å
60	E	97.5	Very high	96.4	Very high	89 Å²	89	86.4 Å²	86.4	42%	0.416	40%	0.401	S	S	.	.	H	α-helix	trans	-60.3	-48.1	174	-73.7	171	-177.5	0	0	111.2	K56 Q57 R58 Y62 M63 H64	K56-E60 WeakPolarHBondContact CE-OE1 3.44Å; K56-E60 IonicContact NZ-OE1 3.38Å; K56-E60 WeakPolarHBondContact O-CG 3.36Å; K56-E60 PolarHBondContact O-N 3.24Å; Q57-E60 PolarHBondContact O-N 3.3Å; R58-E60 VanDerWaalsContact C-N 3.32Å; R58-E60 PolarHBondContact O-N 3.06Å; E60-Y62 PolarHBondContact O-N 3.47Å; E60-M63 PolarHBondContact O-N 3.35Å; E60-H64 PolarHBondContact O-CD2 2.94Å; E60-H64 PolarHBondContact O-N 3.34Å
61	K	97.9	Very high	96.5	Very high	143 Å²	143	85.5 Å²	85.5	62%	0.622	40%	0.397	S	S	*	.	H	α-helix	trans	-54.7	-49.3	175.9	-178.5	-176.5	176.2	-178.2	0	111.9	Q57 R58 M63 H64 E65	Q57-K61 WeakPolarHBondContact O-CB 3.31Å; Q57-K61 PolarHBondContact O-N 3.3Å; R58-K61 WeakPolarHBondContact O-CB 3.45Å; R58-K61 PolarHBondContact O-N 3.45Å; K61-M63 VanDerWaalsContact C-N 3.35Å; K61-M63 PolarHBondContact O-N 3.41Å; K61-H64 PolarHBondContact O-N 2.91Å; K61-E65 PolarHBondContact O-N 3.07Å
62	Y	97.5	Very high	96.7	Very high	29 Å²	29	92 Å²	92	11%	0.114	42%	0.418	C	S	.	.	H	α-helix	trans	-63.7	-40.2	178.8	-59.5	-39.8	0	0	0	112.1	R58 A59 E60 H64 E65 Y66 D193 H196	R58-Y62 HydrophobicContact CB-CE2 3.99Å; R58-Y62 WeakPolarHBondContact O-CD2 3.29Å; R58-Y62 VanDerWaalsContact O-CG 3.27Å; R58-Y62 PolarHBondContact O-N 3.34Å; A59-Y62 PolarHBondContact O-N 2.88Å; E60-Y62 PolarHBondContact O-N 3.47Å; Y62-H64 VanDerWaalsContact C-N 3.34Å; Y62-H64 PolarHBondContact O-N 3.41Å; Y62-E65 WeakPolarHBondContact O-CB 3.32Å; Y62-E65 PolarHBondContact O-N 2.92Å; Y62-Y66 WeakPolarHBondContact O-CD2 3.35Å; Y62-Y66 PolarHBondContact O-N 3.32Å; Y62-D193 VanDerWaalsContact CE2-OD1 3.28Å; Y62-D193 WeakPolarHBondContact CE2-OD1 3.43Å; Y62-D193 PolarHBondContact OH-OD1 3.21Å; Y62-H196 HydrophobicContact CD1-CB 4.15Å; Y62-H196 AromaticContact CD1-CD2 3.77Å; Y62-H196 AromaticContact CD1-CE1 3.55Å; Y62-H196 AromaticContact CD1-CG 3.51Å; Y62-H196 AromaticContact CD1-ND1 3.38Å; Y62-H196 WeakPolarHBondContact CD1-ND1 3.41Å; Y62-H196 AromaticContact CD1-NE2 3.8Å; Y62-H196 HydrophobicContact CD2-CB 3.97Å; Y62-H196 HydrophobicContact CE1-CB 4.19Å; Y62-H196 AromaticContact CE1-CD2 3.41Å; Y62-H196 VanDerWaalsContact CE1-CD2 3.41Å; Y62-H196 WeakPolarHBondContact CE1-CD2 3.15Å; Y62-H196 AromaticContact CE1-CE1 3.88Å; Y62-H196 AromaticContact CE1-CG 3.57Å; Y62-H196 AromaticContact CE1-ND1 3.88Å; Y62-H196 AromaticContact CE1-NE2 3.63Å; Y62-H196 HydrophobicContact CE2-CB 4.03Å; Y62-H196 HydrophobicContact CG-CB 4.05Å; Y62-H196 AromaticContact CG-CG 3.87Å; Y62-H196 AromaticContact CG-ND1 3.79Å; Y62-H196 AromaticContact CZ-CD2 3.9Å; Y62-H196 AromaticContact CZ-CG 3.99Å
63	M	96.3	Very high	96.7	Very high	76 Å²	76	89.4 Å²	89.4	37%	0.374	41%	0.408	S	S	.	.	H	α-helix	trans	-61	-43	175.2	-75.8	-174.9	63.6	0	0	112.2	A59 E60 K61 R67	A59-M63 WeakPolarHBondContact O-CG 3.15Å; A59-M63 PolarHBondContact O-N 3.04Å; E60-M63 PolarHBondContact O-N 3.35Å; K61-M63 VanDerWaalsContact C-N 3.35Å; K61-M63 PolarHBondContact O-N 3.41Å; M63-R67 WeakPolarHBondContact O-CG 3.45Å; M63-R67 PolarHBondContact O-N 2.82Å; M63-R67 VanDerWaalsContact O-N 3.1Å
64	H	97.8	Very high	96.7	Very high	121 Å²	121	91 Å²	91	56%	0.56	41%	0.409	S	S	*	.	H	α-helix	trans	-62.9	-41.8	174.4	-76.6	-66.8	0	0	0	112	E60 K61 Y62 R67 R68	E60-H64 PolarHBondContact O-CD2 2.94Å; E60-H64 PolarHBondContact O-N 3.34Å; K61-H64 PolarHBondContact O-N 2.91Å; Y62-H64 VanDerWaalsContact C-N 3.34Å; Y62-H64 PolarHBondContact O-N 3.41Å; H64-R67 PolarHBondContact O-N 3.43Å; H64-R68 WeakPolarHBondContact O-CB 3.43Å; H64-R68 PolarHBondContact O-N 3.28Å
65	E	97.6	Very high	96.8	Very high	49 Å²	49	90.8 Å²	90.8	23%	0.229	41%	0.411	C	S	.	.	H	α-helix	trans	-59.7	-49.9	176.4	-171.9	-176.5	149.7	0	0	111.9	K61 Y62 R67 R68 M69 H196	K61-E65 PolarHBondContact O-N 3.07Å; Y62-E65 WeakPolarHBondContact O-CB 3.32Å; Y62-E65 PolarHBondContact O-N 2.92Å; E65-R67 VanDerWaalsContact C-N 3.34Å; E65-R67 PolarHBondContact O-N 2.76Å; E65-R68 PolarHBondContact O-N 3.23Å; E65-M69 HydrophobicContact CG-SD 4.27Å; E65-M69 WeakPolarHBondContact O-CG 3.36Å; E65-M69 PolarHBondContact O-N 3.14Å; E65-H196 IonicContact OE1-CE1 3.96Å; E65-H196 PolarHBondContact OE1-CE1 2.99Å; E65-H196 IonicContact OE2-CE1 2.82Å; E65-H196 PolarHBondContact OE2-CE1 3.42Å
66	Y	96.9	Very high	96.9	Very high	19 Å²	19	92.2 Å²	92.2	8%	0.075	42%	0.419	C	S	.	.	H	α-helix	trans	-60.5	-42.6	178.3	-57.8	-39.1	0	0	0	112.5	Y62 R68 M69 A70 L152 H196 Y199 T200	Y62-Y66 WeakPolarHBondContact O-CD2 3.35Å; Y62-Y66 PolarHBondContact O-N 3.32Å; Y66-R68 VanDerWaalsContact C-N 3.34Å; Y66-M69 PolarHBondContact O-N 2.76Å; Y66-A70 WeakPolarHBondContact O-CB 3.3Å; Y66-A70 PolarHBondContact O-N 3.1Å; Y66-L152 HydrophobicContact CD1-CD2 4.39Å; Y66-L152 HydrophobicContact CD2-CD1 4.27Å; Y66-L152 HydrophobicContact CD2-CD2 3.33Å; Y66-L152 HydrophobicContact CD2-CG 4.45Å; Y66-L152 HydrophobicContact CE1-CD1 4.46Å; Y66-L152 HydrophobicContact CE2-CD1 3.82Å; Y66-L152 HydrophobicContact CE2-CD2 3.76Å; Y66-L152 HydrophobicContact CE2-CG 4.45Å; Y66-L152 HydrophobicContact CG-CD2 3.7Å; Y66-H196 AromaticContact CE1-ND1 3.62Å; Y66-H196 AromaticContact CZ-ND1 3.56Å; Y66-H196 WeakPolarHBondContact OH-CA 3.44Å; Y66-H196 VanDerWaalsContact OH-CB 3.23Å; Y66-H196 WeakPolarHBondContact OH-CB 3.25Å; Y66-H196 PolarHBondContact OH-ND1 2.84Å; Y66-Y199 HydrophobicContact CD1-CD1 4.14Å; Y66-Y199 HydrophobicContact CD1-CE1 4.06Å; Y66-Y199 AromaticContact CE1-CD1 3.66Å; Y66-Y199 HydrophobicContact CE1-CD1 3.66Å; Y66-Y199 HydrophobicContact CE1-CE1 4.07Å; Y66-T200 HydrophobicContact CE1-CG2 4.1Å
67	R	97.1	Very high	96.8	Very high	159 Å²	159	89.7 Å²	89.7	60%	0.6	41%	0.409	S	S	*	.	H	α-helix	trans	-62.5	-42.6	176.2	-73.6	177.2	-179.3	171.2	1.1	111.3	M63 H64 E65 A70 K71	M63-R67 WeakPolarHBondContact O-CG 3.45Å; M63-R67 PolarHBondContact O-N 2.82Å; M63-R67 VanDerWaalsContact O-N 3.1Å; H64-R67 PolarHBondContact O-N 3.43Å; E65-R67 VanDerWaalsContact C-N 3.34Å; E65-R67 PolarHBondContact O-N 2.76Å; R67-A70 PolarHBondContact O-N 2.8Å; R67-K71 WeakPolarHBondContact O-CB 3.44Å; R67-K71 PolarHBondContact O-N 2.95Å
68	R	97.5	Very high	96.8	Very high	179 Å²	179	92.6 Å²	92.6	68%	0.675	42%	0.415	S	S	*	.	H	α-helix	trans	-64.8	-43.2	177.9	-173.9	179.2	64.5	-178.1	-0.4	111.6	H64 E65 Y66 K71 R72	H64-R68 WeakPolarHBondContact O-CB 3.43Å; H64-R68 PolarHBondContact O-N 3.28Å; E65-R68 PolarHBondContact O-N 3.23Å; Y66-R68 VanDerWaalsContact C-N 3.34Å; R68-K71 PolarHBondContact O-N 3.22Å; R68-R72 VanDerWaalsContact O-CB 3.32Å; R68-R72 WeakPolarHBondContact O-CB 3.43Å; R68-R72 PolarHBondContact O-N 2.97Å
69	M	95.6	Very high	96.8	Very high	95 Å²	95	93.7 Å²	93.7	47%	0.468	43%	0.426	S	S	.	.	H	α-helix	trans	-60.9	-48.9	175.8	-70.8	175.5	70.5	0	0	111.5	E65 Y66 K71 R72 E73	E65-M69 HydrophobicContact CG-SD 4.27Å; E65-M69 WeakPolarHBondContact O-CG 3.36Å; E65-M69 PolarHBondContact O-N 3.14Å; Y66-M69 PolarHBondContact O-N 2.76Å; M69-K71 PolarHBondContact O-N 3.44Å; M69-R72 PolarHBondContact O-N 2.82Å; M69-E73 PolarHBondContact O-N 3.03Å
70	A	95.3	Very high	96.8	Very high	52 Å²	52	93.3 Å²	93.3	43%	0.43	42%	0.423	S	S	.	.	H	α-helix	trans	-61.1	-43.1	177.7	0	0	0	0	0	112.1	Y66 R67 E73 M74	Y66-A70 WeakPolarHBondContact O-CB 3.3Å; Y66-A70 PolarHBondContact O-N 3.1Å; R67-A70 PolarHBondContact O-N 2.8Å; A70-E73 PolarHBondContact O-N 2.77Å; A70-M74 WeakPolarHBondContact O-CG 3.45Å; A70-M74 PolarHBondContact O-N 3.13Å; A70-M74 VanDerWaalsContact O-N 3.13Å
71	K	97.5	Very high	96.7	Very high	142 Å²	142	97.3 Å²	97.3	62%	0.617	44%	0.439	S	S	*	.	H	α-helix	trans	-63.2	-43.5	176.1	-171	177.6	-178.9	-178.9	0	111.7	R67 R68 M69 E73 M74 T75	R67-K71 WeakPolarHBondContact O-CB 3.44Å; R67-K71 PolarHBondContact O-N 2.95Å; R68-K71 PolarHBondContact O-N 3.22Å; M69-K71 PolarHBondContact O-N 3.44Å; K71-E73 PolarHBondContact O-N 3.02Å; K71-M74 PolarHBondContact O-N 3.47Å; K71-T75 PolarHBondContact O-N 2.89Å; K71-T75 PolarHBondContact O-OG1 2.89Å; K71-T75 VanDerWaalsContact O-OG1 3.07Å
72	R	97	Very high	96.7	Very high	177 Å²	177	99.4 Å²	99.4	67%	0.668	45%	0.448	S	S	*	.	H	α-helix	trans	-58.3	-47.4	177.1	-179.8	179.2	-179.9	175	0.9	111.2	R68 M69 M74 T75 L76	R68-R72 VanDerWaalsContact O-CB 3.32Å; R68-R72 WeakPolarHBondContact O-CB 3.43Å; R68-R72 PolarHBondContact O-N 2.97Å; M69-R72 PolarHBondContact O-N 2.82Å; R72-M74 VanDerWaalsContact C-N 3.35Å; R72-M74 PolarHBondContact O-N 2.86Å; R72-T75 PolarHBondContact O-N 3.38Å; R72-L76 HydrophobicContact CG-CD1 3.97Å; R72-L76 HydrophobicContact CG-CG 4.41Å; R72-L76 WeakPolarHBondContact O-CG 3.45Å; R72-L76 PolarHBondContact O-N 2.86Å
73	E	95.3	Very high	96.6	Very high	60 Å²	60	102.5 Å²	102.5	28%	0.28	47%	0.47	S	S	.	.	H	α-helix	trans	-58.5	-47.3	178.4	-157.7	68.8	-166.2	0	0	111.5	M69 A70 K71 T75 L76 Q77 Y87 P89	M69-E73 PolarHBondContact O-N 3.03Å; A70-E73 PolarHBondContact O-N 2.77Å; K71-E73 PolarHBondContact O-N 3.02Å; E73-T75 PolarHBondContact O-N 3.09Å; E73-L76 PolarHBondContact O-N 2.97Å; E73-Q77 WeakPolarHBondContact O-CG 3.31Å; E73-Q77 PolarHBondContact O-N 2.7Å; E73-Y87 HydrophobicContact CG-CE1 4.49Å; E73-Y87 WeakPolarHBondContact OE1-CE1 3.44Å; E73-Y87 VanDerWaalsContact OE1-CZ 3.3Å; E73-Y87 PolarHBondContact OE1-OH 3.34Å; E73-Y87 PolarHBondContact OE2-OH 3.44Å; E73-P89 WeakPolarHBondContact OE1-CB 3.49Å
74	M	96	Very high	96.5	Very high	94 Å²	94	101.7 Å²	101.7	46%	0.463	48%	0.481	S	S	.	.	H	α-helix	trans	-62.6	-41	176.7	-70.9	-173.9	-69.4	0	0	112.3	A70 K71 R72 R78	A70-M74 WeakPolarHBondContact O-CG 3.45Å; A70-M74 PolarHBondContact O-N 3.13Å; A70-M74 VanDerWaalsContact O-N 3.13Å; K71-M74 PolarHBondContact O-N 3.47Å; R72-M74 VanDerWaalsContact C-N 3.35Å; R72-M74 PolarHBondContact O-N 2.86Å; M74-R78 WeakPolarHBondContact O-CB 3.15Å; M74-R78 VanDerWaalsContact O-CG 3.27Å; M74-R78 WeakPolarHBondContact O-CG 3.48Å; M74-R78 PolarHBondContact O-N 2.81Å
75	T	97.5	Very high	96.4	Very high	58 Å²	58	101 Å²	101	36%	0.356	48%	0.481	S	S	.	.	H	α-helix	trans	-64.7	-44.6	177.1	-62.5	0	0	0	0	111.4	K71 R72 E73 Q77 R78 N79	K71-T75 PolarHBondContact O-N 2.89Å; K71-T75 PolarHBondContact O-OG1 2.89Å; K71-T75 VanDerWaalsContact O-OG1 3.07Å; R72-T75 PolarHBondContact O-N 3.38Å; E73-T75 PolarHBondContact O-N 3.09Å; T75-Q77 PolarHBondContact O-N 2.82Å; T75-R78 PolarHBondContact O-N 2.87Å; T75-N79 WeakPolarHBondContact O-CB 3.22Å; T75-N79 PolarHBondContact O-N 3.04Å; T75-N79 PolarHBondContact O-OD1 3.15Å
76	L	96.7	Very high	96.3	Very high	60 Å²	60	108 Å²	108	31%	0.314	51%	0.512	S	S	.	.	H	α-helix	trans	-61.3	-44.6	178	-70.8	169.3	0	0	0	111.5	R72 E73 R78 N79 A80 Y87	R72-L76 HydrophobicContact CG-CD1 3.97Å; R72-L76 HydrophobicContact CG-CG 4.41Å; R72-L76 WeakPolarHBondContact O-CG 3.45Å; R72-L76 PolarHBondContact O-N 2.86Å; E73-L76 PolarHBondContact O-N 2.97Å; L76-R78 VanDerWaalsContact C-N 3.34Å; L76-R78 PolarHBondContact O-N 2.92Å; L76-N79 PolarHBondContact O-N 2.57Å; L76-A80 WeakPolarHBondContact O-CB 3.49Å; L76-A80 PolarHBondContact O-N 3.43Å; L76-Y87 HydrophobicContact CB-CD2 3.86Å; L76-Y87 HydrophobicContact CB-CE1 4.39Å; L76-Y87 HydrophobicContact CB-CE2 3.61Å; L76-Y87 HydrophobicContact CB-CG 4.36Å; L76-Y87 HydrophobicContact CD1-CE2 3.74Å; L76-Y87 HydrophobicContact CG-CE2 4.19Å
77	Q	95.9	Very high	96.2	Very high	84 Å²	84	110.4 Å²	110.4	39%	0.393	52%	0.521	S	S	.	.	H	α-helix	trans	-60.5	-41.1	174.4	-73.2	177.3	3.7	0	0	112.7	E73 T75 K81 Y87	E73-Q77 WeakPolarHBondContact O-CG 3.31Å; E73-Q77 PolarHBondContact O-N 2.7Å; T75-Q77 PolarHBondContact O-N 2.82Å; Q77-K81 VanDerWaalsContact O-CG 3.29Å; Q77-K81 WeakPolarHBondContact O-CG 3.36Å; Q77-K81 PolarHBondContact O-N 3.29Å; Q77-K81 VanDerWaalsContact O-N 3.17Å; Q77-Y87 HydrophobicContact CB-CD1 4.5Å; Q77-Y87 HydrophobicContact CG-CD1 3.48Å; Q77-Y87 VanDerWaalsContact CG-CD1 3.48Å; Q77-Y87 HydrophobicContact CG-CE1 3.9Å; Q77-Y87 HydrophobicContact CG-CG 4.38Å
78	R	96.8	Very high	96.1	Very high	173 Å²	173	108.7 Å²	108.7	65%	0.653	53%	0.528	S	S	*	.	H	α-helix	trans	-68.9	-40.4	177.7	-74.6	173.5	-177.7	-177.7	-0.7	112.2	M74 T75 L76 K81 K82	M74-R78 WeakPolarHBondContact O-CB 3.15Å; M74-R78 VanDerWaalsContact O-CG 3.27Å; M74-R78 WeakPolarHBondContact O-CG 3.48Å; M74-R78 PolarHBondContact O-N 2.81Å; T75-R78 PolarHBondContact O-N 2.87Å; L76-R78 VanDerWaalsContact C-N 3.34Å; L76-R78 PolarHBondContact O-N 2.92Å; R78-K81 PolarHBondContact O-N 3.08Å; R78-K82 PolarHBondContact O-N 2.94Å
79	N	97.1	Very high	96	Very high	87 Å²	87	103.6 Å²	103.6	47%	0.465	52%	0.518	S	S	.	.	H	α-helix	trans	-64.7	-46.6	179	-72.4	-3.8	0	0	0	111	T75 L76 K81 K82 T83	T75-N79 WeakPolarHBondContact O-CB 3.22Å; T75-N79 PolarHBondContact O-N 3.04Å; T75-N79 PolarHBondContact O-OD1 3.15Å; L76-N79 PolarHBondContact O-N 2.57Å; N79-K81 VanDerWaalsContact C-N 3.34Å; N79-K81 PolarHBondContact O-N 3.46Å; N79-K82 WeakPolarHBondContact O-CA 3.3Å; N79-K82 WeakPolarHBondContact O-CB 3.14Å; N79-K82 PolarHBondContact O-N 2.83Å; N79-T83 PolarHBondContact O-N 3.32Å; N79-T83 PolarHBondContact O-OG1 3.02Å
80	A	96.6	Very high	95.9	Very high	13 Å²	13	103.1 Å²	103.1	11%	0.107	53%	0.529	C	S	.	.	H	α-helix	trans	-60	-43.6	176.6	0	0	0	0	0	111.7	L76 K82 T83 G84 D85	L76-A80 WeakPolarHBondContact O-CB 3.49Å; L76-A80 PolarHBondContact O-N 3.43Å; A80-K82 VanDerWaalsContact C-N 3.25Å; A80-K82 PolarHBondContact O-N 3.45Å; A80-T83 PolarHBondContact O-N 2.79Å; A80-T83 PolarHBondContact O-OG1 3.46Å; A80-G84 CarbonylContact O-C 3.58Å; A80-G84 PolarHBondContact O-N 3.47Å; A80-D85 CarbonylContact C-O 3.57Å; A80-D85 HydrophobicContact CB-CB 4.34Å; A80-D85 WeakPolarHBondContact CB-O 3.48Å; A80-D85 PolarHBondContact O-N 3.14Å
81	K	95.8	Very high	95.9	Very high	174 Å²	174	108.8 Å²	108.8	76%	0.757	55%	0.547	S	S	*	.	H	α-helix	trans	-59.7	-33.6	172.5	-74.4	179	-178.9	-169.6	0	113.5	Q77 R78 N79	Q77-K81 VanDerWaalsContact O-CG 3.29Å; Q77-K81 WeakPolarHBondContact O-CG 3.36Å; Q77-K81 PolarHBondContact O-N 3.29Å; Q77-K81 VanDerWaalsContact O-N 3.17Å; R78-K81 PolarHBondContact O-N 3.08Å; N79-K81 VanDerWaalsContact C-N 3.34Å; N79-K81 PolarHBondContact O-N 3.46Å
82	K	96.7	Very high	95.9	Very high	186 Å²	186	104.7 Å²	104.7	81%	0.809	54%	0.535	S	S	*	.	H	α-helix	trans	-74.2	-39	179.4	-173.7	-174.8	178.8	-172.4	0	111.9	R78 N79 A80	R78-K82 PolarHBondContact O-N 2.94Å; N79-K82 WeakPolarHBondContact O-CA 3.3Å; N79-K82 WeakPolarHBondContact O-CB 3.14Å; N79-K82 PolarHBondContact O-N 2.83Å; A80-K82 VanDerWaalsContact C-N 3.25Å; A80-K82 PolarHBondContact O-N 3.45Å
83	T	96	Very high	95.9	Very high	94 Å²	94	102.9 Å²	102.9	58%	0.577	53%	0.532	S	S	*	.	H	α-helix	trans	-83.3	-17.4	-179.9	53.9	0	0	0	0	113.1	N79 A80 D85	N79-T83 PolarHBondContact O-N 3.32Å; N79-T83 PolarHBondContact O-OG1 3.02Å; A80-T83 PolarHBondContact O-N 2.79Å; A80-T83 PolarHBondContact O-OG1 3.46Å; T83-D85 VanDerWaalsContact CB-OD2 3.29Å; T83-D85 WeakPolarHBondContact CB-OD2 3.29Å; T83-D85 PolarHBondContact OG1-OD2 3.04Å
84	G	94.8	Very high	96	Very high	59 Å²	59	100.6 Å²	100.6	61%	0.608	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	89	6.5	-173	0	0	0	0	0	113.4	A80	A80-G84 CarbonylContact O-C 3.58Å; A80-G84 PolarHBondContact O-N 3.47Å
85	D	95.6	Very high	96.1	Very high	106 Å²	106	96.1 Å²	96.1	57%	0.567	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-82.8	162.6	177.5	-60.1	-50.6	0	0	0	112.5	A80 T83	A80-D85 CarbonylContact C-O 3.57Å; A80-D85 HydrophobicContact CB-CB 4.34Å; A80-D85 WeakPolarHBondContact CB-O 3.48Å; A80-D85 PolarHBondContact O-N 3.14Å; T83-D85 VanDerWaalsContact CB-OD2 3.29Å; T83-D85 WeakPolarHBondContact CB-OD2 3.29Å; T83-D85 PolarHBondContact OG1-OD2 3.04Å
86	F	94.5	Very high	96.2	Very high	197 Å²	197	93.3 Å²	93.3	86%	0.864	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-97.1	125.2	172.5	-60.5	-75.5	0	0	0	111.2
87	Y	95.3	Very high	96.2	Very high	70 Å²	70	90.5 Å²	90.5	28%	0.275	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-100.5	118.9	170.7	177.5	-98.3	0	0	0	110.8	E73 L76 Q77 P89	E73-Y87 HydrophobicContact CG-CE1 4.49Å; E73-Y87 WeakPolarHBondContact OE1-CE1 3.44Å; E73-Y87 VanDerWaalsContact OE1-CZ 3.3Å; E73-Y87 PolarHBondContact OE1-OH 3.34Å; E73-Y87 PolarHBondContact OE2-OH 3.44Å; L76-Y87 HydrophobicContact CB-CD2 3.86Å; L76-Y87 HydrophobicContact CB-CE1 4.39Å; L76-Y87 HydrophobicContact CB-CE2 3.61Å; L76-Y87 HydrophobicContact CB-CG 4.36Å; L76-Y87 HydrophobicContact CD1-CE2 3.74Å; L76-Y87 HydrophobicContact CG-CE2 4.19Å; Q77-Y87 HydrophobicContact CB-CD1 4.5Å; Q77-Y87 HydrophobicContact CG-CD1 3.48Å; Q77-Y87 VanDerWaalsContact CG-CD1 3.48Å; Q77-Y87 HydrophobicContact CG-CE1 3.9Å; Q77-Y87 HydrophobicContact CG-CG 4.38Å; Y87-P89 HydrophobicContact CE1-CB 4.21Å
88	V	94.8	Very high	96.3	Very high	122 Å²	122	86.5 Å²	86.5	74%	0.739	45%	0.449	S	S	*	.	P	Polyproline II helix	trans	-100.7	117.7	174	-176.8	0	0	0	0	108.9
89	P	94.6	Very high	96.4	Very high	73 Å²	73	78.9 Å²	78.9	47%	0.474	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-65.4	150.7	177.3	28.8	-34.8	0	0	0	110.7	E73 Y87	E73-P89 WeakPolarHBondContact OE1-CB 3.49Å; Y87-P89 HydrophobicContact CE1-CB 4.21Å
90	A	95.1	Very high	96.4	Very high	85 Å²	85	74.7 Å²	74.7	70%	0.702	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-60.5	142.2	178	0	0	0	0	0	111.8
91	E	95.3	Very high	96.3	Very high	171 Å²	171	77.7 Å²	77.7	80%	0.799	41%	0.406	S	S	*	.	P	Polyproline II helix	trans	-58.4	140.7	176.2	-67	-173.2	167.9	0	0	111.7	K93	E91-K93 PolarHBondContact O-N 3.26Å
92	P	96.2	Very high	96.2	Very high	55 Å²	55	71.2 Å²	71.2	36%	0.357	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-67.8	131.6	-179.6	26.1	-32.4	0	0	0	111.3	L130 Y149	P92-L130 HydrophobicContact CG-CD1 4.45Å; P92-L130 VanDerWaalsContact O-CD1 3.3Å; P92-L130 WeakPolarHBondContact O-CD1 3.17Å; P92-Y149 HydrophobicContact CB-CD1 3.56Å; P92-Y149 HydrophobicContact CB-CD2 4.29Å; P92-Y149 HydrophobicContact CB-CE1 3.96Å; P92-Y149 HydrophobicContact CB-CG 3.76Å; P92-Y149 HydrophobicContact CG-CD1 3.39Å; P92-Y149 HydrophobicContact CG-CD2 3.84Å; P92-Y149 HydrophobicContact CG-CE1 3.26Å; P92-Y149 HydrophobicContact CG-CE2 3.7Å; P92-Y149 HydrophobicContact CG-CG 3.7Å; P92-Y149 VanDerWaalsContact CG-CZ 3.42Å
93	K	97.2	Very high	96.1	Very high	140 Å²	140	67.9 Å²	67.9	61%	0.609	38%	0.378	S	S	*	.			trans	-91.8	-14.3	179.7	-60.4	178.2	-176.7	176.9	0	113.5	E91 L130 V201	E91-K93 PolarHBondContact O-N 3.26Å; K93-L130 PolarHBondContact O-N 2.88Å; K93-V201 HydrophobicContact CB-CB 4.28Å; K93-V201 HydrophobicContact CB-CG2 3.84Å
94	L	98	Very high	96.1	Very high	11 Å²	11	70.3 Å²	70.3	6%	0.058	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	132	-175.5	-179.6	65.8	0	0	0	110.4	F127 P150 V155 I198 V201 F205	L94-F127 HydrophobicContact CD1-CB 4.11Å; L94-F127 HydrophobicContact CD1-CD1 4.05Å; L94-F127 HydrophobicContact CD1-CG 4.46Å; L94-F127 HydrophobicContact CD2-CD1 4.27Å; L94-F127 HydrophobicContact CG-CD1 4.44Å; L94-P150 HydrophobicContact CD2-CG 3.69Å; L94-P150 HydrophobicContact CG-CG 3.91Å; L94-V155 HydrophobicContact CD2-CG2 4.16Å; L94-I198 HydrophobicContact CD1-CG2 4.45Å; L94-I198 HydrophobicContact CD2-CG2 4.26Å; L94-I198 WeakPolarHBondContact CD2-O 3.42Å; L94-V201 HydrophobicContact CB-CG2 3.79Å; L94-V201 HydrophobicContact CD1-CG2 4.43Å; L94-F205 HydrophobicContact CD1-CE2 3.63Å; L94-F205 HydrophobicContact CD1-CZ 3.72Å
95	A	98.2	Very high	95.9	Very high	0 Å²	0	71.5 Å²	71.5	0%	0	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	151.1	165.4	0	0	0	0	0	111.2	F127 V128 L130 W147 G148	A95-F127 WeakPolarHBondContact O-CA 3.41Å; A95-V128 PolarHBondContact N-O 3.41Å; A95-V128 PolarHBondContact O-N 3.02Å; A95-L130 HydrophobicContact CB-CD1 3.93Å; A95-L130 HydrophobicContact CB-CD2 3.61Å; A95-L130 HydrophobicContact CB-CG 3.76Å; A95-W147 HydrophobicContact CB-CE3 3.95Å; A95-W147 HydrophobicContact CB-CZ3 4.42Å; A95-G148 CarbonylContact C-O 3.52Å; A95-G148 VanDerWaalsContact CA-O 3.25Å; A95-G148 WeakPolarHBondContact CA-O 3.11Å
96	F	98.5	Very high	95.9	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.1	162.3	-166.5	-95.8	0	0	0	109.1	V98 F127 W147 G148 P150 L158 F215 L217 L248	F96-V98 HydrophobicContact CD1-CG2 3.68Å; F96-V98 HydrophobicContact CE1-CG2 3.54Å; F96-F127 HydrophobicContact CB-CD1 4.48Å; F96-F127 AromaticContact CD2-CD1 3.48Å; F96-F127 HydrophobicContact CD2-CD1 3.48Å; F96-F127 VanDerWaalsContact CD2-CD1 3.48Å; F96-F127 HydrophobicContact CD2-CD2 4.49Å; F96-F127 AromaticContact CD2-CE1 3.4Å; F96-F127 HydrophobicContact CD2-CE1 3.4Å; F96-F127 VanDerWaalsContact CD2-CE1 3.4Å; F96-F127 HydrophobicContact CD2-CE2 4.46Å; F96-F127 HydrophobicContact CD2-CG 4.01Å; F96-F127 AromaticContact CD2-CZ 3.93Å; F96-F127 HydrophobicContact CD2-CZ 3.93Å; F96-F127 HydrophobicContact CE2-CD1 4.21Å; F96-F127 HydrophobicContact CE2-CD2 4.47Å; F96-F127 AromaticContact CE2-CE1 3.97Å; F96-F127 HydrophobicContact CE2-CE1 3.97Å; F96-F127 HydrophobicContact CE2-CE2 4.29Å; F96-F127 HydrophobicContact CE2-CG 4.41Å; F96-F127 HydrophobicContact CE2-CZ 4.02Å; F96-F127 HydrophobicContact CG-CD1 4.45Å; F96-F127 HydrophobicContact CG-CE1 4.36Å; F96-W147 VanDerWaalsContact O-CA 3.28Å; F96-W147 WeakPolarHBondContact O-CA 3.39Å; F96-G148 PolarHBondContact N-O 3.47Å; F96-G148 PolarHBondContact O-N 2.93Å; F96-P150 HydrophobicContact CB-CB 4.16Å; F96-P150 HydrophobicContact CB-CG 4.03Å; F96-L158 HydrophobicContact CD1-CD1 4.45Å; F96-L158 HydrophobicContact CD2-CD1 3.84Å; F96-L158 HydrophobicContact CE1-CD1 4.14Å; F96-L158 HydrophobicContact CE1-CD2 4.48Å; F96-L158 HydrophobicContact CE2-CD1 3.5Å; F96-L158 VanDerWaalsContact CE2-CD1 3.5Å; F96-L158 HydrophobicContact CE2-CD2 4.43Å; F96-L158 HydrophobicContact CG-CD1 4.27Å; F96-L158 HydrophobicContact CZ-CD1 3.64Å; F96-L158 HydrophobicContact CZ-CD2 3.9Å; F96-L158 HydrophobicContact CZ-CG 4.43Å; F96-F215 AromaticContact CE2-CD2 3.76Å; F96-F215 HydrophobicContact CE2-CD2 3.76Å; F96-F215 HydrophobicContact CE2-CE2 4.16Å; F96-F215 HydrophobicContact CE2-CG 4.41Å; F96-F215 HydrophobicContact CZ-CB 4.23Å; F96-F215 HydrophobicContact CZ-CD2 4.02Å; F96-F215 HydrophobicContact CZ-CG 4.27Å; F96-L217 HydrophobicContact CE1-CD1 4.05Å; F96-L217 HydrophobicContact CZ-CD1 4.49Å; F96-L248 HydrophobicContact CB-CD1 4.14Å; F96-L248 HydrophobicContact CD1-CD1 3.54Å; F96-L248 HydrophobicContact CD1-CD2 3.49Å; F96-L248 VanDerWaalsContact CD1-CD2 3.49Å; F96-L248 HydrophobicContact CD1-CG 4.14Å; F96-L248 HydrophobicContact CE1-CD1 4.15Å; F96-L248 HydrophobicContact CE1-CD2 3.35Å; F96-L248 HydrophobicContact CE1-CG 4.41Å; F96-L248 HydrophobicContact CG-CD1 4Å; F96-L248 HydrophobicContact CZ-CD2 4.42Å
97	V	98.4	Very high	96	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	124.6	-172.9	-172.9	0	0	0	0	108.5	L119 G125 M126 V128 L138 V145 W147	V97-L119 HydrophobicContact CB-CD1 4.19Å; V97-L119 HydrophobicContact CG1-CD1 3.53Å; V97-G125 CarbonylContact O-C 3.49Å; V97-G125 VanDerWaalsContact O-CA 3.23Å; V97-G125 WeakPolarHBondContact O-CA 3.23Å; V97-M126 PolarHBondContact N-O 3.06Å; V97-M126 PolarHBondContact O-N 3.09Å; V97-V128 HydrophobicContact CB-CG2 4.46Å; V97-V128 HydrophobicContact CG2-CB 4.12Å; V97-V128 HydrophobicContact CG2-CG2 3.67Å; V97-L138 HydrophobicContact CB-CD2 4.46Å; V97-L138 HydrophobicContact CG1-CD2 3.9Å; V97-L138 HydrophobicContact CG2-CD2 3.65Å; V97-V145 HydrophobicContact CG1-CB 3.87Å; V97-V145 HydrophobicContact CG1-CG1 4.12Å; V97-V145 HydrophobicContact CG1-CG2 3.94Å; V97-W147 HydrophobicContact CB-CB 4.16Å; V97-W147 HydrophobicContact CG1-CB 4.13Å; V97-W147 HydrophobicContact CG2-CB 3.91Å
98	V	98	Very high	96	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	129.2	178.7	-177.3	0	0	0	0	109.7	F96 I100 N124 V145 A146 L217 L248 M251	F96-V98 HydrophobicContact CD1-CG2 3.68Å; F96-V98 HydrophobicContact CE1-CG2 3.54Å; V98-I100 HydrophobicContact CG1-CG2 4.3Å; V98-I100 PolarHBondContact O-N 3.4Å; V98-N124 CarbonylContact C-O 3.25Å; V98-N124 WeakPolarHBondContact CA-O 3.34Å; V98-V145 CarbonylContact O-C 3.58Å; V98-V145 WeakPolarHBondContact O-CA 3.4Å; V98-V145 WeakPolarHBondContact O-CB 3.26Å; V98-A146 PolarHBondContact N-O 3.31Å; V98-A146 PolarHBondContact O-N 3.2Å; V98-L217 HydrophobicContact CG1-CD1 4.21Å; V98-L217 HydrophobicContact CG2-CD1 3.92Å; V98-L248 HydrophobicContact CG2-CD2 3.73Å; V98-M251 HydrophobicContact CG1-CE 3.85Å; V98-M251 HydrophobicContact CG1-SD 4.07Å
99	R	97.8	Very high	96.1	Very high	13 Å²	13	65.9 Å²	65.9	5%	0.049	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	121.3	171	177.3	169	176.4	174.3	5.8	110.7	R101 G102 I103 M114 L119 R120 Q121 N123 N124	R99-R101 WeakPolarHBondContact CG-O 3.23Å; R99-R101 PolarHBondContact NE-O 3.26Å; R99-G102 VanDerWaalsContact NH2-C 3.28Å; R99-G102 PolarHBondContact NH2-O 3.19Å; R99-I103 VanDerWaalsContact NH2-CA 3.27Å; R99-I103 VanDerWaalsContact NH2-CG2 3.32Å; R99-M114 HydrophobicContact CG-SD 4.33Å; R99-L119 HydrophobicContact CB-CB 4.19Å; R99-L119 WeakPolarHBondContact CD-O 3.38Å; R99-L119 PolarHBondContact NH1-O 3.06Å; R99-R120 VanDerWaalsContact NH1-C 3.26Å; R99-R120 PolarHBondContact NH1-O 3.47Å; R99-Q121 WeakPolarHBondContact CD-O 3.31Å; R99-N123 WeakPolarHBondContact O-CA 3.44Å; R99-N123 PolarHBondContact O-N 2.89Å; R99-N124 PolarHBondContact N-O 2.82Å
100	I	96.8	Very high	96.2	Very high	0 Å²	0	63 Å²	63	0%	0	35%	0.349	C	S	.	.			trans	-107.9	-18.5	-176.9	60.1	165.8	0	0	0	113.5	V98 I122 Y144 A146 F224 K227 D236 F237	V98-I100 HydrophobicContact CG1-CG2 4.3Å; V98-I100 PolarHBondContact O-N 3.4Å; I100-I122 WeakPolarHBondContact O-CD1 3.39Å; I100-Y144 WeakPolarHBondContact CG1-O 3.35Å; I100-Y144 PolarHBondContact N-O 3.45Å; I100-A146 HydrophobicContact CD1-CB 4.37Å; I100-A146 HydrophobicContact CG2-CB 3.78Å; I100-F224 HydrophobicContact CB-CE1 4.28Å; I100-F224 HydrophobicContact CB-CZ 4.39Å; I100-F224 HydrophobicContact CG2-CE1 3.69Å; I100-F224 HydrophobicContact CG2-CZ 3.95Å; I100-K227 HydrophobicContact CD1-CB 4.45Å; I100-K227 PolarHBondContact O-NZ 3.4Å; I100-D236 HydrophobicContact CD1-CB 4.15Å; I100-F237 HydrophobicContact CD1-CB 3.81Å
101	R	95.2	Very high	96.3	Very high	76 Å²	76	65.3 Å²	65.3	29%	0.287	34%	0.34	S	S	.	.	S	Bend	trans	-100.6	151.3	176.4	-67.4	-163.6	-179.6	179.6	10.1	112.8	R99 P143 Y144 K227 G228	R99-R101 WeakPolarHBondContact CG-O 3.23Å; R99-R101 PolarHBondContact NE-O 3.26Å; R101-P143 VanDerWaalsContact CD-O 3.25Å; R101-P143 WeakPolarHBondContact CD-O 3.35Å; R101-P143 PolarHBondContact NE-O 3.33Å; R101-Y144 HydrophobicContact CB-CD1 4.09Å; R101-Y144 PolarHBondContact N-O 3.1Å; R101-K227 PolarHBondContact NE-O 3.12Å; R101-K227 PolarHBondContact NH2-O 3.43Å; R101-G228 VanDerWaalsContact NH2-CA 3.26Å; R101-G228 PolarHBondContact NH2-O 3.25Å; R101-G228 VanDerWaalsContact NH2-O 3.14Å
102	G	94.1	Very high	96.4	Very high	38 Å²	38	63 Å²	63	39%	0.392	33%	0.327	S	S	.	.			trans	-68.6	-172.8	178.9	0	0	0	0	0	114.1	R99	R99-G102 VanDerWaalsContact NH2-C 3.28Å; R99-G102 PolarHBondContact NH2-O 3.19Å
103	I	95	Very high	96.5	Very high	115 Å²	115	61 Å²	61	59%	0.59	31%	0.314	S	S	*	.	S	Bend	trans	-90	-17.5	-176.8	59.7	170.6	0	0	0	114.3	R99	R99-I103 VanDerWaalsContact NH2-CA 3.27Å; R99-I103 VanDerWaalsContact NH2-CG2 3.32Å
104	N	94.3	Very high	96.5	Very high	146 Å²	146	54.5 Å²	54.5	78%	0.781	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	144.2	-175.2	-60.2	-15.3	0	0	0	111.1	V106	N104-V106 VanDerWaalsContact C-N 3.26Å; N104-V106 PolarHBondContact O-N 3Å
105	G	92	Very high	96.5	Very high	83 Å²	83	58 Å²	58	86%	0.856	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	67	18.1	174.1	0	0	0	0	0	115.6
106	V	94.8	Very high	96.4	Very high	15 Å²	15	63.1 Å²	63.1	9%	0.091	33%	0.328	C	S	.	.			trans	-87.8	120.3	-179.7	-174.7	0	0	0	0	110.4	N104 P110 R111 M114 Y144	N104-V106 VanDerWaalsContact C-N 3.26Å; N104-V106 PolarHBondContact O-N 3Å; V106-P110 HydrophobicContact CG1-CB 4.16Å; V106-R111 HydrophobicContact CG1-CB 3.9Å; V106-M114 HydrophobicContact CG1-CE 3.52Å; V106-M114 HydrophobicContact CG2-CE 4.34Å; V106-Y144 HydrophobicContact CB-CE1 4.27Å; V106-Y144 HydrophobicContact CG1-CD1 4.36Å; V106-Y144 HydrophobicContact CG1-CE1 3.92Å; V106-Y144 HydrophobicContact CG2-CD1 4.14Å; V106-Y144 HydrophobicContact CG2-CE1 3.85Å
107	H	95.7	Very high	96.3	Very high	119 Å²	119	64.1 Å²	64.1	55%	0.551	33%	0.333	S	S	*	.			trans	-53.9	143.6	174.5	-174.7	-92.2	0	0	0	111.9	R109 P110 R111	H107-R109 VanDerWaalsContact C-N 3.27Å; H107-R109 PolarHBondContact ND1-N 3.14Å; H107-R109 PolarHBondContact O-N 2.79Å; H107-R109 VanDerWaalsContact O-N 3.13Å; H107-P110 HydrophobicContact CB-CG 4.39Å; H107-P110 WeakPolarHBondContact O-CD 3.45Å; H107-R111 WeakPolarHBondContact O-CB 3.25Å; H107-R111 PolarHBondContact O-N 2.82Å; H107-R111 VanDerWaalsContact O-N 3.08Å
108	P	96.8	Very high	96.2	Very high	77 Å²	77	67.5 Å²	67.5	50%	0.5	35%	0.345	S	S	.	.	H	α-helix	trans	-53.8	-37.2	-174.6	-30.3	36.4	0	0	0	115	R111 K112	P108-R111 WeakPolarHBondContact O-CB 3.45Å; P108-R111 PolarHBondContact O-N 2.74Å; P108-K112 PolarHBondContact O-N 3.34Å
109	R	96.6	Very high	96.2	Very high	167 Å²	167	67.5 Å²	67.5	63%	0.63	35%	0.345	S	S	*	.	H	α-helix	trans	-64.7	-58	-178.9	-179	-179.7	-176.3	179.3	2.5	112.8	H107 R111 K112 T113 I140	H107-R109 VanDerWaalsContact C-N 3.27Å; H107-R109 PolarHBondContact ND1-N 3.14Å; H107-R109 PolarHBondContact O-N 2.79Å; H107-R109 VanDerWaalsContact O-N 3.13Å; R109-R111 VanDerWaalsContact C-N 3.26Å; R109-R111 PolarHBondContact O-N 2.92Å; R109-K112 PolarHBondContact O-N 3.37Å; R109-T113 PolarHBondContact O-N 3.35Å; R109-T113 PolarHBondContact O-OG1 2.74Å; R109-I140 HydrophobicContact CG-CG2 4.18Å
110	P	97.1	Very high	96.1	Very high	13 Å²	13	75.2 Å²	75.2	8%	0.084	38%	0.375	C	S	.	.	H	α-helix	trans	-56.2	-36.7	170.2	-27.3	33.1	0	0	0	113.9	V106 H107 K112 T113 M114 I140 I141 Y144	V106-P110 HydrophobicContact CG1-CB 4.16Å; H107-P110 HydrophobicContact CB-CG 4.39Å; H107-P110 WeakPolarHBondContact O-CD 3.45Å; P110-K112 PolarHBondContact O-N 2.88Å; P110-T113 PolarHBondContact O-N 2.94Å; P110-M114 PolarHBondContact O-N 3.34Å; P110-I140 HydrophobicContact CG-CG2 4.21Å; P110-I141 HydrophobicContact CB-CG2 4.09Å; P110-I141 WeakPolarHBondContact O-CG2 3.43Å; P110-Y144 HydrophobicContact CB-CD2 3.96Å; P110-Y144 HydrophobicContact CB-CE2 3.59Å; P110-Y144 HydrophobicContact CG-CE2 3.84Å
111	R	97.1	Very high	96.1	Very high	133 Å²	133	80 Å²	80	50%	0.502	40%	0.397	S	S	.	.	H	α-helix	trans	-59.5	-46.4	177.8	-173.5	172.9	70.1	-177.9	1.5	111.6	V106 H107 P108 R109 M114 Q115	V106-R111 HydrophobicContact CG1-CB 3.9Å; H107-R111 WeakPolarHBondContact O-CB 3.25Å; H107-R111 PolarHBondContact O-N 2.82Å; H107-R111 VanDerWaalsContact O-N 3.08Å; P108-R111 WeakPolarHBondContact O-CB 3.45Å; P108-R111 PolarHBondContact O-N 2.74Å; R109-R111 VanDerWaalsContact C-N 3.26Å; R109-R111 PolarHBondContact O-N 2.92Å; R111-M114 PolarHBondContact O-N 2.98Å; R111-Q115 WeakPolarHBondContact O-CG 3.4Å; R111-Q115 PolarHBondContact O-N 3.28Å
112	K	97.6	Very high	96.2	Very high	123 Å²	123	79.9 Å²	79.9	54%	0.535	40%	0.401	S	S	.	.	H	α-helix	trans	-63.9	-42.8	177	-174.2	63.9	175.7	-171.1	0	111.6	P108 R109 P110 M114 Q115 L116	P108-K112 PolarHBondContact O-N 3.34Å; R109-K112 PolarHBondContact O-N 3.37Å; P110-K112 PolarHBondContact O-N 2.88Å; K112-M114 PolarHBondContact O-N 3.37Å; K112-Q115 WeakPolarHBondContact O-CB 3.37Å; K112-Q115 PolarHBondContact O-N 2.97Å; K112-Q115 VanDerWaalsContact O-N 3.14Å; K112-L116 WeakPolarHBondContact O-CG 3.46Å; K112-L116 PolarHBondContact O-N 3.39Å
113	T	97.4	Very high	96.3	Very high	13 Å²	13	78.5 Å²	78.5	8%	0.08	39%	0.385	C	S	.	.	H	α-helix	trans	-62.4	-43.2	177.8	-56.8	0	0	0	0	112.3	R109 P110 Q115 L116 F117 M137 I141	R109-T113 PolarHBondContact O-N 3.35Å; R109-T113 PolarHBondContact O-OG1 2.74Å; P110-T113 PolarHBondContact O-N 2.94Å; T113-Q115 VanDerWaalsContact C-N 3.31Å; T113-Q115 PolarHBondContact O-N 3.31Å; T113-L116 WeakPolarHBondContact O-CB 3.41Å; T113-L116 PolarHBondContact O-N 3.49Å; T113-F117 HydrophobicContact CG2-CD2 3.92Å; T113-F117 HydrophobicContact CG2-CE2 3.67Å; T113-F117 VanDerWaalsContact O-CD2 3.32Å; T113-F117 WeakPolarHBondContact O-CD2 3.35Å; T113-F117 PolarHBondContact O-N 2.98Å; T113-F117 VanDerWaalsContact O-N 3.1Å; T113-M137 HydrophobicContact CG2-CB 3.87Å; T113-M137 HydrophobicContact CG2-CE 3.76Å; T113-M137 HydrophobicContact CG2-CG 4.43Å; T113-M137 WeakPolarHBondContact CG2-O 3.44Å; T113-I141 HydrophobicContact CG2-CD1 4.27Å; T113-I141 HydrophobicContact CG2-CG1 4.42Å; T113-I141 HydrophobicContact CG2-CG2 3.6Å
114	M	97.5	Very high	96.4	Very high	2 Å²	2	73.3 Å²	73.3	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-62.4	-35.9	173.3	-74.2	-170.2	-76.1	0	0	112.6	R99 V106 P110 R111 K112 F117 R118 L119 I141 Y144	R99-M114 HydrophobicContact CG-SD 4.33Å; V106-M114 HydrophobicContact CG1-CE 3.52Å; V106-M114 HydrophobicContact CG2-CE 4.34Å; P110-M114 PolarHBondContact O-N 3.34Å; R111-M114 PolarHBondContact O-N 2.98Å; K112-M114 PolarHBondContact O-N 3.37Å; M114-F117 CarbonylContact O-C 3.53Å; M114-F117 PolarHBondContact O-N 2.78Å; M114-R118 PolarHBondContact O-N 2.91Å; M114-R118 VanDerWaalsContact O-N 3.14Å; M114-L119 HydrophobicContact CB-CB 4.35Å; M114-L119 PolarHBondContact O-N 3.26Å; M114-I141 HydrophobicContact CG-CB 4.23Å; M114-I141 HydrophobicContact CG-CD1 4.25Å; M114-I141 HydrophobicContact CG-CG2 3.87Å; M114-Y144 HydrophobicContact CE-CD1 4.4Å; M114-Y144 HydrophobicContact CE-CG 4.16Å; M114-Y144 HydrophobicContact SD-CG 4.48Å
115	Q	96.8	Very high	96.6	Very high	84 Å²	84	66.4 Å²	66.4	39%	0.393	32%	0.321	S	S	.	.	H	α-helix	trans	-63.2	-40.5	174	-72.4	173.3	-3.6	0	0	112.1	R111 K112 T113 R118	R111-Q115 WeakPolarHBondContact O-CG 3.4Å; R111-Q115 PolarHBondContact O-N 3.28Å; K112-Q115 WeakPolarHBondContact O-CB 3.37Å; K112-Q115 PolarHBondContact O-N 2.97Å; K112-Q115 VanDerWaalsContact O-N 3.14Å; T113-Q115 VanDerWaalsContact C-N 3.31Å; T113-Q115 PolarHBondContact O-N 3.31Å; Q115-R118 WeakPolarHBondContact O-CA 3.19Å; Q115-R118 PolarHBondContact O-N 3.01Å
116	L	96.9	Very high	96.9	Very high	108 Å²	108	62.5 Å²	62.5	57%	0.565	28%	0.281	S	S	*	.	H	α-helix	trans	-63.9	-40.4	176.6	-66.3	174.4	0	0	0	111.8	K112 T113 R118 M137	K112-L116 WeakPolarHBondContact O-CG 3.46Å; K112-L116 PolarHBondContact O-N 3.39Å; T113-L116 WeakPolarHBondContact O-CB 3.41Å; T113-L116 PolarHBondContact O-N 3.49Å; L116-R118 PolarHBondContact O-N 2.91Å; L116-M137 HydrophobicContact CB-CE 4.04Å; L116-M137 HydrophobicContact CD1-CE 3.67Å
117	F	97	Very high	97.1	Very high	22 Å²	22	62 Å²	62	10%	0.096	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-0.4	171.6	-70.9	-61.4	0	0	0	114.2	T113 M114 L119 M126 V128 M137 L138 I141	T113-F117 HydrophobicContact CG2-CD2 3.92Å; T113-F117 HydrophobicContact CG2-CE2 3.67Å; T113-F117 VanDerWaalsContact O-CD2 3.32Å; T113-F117 WeakPolarHBondContact O-CD2 3.35Å; T113-F117 PolarHBondContact O-N 2.98Å; T113-F117 VanDerWaalsContact O-N 3.1Å; M114-F117 CarbonylContact O-C 3.53Å; M114-F117 PolarHBondContact O-N 2.78Å; F117-L119 HydrophobicContact CB-CD1 4.03Å; F117-L119 HydrophobicContact CB-CG 3.95Å; F117-L119 PolarHBondContact O-N 3.2Å; F117-M126 WeakPolarHBondContact O-CG 3.18Å; F117-V128 HydrophobicContact CD1-CG1 4.35Å; F117-V128 HydrophobicContact CD1-CG2 3.63Å; F117-V128 HydrophobicContact CE1-CB 4.41Å; F117-V128 HydrophobicContact CE1-CG1 3.66Å; F117-V128 HydrophobicContact CE1-CG2 3.78Å; F117-V128 HydrophobicContact CZ-CG1 4.47Å; F117-M137 HydrophobicContact CE2-CB 3.76Å; F117-M137 HydrophobicContact CE2-CE 4.01Å; F117-M137 HydrophobicContact CZ-CB 3.76Å; F117-M137 HydrophobicContact CZ-CE 4.15Å; F117-M137 HydrophobicContact CZ-SD 4.41Å; F117-L138 HydrophobicContact CE2-CD2 4.35Å; F117-L138 HydrophobicContact CZ-CD2 4.37Å; F117-L138 HydrophobicContact CZ-CG 4.23Å; F117-I141 HydrophobicContact CD2-CD1 3.6Å; F117-I141 HydrophobicContact CE2-CD1 3.79Å
118	R	96.6	Very high	97.2	Very high	70 Å²	70	56.8 Å²	56.8	26%	0.264	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.8	20.2	-175.6	-52.5	179.2	-74.9	171.1	-6.2	114.4	M114 Q115 L116 R120 V209 L212 T214	M114-R118 PolarHBondContact O-N 2.91Å; M114-R118 VanDerWaalsContact O-N 3.14Å; Q115-R118 WeakPolarHBondContact O-CA 3.19Å; Q115-R118 PolarHBondContact O-N 3.01Å; L116-R118 PolarHBondContact O-N 2.91Å; R118-R120 VanDerWaalsContact C-N 3.33Å; R118-R120 PolarHBondContact O-N 3.45Å; R118-V209 PolarHBondContact NH1-O 2.86Å; R118-V209 PolarHBondContact NH2-O 3.09Å; R118-L212 PolarHBondContact NH1-O 3.33Å; R118-T214 HydrophobicContact CB-CG2 3.44Å; R118-T214 VanDerWaalsContact CB-CG2 3.44Å; R118-T214 WeakPolarHBondContact O-CG2 3.33Å
119	L	97.5	Very high	97.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	25%	0.254	C	S	.	.			trans	-87.2	62.9	179.8	-61.1	178.5	0	0	0	112	V97 R99 M114 F117 N124 M126 V145	V97-L119 HydrophobicContact CB-CD1 4.19Å; V97-L119 HydrophobicContact CG1-CD1 3.53Å; R99-L119 HydrophobicContact CB-CB 4.19Å; R99-L119 WeakPolarHBondContact CD-O 3.38Å; R99-L119 PolarHBondContact NH1-O 3.06Å; M114-L119 HydrophobicContact CB-CB 4.35Å; M114-L119 PolarHBondContact O-N 3.26Å; F117-L119 HydrophobicContact CB-CD1 4.03Å; F117-L119 HydrophobicContact CB-CG 3.95Å; F117-L119 PolarHBondContact O-N 3.2Å; L119-N124 HydrophobicContact CD2-CB 4.16Å; L119-N124 WeakPolarHBondContact CD2-O 3.48Å; L119-M126 HydrophobicContact CD2-CB 4.21Å; L119-M126 HydrophobicContact CD2-CG 4.2Å; L119-V145 HydrophobicContact CD1-CG1 4.04Å
120	R	95.8	Very high	97.3	Very high	176 Å²	176	52.5 Å²	52.5	66%	0.664	23%	0.229	S	C	*	.			trans	-80.5	-29.9	-172.9	-62.7	-176.9	-177.6	-174.6	-0.9	114.9	R99 R118	R99-R120 VanDerWaalsContact NH1-C 3.26Å; R99-R120 PolarHBondContact NH1-O 3.47Å; R118-R120 VanDerWaalsContact C-N 3.33Å; R118-R120 PolarHBondContact O-N 3.45Å
121	Q	96.3	Very high	97.3	Very high	99 Å²	99	55.2 Å²	55.2	46%	0.463	24%	0.244	S	C	.	.	S	Bend	trans	-113.7	156.7	-178.5	-61.1	179.3	-43.4	0	0	110.5	R99 N124	R99-Q121 WeakPolarHBondContact CD-O 3.31Å; Q121-N124 PolarHBondContact N-ND2 3.34Å; Q121-N124 WeakPolarHBondContact O-CB 3.43Å; Q121-N124 PolarHBondContact O-N 3.45Å
122	I	96.6	Very high	97.3	Very high	75 Å²	75	56 Å²	56	39%	0.385	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	145.8	170.2	-168.6	166.9	0	0	0	110.1	I100 N124	I100-I122 WeakPolarHBondContact O-CD1 3.39Å; I122-N124 PolarHBondContact O-N 2.89Å; I122-N124 VanDerWaalsContact O-N 3.14Å
123	N	97.2	Very high	97.2	Very high	9 Å²	9	53.1 Å²	53.1	5%	0.048	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	17.2	-175.1	-55.8	-28.1	0	0	0	114.5	R99 L217 N219 M251	R99-N123 WeakPolarHBondContact O-CA 3.44Å; R99-N123 PolarHBondContact O-N 2.89Å; N123-L217 HydrophobicContact CB-CB 4.41Å; N123-L217 WeakPolarHBondContact CB-O 3.29Å; N123-L217 VanDerWaalsContact O-CB 3.22Å; N123-L217 WeakPolarHBondContact O-CB 3.33Å; N123-L217 WeakPolarHBondContact O-CG 3.47Å; N123-L217 PolarHBondContact O-N 3.35Å; N123-N219 PolarHBondContact ND2-OD1 3.12Å; N123-M251 HydrophobicContact CB-CE 3.69Å; N123-M251 WeakPolarHBondContact OD1-CE 3.35Å
124	N	98	Very high	97.2	Very high	6 Å²	6	53.5 Å²	53.5	3%	0.032	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	139.1	165	-80.6	3.1	0	0	0	110.1	V98 R99 L119 Q121 I122 F215	V98-N124 CarbonylContact C-O 3.25Å; V98-N124 WeakPolarHBondContact CA-O 3.34Å; R99-N124 PolarHBondContact N-O 2.82Å; L119-N124 HydrophobicContact CD2-CB 4.16Å; L119-N124 WeakPolarHBondContact CD2-O 3.48Å; Q121-N124 PolarHBondContact N-ND2 3.34Å; Q121-N124 WeakPolarHBondContact O-CB 3.43Å; Q121-N124 PolarHBondContact O-N 3.45Å; I122-N124 PolarHBondContact O-N 2.89Å; I122-N124 VanDerWaalsContact O-N 3.14Å; N124-F215 CarbonylContact C-O 3.48Å; N124-F215 VanDerWaalsContact CA-O 3.3Å; N124-F215 WeakPolarHBondContact CA-O 3.34Å
125	G	98	Very high	97.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.9	175.7	0	0	0	0	0	112.4	V97 F215	V97-G125 CarbonylContact O-C 3.49Å; V97-G125 VanDerWaalsContact O-CA 3.23Å; V97-G125 WeakPolarHBondContact O-CA 3.23Å; G125-F215 PolarHBondContact N-O 3.4Å; G125-F215 WeakPolarHBondContact O-CB 3.47Å; G125-F215 PolarHBondContact O-N 3.47Å
126	M	98	Very high	97.2	Very high	2 Å²	2	55.2 Å²	55.2	1%	0.01	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	145.9	171.7	-79.8	-57.3	-32.8	0	0	112.1	V97 F117 L119 V209 T214	V97-M126 PolarHBondContact N-O 3.06Å; V97-M126 PolarHBondContact O-N 3.09Å; F117-M126 WeakPolarHBondContact O-CG 3.18Å; L119-M126 HydrophobicContact CD2-CB 4.21Å; L119-M126 HydrophobicContact CD2-CG 4.2Å; M126-V209 HydrophobicContact CE-CG1 3.64Å; M126-T214 HydrophobicContact CG-CG2 3.97Å; M126-T214 WeakPolarHBondContact SD-CA 3.25Å; M126-T214 HydrophobicContact SD-CG2 3.7Å
127	F	98.4	Very high	97.3	Very high	3 Å²	3	52.5 Å²	52.5	1%	0.013	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73	136.4	164.9	-64.6	-66.2	0	0	0	110.6	L94 A95 F96 P150 V155 L158 I159 I198 F205 V209 L212 F215	L94-F127 HydrophobicContact CD1-CB 4.11Å; L94-F127 HydrophobicContact CD1-CD1 4.05Å; L94-F127 HydrophobicContact CD1-CG 4.46Å; L94-F127 HydrophobicContact CD2-CD1 4.27Å; L94-F127 HydrophobicContact CG-CD1 4.44Å; A95-F127 WeakPolarHBondContact O-CA 3.41Å; F96-F127 HydrophobicContact CB-CD1 4.48Å; F96-F127 AromaticContact CD2-CD1 3.48Å; F96-F127 HydrophobicContact CD2-CD1 3.48Å; F96-F127 VanDerWaalsContact CD2-CD1 3.48Å; F96-F127 HydrophobicContact CD2-CD2 4.49Å; F96-F127 AromaticContact CD2-CE1 3.4Å; F96-F127 HydrophobicContact CD2-CE1 3.4Å; F96-F127 VanDerWaalsContact CD2-CE1 3.4Å; F96-F127 HydrophobicContact CD2-CE2 4.46Å; F96-F127 HydrophobicContact CD2-CG 4.01Å; F96-F127 AromaticContact CD2-CZ 3.93Å; F96-F127 HydrophobicContact CD2-CZ 3.93Å; F96-F127 HydrophobicContact CE2-CD1 4.21Å; F96-F127 HydrophobicContact CE2-CD2 4.47Å; F96-F127 AromaticContact CE2-CE1 3.97Å; F96-F127 HydrophobicContact CE2-CE1 3.97Å; F96-F127 HydrophobicContact CE2-CE2 4.29Å; F96-F127 HydrophobicContact CE2-CG 4.41Å; F96-F127 HydrophobicContact CE2-CZ 4.02Å; F96-F127 HydrophobicContact CG-CD1 4.45Å; F96-F127 HydrophobicContact CG-CE1 4.36Å; F127-P150 HydrophobicContact CE1-CG 4.36Å; F127-V155 HydrophobicContact CE1-CB 4.41Å; F127-V155 HydrophobicContact CE1-CG1 4.2Å; F127-V155 HydrophobicContact CE1-CG2 3.91Å; F127-V155 HydrophobicContact CZ-CB 4.34Å; F127-V155 HydrophobicContact CZ-CG1 3.91Å; F127-V155 HydrophobicContact CZ-CG2 4.33Å; F127-L158 HydrophobicContact CE1-CD1 4.21Å; F127-L158 HydrophobicContact CZ-CB 4.36Å; F127-L158 HydrophobicContact CZ-CD1 3.85Å; F127-I159 HydrophobicContact CE2-CD1 4.37Å; F127-I159 HydrophobicContact CE2-CG1 4.27Å; F127-I198 HydrophobicContact CB-CG2 4.25Å; F127-I198 HydrophobicContact CD1-CG2 3.79Å; F127-I198 HydrophobicContact CD2-CD1 4.2Å; F127-I198 HydrophobicContact CD2-CG2 3.68Å; F127-I198 HydrophobicContact CE1-CG2 4.07Å; F127-I198 HydrophobicContact CE2-CD1 4.34Å; F127-I198 HydrophobicContact CE2-CG2 3.93Å; F127-I198 HydrophobicContact CG-CG2 3.63Å; F127-I198 HydrophobicContact CZ-CG2 4.14Å; F127-F205 HydrophobicContact CB-CZ 4.22Å; F127-V209 HydrophobicContact CB-CG2 3.98Å; F127-L212 HydrophobicContact CD2-CD1 4.19Å; F127-L212 HydrophobicContact CE2-CD1 4.32Å; F127-F215 AromaticContact CD2-CE2 3.7Å; F127-F215 HydrophobicContact CD2-CE2 3.7Å; F127-F215 HydrophobicContact CD2-CZ 4.27Å; F127-F215 HydrophobicContact CE2-CD2 4.48Å; F127-F215 AromaticContact CE2-CE2 3.42Å; F127-F215 HydrophobicContact CE2-CE2 3.42Å; F127-F215 VanDerWaalsContact CE2-CE2 3.42Å; F127-F215 AromaticContact CE2-CZ 3.61Å; F127-F215 HydrophobicContact CE2-CZ 3.61Å; F127-F215 HydrophobicContact CZ-CE2 4.34Å; F127-F215 HydrophobicContact CZ-CZ 4.47Å
128	V	97.9	Very high	97.3	Very high	10 Å²	10	51.5 Å²	51.5	6%	0.061	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	128.8	178.1	176.7	0	0	0	0	108.2	A95 V97 F117 L130 T134	A95-V128 PolarHBondContact N-O 3.41Å; A95-V128 PolarHBondContact O-N 3.02Å; V97-V128 HydrophobicContact CB-CG2 4.46Å; V97-V128 HydrophobicContact CG2-CB 4.12Å; V97-V128 HydrophobicContact CG2-CG2 3.67Å; F117-V128 HydrophobicContact CD1-CG1 4.35Å; F117-V128 HydrophobicContact CD1-CG2 3.63Å; F117-V128 HydrophobicContact CE1-CB 4.41Å; F117-V128 HydrophobicContact CE1-CG1 3.66Å; F117-V128 HydrophobicContact CE1-CG2 3.78Å; F117-V128 HydrophobicContact CZ-CG1 4.47Å; V128-L130 PolarHBondContact O-N 3.23Å; V128-T134 HydrophobicContact CG1-CG2 4.03Å
129	R	97.7	Very high	97.3	Very high	131 Å²	131	56.1 Å²	56.1	49%	0.494	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	127.3	168.3	170.2	172.7	178.4	174.7	-1.9	108	T134 V201 F205	R129-T134 WeakPolarHBondContact O-CG2 3.37Å; R129-T134 PolarHBondContact O-OG1 2.93Å; R129-V201 HydrophobicContact CB-CG1 4.15Å; R129-V201 HydrophobicContact CG-CG1 3.78Å; R129-F205 HydrophobicContact CB-CD1 3.85Å; R129-F205 HydrophobicContact CB-CE1 3.51Å; R129-F205 HydrophobicContact CB-CZ 4.11Å
130	L	97.2	Very high	97.3	Very high	23 Å²	23	58.7 Å²	58.7	12%	0.12	27%	0.274	C	S	.	.			trans	-80.9	118.1	175.7	-67	178.2	0	0	0	109.8	P92 K93 A95 V128 L135 L138 W147 Y149	P92-L130 HydrophobicContact CG-CD1 4.45Å; P92-L130 VanDerWaalsContact O-CD1 3.3Å; P92-L130 WeakPolarHBondContact O-CD1 3.17Å; K93-L130 PolarHBondContact O-N 2.88Å; A95-L130 HydrophobicContact CB-CD1 3.93Å; A95-L130 HydrophobicContact CB-CD2 3.61Å; A95-L130 HydrophobicContact CB-CG 3.76Å; V128-L130 PolarHBondContact O-N 3.23Å; L130-L135 HydrophobicContact CD2-CD2 3.85Å; L130-L135 HydrophobicContact CD2-CG 4.32Å; L130-L138 HydrophobicContact CD2-CD1 3.88Å; L130-W147 HydrophobicContact CD1-CZ3 4.44Å; L130-W147 HydrophobicContact CD2-CZ3 4.11Å; L130-Y149 HydrophobicContact CD1-CD1 4.04Å; L130-Y149 HydrophobicContact CD1-CE1 3.74Å
131	N	96.8	Very high	97.3	Very high	71 Å²	71	50.3 Å²	50.3	38%	0.38	24%	0.243	S	C	.	.			trans	-140.8	176.3	164.8	66.3	22.2	0	0	0	108.6	A133 T134 L135	N131-A133 VanDerWaalsContact C-N 3.26Å; N131-A133 PolarHBondContact O-N 3.43Å; N131-A133 PolarHBondContact OD1-N 3.45Å; N131-A133 VanDerWaalsContact OD1-N 3.13Å; N131-T134 PolarHBondContact N-OG1 2.97Å; N131-T134 PolarHBondContact O-N 3.32Å; N131-T134 PolarHBondContact O-OG1 2.84Å; N131-T134 VanDerWaalsContact O-OG1 3.06Å; N131-T134 WeakPolarHBondContact OD1-CG2 3.45Å; N131-T134 PolarHBondContact OD1-N 3.12Å; N131-T134 PolarHBondContact OD1-OG1 2.88Å; N131-T134 VanDerWaalsContact OD1-OG1 3.12Å; N131-L135 WeakPolarHBondContact O-CB 3.42Å; N131-L135 VanDerWaalsContact O-CG 3.3Å; N131-L135 WeakPolarHBondContact O-CG 3.28Å; N131-L135 PolarHBondContact O-N 3.48Å
132	K	97.1	Very high	97.3	Very high	150 Å²	150	46.8 Å²	46.8	65%	0.652	23%	0.227	S	C	*	.	H	α-helix	trans	-54.9	-41.1	-179	-174.5	63.8	173.2	-172.3	0	112.9	N136	K132-N136 PolarHBondContact O-N 2.97Å; K132-N136 VanDerWaalsContact O-N 3.12Å
133	A	97.1	Very high	97.3	Very high	61 Å²	61	45.3 Å²	45.3	50%	0.504	22%	0.223	S	C	.	.	H	α-helix	trans	-68.2	-48.3	-178.8	0	0	0	0	0	112.4	N131 L135 N136 M137	N131-A133 VanDerWaalsContact C-N 3.26Å; N131-A133 PolarHBondContact O-N 3.43Å; N131-A133 PolarHBondContact OD1-N 3.45Å; N131-A133 VanDerWaalsContact OD1-N 3.13Å; A133-L135 VanDerWaalsContact C-N 3.32Å; A133-L135 PolarHBondContact O-N 3.27Å; A133-N136 PolarHBondContact O-N 3.4Å; A133-M137 WeakPolarHBondContact O-CG 3.28Å; A133-M137 PolarHBondContact O-N 3.49Å
134	T	97.2	Very high	97.3	Very high	22 Å²	22	46.8 Å²	46.8	14%	0.135	23%	0.228	C	C	.	.	H	α-helix	trans	-67.2	-34.6	179.1	58.1	0	0	0	0	111.6	V128 R129 N131 M137 L138	V128-T134 HydrophobicContact CG1-CG2 4.03Å; R129-T134 WeakPolarHBondContact O-CG2 3.37Å; R129-T134 PolarHBondContact O-OG1 2.93Å; N131-T134 PolarHBondContact N-OG1 2.97Å; N131-T134 PolarHBondContact O-N 3.32Å; N131-T134 PolarHBondContact O-OG1 2.84Å; N131-T134 VanDerWaalsContact O-OG1 3.06Å; N131-T134 WeakPolarHBondContact OD1-CG2 3.45Å; N131-T134 PolarHBondContact OD1-N 3.12Å; N131-T134 PolarHBondContact OD1-OG1 2.88Å; N131-T134 VanDerWaalsContact OD1-OG1 3.12Å; T134-M137 PolarHBondContact O-N 2.97Å; T134-L138 WeakPolarHBondContact O-CB 3.38Å; T134-L138 VanDerWaalsContact O-CG 3.27Å; T134-L138 WeakPolarHBondContact O-CG 3.39Å; T134-L138 PolarHBondContact O-N 3.35Å
135	L	97.1	Very high	97.3	Very high	52 Å²	52	46.5 Å²	46.5	27%	0.272	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-45.2	174	-76.7	169.1	0	0	0	111.2	L130 N131 A133 M137 L138 R139 W147	L130-L135 HydrophobicContact CD2-CD2 3.85Å; L130-L135 HydrophobicContact CD2-CG 4.32Å; N131-L135 WeakPolarHBondContact O-CB 3.42Å; N131-L135 VanDerWaalsContact O-CG 3.3Å; N131-L135 WeakPolarHBondContact O-CG 3.28Å; N131-L135 PolarHBondContact O-N 3.48Å; A133-L135 VanDerWaalsContact C-N 3.32Å; A133-L135 PolarHBondContact O-N 3.27Å; L135-M137 VanDerWaalsContact C-N 3.32Å; L135-M137 PolarHBondContact O-N 3.38Å; L135-L138 PolarHBondContact O-N 3.42Å; L135-R139 WeakPolarHBondContact O-CG 3.45Å; L135-R139 PolarHBondContact O-N 2.9Å; L135-W147 HydrophobicContact CD2-CH2 3.78Å; L135-W147 HydrophobicContact CD2-CZ3 4.36Å
136	N	97.5	Very high	97.3	Very high	69 Å²	69	46.5 Å²	46.5	37%	0.369	23%	0.226	S	C	.	.	H	α-helix	trans	-62.4	-39.5	174.8	-73.1	-13.6	0	0	0	112	K132 A133 R139 I140	K132-N136 PolarHBondContact O-N 2.97Å; K132-N136 VanDerWaalsContact O-N 3.12Å; A133-N136 PolarHBondContact O-N 3.4Å; N136-R139 PolarHBondContact O-N 3.23Å; N136-I140 PolarHBondContact O-N 3.2Å
137	M	97.8	Very high	97.3	Very high	52 Å²	52	47 Å²	47	26%	0.256	23%	0.228	S	C	.	.	H	α-helix	trans	-64.6	-39.3	174	-71.3	-179.8	68.5	0	0	112.6	T113 L116 F117 A133 T134 L135 I140	T113-M137 HydrophobicContact CG2-CB 3.87Å; T113-M137 HydrophobicContact CG2-CE 3.76Å; T113-M137 HydrophobicContact CG2-CG 4.43Å; T113-M137 WeakPolarHBondContact CG2-O 3.44Å; L116-M137 HydrophobicContact CB-CE 4.04Å; L116-M137 HydrophobicContact CD1-CE 3.67Å; F117-M137 HydrophobicContact CE2-CB 3.76Å; F117-M137 HydrophobicContact CE2-CE 4.01Å; F117-M137 HydrophobicContact CZ-CB 3.76Å; F117-M137 HydrophobicContact CZ-CE 4.15Å; F117-M137 HydrophobicContact CZ-SD 4.41Å; A133-M137 WeakPolarHBondContact O-CG 3.28Å; A133-M137 PolarHBondContact O-N 3.49Å; T134-M137 PolarHBondContact O-N 2.97Å; L135-M137 VanDerWaalsContact C-N 3.32Å; L135-M137 PolarHBondContact O-N 3.38Å; M137-I140 PolarHBondContact O-N 3.04Å
138	L	97.6	Very high	97.3	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-64	-42.4	176.9	-75.9	166.1	0	0	0	111.5	V97 F117 L130 T134 L135 I140 I141 D142 W147	V97-L138 HydrophobicContact CB-CD2 4.46Å; V97-L138 HydrophobicContact CG1-CD2 3.9Å; V97-L138 HydrophobicContact CG2-CD2 3.65Å; F117-L138 HydrophobicContact CE2-CD2 4.35Å; F117-L138 HydrophobicContact CZ-CD2 4.37Å; F117-L138 HydrophobicContact CZ-CG 4.23Å; L130-L138 HydrophobicContact CD2-CD1 3.88Å; T134-L138 WeakPolarHBondContact O-CB 3.38Å; T134-L138 VanDerWaalsContact O-CG 3.27Å; T134-L138 WeakPolarHBondContact O-CG 3.39Å; T134-L138 PolarHBondContact O-N 3.35Å; L135-L138 PolarHBondContact O-N 3.42Å; L138-I140 PolarHBondContact O-N 3.32Å; L138-I141 HydrophobicContact CD2-CD1 4.23Å; L138-I141 CarbonylContact O-C 3.59Å; L138-I141 WeakPolarHBondContact O-CG1 3.4Å; L138-I141 PolarHBondContact O-N 3.02Å; L138-D142 PolarHBondContact O-N 3.23Å; L138-W147 HydrophobicContact CB-CZ2 4.36Å; L138-W147 HydrophobicContact CD1-CD2 4.11Å; L138-W147 HydrophobicContact CD1-CE3 4.12Å; L138-W147 HydrophobicContact CD1-CH2 4.37Å; L138-W147 HydrophobicContact CD1-CZ2 4.35Å; L138-W147 HydrophobicContact CD1-CZ3 4.25Å; L138-W147 HydrophobicContact CD2-CG 4.34Å
139	R	96.5	Very high	97.3	Very high	168 Å²	168	49.2 Å²	49.2	63%	0.634	24%	0.236	S	C	*	.	H	α-helix	trans	-55.5	-35	175.2	-70.7	172.6	-177.9	-174.9	-4.8	113	L135 N136	L135-R139 WeakPolarHBondContact O-CG 3.45Å; L135-R139 PolarHBondContact O-N 2.9Å; N136-R139 PolarHBondContact O-N 3.23Å
140	I	96.6	Very high	97.3	Very high	53 Å²	53	43.5 Å²	43.5	27%	0.272	22%	0.215	S	C	.	.	H	α-helix	trans	-68.6	-34.9	177.4	-64.6	168.6	0	0	0	112	R109 P110 N136 M137 L138	R109-I140 HydrophobicContact CG-CG2 4.18Å; P110-I140 HydrophobicContact CG-CG2 4.21Å; N136-I140 PolarHBondContact O-N 3.2Å; M137-I140 PolarHBondContact O-N 3.04Å; L138-I140 PolarHBondContact O-N 3.32Å
141	I	97.1	Very high	97.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-101.5	3.8	-176.3	60.8	171.6	0	0	0	113.2	P110 T113 M114 F117 L138 P143 Y144 V145	P110-I141 HydrophobicContact CB-CG2 4.09Å; P110-I141 WeakPolarHBondContact O-CG2 3.43Å; T113-I141 HydrophobicContact CG2-CD1 4.27Å; T113-I141 HydrophobicContact CG2-CG1 4.42Å; T113-I141 HydrophobicContact CG2-CG2 3.6Å; M114-I141 HydrophobicContact CG-CB 4.23Å; M114-I141 HydrophobicContact CG-CD1 4.25Å; M114-I141 HydrophobicContact CG-CG2 3.87Å; F117-I141 HydrophobicContact CD2-CD1 3.6Å; F117-I141 HydrophobicContact CE2-CD1 3.79Å; L138-I141 HydrophobicContact CD2-CD1 4.23Å; L138-I141 CarbonylContact O-C 3.59Å; L138-I141 WeakPolarHBondContact O-CG1 3.4Å; L138-I141 PolarHBondContact O-N 3.02Å; I141-P143 VanDerWaalsContact C-CD 3.43Å; I141-P143 VanDerWaalsContact C-N 3.31Å; I141-Y144 WeakPolarHBondContact O-CA 3.1Å; I141-Y144 WeakPolarHBondContact O-CB 3.3Å; I141-Y144 PolarHBondContact O-N 3.13Å; I141-V145 HydrophobicContact CB-CG1 4.48Å; I141-V145 HydrophobicContact CD1-CG1 3.89Å; I141-V145 HydrophobicContact CD1-CG2 4.1Å; I141-V145 HydrophobicContact CG1-CG1 4.3Å; I141-V145 HydrophobicContact CG1-CG2 3.93Å; I141-V145 PolarHBondContact O-N 2.96Å
142	D	95.9	Very high	97.3	Very high	25 Å²	25	42.7 Å²	42.7	13%	0.134	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-49.9	-44	-173.4	-149.4	62.5	0	0	0	112.8	L138 Y144 V145 W147 H230 F237 G238	L138-D142 PolarHBondContact O-N 3.23Å; D142-Y144 PolarHBondContact O-N 3.38Å; D142-V145 PolarHBondContact O-N 3.08Å; D142-W147 PolarHBondContact OD1-NE1 2.84Å; D142-H230 IonicContact OD2-CD2 2.84Å; D142-H230 PolarHBondContact OD2-CD2 2.93Å; D142-H230 IonicContact OD2-NE2 3.66Å; D142-F237 WeakPolarHBondContact O-CB 3.4Å; D142-F237 WeakPolarHBondContact O-CD2 3.45Å; D142-G238 PolarHBondContact O-N 3.32Å; D142-G238 WeakPolarHBondContact OD1-CA 3.38Å; D142-G238 WeakPolarHBondContact OD2-CA 3.45Å
143	P	96.5	Very high	97.3	Very high	45 Å²	45	41.7 Å²	41.7	29%	0.292	21%	0.21	S	C	.	.	G	3₁₀ helix	trans	-61.8	-18.5	176.6	-24.7	36.7	0	0	0	115.6	R101 I141 F237	R101-P143 VanDerWaalsContact CD-O 3.25Å; R101-P143 WeakPolarHBondContact CD-O 3.35Å; R101-P143 PolarHBondContact NE-O 3.33Å; I141-P143 VanDerWaalsContact C-CD 3.43Å; I141-P143 VanDerWaalsContact C-N 3.31Å; P143-F237 VanDerWaalsContact CA-CD2 3.48Å; P143-F237 HydrophobicContact CB-CE2 4.46Å; P143-F237 HydrophobicContact CG-CE2 4.4Å
144	Y	97	Very high	97.3	Very high	39 Å²	39	39.1 Å²	39.1	15%	0.153	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-105.2	-16.3	-173.3	-56.4	-85.3	0	0	0	113.6	I100 R101 V106 P110 M114 I141 D142	I100-Y144 WeakPolarHBondContact CG1-O 3.35Å; I100-Y144 PolarHBondContact N-O 3.45Å; R101-Y144 HydrophobicContact CB-CD1 4.09Å; R101-Y144 PolarHBondContact N-O 3.1Å; V106-Y144 HydrophobicContact CB-CE1 4.27Å; V106-Y144 HydrophobicContact CG1-CD1 4.36Å; V106-Y144 HydrophobicContact CG1-CE1 3.92Å; V106-Y144 HydrophobicContact CG2-CD1 4.14Å; V106-Y144 HydrophobicContact CG2-CE1 3.85Å; P110-Y144 HydrophobicContact CB-CD2 3.96Å; P110-Y144 HydrophobicContact CB-CE2 3.59Å; P110-Y144 HydrophobicContact CG-CE2 3.84Å; M114-Y144 HydrophobicContact CE-CD1 4.4Å; M114-Y144 HydrophobicContact CE-CG 4.16Å; M114-Y144 HydrophobicContact SD-CG 4.48Å; I141-Y144 WeakPolarHBondContact O-CA 3.1Å; I141-Y144 WeakPolarHBondContact O-CB 3.3Å; I141-Y144 PolarHBondContact O-N 3.13Å; D142-Y144 PolarHBondContact O-N 3.38Å
145	V	97.7	Very high	97.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	153.5	-173.6	-55.9	0	0	0	0	111.4	V97 V98 L119 I141 D142 F237 G238	V97-V145 HydrophobicContact CG1-CB 3.87Å; V97-V145 HydrophobicContact CG1-CG1 4.12Å; V97-V145 HydrophobicContact CG1-CG2 3.94Å; V98-V145 CarbonylContact O-C 3.58Å; V98-V145 WeakPolarHBondContact O-CA 3.4Å; V98-V145 WeakPolarHBondContact O-CB 3.26Å; L119-V145 HydrophobicContact CD1-CG1 4.04Å; I141-V145 HydrophobicContact CB-CG1 4.48Å; I141-V145 HydrophobicContact CD1-CG1 3.89Å; I141-V145 HydrophobicContact CD1-CG2 4.1Å; I141-V145 HydrophobicContact CG1-CG1 4.3Å; I141-V145 HydrophobicContact CG1-CG2 3.93Å; I141-V145 PolarHBondContact O-N 2.96Å; D142-V145 PolarHBondContact O-N 3.08Å; V145-F237 CarbonylContact O-C 3.6Å; V145-F237 WeakPolarHBondContact O-CA 3.34Å; V145-G238 PolarHBondContact O-N 3.34Å
146	A	97.9	Very high	97.4	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	130	164.8	0	0	0	0	0	107.4	V98 I100 D236 L247	V98-A146 PolarHBondContact N-O 3.31Å; V98-A146 PolarHBondContact O-N 3.2Å; I100-A146 HydrophobicContact CD1-CB 4.37Å; I100-A146 HydrophobicContact CG2-CB 3.78Å; A146-D236 WeakPolarHBondContact CB-O 3.41Å; A146-L247 HydrophobicContact CB-CD2 4.14Å
147	W	98.1	Very high	97.4	Very high	14 Å²	14	38.9 Å²	38.9	5%	0.053	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	162.1	-178.8	66.4	-80	0	0	0	112.2	A95 F96 V97 L130 L135 L138 D142 Y149 G238 N239 R240	A95-W147 HydrophobicContact CB-CE3 3.95Å; A95-W147 HydrophobicContact CB-CZ3 4.42Å; F96-W147 VanDerWaalsContact O-CA 3.28Å; F96-W147 WeakPolarHBondContact O-CA 3.39Å; V97-W147 HydrophobicContact CB-CB 4.16Å; V97-W147 HydrophobicContact CG1-CB 4.13Å; V97-W147 HydrophobicContact CG2-CB 3.91Å; L130-W147 HydrophobicContact CD1-CZ3 4.44Å; L130-W147 HydrophobicContact CD2-CZ3 4.11Å; L135-W147 HydrophobicContact CD2-CH2 3.78Å; L135-W147 HydrophobicContact CD2-CZ3 4.36Å; L138-W147 HydrophobicContact CB-CZ2 4.36Å; L138-W147 HydrophobicContact CD1-CD2 4.11Å; L138-W147 HydrophobicContact CD1-CE3 4.12Å; L138-W147 HydrophobicContact CD1-CH2 4.37Å; L138-W147 HydrophobicContact CD1-CZ2 4.35Å; L138-W147 HydrophobicContact CD1-CZ3 4.25Å; L138-W147 HydrophobicContact CD2-CG 4.34Å; D142-W147 PolarHBondContact OD1-NE1 2.84Å; W147-Y149 HydrophobicContact CZ3-CE1 4.12Å; W147-G238 PolarHBondContact N-O 3.13Å; W147-N239 HydrophobicContact CD2-CB 4.23Å; W147-N239 HydrophobicContact CH2-CB 3.97Å; W147-N239 WeakPolarHBondContact CH2-ND2 3.3Å; W147-N239 HydrophobicContact CZ2-CB 3.56Å; W147-N239 HydrophobicContact CZ3-CB 4.46Å; W147-N239 WeakPolarHBondContact O-CA 3.43Å; W147-N239 PolarHBondContact O-OD1 2.93Å; W147-R240 WeakPolarHBondContact O-CG 3.41Å; W147-R240 PolarHBondContact O-N 3.29Å
148	G	98.1	Very high	97.4	Very high	0 Å²	0	36.4 Å²	36.4	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	177.2	-164	178.3	0	0	0	0	0	111.3	A95 F96 P150 E241	A95-G148 CarbonylContact C-O 3.52Å; A95-G148 VanDerWaalsContact CA-O 3.25Å; A95-G148 WeakPolarHBondContact CA-O 3.11Å; F96-G148 PolarHBondContact N-O 3.47Å; F96-G148 PolarHBondContact O-N 2.93Å; G148-P150 WeakPolarHBondContact O-CD 3.28Å; G148-E241 CarbonylContact C-O 3.59Å; G148-E241 VanDerWaalsContact CA-O 3.29Å; G148-E241 WeakPolarHBondContact CA-O 3.36Å
149	Y	98.1	Very high	97.4	Very high	59 Å²	59	36.5 Å²	36.5	23%	0.231	17%	0.167	C	C	.	.			trans	-99.8	107.4	-169.5	-40.7	-49.8	0	0	0	110.9	P92 L130 W147 N239 E241 I244 N245	P92-Y149 HydrophobicContact CB-CD1 3.56Å; P92-Y149 HydrophobicContact CB-CD2 4.29Å; P92-Y149 HydrophobicContact CB-CE1 3.96Å; P92-Y149 HydrophobicContact CB-CG 3.76Å; P92-Y149 HydrophobicContact CG-CD1 3.39Å; P92-Y149 HydrophobicContact CG-CD2 3.84Å; P92-Y149 HydrophobicContact CG-CE1 3.26Å; P92-Y149 HydrophobicContact CG-CE2 3.7Å; P92-Y149 HydrophobicContact CG-CG 3.7Å; P92-Y149 VanDerWaalsContact CG-CZ 3.42Å; L130-Y149 HydrophobicContact CD1-CD1 4.04Å; L130-Y149 HydrophobicContact CD1-CE1 3.74Å; W147-Y149 HydrophobicContact CZ3-CE1 4.12Å; Y149-N239 PolarHBondContact OH-ND2 3.48Å; Y149-N239 VanDerWaalsContact OH-ND2 3.12Å; Y149-E241 HydrophobicContact CD2-CB 3.96Å; Y149-E241 HydrophobicContact CE2-CB 3.69Å; Y149-E241 HydrophobicContact CE2-CG 3.83Å; Y149-E241 PolarHBondContact N-O 2.9Å; Y149-I244 WeakPolarHBondContact O-CG2 3.13Å; Y149-N245 PolarHBondContact O-ND2 3.48Å
150	P	98.1	Very high	97.4	Very high	10 Å²	10	34.7 Å²	34.7	7%	0.065	16%	0.161	C	C	.	.			trans	-75	134.3	-177.6	32.5	-35.8	0	0	0	110.9	L94 F96 F127 G148 I154 V155	L94-P150 HydrophobicContact CD2-CG 3.69Å; L94-P150 HydrophobicContact CG-CG 3.91Å; F96-P150 HydrophobicContact CB-CB 4.16Å; F96-P150 HydrophobicContact CB-CG 4.03Å; F127-P150 HydrophobicContact CE1-CG 4.36Å; G148-P150 WeakPolarHBondContact O-CD 3.28Å; P150-I154 HydrophobicContact CB-CG2 4.3Å; P150-V155 HydrophobicContact CB-CG2 3.9Å; P150-V155 HydrophobicContact CG-CG2 3.98Å
151	S	97.2	Very high	97.4	Very high	43 Å²	43	38.6 Å²	38.6	30%	0.301	18%	0.176	S	C	.	.			trans	-71.1	156.6	169.2	62.4	0	0	0	0	110.9	K153 I154 V155 N245	S151-K153 PolarHBondContact O-N 3.05Å; S151-K153 VanDerWaalsContact O-N 3.12Å; S151-I154 PolarHBondContact O-N 3.29Å; S151-V155 PolarHBondContact O-N 3.33Å; S151-N245 WeakPolarHBondContact CB-OD1 3.32Å; S151-N245 PolarHBondContact N-OD1 3.46Å; S151-N245 PolarHBondContact OG-OD1 2.9Å
152	L	97.1	Very high	97.4	Very high	34 Å²	34	40.8 Å²	40.8	18%	0.178	18%	0.184	C	C	.	.	H	α-helix	trans	-50.6	-39.4	175.2	178	63.6	0	0	0	112.4	Y66 I154 V155 R156 V195 Y199	Y66-L152 HydrophobicContact CD1-CD2 4.39Å; Y66-L152 HydrophobicContact CD2-CD1 4.27Å; Y66-L152 HydrophobicContact CD2-CD2 3.33Å; Y66-L152 HydrophobicContact CD2-CG 4.45Å; Y66-L152 HydrophobicContact CE1-CD1 4.46Å; Y66-L152 HydrophobicContact CE2-CD1 3.82Å; Y66-L152 HydrophobicContact CE2-CD2 3.76Å; Y66-L152 HydrophobicContact CE2-CG 4.45Å; Y66-L152 HydrophobicContact CG-CD2 3.7Å; L152-I154 PolarHBondContact O-N 3.12Å; L152-V155 PolarHBondContact O-N 2.71Å; L152-R156 VanDerWaalsContact O-CB 3.26Å; L152-R156 WeakPolarHBondContact O-CB 3.44Å; L152-R156 PolarHBondContact O-N 3.26Å; L152-V195 HydrophobicContact CD1-CG1 4.09Å; L152-Y199 HydrophobicContact CB-CD2 4.22Å; L152-Y199 HydrophobicContact CB-CE1 4.19Å; L152-Y199 HydrophobicContact CB-CE2 3.87Å; L152-Y199 HydrophobicContact CD1-CD1 3.87Å; L152-Y199 HydrophobicContact CD1-CD2 4.3Å; L152-Y199 HydrophobicContact CD1-CE1 4.29Å; L152-Y199 HydrophobicContact CD1-CG 3.87Å
153	K	97.4	Very high	97.4	Very high	130 Å²	130	40 Å²	40	57%	0.565	18%	0.182	S	C	*	.	H	α-helix	trans	-58.6	-46.3	177.1	-179.5	174	-179.1	170.8	0	111.9	S151 Q157	S151-K153 PolarHBondContact O-N 3.05Å; S151-K153 VanDerWaalsContact O-N 3.12Å; K153-Q157 WeakPolarHBondContact O-CB 3.4Å; K153-Q157 VanDerWaalsContact O-CG 3.28Å; K153-Q157 WeakPolarHBondContact O-CG 2.98Å; K153-Q157 PolarHBondContact O-N 2.99Å
154	I	97.8	Very high	97.4	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.031	18%	0.179	C	C	.	.	H	α-helix	trans	-71.3	-42.3	-178.9	-68.9	-62.8	0	0	0	111.4	P150 S151 L152 R156 Q157 L158 N245 L248 K249 I252	P150-I154 HydrophobicContact CB-CG2 4.3Å; S151-I154 PolarHBondContact O-N 3.29Å; L152-I154 PolarHBondContact O-N 3.12Å; I154-R156 VanDerWaalsContact C-N 3.29Å; I154-R156 PolarHBondContact O-N 3.16Å; I154-Q157 PolarHBondContact O-N 3.29Å; I154-L158 HydrophobicContact CG2-CD1 3.78Å; I154-L158 HydrophobicContact CG2-CG 4.3Å; I154-L158 WeakPolarHBondContact O-CB 3.44Å; I154-L158 WeakPolarHBondContact O-CG 3.32Å; I154-L158 PolarHBondContact O-N 3.27Å; I154-N245 HydrophobicContact CG1-CB 4.03Å; I154-N245 VanDerWaalsContact CG1-OD1 3.25Å; I154-N245 WeakPolarHBondContact CG1-OD1 3.41Å; I154-L248 HydrophobicContact CD1-CB 4.25Å; I154-L248 HydrophobicContact CG2-CB 3.79Å; I154-L248 HydrophobicContact CG2-CD1 3.46Å; I154-L248 VanDerWaalsContact CG2-CD1 3.46Å; I154-L248 HydrophobicContact CG2-CG 4.25Å; I154-K249 HydrophobicContact CD1-CB 4.32Å; I154-I252 HydrophobicContact CD1-CD1 4.19Å; I154-I252 HydrophobicContact CG2-CD1 4.26Å
155	V	98	Very high	97.4	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-56	-48.6	174.8	179	0	0	0	0	110.2	L94 F127 P150 S151 L152 L158 I159 V195 I198 Y199	L94-V155 HydrophobicContact CD2-CG2 4.16Å; F127-V155 HydrophobicContact CE1-CB 4.41Å; F127-V155 HydrophobicContact CE1-CG1 4.2Å; F127-V155 HydrophobicContact CE1-CG2 3.91Å; F127-V155 HydrophobicContact CZ-CB 4.34Å; F127-V155 HydrophobicContact CZ-CG1 3.91Å; F127-V155 HydrophobicContact CZ-CG2 4.33Å; P150-V155 HydrophobicContact CB-CG2 3.9Å; P150-V155 HydrophobicContact CG-CG2 3.98Å; S151-V155 PolarHBondContact O-N 3.33Å; L152-V155 PolarHBondContact O-N 2.71Å; V155-L158 PolarHBondContact O-N 2.9Å; V155-I159 HydrophobicContact CG1-CD1 3.87Å; V155-I159 WeakPolarHBondContact O-CG1 3.4Å; V155-I159 PolarHBondContact O-N 2.8Å; V155-I159 VanDerWaalsContact O-N 3.12Å; V155-V195 HydrophobicContact CG1-CG1 4.28Å; V155-I198 HydrophobicContact CG1-CB 4.47Å; V155-I198 HydrophobicContact CG1-CG2 3.96Å; V155-Y199 HydrophobicContact CG2-CD2 4.07Å
156	R	97.4	Very high	97.2	Very high	71 Å²	71	44 Å²	44	27%	0.268	20%	0.195	S	C	.	.	H	α-helix	trans	-59.3	-51	176.9	-176.9	174.2	-77.5	159.1	-2.6	111.8	L152 I154 L158 I159 Y160 E192 V195	L152-R156 VanDerWaalsContact O-CB 3.26Å; L152-R156 WeakPolarHBondContact O-CB 3.44Å; L152-R156 PolarHBondContact O-N 3.26Å; I154-R156 VanDerWaalsContact C-N 3.29Å; I154-R156 PolarHBondContact O-N 3.16Å; R156-L158 PolarHBondContact O-N 3.14Å; R156-I159 PolarHBondContact O-N 3.36Å; R156-Y160 HydrophobicContact CG-CD2 3.41Å; R156-Y160 VanDerWaalsContact CG-CD2 3.41Å; R156-Y160 HydrophobicContact CG-CE2 3.44Å; R156-Y160 VanDerWaalsContact CG-CE2 3.44Å; R156-Y160 VanDerWaalsContact O-CD2 3.23Å; R156-Y160 WeakPolarHBondContact O-CD2 3.43Å; R156-Y160 PolarHBondContact O-N 2.81Å; R156-E192 IonicContact CZ-OE2 3.61Å; R156-E192 IonicContact NE-OE1 3.53Å; R156-E192 PolarHBondContact NE-OE1 3.45Å; R156-E192 IonicContact NE-OE2 3.48Å; R156-E192 IonicContact NH2-OE1 3.42Å; R156-E192 IonicContact NH2-OE2 3.65Å; R156-E192 PolarHBondContact NH2-OE2 2.8Å; R156-V195 HydrophobicContact CB-CG1 4.42Å
157	Q	97.6	Very high	96.9	Very high	68 Å²	68	46.1 Å²	46.1	32%	0.318	20%	0.204	S	C	.	.	H	α-helix	trans	-61.6	-41	-179.4	-77.4	-179	-24.6	0	0	113	K153 I154 K161 I252	K153-Q157 WeakPolarHBondContact O-CB 3.4Å; K153-Q157 VanDerWaalsContact O-CG 3.28Å; K153-Q157 WeakPolarHBondContact O-CG 2.98Å; K153-Q157 PolarHBondContact O-N 2.99Å; I154-Q157 PolarHBondContact O-N 3.29Å; Q157-K161 VanDerWaalsContact O-CB 3.31Å; Q157-K161 WeakPolarHBondContact O-CB 3.4Å; Q157-K161 PolarHBondContact O-N 2.93Å; Q157-I252 HydrophobicContact CB-CD1 4.26Å; Q157-I252 HydrophobicContact CB-CG2 4.41Å
158	L	97.7	Very high	96.5	Very high	0 Å²	0	53.1 Å²	53.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.9	-49.4	176.1	-79.2	164.9	0	0	0	111.3	F96 F127 I154 V155 R156 R162 G163 F215 L217 L248 I252	F96-L158 HydrophobicContact CD1-CD1 4.45Å; F96-L158 HydrophobicContact CD2-CD1 3.84Å; F96-L158 HydrophobicContact CE1-CD1 4.14Å; F96-L158 HydrophobicContact CE1-CD2 4.48Å; F96-L158 HydrophobicContact CE2-CD1 3.5Å; F96-L158 VanDerWaalsContact CE2-CD1 3.5Å; F96-L158 HydrophobicContact CE2-CD2 4.43Å; F96-L158 HydrophobicContact CG-CD1 4.27Å; F96-L158 HydrophobicContact CZ-CD1 3.64Å; F96-L158 HydrophobicContact CZ-CD2 3.9Å; F96-L158 HydrophobicContact CZ-CG 4.43Å; F127-L158 HydrophobicContact CE1-CD1 4.21Å; F127-L158 HydrophobicContact CZ-CB 4.36Å; F127-L158 HydrophobicContact CZ-CD1 3.85Å; I154-L158 HydrophobicContact CG2-CD1 3.78Å; I154-L158 HydrophobicContact CG2-CG 4.3Å; I154-L158 WeakPolarHBondContact O-CB 3.44Å; I154-L158 WeakPolarHBondContact O-CG 3.32Å; I154-L158 PolarHBondContact O-N 3.27Å; V155-L158 PolarHBondContact O-N 2.9Å; R156-L158 PolarHBondContact O-N 3.14Å; L158-R162 CarbonylContact O-C 3.46Å; L158-R162 VanDerWaalsContact O-C 3.25Å; L158-R162 VanDerWaalsContact O-CA 3.3Å; L158-R162 WeakPolarHBondContact O-CA 3.5Å; L158-R162 PolarHBondContact O-N 2.86Å; L158-G163 PolarHBondContact O-N 3.39Å; L158-F215 HydrophobicContact CB-CD1 4.32Å; L158-F215 HydrophobicContact CB-CE1 4.02Å; L158-F215 HydrophobicContact CB-CZ 4.4Å; L158-F215 HydrophobicContact CD2-CD1 4.29Å; L158-F215 HydrophobicContact CD2-CG 4.45Å; L158-F215 WeakPolarHBondContact O-CE1 3.38Å; L158-L217 HydrophobicContact CD2-CD2 3.67Å; L158-L248 HydrophobicContact CD1-CD1 4.43Å; L158-I252 HydrophobicContact CD2-CD1 3.76Å; L158-I252 HydrophobicContact CD2-CG1 3.64Å; L158-I252 HydrophobicContact CG-CD1 3.67Å; L158-I252 HydrophobicContact CG-CG1 4.14Å
159	I	97.4	Very high	96.2	Very high	2 Å²	2	55.6 Å²	55.6	1%	0.01	26%	0.262	C	S	.	.	H	α-helix	trans	-67.9	-41.8	-177.4	-66.3	170.6	0	0	0	110.8	F127 V155 R156 G163 L174 V191 L194 V195 I198 F215	F127-I159 HydrophobicContact CE2-CD1 4.37Å; F127-I159 HydrophobicContact CE2-CG1 4.27Å; V155-I159 HydrophobicContact CG1-CD1 3.87Å; V155-I159 WeakPolarHBondContact O-CG1 3.4Å; V155-I159 PolarHBondContact O-N 2.8Å; V155-I159 VanDerWaalsContact O-N 3.12Å; R156-I159 PolarHBondContact O-N 3.36Å; I159-G163 WeakPolarHBondContact O-CA 3.32Å; I159-G163 PolarHBondContact O-N 2.96Å; I159-G163 VanDerWaalsContact O-N 3.09Å; I159-L174 HydrophobicContact CG2-CD2 3.51Å; I159-V191 HydrophobicContact CG2-CG1 3.67Å; I159-L194 HydrophobicContact CG2-CD2 4.38Å; I159-V195 HydrophobicContact CB-CG2 4.22Å; I159-V195 HydrophobicContact CD1-CB 4.34Å; I159-V195 HydrophobicContact CD1-CG2 3.71Å; I159-V195 HydrophobicContact CG2-CG2 4.19Å; I159-I198 HydrophobicContact CD1-CD1 3.73Å; I159-F215 HydrophobicContact CG1-CZ 4.21Å
160	Y	97.2	Very high	96	Very high	130 Å²	130	56.2 Å²	56.2	51%	0.51	27%	0.272	S	S	.	.	H	α-helix	trans	-71.1	-45	179	-81.2	-66	0	0	0	113.7	R156 V191 E192	R156-Y160 HydrophobicContact CG-CD2 3.41Å; R156-Y160 VanDerWaalsContact CG-CD2 3.41Å; R156-Y160 HydrophobicContact CG-CE2 3.44Å; R156-Y160 VanDerWaalsContact CG-CE2 3.44Å; R156-Y160 VanDerWaalsContact O-CD2 3.23Å; R156-Y160 WeakPolarHBondContact O-CD2 3.43Å; R156-Y160 PolarHBondContact O-N 2.81Å; Y160-V191 HydrophobicContact CD1-CG1 4.17Å; Y160-V191 HydrophobicContact CE1-CB 4.27Å; Y160-V191 HydrophobicContact CE1-CG1 3.7Å; Y160-V191 HydrophobicContact CE2-CG1 4.31Å; Y160-E192 WeakPolarHBondContact CE2-OE1 3.41Å; Y160-E192 PolarHBondContact OH-OE1 2.8Å
161	K	96.7	Very high	95.9	Very high	134 Å²	134	60.1 Å²	60.1	58%	0.583	29%	0.286	S	S	*	.	H	α-helix	trans	-87.5	-35.7	-174	-171.1	177.1	178.1	-172.2	0	113.2	Q157 I252	Q157-K161 VanDerWaalsContact O-CB 3.31Å; Q157-K161 WeakPolarHBondContact O-CB 3.4Å; Q157-K161 PolarHBondContact O-N 2.93Å; K161-I252 HydrophobicContact CB-CG2 4.32Å; K161-I252 HydrophobicContact CD-CG2 3.64Å; K161-I252 WeakPolarHBondContact CD-O 3.29Å; K161-I252 WeakPolarHBondContact CE-O 3.29Å; K161-I252 HydrophobicContact CG-CG2 4.49Å; K161-I252 PolarHBondContact NZ-O 3.28Å; K161-I252 PolarHBondContact NZ-OXT 3.01Å
162	R	96.5	Very high	95.8	Very high	46 Å²	46	60.9 Å²	60.9	17%	0.174	29%	0.286	C	S	.	.	H	α-helix	trans	-125.5	9.9	-172.2	-62.3	-170.7	177.6	-103.4	1.7	113.2	L158 F164 F215 K216 S218 M251 I252	L158-R162 CarbonylContact O-C 3.46Å; L158-R162 VanDerWaalsContact O-C 3.25Å; L158-R162 VanDerWaalsContact O-CA 3.3Å; L158-R162 WeakPolarHBondContact O-CA 3.5Å; L158-R162 PolarHBondContact O-N 2.86Å; R162-F164 PolarHBondContact O-N 3.29Å; R162-F215 HydrophobicContact CB-CD1 3.93Å; R162-F215 VanDerWaalsContact O-CD1 3.31Å; R162-F215 WeakPolarHBondContact O-CD1 3.21Å; R162-K216 PolarHBondContact NH1-O 3.12Å; R162-S218 PolarHBondContact NH2-OG 3.13Å; R162-M251 PolarHBondContact NH2-O 2.92Å; R162-M251 VanDerWaalsContact NH2-O 3.15Å; R162-I252 PolarHBondContact NE-O 3.22Å; R162-I252 PolarHBondContact NH2-O 3.21Å
163	G	95.8	Very high	95.8	Very high	8 Å²	8	63 Å²	63	8%	0.082	30%	0.302	C	S	.	.			trans	-71.4	114.2	175.8	0	0	0	0	0	111.4	L158 I159 L174	L158-G163 PolarHBondContact O-N 3.39Å; I159-G163 WeakPolarHBondContact O-CA 3.32Å; I159-G163 PolarHBondContact O-N 2.96Å; I159-G163 VanDerWaalsContact O-N 3.09Å; G163-L174 WeakPolarHBondContact O-CB 3.42Å; G163-L174 PolarHBondContact O-N 2.91Å
164	F	97.4	Very high	95.7	Very high	53 Å²	53	58.1 Å²	58.1	23%	0.232	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	153.5	167.6	-75.7	-106.1	0	0	0	107.7	R162 R171 L172 P173 W213	R162-F164 PolarHBondContact O-N 3.29Å; F164-R171 HydrophobicContact CB-CG 3.81Å; F164-R171 HydrophobicContact CD1-CG 3.72Å; F164-R171 HydrophobicContact CG-CG 4.04Å; F164-L172 CarbonylContact C-O 3.53Å; F164-L172 VanDerWaalsContact CA-O 3.29Å; F164-L172 WeakPolarHBondContact CA-O 3.48Å; F164-L172 WeakPolarHBondContact CB-O 3.46Å; F164-L172 WeakPolarHBondContact CD1-O 3.36Å; F164-P173 HydrophobicContact CD1-CB 4.47Å; F164-P173 HydrophobicContact CE1-CB 4.19Å; F164-W213 HydrophobicContact CB-CB 3.95Å; F164-W213 WeakPolarHBondContact O-CB 3.28Å; F164-W213 PolarHBondContact O-N 2.94Å
165	C	96.2	Very high	95.6	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	156.1	178	66.2	0	0	0	0	111.5	L172 L174 F211	C165-L172 PolarHBondContact N-O 3.47Å; C165-L172 PolarHBondContact O-N 3.19Å; C165-L172 VanDerWaalsContact O-N 3.1Å; C165-L174 HydrophobicContact CB-CD1 4.2Å; C165-F211 CarbonylContact C-O 3.55Å; C165-F211 VanDerWaalsContact CA-O 3.32Å; C165-F211 WeakPolarHBondContact CA-O 3.38Å; C165-F211 HydrophobicContact CB-CD1 4.23Å; C165-F211 HydrophobicContact CB-CD2 4.04Å; C165-F211 HydrophobicContact CB-CE1 3.67Å; C165-F211 HydrophobicContact CB-CE2 3.47Å; C165-F211 VanDerWaalsContact CB-CE2 3.47Å; C165-F211 HydrophobicContact CB-CG 4.41Å; C165-F211 HydrophobicContact CB-CZ 3.27Å
166	K	94.1	Very high	95.4	Very high	116 Å²	116	63.5 Å²	63.5	50%	0.504	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.4	170	-177.3	177.9	178.3	-176.1	0	108.7	F211 W213	K166-F211 PolarHBondContact N-O 3.06Å; K166-W213 HydrophobicContact CB-CE3 3.81Å; K166-W213 HydrophobicContact CB-CZ3 4.16Å; K166-W213 HydrophobicContact CG-CE3 4.14Å; K166-W213 HydrophobicContact CG-CZ3 3.98Å
167	Y	91.6	Very high	95.3	Very high	45 Å²	45	65.8 Å²	65.8	18%	0.176	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	119.5	179.3	-163.9	-103.4	0	0	0	109.7	G169 T170 L172 L178 H181	Y167-G169 PolarHBondContact O-N 3.29Å; Y167-G169 VanDerWaalsContact O-N 3.12Å; Y167-T170 PolarHBondContact N-O 3.15Å; Y167-T170 PolarHBondContact O-N 2.93Å; Y167-T170 PolarHBondContact O-OG1 2.9Å; Y167-L172 HydrophobicContact CD1-CD1 4.02Å; Y167-L172 HydrophobicContact CG-CD1 4.32Å; Y167-L178 HydrophobicContact CD1-CD2 4.14Å; Y167-L178 HydrophobicContact CD2-CD2 4.02Å; Y167-L178 HydrophobicContact CE1-CD2 4.24Å; Y167-L178 HydrophobicContact CE2-CD2 4.14Å; Y167-L178 HydrophobicContact CG-CD2 4.05Å; Y167-H181 AromaticContact CE2-ND1 3.73Å; Y167-H181 AromaticContact CZ-ND1 3.87Å; Y167-H181 PolarHBondContact OH-CE1 3.12Å; Y167-H181 PolarHBondContact OH-ND1 2.66Å; Y167-H181 VanDerWaalsContact OH-ND1 3.1Å
168	H	90	Very high	95.2	Very high	160 Å²	160	64 Å²	64	74%	0.741	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	44	42.8	-172.1	-62.2	-72.2	0	0	0	114.5	T170	H168-T170 PolarHBondContact O-N 2.8Å
169	G	90.3	Very high	95.1	Very high	52 Å²	52	64 Å²	64	54%	0.536	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.8	-10.9	-179.4	0	0	0	0	0	115.3	Y167	Y167-G169 PolarHBondContact O-N 3.29Å; Y167-G169 VanDerWaalsContact O-N 3.12Å
170	T	94.6	Very high	94.9	Very high	73 Å²	73	67.7 Å²	67.7	45%	0.448	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	154.5	178.7	69.8	0	0	0	0	112	Y167 H168	Y167-T170 PolarHBondContact N-O 3.15Å; Y167-T170 PolarHBondContact O-N 2.93Å; Y167-T170 PolarHBondContact O-OG1 2.9Å; H168-T170 PolarHBondContact O-N 2.8Å
171	R	95.9	Very high	94.8	Very high	91 Å²	91	68 Å²	68	34%	0.343	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	104.8	176.2	-179	-180	175.5	-110	0.9	109.1	F164 W213	F164-R171 HydrophobicContact CB-CG 3.81Å; F164-R171 HydrophobicContact CD1-CG 3.72Å; F164-R171 HydrophobicContact CG-CG 4.04Å; R171-W213 HydrophobicContact CB-CD2 3.77Å; R171-W213 HydrophobicContact CB-CE3 3.65Å; R171-W213 HydrophobicContact CB-CG 4.42Å; R171-W213 HydrophobicContact CB-CH2 4.05Å; R171-W213 HydrophobicContact CB-CZ2 4.17Å; R171-W213 HydrophobicContact CB-CZ3 3.8Å; R171-W213 HydrophobicContact CG-CB 4.35Å; R171-W213 HydrophobicContact CG-CD2 3.74Å; R171-W213 HydrophobicContact CG-CE3 4.03Å; R171-W213 HydrophobicContact CG-CG 3.85Å
172	L	96.4	Very high	94.7	Very high	60 Å²	60	66.9 Å²	66.9	31%	0.314	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	148	178.9	-62.4	-179.1	0	0	0	111.3	F164 C165 Y167 L178	F164-L172 CarbonylContact C-O 3.53Å; F164-L172 VanDerWaalsContact CA-O 3.29Å; F164-L172 WeakPolarHBondContact CA-O 3.48Å; F164-L172 WeakPolarHBondContact CB-O 3.46Å; F164-L172 WeakPolarHBondContact CD1-O 3.36Å; C165-L172 PolarHBondContact N-O 3.47Å; C165-L172 PolarHBondContact O-N 3.19Å; C165-L172 VanDerWaalsContact O-N 3.1Å; Y167-L172 HydrophobicContact CD1-CD1 4.02Å; Y167-L172 HydrophobicContact CG-CD1 4.32Å; L172-L178 HydrophobicContact CB-CD1 4.1Å; L172-L178 HydrophobicContact CD1-CD1 4.2Å
173	P	96.1	Very high	94.7	Very high	77 Å²	77	65 Å²	65	50%	0.5	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	145.1	171.9	26.9	-34.3	0	0	0	110.3	F164 T175	F164-P173 HydrophobicContact CD1-CB 4.47Å; F164-P173 HydrophobicContact CE1-CB 4.19Å; P173-T175 PolarHBondContact O-N 2.89Å
174	L	95.9	Very high	94.6	Very high	28 Å²	28	65.9 Å²	65.9	15%	0.147	34%	0.34	C	S	.	.			trans	-69.4	122.9	-177.7	-172.3	70.4	0	0	0	110.9	I159 G163 C165 I179 V191 L194 F211	I159-L174 HydrophobicContact CG2-CD2 3.51Å; G163-L174 WeakPolarHBondContact O-CB 3.42Å; G163-L174 PolarHBondContact O-N 2.91Å; C165-L174 HydrophobicContact CB-CD1 4.2Å; L174-I179 HydrophobicContact CD1-CD1 3.79Å; L174-I179 HydrophobicContact CD1-CG1 3.66Å; L174-I179 HydrophobicContact CD2-CD1 4.23Å; L174-I179 HydrophobicContact CG-CD1 3.94Å; L174-I179 HydrophobicContact CG-CG1 4.31Å; L174-V191 HydrophobicContact CD2-CG1 4.33Å; L174-V191 HydrophobicContact CD2-CG2 3.9Å; L174-V191 HydrophobicContact CG-CG2 4.25Å; L174-L194 HydrophobicContact CD1-CD2 4.18Å; L174-L194 HydrophobicContact CD2-CD2 3.96Å; L174-F211 HydrophobicContact CD1-CD1 4.45Å; L174-F211 HydrophobicContact CD1-CE1 3.49Å; L174-F211 VanDerWaalsContact CD1-CE1 3.49Å; L174-F211 HydrophobicContact CD1-CZ 4.09Å
175	T	95.1	Very high	94.5	Very high	57 Å²	57	70.6 Å²	70.6	35%	0.35	36%	0.362	S	S	.	.			trans	-129.2	151.6	172.5	67.5	0	0	0	0	110.2	P173 E177 L178 I179	P173-T175 PolarHBondContact O-N 2.89Å; T175-E177 PolarHBondContact O-N 3.1Å; T175-L178 PolarHBondContact O-N 2.86Å; T175-L178 VanDerWaalsContact O-N 3.15Å; T175-L178 WeakPolarHBondContact OG1-CD1 3.24Å; T175-L178 VanDerWaalsContact OG1-CG 3.28Å; T175-L178 WeakPolarHBondContact OG1-CG 3.35Å; T175-L178 PolarHBondContact OG1-N 3.47Å; T175-I179 WeakPolarHBondContact O-CG1 3.24Å; T175-I179 PolarHBondContact O-N 3.34Å
176	N	94.8	Very high	94.5	Very high	63 Å²	63	72.6 Å²	72.6	34%	0.337	37%	0.373	S	S	.	.	H	α-helix	trans	-59.2	-35.6	177.8	-71.2	-28.9	0	0	0	112	L178 I179 Q180 C190 V191	N176-L178 PolarHBondContact O-N 3.21Å; N176-I179 PolarHBondContact O-N 3.01Å; N176-Q180 WeakPolarHBondContact O-CB 3.25Å; N176-Q180 PolarHBondContact O-N 3.45Å; N176-C190 VanDerWaalsContact OD1-CA 3.29Å; N176-C190 WeakPolarHBondContact OD1-CA 3.35Å; N176-C190 WeakPolarHBondContact OD1-CB 3.15Å; N176-V191 WeakPolarHBondContact OD1-CG2 3.25Å; N176-V191 PolarHBondContact OD1-N 3.3Å
177	E	93.7	Very high	94.5	Very high	119 Å²	119	68.8 Å²	68.8	56%	0.556	37%	0.367	S	S	*	.	H	α-helix	trans	-61.4	-43	176.7	-63.1	-175.5	161	0	0	111.4	R44 T175 Q180 H181	R44-E177 IonicContact NH2-OE1 2.67Å; R44-E177 PolarHBondContact NH2-OE1 2.87Å; T175-E177 PolarHBondContact O-N 3.1Å; E177-Q180 PolarHBondContact O-N 2.7Å; E177-H181 WeakPolarHBondContact O-CB 3.46Å; E177-H181 PolarHBondContact O-N 2.96Å
178	L	95.3	Very high	94.7	Very high	30 Å²	30	66.9 Å²	66.9	16%	0.157	36%	0.36	C	S	.	.	H	α-helix	trans	-69.5	-38	177.7	-70	171.8	0	0	0	112.5	Y167 L172 T175 N176 K182 F211	Y167-L178 HydrophobicContact CD1-CD2 4.14Å; Y167-L178 HydrophobicContact CD2-CD2 4.02Å; Y167-L178 HydrophobicContact CE1-CD2 4.24Å; Y167-L178 HydrophobicContact CE2-CD2 4.14Å; Y167-L178 HydrophobicContact CG-CD2 4.05Å; L172-L178 HydrophobicContact CB-CD1 4.1Å; L172-L178 HydrophobicContact CD1-CD1 4.2Å; T175-L178 PolarHBondContact O-N 2.86Å; T175-L178 VanDerWaalsContact O-N 3.15Å; T175-L178 WeakPolarHBondContact OG1-CD1 3.24Å; T175-L178 VanDerWaalsContact OG1-CG 3.28Å; T175-L178 WeakPolarHBondContact OG1-CG 3.35Å; T175-L178 PolarHBondContact OG1-N 3.47Å; N176-L178 PolarHBondContact O-N 3.21Å; L178-K182 WeakPolarHBondContact O-CB 3.42Å; L178-K182 PolarHBondContact O-N 3.4Å; L178-F211 HydrophobicContact CB-CZ 4.47Å
179	I	95.8	Very high	94.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-60.5	-53	173.8	-66.6	167.4	0	0	0	109.4	L174 T175 N176 H181 K182 L183 L188 V191 L194 F211	L174-I179 HydrophobicContact CD1-CD1 3.79Å; L174-I179 HydrophobicContact CD1-CG1 3.66Å; L174-I179 HydrophobicContact CD2-CD1 4.23Å; L174-I179 HydrophobicContact CG-CD1 3.94Å; L174-I179 HydrophobicContact CG-CG1 4.31Å; T175-I179 WeakPolarHBondContact O-CG1 3.24Å; T175-I179 PolarHBondContact O-N 3.34Å; N176-I179 PolarHBondContact O-N 3.01Å; I179-H181 VanDerWaalsContact C-N 3.32Å; I179-H181 PolarHBondContact O-N 3.46Å; I179-K182 PolarHBondContact O-N 3.4Å; I179-L183 WeakPolarHBondContact O-CA 3.36Å; I179-L183 WeakPolarHBondContact O-CB 3.18Å; I179-L183 PolarHBondContact O-N 3.19Å; I179-L188 HydrophobicContact CG2-CB 4.45Å; I179-V191 HydrophobicContact CD1-CB 4.33Å; I179-V191 HydrophobicContact CD1-CG2 3.66Å; I179-L194 HydrophobicContact CD1-CD2 4.36Å; I179-F211 HydrophobicContact CG1-CE1 3.75Å; I179-F211 HydrophobicContact CG1-CZ 4.14Å
180	Q	94.1	Very high	95.1	Very high	80 Å²	80	58 Å²	58	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-59.4	-43.2	-179.3	-174.9	179.7	12.3	0	0	111.6	N176 E177 K182 G184	N176-Q180 WeakPolarHBondContact O-CB 3.25Å; N176-Q180 PolarHBondContact O-N 3.45Å; E177-Q180 PolarHBondContact O-N 2.7Å; Q180-K182 PolarHBondContact O-N 2.91Å; Q180-G184 WeakPolarHBondContact O-CA 3.29Å; Q180-G184 PolarHBondContact O-N 3.5Å
181	H	94.1	Very high	95.3	Very high	135 Å²	135	55.3 Å²	55.3	63%	0.625	29%	0.289	S	S	*	.	H	α-helix	trans	-64.4	-41.2	179.5	-170.8	-87.6	0	0	0	112.3	Y167 E177 I179	Y167-H181 AromaticContact CE2-ND1 3.73Å; Y167-H181 AromaticContact CZ-ND1 3.87Å; Y167-H181 PolarHBondContact OH-CE1 3.12Å; Y167-H181 PolarHBondContact OH-ND1 2.66Å; Y167-H181 VanDerWaalsContact OH-ND1 3.1Å; E177-H181 WeakPolarHBondContact O-CB 3.46Å; E177-H181 PolarHBondContact O-N 2.96Å; I179-H181 VanDerWaalsContact C-N 3.32Å; I179-H181 PolarHBondContact O-N 3.46Å
182	K	94.6	Very high	95.3	Very high	111 Å²	111	52 Å²	52	48%	0.483	28%	0.277	S	S	.	.	H	α-helix	trans	-89.1	-33.7	-174.8	-169.6	58.2	175.3	178.3	0	114.2	L178 I179 Q180 H185 F211	L178-K182 WeakPolarHBondContact O-CB 3.42Å; L178-K182 PolarHBondContact O-N 3.4Å; I179-K182 PolarHBondContact O-N 3.4Å; Q180-K182 PolarHBondContact O-N 2.91Å; K182-H185 PolarHBondContact O-CE1 3.18Å; K182-H185 PolarHBondContact O-ND1 2.96Å; K182-F211 HydrophobicContact CB-CD2 3.93Å; K182-F211 HydrophobicContact CB-CE2 3.69Å; K182-F211 HydrophobicContact CG-CD2 3.63Å; K182-F211 HydrophobicContact CG-CE2 3.89Å
183	L	96.2	Very high	95.3	Very high	6 Å²	6	49.2 Å²	49.2	3%	0.031	26%	0.262	C	S	.	.	H	α-helix	trans	-123	0.1	-170.9	-58.3	175.4	0	0	0	113.3	I179 H185 L186 L188 L194 H207 F211	I179-L183 WeakPolarHBondContact O-CA 3.36Å; I179-L183 WeakPolarHBondContact O-CB 3.18Å; I179-L183 PolarHBondContact O-N 3.19Å; L183-H185 PolarHBondContact O-N 3.01Å; L183-L186 HydrophobicContact CD2-CD1 4.03Å; L183-L186 WeakPolarHBondContact O-CA 3.46Å; L183-L186 WeakPolarHBondContact O-CB 3.43Å; L183-L186 PolarHBondContact O-N 3.42Å; L183-L188 CarbonylContact C-O 3.59Å; L183-L188 HydrophobicContact CB-CB 3.87Å; L183-L188 HydrophobicContact CB-CD1 4.13Å; L183-L188 HydrophobicContact CD1-CD1 3.93Å; L183-L188 PolarHBondContact O-N 2.97Å; L183-L194 HydrophobicContact CD1-CD1 4.14Å; L183-H207 HydrophobicContact CD2-CB 4.21Å; L183-F211 HydrophobicContact CD1-CB 3.91Å; L183-F211 HydrophobicContact CD1-CD1 3.59Å; L183-F211 HydrophobicContact CD1-CE1 4.21Å; L183-F211 HydrophobicContact CD1-CG 3.79Å; L183-F211 HydrophobicContact CD2-CB 4.24Å; L183-F211 HydrophobicContact CG-CB 4.35Å; L183-F211 HydrophobicContact CG-CD1 4.41Å; L183-F211 HydrophobicContact CG-CG 4.22Å
184	G	93.9	Very high	95.4	Very high	28 Å²	28	45.5 Å²	45.5	29%	0.289	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-59.9	-31.7	-179.6	0	0	0	0	0	113.6	Q180 L186 G187 L188	Q180-G184 WeakPolarHBondContact O-CA 3.29Å; Q180-G184 PolarHBondContact O-N 3.5Å; G184-L186 PolarHBondContact O-N 3.1Å; G184-G187 PolarHBondContact O-N 3.46Å; G184-L188 WeakPolarHBondContact CA-O 3.46Å; G184-L188 PolarHBondContact N-O 3Å
185	H	95.6	Very high	95.5	Very high	151 Å²	151	44.2 Å²	44.2	70%	0.699	23%	0.232	S	C	*	.	G	3₁₀ helix	trans	-64.4	-21.2	173.9	66.4	-85.4	0	0	0	113.4	K182 L183 G187	K182-H185 PolarHBondContact O-CE1 3.18Å; K182-H185 PolarHBondContact O-ND1 2.96Å; L183-H185 PolarHBondContact O-N 3.01Å; H185-G187 VanDerWaalsContact C-N 3.34Å
186	L	95.8	Very high	95.6	Very high	42 Å²	42	42.6 Å²	42.6	22%	0.22	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-93	4.2	174.3	-55.9	176.9	0	0	0	112.3	L183 G184 N204 H207	L183-L186 HydrophobicContact CD2-CD1 4.03Å; L183-L186 WeakPolarHBondContact O-CA 3.46Å; L183-L186 WeakPolarHBondContact O-CB 3.43Å; L183-L186 PolarHBondContact O-N 3.42Å; G184-L186 PolarHBondContact O-N 3.1Å; L186-N204 HydrophobicContact CB-CB 4.41Å; L186-N204 HydrophobicContact CD1-CB 4.17Å; L186-N204 PolarHBondContact O-ND2 3.47Å; L186-H207 HydrophobicContact CD1-CB 3.44Å; L186-H207 VanDerWaalsContact CD1-CB 3.44Å
187	G	94.5	Very high	95.7	Very high	36 Å²	36	40.5 Å²	40.5	37%	0.371	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	83.7	4.4	-177.8	0	0	0	0	0	115.1	R58 G184 H185	R58-G187 PolarHBondContact NH1-O 2.93Å; G184-G187 PolarHBondContact O-N 3.46Å; H185-G187 VanDerWaalsContact C-N 3.34Å
188	L	95.7	Very high	95.9	Very high	6 Å²	6	34.8 Å²	34.8	3%	0.031	18%	0.182	C	C	.	.			trans	-90.3	113.7	177.7	-57.1	175.3	0	0	0	110.3	I179 L183 G184 D193 E197 A208	I179-L188 HydrophobicContact CG2-CB 4.45Å; L183-L188 CarbonylContact C-O 3.59Å; L183-L188 HydrophobicContact CB-CB 3.87Å; L183-L188 HydrophobicContact CB-CD1 4.13Å; L183-L188 HydrophobicContact CD1-CD1 3.93Å; L183-L188 PolarHBondContact O-N 2.97Å; G184-L188 WeakPolarHBondContact CA-O 3.46Å; G184-L188 PolarHBondContact N-O 3Å; L188-D193 HydrophobicContact CB-CB 4.48Å; L188-D193 HydrophobicContact CD2-CB 3.92Å; L188-E197 HydrophobicContact CD1-CG 4.2Å; L188-E197 HydrophobicContact CD2-CB 3.96Å; L188-E197 HydrophobicContact CD2-CG 4.18Å; L188-A208 HydrophobicContact CD1-CB 4.34Å
189	I	94.9	Very high	96.1	Very high	20 Å²	20	37.1 Å²	37.1	10%	0.103	19%	0.189	C	C	.	.			trans	-108	-35.4	-172.3	-56.4	175.7	0	0	0	111.3	L51 L54 M55 D193	L51-I189 HydrophobicContact CD2-CG2 4.28Å; L54-I189 HydrophobicContact CD2-CD1 3.68Å; M55-I189 HydrophobicContact CG-CG2 4.38Å; I189-D193 PolarHBondContact N-OD2 3.31Å
190	C	95.5	Very high	96.1	Very high	6 Å²	6	39.1 Å²	39.1	4%	0.041	20%	0.201	C	C	.	.	S	Bend	trans	-135.5	175.4	-170.9	73	0	0	0	0	113.6	M55 N176 E192 D193 L194	M55-C190 HydrophobicContact CB-CB 4.47Å; M55-C190 HydrophobicContact CG-CB 3.67Å; M55-C190 HydrophobicContact SD-CB 3.48Å; M55-C190 WeakPolarHBondContact SD-CB 3.44Å; N176-C190 VanDerWaalsContact OD1-CA 3.29Å; N176-C190 WeakPolarHBondContact OD1-CA 3.35Å; N176-C190 WeakPolarHBondContact OD1-CB 3.15Å; C190-E192 VanDerWaalsContact C-N 3.31Å; C190-E192 PolarHBondContact O-N 3.2Å; C190-D193 PolarHBondContact N-OD2 3.43Å; C190-D193 PolarHBondContact O-N 2.99Å; C190-D193 VanDerWaalsContact SG-CG 3.55Å; C190-D193 PolarHBondContact SG-N 3.33Å; C190-D193 PolarHBondContact SG-OD1 2.84Å; C190-L194 PolarHBondContact O-N 3.44Å; C190-L194 VanDerWaalsContact O-N 3.13Å
191	V	96.8	Very high	96.3	Very high	15 Å²	15	36.2 Å²	36.2	9%	0.091	19%	0.189	C	C	.	.	H	α-helix	trans	-60.1	-38.7	176.4	177.9	0	0	0	0	112.1	I159 Y160 L174 N176 I179 L194 V195	I159-V191 HydrophobicContact CG2-CG1 3.67Å; Y160-V191 HydrophobicContact CD1-CG1 4.17Å; Y160-V191 HydrophobicContact CE1-CB 4.27Å; Y160-V191 HydrophobicContact CE1-CG1 3.7Å; Y160-V191 HydrophobicContact CE2-CG1 4.31Å; L174-V191 HydrophobicContact CD2-CG1 4.33Å; L174-V191 HydrophobicContact CD2-CG2 3.9Å; L174-V191 HydrophobicContact CG-CG2 4.25Å; N176-V191 WeakPolarHBondContact OD1-CG2 3.25Å; N176-V191 PolarHBondContact OD1-N 3.3Å; I179-V191 HydrophobicContact CD1-CB 4.33Å; I179-V191 HydrophobicContact CD1-CG2 3.66Å; V191-L194 WeakPolarHBondContact O-CB 3.47Å; V191-L194 PolarHBondContact O-N 3.06Å; V191-V195 HydrophobicContact CG1-CG2 4.25Å; V191-V195 VanDerWaalsContact O-CG2 3.28Å; V191-V195 WeakPolarHBondContact O-CG2 3.35Å; V191-V195 PolarHBondContact O-N 2.8Å
192	E	96.7	Very high	96.4	Very high	23 Å²	23	30.3 Å²	30.3	11%	0.107	16%	0.164	C	C	.	.	H	α-helix	trans	-67.9	-36.9	179	-72.9	-63.6	128	0	0	112.2	A59 R156 Y160 C190 L194 V195 H196	A59-E192 HydrophobicContact CB-CB 4.29Å; A59-E192 HydrophobicContact CB-CG 4.08Å; R156-E192 IonicContact CZ-OE2 3.61Å; R156-E192 IonicContact NE-OE1 3.53Å; R156-E192 PolarHBondContact NE-OE1 3.45Å; R156-E192 IonicContact NE-OE2 3.48Å; R156-E192 IonicContact NH2-OE1 3.42Å; R156-E192 IonicContact NH2-OE2 3.65Å; R156-E192 PolarHBondContact NH2-OE2 2.8Å; Y160-E192 WeakPolarHBondContact CE2-OE1 3.41Å; Y160-E192 PolarHBondContact OH-OE1 2.8Å; C190-E192 VanDerWaalsContact C-N 3.31Å; C190-E192 PolarHBondContact O-N 3.2Å; E192-L194 VanDerWaalsContact C-N 3.29Å; E192-L194 PolarHBondContact O-N 2.94Å; E192-V195 PolarHBondContact O-N 3.45Å; E192-H196 WeakPolarHBondContact O-CB 3.14Å; E192-H196 PolarHBondContact O-N 3.28Å
193	D	97.1	Very high	96.5	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60	-42.7	171.5	-63	-8.1	0	0	0	110.2	R58 Y62 L188 I189 C190 H196 E197	R58-D193 WeakPolarHBondContact CD-OD1 3.23Å; R58-D193 IonicContact CZ-OD2 3.98Å; R58-D193 IonicContact NH1-OD1 3.48Å; R58-D193 IonicContact NH1-OD2 2.8Å; R58-D193 PolarHBondContact NH1-OD2 2.94Å; Y62-D193 VanDerWaalsContact CE2-OD1 3.28Å; Y62-D193 WeakPolarHBondContact CE2-OD1 3.43Å; Y62-D193 PolarHBondContact OH-OD1 3.21Å; L188-D193 HydrophobicContact CB-CB 4.48Å; L188-D193 HydrophobicContact CD2-CB 3.92Å; I189-D193 PolarHBondContact N-OD2 3.31Å; C190-D193 PolarHBondContact N-OD2 3.43Å; C190-D193 PolarHBondContact O-N 2.99Å; C190-D193 VanDerWaalsContact SG-CG 3.55Å; C190-D193 PolarHBondContact SG-N 3.33Å; C190-D193 PolarHBondContact SG-OD1 2.84Å; D193-H196 PolarHBondContact O-N 2.9Å; D193-E197 WeakPolarHBondContact O-CB 3.44Å; D193-E197 PolarHBondContact O-N 2.99Å
194	L	97	Very high	96.6	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.5	-42.4	177.7	-174	67.6	0	0	0	112.4	I159 L174 I179 L183 C190 V191 E192 H196 I198 A208 L212	I159-L194 HydrophobicContact CG2-CD2 4.38Å; L174-L194 HydrophobicContact CD1-CD2 4.18Å; L174-L194 HydrophobicContact CD2-CD2 3.96Å; I179-L194 HydrophobicContact CD1-CD2 4.36Å; L183-L194 HydrophobicContact CD1-CD1 4.14Å; C190-L194 PolarHBondContact O-N 3.44Å; C190-L194 VanDerWaalsContact O-N 3.13Å; V191-L194 WeakPolarHBondContact O-CB 3.47Å; V191-L194 PolarHBondContact O-N 3.06Å; E192-L194 VanDerWaalsContact C-N 3.29Å; E192-L194 PolarHBondContact O-N 2.94Å; L194-H196 VanDerWaalsContact C-N 3.32Å; L194-I198 HydrophobicContact CD1-CD1 4.11Å; L194-I198 HydrophobicContact CG-CD1 3.99Å; L194-I198 WeakPolarHBondContact O-CB 3.29Å; L194-I198 WeakPolarHBondContact O-CD1 3.27Å; L194-I198 VanDerWaalsContact O-CG1 3.29Å; L194-I198 WeakPolarHBondContact O-CG1 3.39Å; L194-I198 PolarHBondContact O-N 3.49Å; L194-I198 VanDerWaalsContact O-N 3.09Å; L194-A208 HydrophobicContact CD1-CB 3.61Å; L194-L212 HydrophobicContact CD2-CD2 3.95Å; L194-L212 HydrophobicContact CD2-CG 4.33Å
195	V	97.7	Very high	96.7	Very high	0 Å²	0	31.6 Å²	31.6	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-45.4	174.8	170.7	0	0	0	0	109.9	L152 V155 R156 I159 V191 E192 I198 Y199	L152-V195 HydrophobicContact CD1-CG1 4.09Å; V155-V195 HydrophobicContact CG1-CG1 4.28Å; R156-V195 HydrophobicContact CB-CG1 4.42Å; I159-V195 HydrophobicContact CB-CG2 4.22Å; I159-V195 HydrophobicContact CD1-CB 4.34Å; I159-V195 HydrophobicContact CD1-CG2 3.71Å; I159-V195 HydrophobicContact CG2-CG2 4.19Å; V191-V195 HydrophobicContact CG1-CG2 4.25Å; V191-V195 VanDerWaalsContact O-CG2 3.28Å; V191-V195 WeakPolarHBondContact O-CG2 3.35Å; V191-V195 PolarHBondContact O-N 2.8Å; E192-V195 PolarHBondContact O-N 3.45Å; V195-I198 PolarHBondContact O-N 3.04Å; V195-Y199 VanDerWaalsContact O-CB 3.25Å; V195-Y199 WeakPolarHBondContact O-CB 3.45Å; V195-Y199 PolarHBondContact O-N 3.2Å
196	H	97.8	Very high	96.8	Very high	24 Å²	24	32.2 Å²	32.2	11%	0.111	18%	0.177	C	C	.	.	H	α-helix	trans	-61.8	-53.3	178.7	-179.1	76.6	0	0	0	111.7	Y62 E65 Y66 E192 D193 L194 I198 Y199 T200	Y62-H196 HydrophobicContact CD1-CB 4.15Å; Y62-H196 AromaticContact CD1-CD2 3.77Å; Y62-H196 AromaticContact CD1-CE1 3.55Å; Y62-H196 AromaticContact CD1-CG 3.51Å; Y62-H196 AromaticContact CD1-ND1 3.38Å; Y62-H196 WeakPolarHBondContact CD1-ND1 3.41Å; Y62-H196 AromaticContact CD1-NE2 3.8Å; Y62-H196 HydrophobicContact CD2-CB 3.97Å; Y62-H196 HydrophobicContact CE1-CB 4.19Å; Y62-H196 AromaticContact CE1-CD2 3.41Å; Y62-H196 VanDerWaalsContact CE1-CD2 3.41Å; Y62-H196 WeakPolarHBondContact CE1-CD2 3.15Å; Y62-H196 AromaticContact CE1-CE1 3.88Å; Y62-H196 AromaticContact CE1-CG 3.57Å; Y62-H196 AromaticContact CE1-ND1 3.88Å; Y62-H196 AromaticContact CE1-NE2 3.63Å; Y62-H196 HydrophobicContact CE2-CB 4.03Å; Y62-H196 HydrophobicContact CG-CB 4.05Å; Y62-H196 AromaticContact CG-CG 3.87Å; Y62-H196 AromaticContact CG-ND1 3.79Å; Y62-H196 AromaticContact CZ-CD2 3.9Å; Y62-H196 AromaticContact CZ-CG 3.99Å; E65-H196 IonicContact OE1-CE1 3.96Å; E65-H196 PolarHBondContact OE1-CE1 2.99Å; E65-H196 IonicContact OE2-CE1 2.82Å; E65-H196 PolarHBondContact OE2-CE1 3.42Å; Y66-H196 AromaticContact CE1-ND1 3.62Å; Y66-H196 AromaticContact CZ-ND1 3.56Å; Y66-H196 WeakPolarHBondContact OH-CA 3.44Å; Y66-H196 VanDerWaalsContact OH-CB 3.23Å; Y66-H196 WeakPolarHBondContact OH-CB 3.25Å; Y66-H196 PolarHBondContact OH-ND1 2.84Å; E192-H196 WeakPolarHBondContact O-CB 3.14Å; E192-H196 PolarHBondContact O-N 3.28Å; D193-H196 PolarHBondContact O-N 2.9Å; L194-H196 VanDerWaalsContact C-N 3.32Å; H196-I198 PolarHBondContact O-N 3.09Å; H196-Y199 PolarHBondContact O-N 2.86Å; H196-Y199 VanDerWaalsContact O-N 3.15Å; H196-T200 PolarHBondContact O-N 3.25Å; H196-T200 PolarHBondContact O-OG1 3.35Å
197	E	97.7	Very high	96.8	Very high	18 Å²	18	34.7 Å²	34.7	8%	0.084	19%	0.187	C	C	.	.	H	α-helix	trans	-54.9	-39.1	179.6	-169.2	66.5	-155.3	0	0	112.3	L188 D193 V201 G202 P203 N204 F205 A208	L188-E197 HydrophobicContact CD1-CG 4.2Å; L188-E197 HydrophobicContact CD2-CB 3.96Å; L188-E197 HydrophobicContact CD2-CG 4.18Å; D193-E197 WeakPolarHBondContact O-CB 3.44Å; D193-E197 PolarHBondContact O-N 2.99Å; E197-V201 WeakPolarHBondContact O-CA 3.41Å; E197-V201 PolarHBondContact O-N 2.93Å; E197-G202 PolarHBondContact O-N 2.86Å; E197-G202 WeakPolarHBondContact OE1-CA 3.35Å; E197-P203 WeakPolarHBondContact OE1-CD 3.42Å; E197-N204 HydrophobicContact CG-CB 4.38Å; E197-N204 VanDerWaalsContact OE1-CA 3.24Å; E197-N204 WeakPolarHBondContact OE1-CA 3.5Å; E197-N204 WeakPolarHBondContact OE1-CB 3.29Å; E197-N204 PolarHBondContact OE1-N 3.44Å; E197-F205 PolarHBondContact OE1-N 3.48Å; E197-A208 HydrophobicContact CG-CB 4.03Å
198	I	97.9	Very high	97	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-73.5	-48.6	178.1	-70.4	168.1	0	0	0	111.2	L94 F127 V155 I159 L194 V195 H196 V201 F205 A208 V209 L212	L94-I198 HydrophobicContact CD1-CG2 4.45Å; L94-I198 HydrophobicContact CD2-CG2 4.26Å; L94-I198 WeakPolarHBondContact CD2-O 3.42Å; F127-I198 HydrophobicContact CB-CG2 4.25Å; F127-I198 HydrophobicContact CD1-CG2 3.79Å; F127-I198 HydrophobicContact CD2-CD1 4.2Å; F127-I198 HydrophobicContact CD2-CG2 3.68Å; F127-I198 HydrophobicContact CE1-CG2 4.07Å; F127-I198 HydrophobicContact CE2-CD1 4.34Å; F127-I198 HydrophobicContact CE2-CG2 3.93Å; F127-I198 HydrophobicContact CG-CG2 3.63Å; F127-I198 HydrophobicContact CZ-CG2 4.14Å; V155-I198 HydrophobicContact CG1-CB 4.47Å; V155-I198 HydrophobicContact CG1-CG2 3.96Å; I159-I198 HydrophobicContact CD1-CD1 3.73Å; L194-I198 HydrophobicContact CD1-CD1 4.11Å; L194-I198 HydrophobicContact CG-CD1 3.99Å; L194-I198 WeakPolarHBondContact O-CB 3.29Å; L194-I198 WeakPolarHBondContact O-CD1 3.27Å; L194-I198 VanDerWaalsContact O-CG1 3.29Å; L194-I198 WeakPolarHBondContact O-CG1 3.39Å; L194-I198 PolarHBondContact O-N 3.49Å; L194-I198 VanDerWaalsContact O-N 3.09Å; V195-I198 PolarHBondContact O-N 3.04Å; H196-I198 PolarHBondContact O-N 3.09Å; I198-V201 PolarHBondContact O-N 2.92Å; I198-F205 HydrophobicContact CG2-CE2 4.25Å; I198-A208 HydrophobicContact CG1-CB 4.22Å; I198-V209 HydrophobicContact CG1-CG2 4.4Å; I198-L212 HydrophobicContact CD1-CD1 3.32Å; I198-L212 HydrophobicContact CD1-CG 4.47Å
199	Y	97.8	Very high	97	Very high	78 Å²	78	33.4 Å²	33.4	31%	0.306	17%	0.172	S	C	.	.	H	α-helix	trans	-67.2	-43.6	-174.3	179.5	-109.5	0	0	0	112.5	Y66 L152 V155 V195 H196 V201	Y66-Y199 HydrophobicContact CD1-CD1 4.14Å; Y66-Y199 HydrophobicContact CD1-CE1 4.06Å; Y66-Y199 AromaticContact CE1-CD1 3.66Å; Y66-Y199 HydrophobicContact CE1-CD1 3.66Å; Y66-Y199 HydrophobicContact CE1-CE1 4.07Å; L152-Y199 HydrophobicContact CB-CD2 4.22Å; L152-Y199 HydrophobicContact CB-CE1 4.19Å; L152-Y199 HydrophobicContact CB-CE2 3.87Å; L152-Y199 HydrophobicContact CD1-CD1 3.87Å; L152-Y199 HydrophobicContact CD1-CD2 4.3Å; L152-Y199 HydrophobicContact CD1-CE1 4.29Å; L152-Y199 HydrophobicContact CD1-CG 3.87Å; V155-Y199 HydrophobicContact CG2-CD2 4.07Å; V195-Y199 VanDerWaalsContact O-CB 3.25Å; V195-Y199 WeakPolarHBondContact O-CB 3.45Å; V195-Y199 PolarHBondContact O-N 3.2Å; H196-Y199 PolarHBondContact O-N 2.86Å; H196-Y199 VanDerWaalsContact O-N 3.15Å; Y199-V201 VanDerWaalsContact C-N 3.29Å
200	T	96.8	Very high	97.1	Very high	42 Å²	42	35 Å²	35	26%	0.258	19%	0.188	S	C	.	.	H	α-helix	trans	-82.1	-9.7	179.5	62.9	0	0	0	0	113.1	Y66 H196	Y66-T200 HydrophobicContact CE1-CG2 4.1Å; H196-T200 PolarHBondContact O-N 3.25Å; H196-T200 PolarHBondContact O-OG1 3.35Å
201	V	97.6	Very high	97.1	Very high	19 Å²	19	35 Å²	35	12%	0.115	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.2	60.4	-173.3	-167	0	0	0	0	110.4	K93 L94 R129 E197 I198 Y199 F205	K93-V201 HydrophobicContact CB-CB 4.28Å; K93-V201 HydrophobicContact CB-CG2 3.84Å; L94-V201 HydrophobicContact CB-CG2 3.79Å; L94-V201 HydrophobicContact CD1-CG2 4.43Å; R129-V201 HydrophobicContact CB-CG1 4.15Å; R129-V201 HydrophobicContact CG-CG1 3.78Å; E197-V201 WeakPolarHBondContact O-CA 3.41Å; E197-V201 PolarHBondContact O-N 2.93Å; I198-V201 PolarHBondContact O-N 2.92Å; Y199-V201 VanDerWaalsContact C-N 3.29Å; V201-F205 HydrophobicContact CB-CD2 4.36Å; V201-F205 HydrophobicContact CG1-CB 4.32Å; V201-F205 HydrophobicContact CG1-CD2 4.02Å; V201-F205 HydrophobicContact CG1-CE2 4.48Å; V201-F205 HydrophobicContact CG1-CG 4.03Å; V201-F205 HydrophobicContact CG2-CD2 4.46Å; V201-F205 HydrophobicContact CG2-CE2 4.41Å
202	G	96.4	Very high	97.1	Very high	11 Å²	11	34.3 Å²	34.3	11%	0.113	18%	0.183	C	C	.	.			trans	-67.3	176.2	-179.9	0	0	0	0	0	114	E197 N204 F205	E197-G202 PolarHBondContact O-N 2.86Å; E197-G202 WeakPolarHBondContact OE1-CA 3.35Å; G202-N204 PolarHBondContact O-N 2.86Å; G202-F205 VanDerWaalsContact O-CB 3.24Å; G202-F205 WeakPolarHBondContact O-CB 3.49Å; G202-F205 PolarHBondContact O-N 3.42Å; G202-F205 VanDerWaalsContact O-N 3.16Å
203	P	97.2	Very high	97.1	Very high	120 Å²	120	36.5 Å²	36.5	78%	0.779	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-32.2	-176.9	25.3	-34.1	0	0	0	113.1	E197	E197-P203 WeakPolarHBondContact OE1-CD 3.42Å
204	N	97.2	Very high	97.1	Very high	39 Å²	39	37.3 Å²	37.3	21%	0.209	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	12.8	-178.1	-63.3	-47.9	0	0	0	113	L186 E197 G202 K206 H207 A208	L186-N204 HydrophobicContact CB-CB 4.41Å; L186-N204 HydrophobicContact CD1-CB 4.17Å; L186-N204 PolarHBondContact O-ND2 3.47Å; E197-N204 HydrophobicContact CG-CB 4.38Å; E197-N204 VanDerWaalsContact OE1-CA 3.24Å; E197-N204 WeakPolarHBondContact OE1-CA 3.5Å; E197-N204 WeakPolarHBondContact OE1-CB 3.29Å; E197-N204 PolarHBondContact OE1-N 3.44Å; G202-N204 PolarHBondContact O-N 2.86Å; N204-K206 PolarHBondContact O-N 2.96Å; N204-K206 VanDerWaalsContact O-N 3.12Å; N204-H207 PolarHBondContact O-N 3.16Å; N204-A208 PolarHBondContact O-N 3.23Å
205	F	97.6	Very high	97.2	Very high	14 Å²	14	37.3 Å²	37.3	6%	0.061	20%	0.195	C	C	.	.	H	α-helix	trans	-48.7	-42.9	179.7	179.5	-90.9	0	0	0	113.1	L94 F127 R129 E197 I198 V201 G202 H207 A208 V209	L94-F205 HydrophobicContact CD1-CE2 3.63Å; L94-F205 HydrophobicContact CD1-CZ 3.72Å; F127-F205 HydrophobicContact CB-CZ 4.22Å; R129-F205 HydrophobicContact CB-CD1 3.85Å; R129-F205 HydrophobicContact CB-CE1 3.51Å; R129-F205 HydrophobicContact CB-CZ 4.11Å; E197-F205 PolarHBondContact OE1-N 3.48Å; I198-F205 HydrophobicContact CG2-CE2 4.25Å; V201-F205 HydrophobicContact CB-CD2 4.36Å; V201-F205 HydrophobicContact CG1-CB 4.32Å; V201-F205 HydrophobicContact CG1-CD2 4.02Å; V201-F205 HydrophobicContact CG1-CE2 4.48Å; V201-F205 HydrophobicContact CG1-CG 4.03Å; V201-F205 HydrophobicContact CG2-CD2 4.46Å; V201-F205 HydrophobicContact CG2-CE2 4.41Å; G202-F205 VanDerWaalsContact O-CB 3.24Å; G202-F205 WeakPolarHBondContact O-CB 3.49Å; G202-F205 PolarHBondContact O-N 3.42Å; G202-F205 VanDerWaalsContact O-N 3.16Å; F205-H207 VanDerWaalsContact C-N 3.32Å; F205-H207 PolarHBondContact O-N 3.21Å; F205-A208 PolarHBondContact O-N 2.77Å; F205-V209 HydrophobicContact CD1-CG2 4.06Å; F205-V209 HydrophobicContact CD2-CG2 4.19Å; F205-V209 HydrophobicContact CE1-CB 4.37Å; F205-V209 HydrophobicContact CE1-CG2 3.6Å; F205-V209 HydrophobicContact CE2-CG2 3.76Å; F205-V209 HydrophobicContact CG-CG2 4.34Å; F205-V209 HydrophobicContact CZ-CG2 3.46Å; F205-V209 VanDerWaalsContact CZ-CG2 3.46Å; F205-V209 WeakPolarHBondContact O-CB 3.21Å; F205-V209 WeakPolarHBondContact O-CG2 3Å; F205-V209 PolarHBondContact O-N 3.04Å
206	K	96.9	Very high	97.1	Very high	164 Å²	164	41.3 Å²	41.3	71%	0.713	21%	0.213	S	C	*	.	H	α-helix	trans	-58.2	-44.4	178.7	-178.3	-179.1	176.7	-176.9	0	111.5	N204 A210	N204-K206 PolarHBondContact O-N 2.96Å; N204-K206 VanDerWaalsContact O-N 3.12Å; K206-A210 WeakPolarHBondContact O-CB 3.19Å; K206-A210 PolarHBondContact O-N 2.87Å
207	H	96.6	Very high	97.1	Very high	94 Å²	94	40.9 Å²	40.9	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-72.7	-42	-179.8	-63.6	-77.8	0	0	0	111.7	L183 L186 N204 F205 A210 F211	L183-H207 HydrophobicContact CD2-CB 4.21Å; L186-H207 HydrophobicContact CD1-CB 3.44Å; L186-H207 VanDerWaalsContact CD1-CB 3.44Å; N204-H207 PolarHBondContact O-N 3.16Å; F205-H207 VanDerWaalsContact C-N 3.32Å; F205-H207 PolarHBondContact O-N 3.21Å; H207-A210 PolarHBondContact O-N 2.75Å; H207-F211 WeakPolarHBondContact O-CB 3.19Å; H207-F211 PolarHBondContact O-N 2.91Å
208	A	97.3	Very high	97.1	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-58	-48.7	174.7	0	0	0	0	0	112.1	L188 L194 E197 I198 N204 F205 F211 L212	L188-A208 HydrophobicContact CD1-CB 4.34Å; L194-A208 HydrophobicContact CD1-CB 3.61Å; E197-A208 HydrophobicContact CG-CB 4.03Å; I198-A208 HydrophobicContact CG1-CB 4.22Å; N204-A208 PolarHBondContact O-N 3.23Å; F205-A208 PolarHBondContact O-N 2.77Å; A208-F211 PolarHBondContact O-N 2.93Å; A208-L212 PolarHBondContact O-N 3.46Å
209	V	97.1	Very high	97	Very high	14 Å²	14	48 Å²	48	9%	0.085	26%	0.255	C	S	.	.	H	α-helix	trans	-69.4	-37.4	178.4	169.5	0	0	0	0	111.9	R118 M126 F127 I198 F205 F211 L212	R118-V209 PolarHBondContact NH1-O 2.86Å; R118-V209 PolarHBondContact NH2-O 3.09Å; M126-V209 HydrophobicContact CE-CG1 3.64Å; F127-V209 HydrophobicContact CB-CG2 3.98Å; I198-V209 HydrophobicContact CG1-CG2 4.4Å; F205-V209 HydrophobicContact CD1-CG2 4.06Å; F205-V209 HydrophobicContact CD2-CG2 4.19Å; F205-V209 HydrophobicContact CE1-CB 4.37Å; F205-V209 HydrophobicContact CE1-CG2 3.6Å; F205-V209 HydrophobicContact CE2-CG2 3.76Å; F205-V209 HydrophobicContact CG-CG2 4.34Å; F205-V209 HydrophobicContact CZ-CG2 3.46Å; F205-V209 VanDerWaalsContact CZ-CG2 3.46Å; F205-V209 WeakPolarHBondContact O-CB 3.21Å; F205-V209 WeakPolarHBondContact O-CG2 3Å; F205-V209 PolarHBondContact O-N 3.04Å; V209-F211 VanDerWaalsContact C-N 3.32Å; V209-L212 PolarHBondContact O-N 3.1Å
210	A	95.6	Very high	97	Very high	53 Å²	53	44.8 Å²	44.8	44%	0.438	24%	0.243	S	C	.	.	H	α-helix	trans	-66.3	-34.2	176.3	0	0	0	0	0	112.7	K206 H207	K206-A210 WeakPolarHBondContact O-CB 3.19Å; K206-A210 PolarHBondContact O-N 2.87Å; H207-A210 PolarHBondContact O-N 2.75Å
211	F	96.3	Very high	96.8	Very high	8 Å²	8	47.8 Å²	47.8	4%	0.035	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-39.4	174.8	172.8	-113.1	0	0	0	112.2	C165 K166 L174 L178 I179 K182 L183 H207 A208 V209 W213	C165-F211 CarbonylContact C-O 3.55Å; C165-F211 VanDerWaalsContact CA-O 3.32Å; C165-F211 WeakPolarHBondContact CA-O 3.38Å; C165-F211 HydrophobicContact CB-CD1 4.23Å; C165-F211 HydrophobicContact CB-CD2 4.04Å; C165-F211 HydrophobicContact CB-CE1 3.67Å; C165-F211 HydrophobicContact CB-CE2 3.47Å; C165-F211 VanDerWaalsContact CB-CE2 3.47Å; C165-F211 HydrophobicContact CB-CG 4.41Å; C165-F211 HydrophobicContact CB-CZ 3.27Å; K166-F211 PolarHBondContact N-O 3.06Å; L174-F211 HydrophobicContact CD1-CD1 4.45Å; L174-F211 HydrophobicContact CD1-CE1 3.49Å; L174-F211 VanDerWaalsContact CD1-CE1 3.49Å; L174-F211 HydrophobicContact CD1-CZ 4.09Å; L178-F211 HydrophobicContact CB-CZ 4.47Å; I179-F211 HydrophobicContact CG1-CE1 3.75Å; I179-F211 HydrophobicContact CG1-CZ 4.14Å; K182-F211 HydrophobicContact CB-CD2 3.93Å; K182-F211 HydrophobicContact CB-CE2 3.69Å; K182-F211 HydrophobicContact CG-CD2 3.63Å; K182-F211 HydrophobicContact CG-CE2 3.89Å; L183-F211 HydrophobicContact CD1-CB 3.91Å; L183-F211 HydrophobicContact CD1-CD1 3.59Å; L183-F211 HydrophobicContact CD1-CE1 4.21Å; L183-F211 HydrophobicContact CD1-CG 3.79Å; L183-F211 HydrophobicContact CD2-CB 4.24Å; L183-F211 HydrophobicContact CG-CB 4.35Å; L183-F211 HydrophobicContact CG-CD1 4.41Å; L183-F211 HydrophobicContact CG-CG 4.22Å; H207-F211 WeakPolarHBondContact O-CB 3.19Å; H207-F211 PolarHBondContact O-N 2.91Å; A208-F211 PolarHBondContact O-N 2.93Å; V209-F211 VanDerWaalsContact C-N 3.32Å; F211-W213 PolarHBondContact O-N 3.23Å
212	L	97.2	Very high	96.6	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-65	132.9	173.4	-71.6	174.6	0	0	0	111.3	R118 F127 L194 I198 A208 V209 F215	R118-L212 PolarHBondContact NH1-O 3.33Å; F127-L212 HydrophobicContact CD2-CD1 4.19Å; F127-L212 HydrophobicContact CE2-CD1 4.32Å; L194-L212 HydrophobicContact CD2-CD2 3.95Å; L194-L212 HydrophobicContact CD2-CG 4.33Å; I198-L212 HydrophobicContact CD1-CD1 3.32Å; I198-L212 HydrophobicContact CD1-CG 4.47Å; A208-L212 PolarHBondContact O-N 3.46Å; V209-L212 PolarHBondContact O-N 3.1Å; L212-F215 HydrophobicContact CD1-CE2 4.15Å; L212-F215 HydrophobicContact CD1-CZ 3.9Å; L212-F215 HydrophobicContact CD2-CZ 4.42Å
213	W	97	Very high	96.5	Very high	69 Å²	69	52.8 Å²	52.8	26%	0.261	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-70.3	157	164.6	-157.9	-80.5	0	0	0	109.5	F164 K166 R171 F211 F215	F164-W213 HydrophobicContact CB-CB 3.95Å; F164-W213 WeakPolarHBondContact O-CB 3.28Å; F164-W213 PolarHBondContact O-N 2.94Å; K166-W213 HydrophobicContact CB-CE3 3.81Å; K166-W213 HydrophobicContact CB-CZ3 4.16Å; K166-W213 HydrophobicContact CG-CE3 4.14Å; K166-W213 HydrophobicContact CG-CZ3 3.98Å; R171-W213 HydrophobicContact CB-CD2 3.77Å; R171-W213 HydrophobicContact CB-CE3 3.65Å; R171-W213 HydrophobicContact CB-CG 4.42Å; R171-W213 HydrophobicContact CB-CH2 4.05Å; R171-W213 HydrophobicContact CB-CZ2 4.17Å; R171-W213 HydrophobicContact CB-CZ3 3.8Å; R171-W213 HydrophobicContact CG-CB 4.35Å; R171-W213 HydrophobicContact CG-CD2 3.74Å; R171-W213 HydrophobicContact CG-CE3 4.03Å; R171-W213 HydrophobicContact CG-CG 3.85Å; F211-W213 PolarHBondContact O-N 3.23Å; W213-F215 PolarHBondContact O-N 3.1Å
214	T	96.9	Very high	96.3	Very high	16 Å²	16	49 Å²	49	10%	0.098	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-57.4	127.4	173.1	57.6	0	0	0	0	111.3	R118 M126 K216	R118-T214 HydrophobicContact CB-CG2 3.44Å; R118-T214 VanDerWaalsContact CB-CG2 3.44Å; R118-T214 WeakPolarHBondContact O-CG2 3.33Å; M126-T214 HydrophobicContact CG-CG2 3.97Å; M126-T214 WeakPolarHBondContact SD-CA 3.25Å; M126-T214 HydrophobicContact SD-CG2 3.7Å; T214-K216 PolarHBondContact O-N 3.27Å; T214-K216 VanDerWaalsContact O-N 3.1Å
215	F	98.1	Very high	96	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	115.1	178.5	-66.5	-83.6	0	0	0	108.5	F96 N124 G125 F127 L158 I159 R162 L212 W213 L217	F96-F215 AromaticContact CE2-CD2 3.76Å; F96-F215 HydrophobicContact CE2-CD2 3.76Å; F96-F215 HydrophobicContact CE2-CE2 4.16Å; F96-F215 HydrophobicContact CE2-CG 4.41Å; F96-F215 HydrophobicContact CZ-CB 4.23Å; F96-F215 HydrophobicContact CZ-CD2 4.02Å; F96-F215 HydrophobicContact CZ-CG 4.27Å; N124-F215 CarbonylContact C-O 3.48Å; N124-F215 VanDerWaalsContact CA-O 3.3Å; N124-F215 WeakPolarHBondContact CA-O 3.34Å; G125-F215 PolarHBondContact N-O 3.4Å; G125-F215 WeakPolarHBondContact O-CB 3.47Å; G125-F215 PolarHBondContact O-N 3.47Å; F127-F215 AromaticContact CD2-CE2 3.7Å; F127-F215 HydrophobicContact CD2-CE2 3.7Å; F127-F215 HydrophobicContact CD2-CZ 4.27Å; F127-F215 HydrophobicContact CE2-CD2 4.48Å; F127-F215 AromaticContact CE2-CE2 3.42Å; F127-F215 HydrophobicContact CE2-CE2 3.42Å; F127-F215 VanDerWaalsContact CE2-CE2 3.42Å; F127-F215 AromaticContact CE2-CZ 3.61Å; F127-F215 HydrophobicContact CE2-CZ 3.61Å; F127-F215 HydrophobicContact CZ-CE2 4.34Å; F127-F215 HydrophobicContact CZ-CZ 4.47Å; L158-F215 HydrophobicContact CB-CD1 4.32Å; L158-F215 HydrophobicContact CB-CE1 4.02Å; L158-F215 HydrophobicContact CB-CZ 4.4Å; L158-F215 HydrophobicContact CD2-CD1 4.29Å; L158-F215 HydrophobicContact CD2-CG 4.45Å; L158-F215 WeakPolarHBondContact O-CE1 3.38Å; I159-F215 HydrophobicContact CG1-CZ 4.21Å; R162-F215 HydrophobicContact CB-CD1 3.93Å; R162-F215 VanDerWaalsContact O-CD1 3.31Å; R162-F215 WeakPolarHBondContact O-CD1 3.21Å; L212-F215 HydrophobicContact CD1-CE2 4.15Å; L212-F215 HydrophobicContact CD1-CZ 3.9Å; L212-F215 HydrophobicContact CD2-CZ 4.42Å; W213-F215 PolarHBondContact O-N 3.1Å; F215-L217 HydrophobicContact CB-CD2 4.04Å; F215-L217 HydrophobicContact CB-CG 4.47Å; F215-L217 PolarHBondContact O-N 3.45Å
216	K	97	Very high	95.8	Very high	85 Å²	85	60.8 Å²	60.8	37%	0.37	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	102.4	171.7	-67.4	-171	171.1	-168	0	107.5	R162 T214	R162-K216 PolarHBondContact NH1-O 3.12Å; T214-K216 PolarHBondContact O-N 3.27Å; T214-K216 VanDerWaalsContact O-N 3.1Å
217	L	97.6	Very high	95.6	Very high	14 Å²	14	56 Å²	56	7%	0.073	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-92	158.8	-178.7	-51.6	177.4	0	0	0	111.1	F96 V98 N123 L158 F215 L248 M251	F96-L217 HydrophobicContact CE1-CD1 4.05Å; F96-L217 HydrophobicContact CZ-CD1 4.49Å; V98-L217 HydrophobicContact CG1-CD1 4.21Å; V98-L217 HydrophobicContact CG2-CD1 3.92Å; N123-L217 HydrophobicContact CB-CB 4.41Å; N123-L217 WeakPolarHBondContact CB-O 3.29Å; N123-L217 VanDerWaalsContact O-CB 3.22Å; N123-L217 WeakPolarHBondContact O-CB 3.33Å; N123-L217 WeakPolarHBondContact O-CG 3.47Å; N123-L217 PolarHBondContact O-N 3.35Å; L158-L217 HydrophobicContact CD2-CD2 3.67Å; F215-L217 HydrophobicContact CB-CD2 4.04Å; F215-L217 HydrophobicContact CB-CG 4.47Å; F215-L217 PolarHBondContact O-N 3.45Å; L217-L248 HydrophobicContact CD1-CD2 3.89Å; L217-M251 HydrophobicContact CB-CB 4.03Å; L217-M251 HydrophobicContact CB-CE 3.92Å; L217-M251 HydrophobicContact CD1-CB 4.24Å; L217-M251 HydrophobicContact CD1-CE 4.1Å; L217-M251 HydrophobicContact CD1-SD 4.2Å
218	S	97.1	Very high	95.4	Very high	59 Å²	59	54 Å²	54	41%	0.413	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-81.3	167.8	171.8	-65.3	0	0	0	0	110.8	R162 M251	R162-S218 PolarHBondContact NH2-OG 3.13Å; S218-M251 PolarHBondContact N-O 3.3Å; S218-M251 WeakPolarHBondContact O-CB 3.28Å; S218-M251 WeakPolarHBondContact O-CE 3.42Å
219	N	96.6	Very high	95.3	Very high	110 Å²	110	58.9 Å²	58.9	59%	0.588	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-58.4	143.9	164.4	-72.1	-46.6	0	0	0	109.5	N123 S221	N123-N219 PolarHBondContact ND2-OD1 3.12Å; N219-S221 PolarHBondContact O-N 3.24Å
220	P	96.6	Very high	95.3	Very high	9 Å²	9	60.2 Å²	60.2	6%	0.058	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-64.9	129.9	178.9	26.6	-33.5	0	0	0	110.4	G222 G223 F224 L247 A250 M251	P220-G222 PolarHBondContact O-N 3.31Å; P220-G223 PolarHBondContact O-N 3.38Å; P220-F224 HydrophobicContact CG-CD1 4.27Å; P220-F224 HydrophobicContact CG-CD2 3.66Å; P220-F224 HydrophobicContact CG-CE1 4.05Å; P220-F224 HydrophobicContact CG-CE2 3.44Å; P220-F224 VanDerWaalsContact CG-CE2 3.44Å; P220-F224 HydrophobicContact CG-CG 4.11Å; P220-F224 HydrophobicContact CG-CZ 3.65Å; P220-L247 HydrophobicContact CB-CD1 3.89Å; P220-L247 HydrophobicContact CG-CD1 4.19Å; P220-A250 WeakPolarHBondContact CA-O 3.38Å; P220-A250 HydrophobicContact CB-CB 3.95Å; P220-M251 HydrophobicContact CB-CG 3.76Å; P220-M251 HydrophobicContact CG-CG 4.39Å
221	S	93.8	Very high	95.3	Very high	105 Å²	105	59.8 Å²	59.8	73%	0.734	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	119.4	167.2	-57.4	0	0	0	0	109.6	N219 A250	N219-S221 PolarHBondContact O-N 3.24Å; S221-A250 PolarHBondContact N-O 2.96Å
222	G	93.4	Very high	95.3	Very high	90 Å²	90	65.2 Å²	65.2	93%	0.928	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.5	-4.1	-171.7	0	0	0	0	0	114.9	P220	P220-G222 PolarHBondContact O-N 3.31Å
223	G	92.8	Very high	95.2	Very high	46 Å²	46	71.4 Å²	71.4	47%	0.474	40%	0.399	S	S	.	.			trans	76.7	-173.2	173.9	0	0	0	0	0	114.7	P220	P220-G223 PolarHBondContact O-N 3.38Å
224	F	93.6	Very high	95.1	Very high	40 Å²	40	70 Å²	70	18%	0.175	41%	0.405	C	S	.	.			trans	-103	151.2	172.5	-67.6	-85.7	0	0	0	108.5	I100 P220 K227 D236 L247 M251	I100-F224 HydrophobicContact CB-CE1 4.28Å; I100-F224 HydrophobicContact CB-CZ 4.39Å; I100-F224 HydrophobicContact CG2-CE1 3.69Å; I100-F224 HydrophobicContact CG2-CZ 3.95Å; P220-F224 HydrophobicContact CG-CD1 4.27Å; P220-F224 HydrophobicContact CG-CD2 3.66Å; P220-F224 HydrophobicContact CG-CE1 4.05Å; P220-F224 HydrophobicContact CG-CE2 3.44Å; P220-F224 VanDerWaalsContact CG-CE2 3.44Å; P220-F224 HydrophobicContact CG-CG 4.11Å; P220-F224 HydrophobicContact CG-CZ 3.65Å; F224-K227 HydrophobicContact CB-CG 3.87Å; F224-K227 HydrophobicContact CD1-CG 4.41Å; F224-K227 HydrophobicContact CD2-CD 4.29Å; F224-K227 HydrophobicContact CD2-CG 4.41Å; F224-K227 HydrophobicContact CG-CD 4.38Å; F224-K227 VanDerWaalsContact CG-CE 3.46Å; F224-K227 HydrophobicContact CG-CG 4Å; F224-D236 WeakPolarHBondContact CB-OD2 3.36Å; F224-D236 HydrophobicContact CD1-CB 4.16Å; F224-L247 HydrophobicContact CD1-CD1 4.44Å; F224-L247 HydrophobicContact CE1-CD1 3.91Å; F224-L247 HydrophobicContact CE1-CD2 4.4Å; F224-M251 HydrophobicContact CZ-CE 4.43Å
225	R	91.9	Very high	95	Very high	171 Å²	171	69.2 Å²	69.2	65%	0.645	40%	0.4	S	S	*	.	S	Bend	trans	-71.4	-69.4	174.5	-64.1	177.6	176.1	-179.4	-4.7	110.3	D236	R225-D236 WeakPolarHBondContact CA-OD2 3.46Å; R225-D236 PolarHBondContact N-OD2 2.93Å
226	K	93.3	Very high	94.9	Very high	129 Å²	129	69.6 Å²	69.6	56%	0.561	40%	0.403	S	S	*	.			trans	-151.6	97.7	178.9	-71.5	-171.4	-179.9	178.1	0	109.5	G228 K229 G235 D236	K226-G228 PolarHBondContact O-N 3Å; K226-K229 HydrophobicContact CD-CD 4.46Å; K226-K229 PolarHBondContact O-N 3.34Å; K226-G235 CarbonylContact O-C 3.38Å; K226-G235 WeakPolarHBondContact O-CA 3.38Å; K226-D236 PolarHBondContact N-OD2 2.66Å; K226-D236 VanDerWaalsContact N-OD2 3.1Å; K226-D236 PolarHBondContact O-N 2.92Å; K226-D236 VanDerWaalsContact O-N 3.09Å
227	K	91.5	Very high	94.8	Very high	64 Å²	64	66.9 Å²	66.9	28%	0.278	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-18.6	175.2	-61	-179.2	176.8	-172.7	0	113.9	I100 R101 F224	I100-K227 HydrophobicContact CD1-CB 4.45Å; I100-K227 PolarHBondContact O-NZ 3.4Å; R101-K227 PolarHBondContact NE-O 3.12Å; R101-K227 PolarHBondContact NH2-O 3.43Å; F224-K227 HydrophobicContact CB-CG 3.87Å; F224-K227 HydrophobicContact CD1-CG 4.41Å; F224-K227 HydrophobicContact CD2-CD 4.29Å; F224-K227 HydrophobicContact CD2-CG 4.41Å; F224-K227 HydrophobicContact CG-CD 4.38Å; F224-K227 VanDerWaalsContact CG-CE 3.46Å; F224-K227 HydrophobicContact CG-CG 4Å
228	G	91.9	Very high	94.8	Very high	52 Å²	52	66.2 Å²	66.2	54%	0.536	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-27.9	-179.3	0	0	0	0	0	114.7	R101 K226 F237	R101-G228 VanDerWaalsContact NH2-CA 3.26Å; R101-G228 PolarHBondContact NH2-O 3.25Å; R101-G228 VanDerWaalsContact NH2-O 3.14Å; K226-G228 PolarHBondContact O-N 3Å; G228-F237 VanDerWaalsContact O-CE1 3.29Å; G228-F237 WeakPolarHBondContact O-CE1 3.35Å
229	K	95.3	Very high	94.8	Very high	102 Å²	102	65.1 Å²	65.1	44%	0.443	38%	0.377	S	S	.	.	S	Bend	trans	-114.8	155.5	-170.4	-64.7	-167.1	174.7	-162.6	0	112.3	K226 G235 D236 F237	K226-K229 HydrophobicContact CD-CD 4.46Å; K226-K229 PolarHBondContact O-N 3.34Å; K229-G235 CarbonylContact O-C 3.5Å; K229-G235 WeakPolarHBondContact O-CA 3.23Å; K229-D236 PolarHBondContact O-N 3.41Å; K229-F237 WeakPolarHBondContact O-CD1 3.04Å; K229-F237 WeakPolarHBondContact O-CE1 3.38Å; K229-F237 PolarHBondContact O-N 3.37Å
230	H	97.2	Very high	94.8	Very high	43 Å²	43	60.5 Å²	60.5	20%	0.199	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-67.9	151.6	177.8	-173.7	-102.6	0	0	0	109.7	D142 V232 E233 G235 F237	D142-H230 IonicContact OD2-CD2 2.84Å; D142-H230 PolarHBondContact OD2-CD2 2.93Å; D142-H230 IonicContact OD2-NE2 3.66Å; H230-V232 VanDerWaalsContact C-N 3.27Å; H230-V232 PolarHBondContact ND1-N 3.26Å; H230-V232 PolarHBondContact O-N 3.13Å; H230-E233 HydrophobicContact CB-CG 4.25Å; H230-E233 PolarHBondContact N-OE2 3.28Å; H230-E233 PolarHBondContact O-N 3.4Å; H230-G235 WeakPolarHBondContact O-CA 3.43Å; H230-G235 PolarHBondContact O-N 2.98Å; H230-F237 HydrophobicContact CB-CD2 4.21Å; H230-F237 HydrophobicContact CB-CE1 4.21Å; H230-F237 HydrophobicContact CB-CE2 3.63Å; H230-F237 HydrophobicContact CB-CZ 3.61Å; H230-F237 AromaticContact CD2-CD2 3.73Å; H230-F237 AromaticContact CD2-CE2 3.5Å; H230-F237 VanDerWaalsContact CD2-CE2 3.5Å; H230-F237 WeakPolarHBondContact CD2-CE2 3.3Å; H230-F237 AromaticContact CG-CE2 3.95Å
231	F	97	Very high	94.9	Very high	44 Å²	44	65 Å²	65	19%	0.193	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-56.9	-40	-177.3	178.2	-107	0	0	0	112.9	E233 G234 F237 R240 Y243	F231-E233 PolarHBondContact O-N 3.48Å; F231-G234 PolarHBondContact O-N 2.88Å; F231-G234 VanDerWaalsContact O-N 3.13Å; F231-F237 PolarHBondContact N-O 3.02Å; F231-R240 HydrophobicContact CB-CB 4.23Å; F231-R240 HydrophobicContact CD1-CB 3.51Å; F231-R240 HydrophobicContact CD2-CB 3.81Å; F231-R240 HydrophobicContact CE1-CB 3.72Å; F231-R240 HydrophobicContact CE2-CB 4Å; F231-R240 HydrophobicContact CG-CB 3.56Å; F231-R240 HydrophobicContact CZ-CB 3.96Å; F231-Y243 AromaticContact CE1-CD2 3.71Å; F231-Y243 HydrophobicContact CE1-CD2 3.71Å; F231-Y243 HydrophobicContact CE1-CE2 4.36Å; F231-Y243 HydrophobicContact CE1-CG 4.24Å; F231-Y243 AromaticContact CZ-CD2 3.73Å; F231-Y243 HydrophobicContact CZ-CD2 3.73Å; F231-Y243 HydrophobicContact CZ-CE2 4.49Å; F231-Y243 AromaticContact CZ-CG 3.78Å; F231-Y243 HydrophobicContact CZ-CG 3.78Å
232	V	95.7	Very high	95	Very high	121 Å²	121	64 Å²	64	73%	0.733	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-63.8	-29.2	177.4	178	0	0	0	0	112.1	H230 G234	H230-V232 VanDerWaalsContact C-N 3.27Å; H230-V232 PolarHBondContact ND1-N 3.26Å; H230-V232 PolarHBondContact O-N 3.13Å; V232-G234 PolarHBondContact O-N 3.17Å
233	E	95.2	Very high	95.2	Very high	131 Å²	131	66.3 Å²	66.3	61%	0.612	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-89.2	16.6	178	-56.9	171.5	167.9	0	0	112.7	H230 F231	H230-E233 HydrophobicContact CB-CG 4.25Å; H230-E233 PolarHBondContact N-OE2 3.28Å; H230-E233 PolarHBondContact O-N 3.4Å; F231-E233 PolarHBondContact O-N 3.48Å
234	G	94	Very high	95.4	Very high	38 Å²	38	64.1 Å²	64.1	39%	0.392	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.5	11.8	-177.9	0	0	0	0	0	115	F231 V232	F231-G234 PolarHBondContact O-N 2.88Å; F231-G234 VanDerWaalsContact O-N 3.13Å; V232-G234 PolarHBondContact O-N 3.17Å
235	G	95.1	Very high	95.6	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.319	C	S	.	.	S	Bend	trans	-93.5	-148.1	175	0	0	0	0	0	114.5	K226 K229 H230	K226-G235 CarbonylContact O-C 3.38Å; K226-G235 WeakPolarHBondContact O-CA 3.38Å; K229-G235 CarbonylContact O-C 3.5Å; K229-G235 WeakPolarHBondContact O-CA 3.23Å; H230-G235 WeakPolarHBondContact O-CA 3.43Å; H230-G235 PolarHBondContact O-N 2.98Å
236	D	95.5	Very high	95.8	Very high	9 Å²	9	64.6 Å²	64.6	5%	0.048	32%	0.323	C	S	.	.	S	Bend	trans	-134.5	-17.6	-174.8	-84.3	-72.9	0	0	0	114.9	I100 A146 F224 R225 K226 K229 R240	I100-D236 HydrophobicContact CD1-CB 4.15Å; A146-D236 WeakPolarHBondContact CB-O 3.41Å; F224-D236 WeakPolarHBondContact CB-OD2 3.36Å; F224-D236 HydrophobicContact CD1-CB 4.16Å; R225-D236 WeakPolarHBondContact CA-OD2 3.46Å; R225-D236 PolarHBondContact N-OD2 2.93Å; K226-D236 PolarHBondContact N-OD2 2.66Å; K226-D236 VanDerWaalsContact N-OD2 3.1Å; K226-D236 PolarHBondContact O-N 2.92Å; K226-D236 VanDerWaalsContact O-N 3.09Å; K229-D236 PolarHBondContact O-N 3.41Å; D236-R240 PolarHBondContact O-NH2 3Å; D236-R240 IonicContact OD1-CZ 3.89Å; D236-R240 IonicContact OD1-NH1 2.91Å; D236-R240 IonicContact OD1-NH2 3.06Å; D236-R240 PolarHBondContact OD1-NH2 3.26Å
237	F	96.6	Very high	96	Very high	28 Å²	28	59.1 Å²	59.1	12%	0.123	30%	0.3	C	S	.	.	B	Isolated β-bridge	trans	-80.9	159.6	179.6	81.8	-113.4	0	0	0	111.4	I100 D142 P143 V145 G228 K229 H230 F231	I100-F237 HydrophobicContact CD1-CB 3.81Å; D142-F237 WeakPolarHBondContact O-CB 3.4Å; D142-F237 WeakPolarHBondContact O-CD2 3.45Å; P143-F237 VanDerWaalsContact CA-CD2 3.48Å; P143-F237 HydrophobicContact CB-CE2 4.46Å; P143-F237 HydrophobicContact CG-CE2 4.4Å; V145-F237 CarbonylContact O-C 3.6Å; V145-F237 WeakPolarHBondContact O-CA 3.34Å; G228-F237 VanDerWaalsContact O-CE1 3.29Å; G228-F237 WeakPolarHBondContact O-CE1 3.35Å; K229-F237 WeakPolarHBondContact O-CD1 3.04Å; K229-F237 WeakPolarHBondContact O-CE1 3.38Å; K229-F237 PolarHBondContact O-N 3.37Å; H230-F237 HydrophobicContact CB-CD2 4.21Å; H230-F237 HydrophobicContact CB-CE1 4.21Å; H230-F237 HydrophobicContact CB-CE2 3.63Å; H230-F237 HydrophobicContact CB-CZ 3.61Å; H230-F237 AromaticContact CD2-CD2 3.73Å; H230-F237 AromaticContact CD2-CE2 3.5Å; H230-F237 VanDerWaalsContact CD2-CE2 3.5Å; H230-F237 WeakPolarHBondContact CD2-CE2 3.3Å; H230-F237 AromaticContact CG-CE2 3.95Å; F231-F237 PolarHBondContact N-O 3.02Å
238	G	97.1	Very high	96.3	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.8	-162.4	173.2	0	0	0	0	0	115.7	D142 V145 W147 R240	D142-G238 PolarHBondContact O-N 3.32Å; D142-G238 WeakPolarHBondContact OD1-CA 3.38Å; D142-G238 WeakPolarHBondContact OD2-CA 3.45Å; V145-G238 PolarHBondContact O-N 3.34Å; W147-G238 PolarHBondContact N-O 3.13Å; G238-R240 PolarHBondContact O-N 3.45Å
239	N	97.3	Very high	96.5	Very high	36 Å²	36	60.5 Å²	60.5	19%	0.193	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	119.7	-178.7	-167	3.2	0	0	0	110.3	W147 Y149 E241	W147-N239 HydrophobicContact CD2-CB 4.23Å; W147-N239 HydrophobicContact CH2-CB 3.97Å; W147-N239 WeakPolarHBondContact CH2-ND2 3.3Å; W147-N239 HydrophobicContact CZ2-CB 3.56Å; W147-N239 HydrophobicContact CZ3-CB 4.46Å; W147-N239 WeakPolarHBondContact O-CA 3.43Å; W147-N239 PolarHBondContact O-OD1 2.93Å; Y149-N239 PolarHBondContact OH-ND2 3.48Å; Y149-N239 VanDerWaalsContact OH-ND2 3.12Å; N239-E241 PolarHBondContact OD1-N 2.86Å
240	R	96.6	Very high	96.5	Very high	12 Å²	12	56.9 Å²	56.9	5%	0.045	28%	0.28	C	S	.	.			trans	-115.8	16.7	174.4	62.6	172	70.2	-165.8	4.6	112.6	W147 F231 D236 G238 T242 Y243 I244	W147-R240 WeakPolarHBondContact O-CG 3.41Å; W147-R240 PolarHBondContact O-N 3.29Å; F231-R240 HydrophobicContact CB-CB 4.23Å; F231-R240 HydrophobicContact CD1-CB 3.51Å; F231-R240 HydrophobicContact CD2-CB 3.81Å; F231-R240 HydrophobicContact CE1-CB 3.72Å; F231-R240 HydrophobicContact CE2-CB 4Å; F231-R240 HydrophobicContact CG-CB 3.56Å; F231-R240 HydrophobicContact CZ-CB 3.96Å; D236-R240 PolarHBondContact O-NH2 3Å; D236-R240 IonicContact OD1-CZ 3.89Å; D236-R240 IonicContact OD1-NH1 2.91Å; D236-R240 IonicContact OD1-NH2 3.06Å; D236-R240 PolarHBondContact OD1-NH2 3.26Å; G238-R240 PolarHBondContact O-N 3.45Å; R240-T242 PolarHBondContact O-N 3.44Å; R240-Y243 WeakPolarHBondContact O-CA 3.36Å; R240-Y243 VanDerWaalsContact O-CB 3.23Å; R240-Y243 WeakPolarHBondContact O-CB 3.38Å; R240-Y243 WeakPolarHBondContact O-CD2 3.34Å; R240-Y243 PolarHBondContact O-N 3.44Å; R240-I244 HydrophobicContact CG-CB 3.98Å; R240-I244 HydrophobicContact CG-CD1 4.08Å
241	E	96.9	Very high	96.5	Very high	104 Å²	104	54.9 Å²	54.9	49%	0.486	27%	0.271	S	S	.	.	G	3₁₀ helix	trans	48.1	-123.2	174.3	-55.6	-178.3	174.4	0	0	112.7	G148 Y149 N239 Y243 I244	G148-E241 CarbonylContact C-O 3.59Å; G148-E241 VanDerWaalsContact CA-O 3.29Å; G148-E241 WeakPolarHBondContact CA-O 3.36Å; Y149-E241 HydrophobicContact CD2-CB 3.96Å; Y149-E241 HydrophobicContact CE2-CB 3.69Å; Y149-E241 HydrophobicContact CE2-CG 3.83Å; Y149-E241 PolarHBondContact N-O 2.9Å; N239-E241 PolarHBondContact OD1-N 2.86Å; E241-Y243 VanDerWaalsContact C-N 3.31Å; E241-Y243 PolarHBondContact O-N 3.07Å; E241-I244 VanDerWaalsContact O-CG2 3.28Å; E241-I244 WeakPolarHBondContact O-CG2 3.45Å
242	T	96.9	Very high	96.4	Very high	85 Å²	85	54.1 Å²	54.1	52%	0.521	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-74.5	-17.8	179.4	61	0	0	0	0	113.1	R240 I244 N245	R240-T242 PolarHBondContact O-N 3.44Å; T242-I244 PolarHBondContact O-N 3.44Å; T242-I244 VanDerWaalsContact O-N 3.16Å; T242-N245 WeakPolarHBondContact O-CB 3.42Å; T242-N245 PolarHBondContact O-N 3.04Å; T242-N245 VanDerWaalsContact O-N 3.1Å; T242-N245 PolarHBondContact O-ND2 3.36Å
243	Y	97.2	Very high	96.4	Very high	138 Å²	138	50.8 Å²	50.8	54%	0.541	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-68.4	-12.5	177.7	-59.3	-78.1	0	0	0	113.1	F231 R240 E241 N245 R246 L247	F231-Y243 AromaticContact CE1-CD2 3.71Å; F231-Y243 HydrophobicContact CE1-CD2 3.71Å; F231-Y243 HydrophobicContact CE1-CE2 4.36Å; F231-Y243 HydrophobicContact CE1-CG 4.24Å; F231-Y243 AromaticContact CZ-CD2 3.73Å; F231-Y243 HydrophobicContact CZ-CD2 3.73Å; F231-Y243 HydrophobicContact CZ-CE2 4.49Å; F231-Y243 AromaticContact CZ-CG 3.78Å; F231-Y243 HydrophobicContact CZ-CG 3.78Å; R240-Y243 WeakPolarHBondContact O-CA 3.36Å; R240-Y243 VanDerWaalsContact O-CB 3.23Å; R240-Y243 WeakPolarHBondContact O-CB 3.38Å; R240-Y243 WeakPolarHBondContact O-CD2 3.34Å; R240-Y243 PolarHBondContact O-N 3.44Å; E241-Y243 VanDerWaalsContact C-N 3.31Å; E241-Y243 PolarHBondContact O-N 3.07Å; Y243-N245 PolarHBondContact O-N 3.41Å; Y243-R246 PolarHBondContact O-N 3.01Å; Y243-L247 PolarHBondContact O-N 3.39Å
244	I	97.4	Very high	96.5	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-56.3	-32.4	169	-162.6	61	0	0	0	111.7	Y149 R240 E241 T242 R246 L247 L248	Y149-I244 WeakPolarHBondContact O-CG2 3.13Å; R240-I244 HydrophobicContact CG-CB 3.98Å; R240-I244 HydrophobicContact CG-CD1 4.08Å; E241-I244 VanDerWaalsContact O-CG2 3.28Å; E241-I244 WeakPolarHBondContact O-CG2 3.45Å; T242-I244 PolarHBondContact O-N 3.44Å; T242-I244 VanDerWaalsContact O-N 3.16Å; I244-R246 VanDerWaalsContact C-N 3.29Å; I244-R246 PolarHBondContact O-N 3.21Å; I244-L247 HydrophobicContact CD1-CD2 4.11Å; I244-L247 PolarHBondContact O-N 3.21Å; I244-L248 HydrophobicContact CD1-CG 4.44Å; I244-L248 HydrophobicContact CG1-CD1 3.74Å; I244-L248 HydrophobicContact CG1-CG 4.05Å; I244-L248 WeakPolarHBondContact O-CB 3.38Å; I244-L248 VanDerWaalsContact O-CG 3.29Å; I244-L248 WeakPolarHBondContact O-CG 3.27Å; I244-L248 PolarHBondContact O-N 3.43Å
245	N	97.8	Very high	96.6	Very high	29 Å²	29	47.1 Å²	47.1	16%	0.155	22%	0.217	C	C	.	.	H	α-helix	trans	-62.6	-37.6	-178.4	-67.2	-69.8	0	0	0	111.9	Y149 S151 I154 T242 Y243 K249	Y149-N245 PolarHBondContact O-ND2 3.48Å; S151-N245 WeakPolarHBondContact CB-OD1 3.32Å; S151-N245 PolarHBondContact N-OD1 3.46Å; S151-N245 PolarHBondContact OG-OD1 2.9Å; I154-N245 HydrophobicContact CG1-CB 4.03Å; I154-N245 VanDerWaalsContact CG1-OD1 3.25Å; I154-N245 WeakPolarHBondContact CG1-OD1 3.41Å; T242-N245 WeakPolarHBondContact O-CB 3.42Å; T242-N245 PolarHBondContact O-N 3.04Å; T242-N245 VanDerWaalsContact O-N 3.1Å; T242-N245 PolarHBondContact O-ND2 3.36Å; Y243-N245 PolarHBondContact O-N 3.41Å; N245-K249 WeakPolarHBondContact O-CB 3.48Å; N245-K249 PolarHBondContact O-N 3.34Å
246	R	96.6	Very high	96.7	Very high	192 Å²	192	49.8 Å²	49.8	73%	0.725	23%	0.23	S	C	*	.	H	α-helix	trans	-67.3	-45	176	-177.3	179.4	175.4	175.1	0.4	111.2	Y243 I244 K249 A250	Y243-R246 PolarHBondContact O-N 3.01Å; I244-R246 VanDerWaalsContact C-N 3.29Å; I244-R246 PolarHBondContact O-N 3.21Å; R246-K249 PolarHBondContact O-N 2.85Å; R246-A250 PolarHBondContact O-N 3.01Å
247	L	96.6	Very high	96.8	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-61.1	-48.4	176.7	177.4	66	0	0	0	110.9	A146 P220 F224 Y243 I244 K249 A250 M251	A146-L247 HydrophobicContact CB-CD2 4.14Å; P220-L247 HydrophobicContact CB-CD1 3.89Å; P220-L247 HydrophobicContact CG-CD1 4.19Å; F224-L247 HydrophobicContact CD1-CD1 4.44Å; F224-L247 HydrophobicContact CE1-CD1 3.91Å; F224-L247 HydrophobicContact CE1-CD2 4.4Å; Y243-L247 PolarHBondContact O-N 3.39Å; I244-L247 HydrophobicContact CD1-CD2 4.11Å; I244-L247 PolarHBondContact O-N 3.21Å; L247-K249 VanDerWaalsContact C-N 3.33Å; L247-K249 PolarHBondContact O-N 3.17Å; L247-A250 WeakPolarHBondContact O-CB 3.35Å; L247-A250 PolarHBondContact O-N 3.43Å; L247-M251 HydrophobicContact CD1-CG 4.18Å; L247-M251 HydrophobicContact CD1-SD 3.9Å; L247-M251 HydrophobicContact CD2-SD 4.09Å; L247-M251 HydrophobicContact CG-CG 4.34Å; L247-M251 HydrophobicContact CG-SD 3.77Å; L247-M251 WeakPolarHBondContact O-CG 3.42Å; L247-M251 PolarHBondContact O-N 2.62Å; L247-M251 VanDerWaalsContact O-N 3.09Å
248	L	97.3	Very high	96.8	Very high	0 Å²	0	54 Å²	54	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-63.4	-39.6	-178.3	-69.1	173.6	0	0	0	111.8	F96 V98 I154 L158 L217 I244 A250 M251 I252	F96-L248 HydrophobicContact CB-CD1 4.14Å; F96-L248 HydrophobicContact CD1-CD1 3.54Å; F96-L248 HydrophobicContact CD1-CD2 3.49Å; F96-L248 VanDerWaalsContact CD1-CD2 3.49Å; F96-L248 HydrophobicContact CD1-CG 4.14Å; F96-L248 HydrophobicContact CE1-CD1 4.15Å; F96-L248 HydrophobicContact CE1-CD2 3.35Å; F96-L248 HydrophobicContact CE1-CG 4.41Å; F96-L248 HydrophobicContact CG-CD1 4Å; F96-L248 HydrophobicContact CZ-CD2 4.42Å; V98-L248 HydrophobicContact CG2-CD2 3.73Å; I154-L248 HydrophobicContact CD1-CB 4.25Å; I154-L248 HydrophobicContact CG2-CB 3.79Å; I154-L248 HydrophobicContact CG2-CD1 3.46Å; I154-L248 VanDerWaalsContact CG2-CD1 3.46Å; I154-L248 HydrophobicContact CG2-CG 4.25Å; L158-L248 HydrophobicContact CD1-CD1 4.43Å; L217-L248 HydrophobicContact CD1-CD2 3.89Å; I244-L248 HydrophobicContact CD1-CG 4.44Å; I244-L248 HydrophobicContact CG1-CD1 3.74Å; I244-L248 HydrophobicContact CG1-CG 4.05Å; I244-L248 WeakPolarHBondContact O-CB 3.38Å; I244-L248 VanDerWaalsContact O-CG 3.29Å; I244-L248 WeakPolarHBondContact O-CG 3.27Å; I244-L248 PolarHBondContact O-N 3.43Å; L248-A250 PolarHBondContact O-N 3Å; L248-M251 PolarHBondContact O-N 2.95Å; L248-I252 HydrophobicContact CB-CD1 4.11Å; L248-I252 VanDerWaalsContact O-CB 3.3Å; L248-I252 WeakPolarHBondContact O-CB 3.46Å; L248-I252 WeakPolarHBondContact O-CD1 3.49Å; L248-I252 WeakPolarHBondContact O-CG1 3.39Å; L248-I252 PolarHBondContact O-N 2.98Å
249	K	96.9	Very high	96.8	Very high	145 Å²	145	57.9 Å²	57.9	63%	0.63	27%	0.267	S	S	*	.	H	α-helix	trans	-56.4	-35.3	172.8	-170.5	-176.1	177	-168.6	0	112.5	I154 N245 R246 L247	I154-K249 HydrophobicContact CD1-CB 4.32Å; N245-K249 WeakPolarHBondContact O-CB 3.48Å; N245-K249 PolarHBondContact O-N 3.34Å; R246-K249 PolarHBondContact O-N 2.85Å; L247-K249 VanDerWaalsContact C-N 3.33Å; L247-K249 PolarHBondContact O-N 3.17Å
250	A	96.5	Very high	96.8	Very high	27 Å²	27	59.5 Å²	59.5	22%	0.223	27%	0.273	C	S	.	.	H	α-helix	trans	-79.1	-22.4	178.1	0	0	0	0	0	113.8	P220 S221 R246 L247 L248	P220-A250 WeakPolarHBondContact CA-O 3.38Å; P220-A250 HydrophobicContact CB-CB 3.95Å; S221-A250 PolarHBondContact N-O 2.96Å; R246-A250 PolarHBondContact O-N 3.01Å; L247-A250 WeakPolarHBondContact O-CB 3.35Å; L247-A250 PolarHBondContact O-N 3.43Å; L248-A250 PolarHBondContact O-N 3Å
251	M	97.2	Very high	96.8	Very high	1 Å²	1	63.5 Å²	63.5	1%	0.005	29%	0.292	C	S	.	.	H	α-helix	trans	-98.3	-19	-178.5	-63.3	-177	79.7	0	0	114	V98 N123 R162 L217 S218 P220 F224 L247 L248	V98-M251 HydrophobicContact CG1-CE 3.85Å; V98-M251 HydrophobicContact CG1-SD 4.07Å; N123-M251 HydrophobicContact CB-CE 3.69Å; N123-M251 WeakPolarHBondContact OD1-CE 3.35Å; R162-M251 PolarHBondContact NH2-O 2.92Å; R162-M251 VanDerWaalsContact NH2-O 3.15Å; L217-M251 HydrophobicContact CB-CB 4.03Å; L217-M251 HydrophobicContact CB-CE 3.92Å; L217-M251 HydrophobicContact CD1-CB 4.24Å; L217-M251 HydrophobicContact CD1-CE 4.1Å; L217-M251 HydrophobicContact CD1-SD 4.2Å; S218-M251 PolarHBondContact N-O 3.3Å; S218-M251 WeakPolarHBondContact O-CB 3.28Å; S218-M251 WeakPolarHBondContact O-CE 3.42Å; P220-M251 HydrophobicContact CB-CG 3.76Å; P220-M251 HydrophobicContact CG-CG 4.39Å; F224-M251 HydrophobicContact CZ-CE 4.43Å; L247-M251 HydrophobicContact CD1-CG 4.18Å; L247-M251 HydrophobicContact CD1-SD 3.9Å; L247-M251 HydrophobicContact CD2-SD 4.09Å; L247-M251 HydrophobicContact CG-CG 4.34Å; L247-M251 HydrophobicContact CG-SD 3.77Å; L247-M251 WeakPolarHBondContact O-CG 3.42Å; L247-M251 PolarHBondContact O-N 2.62Å; L247-M251 VanDerWaalsContact O-N 3.09Å; L248-M251 PolarHBondContact O-N 2.95Å
252	I	94.1	Very high	96.8	Very high	28 Å²	28	59.8 Å²	59.8	14%	0.144	27%	0.274	C	S	.	.			trans	-77.3	0	-179.6	-73.7	165.9	0	0	0	110.6	I154 Q157 L158 K161 R162 L248	I154-I252 HydrophobicContact CD1-CD1 4.19Å; I154-I252 HydrophobicContact CG2-CD1 4.26Å; Q157-I252 HydrophobicContact CB-CD1 4.26Å; Q157-I252 HydrophobicContact CB-CG2 4.41Å; L158-I252 HydrophobicContact CD2-CD1 3.76Å; L158-I252 HydrophobicContact CD2-CG1 3.64Å; L158-I252 HydrophobicContact CG-CD1 3.67Å; L158-I252 HydrophobicContact CG-CG1 4.14Å; K161-I252 HydrophobicContact CB-CG2 4.32Å; K161-I252 HydrophobicContact CD-CG2 3.64Å; K161-I252 WeakPolarHBondContact CD-O 3.29Å; K161-I252 WeakPolarHBondContact CE-O 3.29Å; K161-I252 HydrophobicContact CG-CG2 4.49Å; K161-I252 PolarHBondContact NZ-O 3.28Å; K161-I252 PolarHBondContact NZ-OXT 3.01Å; R162-I252 PolarHBondContact NE-O 3.22Å; R162-I252 PolarHBondContact NH2-O 3.21Å; L248-I252 HydrophobicContact CB-CD1 4.11Å; L248-I252 VanDerWaalsContact O-CB 3.3Å; L248-I252 WeakPolarHBondContact O-CB 3.46Å; L248-I252 WeakPolarHBondContact O-CD1 3.49Å; L248-I252 WeakPolarHBondContact O-CG1 3.39Å; L248-I252 PolarHBondContact O-N 2.98Å

Retrieved 252 of 252 residues in 199.2 ms (Link to these results)

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